NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
481143 | 1azh | cing | 4-filtered-FRED | STAR | entry | full | 207 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1azh # This FRED archive file contains, for PDB entry <1azh>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.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_1azh _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1azh _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3648.99 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 $CELLOBIOHYDROLASE_I A . 1 1 stop_ save_ save_CELLOBIOHYDROLASE_I _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "CELLOBIOHYDROLASE I" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code TQSHAGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL _Entity.Number_of_monomers 36 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 THR . 1 1 2 GLN . 1 1 3 SER . 1 1 4 HIS . 1 1 5 ALA . 1 1 6 GLY . 1 1 7 GLN . 1 1 8 CYS . 1 1 9 GLY . 1 1 10 GLY . 1 1 11 ILE . 1 1 12 GLY . 1 1 13 TYR . 1 1 14 SER . 1 1 15 GLY . 1 1 16 PRO . 1 1 17 THR . 1 1 18 VAL . 1 1 19 CYS . 1 1 20 ALA . 1 1 21 SER . 1 1 22 GLY . 1 1 23 THR . 1 1 24 THR . 1 1 25 CYS . 1 1 26 GLN . 1 1 27 VAL . 1 1 28 LEU . 1 1 29 ASN . 1 1 30 PRO . 1 1 31 TYR . 1 1 32 TYR . 1 1 33 SER . 1 1 34 GLN . 1 1 35 CYS . 1 1 36 LEU . 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 THR 1 1 1 1 GLN 2 2 1 1 SER 3 3 1 1 HIS 4 4 1 1 ALA 5 5 1 1 GLY 6 6 1 1 GLN 7 7 1 1 CYS 8 8 1 1 GLY 9 9 1 1 GLY 10 10 1 1 ILE 11 11 1 1 GLY 12 12 1 1 TYR 13 13 1 1 SER 14 14 1 1 GLY 15 15 1 1 PRO 16 16 1 1 THR 17 17 1 1 VAL 18 18 1 1 CYS 19 19 1 1 ALA 20 20 1 1 SER 21 21 1 1 GLY 22 22 1 1 THR 23 23 1 1 THR 24 24 1 1 CYS 25 25 1 1 GLN 26 26 1 1 VAL 27 27 1 1 LEU 28 28 1 1 ASN 29 29 1 1 PRO 30 30 1 1 TYR 31 31 1 1 TYR 32 32 1 1 SER 33 33 1 1 GLN 34 34 1 1 CYS 35 35 1 1 LEU 36 36 1 1 stop_ save_ save_Discover_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "disulfide bond" _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 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 8 CYS SG 1 8 CYSH SG 1 1 1 1 2 1 1 25 CYS SG 1 25 CYSH SG 1 1 2 1 1 1 1 19 CYS SG 1 19 CYSH SG 1 1 2 1 2 1 1 35 CYS SG 1 35 CYSH SG 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 . . . . . . 1.85 4.0 1 1 2 1 . . . . . . 1.85 4.0 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 2 _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 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 8 CYS H 1 8 CYSH HN 1 2 1 1 2 1 1 9 GLY H 1 9 GLY HN 1 2 2 1 1 1 1 12 GLY H 1 12 GLY HN 1 2 2 1 2 1 1 13 TYR H 1 13 TYR HN 1 2 3 1 1 1 1 17 THR H 1 17 THR HN 1 2 3 1 2 1 1 18 VAL H 1 18 VAL HN 1 2 4 1 1 1 1 22 GLY H 1 22 GLY HN 1 2 4 1 2 1 1 23 THR H 1 23 THR HN 1 2 5 1 1 1 1 31 TYR H 1 31 TYR HN 1 2 5 1 2 1 1 32 TYR H 1 32 TYR HN 1 2 6 1 1 1 1 6 GLY QA 1 6 GLY HA* 1 2 6 1 2 1 1 7 GLN H 1 7 GLN HN 1 2 7 1 1 1 1 7 GLN HA 1 7 GLN HA 1 2 7 1 2 1 1 8 CYS H 1 8 CYSH HN 1 2 8 1 1 1 1 10 GLY HA2 1 10 GLY HA1 1 2 8 1 2 1 1 11 ILE H 1 11 ILE HN 1 2 9 1 1 1 1 10 GLY HA3 1 10 GLY HA2 1 2 9 1 2 1 1 11 ILE H 1 11 ILE HN 1 2 10 1 1 1 1 11 ILE HA 1 11 ILE HA 1 2 10 1 2 1 1 12 GLY H 1 12 GLY HN 1 2 11 1 1 1 1 13 TYR HA 1 13 TYR HA 1 2 11 1 2 1 1 14 SER H 1 14 SER HN 1 2 12 1 1 1 1 16 PRO HA 1 16 PRO HA 1 2 12 1 2 1 1 17 THR H 1 17 THR HN 1 2 13 1 1 1 1 21 SER HA 1 21 SER HA 1 2 13 1 2 1 1 22 GLY H 1 22 GLY HN 1 2 14 1 1 1 1 27 VAL HA 1 27 VAL HA 1 2 14 1 2 1 1 28 LEU H 1 28 LEU HN 1 2 15 1 1 1 1 11 ILE HA 1 11 ILE HA 1 2 15 1 2 1 1 13 TYR H 1 13 TYR HN 1 2 16 1 1 1 1 21 SER HA 1 21 SER HA 1 2 16 1 2 1 1 23 THR H 1 23 THR HN 1 2 17 1 1 1 1 19 CYS QB 1 19 CYSH HB1 1 2 17 1 2 1 1 20 ALA H 1 20 ALA HN 1 2 18 1 1 1 1 20 ALA MB 1 20 ALA HB* 1 2 18 1 2 1 1 21 SER H 1 21 SER HN 1 2 19 1 1 1 1 21 SER QB 1 21 SER HB* 1 2 19 1 2 1 1 22 GLY H 1 22 GLY HN 1 2 20 1 1 1 1 24 THR HB 1 24 THR HB 1 2 20 1 2 1 1 25 CYS H 1 25 CYSH HN 1 2 21 1 1 1 1 26 GLN HB3 1 26 GLN HB1 1 2 21 1 2 1 1 27 VAL H 1 27 VAL HN 1 2 22 1 1 1 1 28 LEU QB 1 28 LEU HB2 1 2 22 1 2 1 1 29 ASN H 1 29 ASN HN 1 2 23 1 1 1 1 28 LEU H 1 28 LEU HN 1 2 23 1 2 1 1 33 SER HA 1 33 SER HA 1 2 24 1 1 1 1 9 GLY QA 1 9 GLY HA1 1 2 24 1 2 1 1 13 TYR QD 1 13 TYR HD* 1 2 25 1 1 1 1 13 TYR QE 1 13 TYR HE* 1 2 25 1 2 1 1 17 THR HG1 1 17 THR HG* 1 2 25 1 2 1 1 17 THR MG 1 17 THR HG* 1 2 26 1 1 1 1 28 LEU QB 1 28 LEU HB1 1 2 26 1 2 1 1 32 TYR QD 1 32 TYR HD* 1 2 27 1 1 1 1 28 LEU QD 1 28 LEU HD1* 1 2 27 1 2 1 1 32 TYR QD 1 32 TYR HD* 1 2 28 1 1 1 1 28 LEU QD 1 28 LEU HD1* 1 2 28 1 2 1 1 32 TYR QE 1 32 TYR HE* 1 2 29 1 1 1 1 7 GLN QG 1 7 GLN HG1 1 2 29 1 2 1 1 8 CYS H 1 8 CYSH HN 1 2 30 1 1 1 1 7 GLN QG 1 7 GLN HG1 1 2 30 1 2 1 1 9 GLY H 1 9 GLY HN 1 2 31 1 1 1 1 11 ILE MG 1 11 ILE HG2* 1 2 31 1 2 1 1 12 GLY H 1 12 GLY HN 1 2 32 1 1 1 1 23 THR HG1 1 23 THR HG* 1 2 32 1 1 1 1 23 THR MG 1 23 THR HG* 1 2 32 1 2 1 1 24 THR H 1 24 THR HN 1 2 33 1 1 1 1 24 THR HG1 1 24 THR HG* 1 2 33 1 1 1 1 24 THR MG 1 24 THR HG* 1 2 33 1 2 1 1 25 CYS H 1 25 CYSH HN 1 2 34 1 1 1 1 27 VAL QG 1 27 VAL HG1* 1 2 34 1 2 1 1 28 LEU H 1 28 LEU HN 1 2 35 1 1 1 1 27 VAL QG 1 27 VAL HG1* 1 2 35 1 2 1 1 29 ASN H 1 29 ASN HN 1 2 36 1 1 1 1 11 ILE H 1 11 ILE HN 1 2 36 1 2 1 1 31 TYR HA 1 31 TYR HA 1 2 37 1 1 1 1 9 GLY H 1 9 GLY HN 1 2 37 1 2 1 1 33 SER QB 1 33 SER HB2 1 2 38 1 1 1 1 11 ILE MD 1 11 ILE HD* 1 2 38 1 2 1 1 30 PRO QB 1 30 PRO HB1 1 2 39 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 39 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 40 1 1 1 1 11 ILE MG 1 11 ILE HG2* 1 2 40 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 41 1 1 1 1 11 ILE MG 1 11 ILE HG2* 1 2 41 1 2 1 1 31 TYR QE 1 31 TYR HE* 1 2 42 1 1 1 1 7 GLN QB 1 7 GLN HB1 1 2 42 1 2 1 1 32 TYR QE 1 32 TYR HE* 1 2 43 1 1 1 1 32 TYR QE 1 32 TYR HE* 1 2 43 1 2 1 1 34 GLN QB 1 34 GLN HB* 1 2 44 1 1 1 1 6 GLY H 1 6 GLY HN 1 2 44 1 2 1 1 6 GLY QA 1 6 GLY HA* 1 2 45 1 1 1 1 9 GLY H 1 9 GLY HN 1 2 45 1 2 1 1 9 GLY QA 1 9 GLY HA1 1 2 46 1 1 1 1 10 GLY H 1 10 GLY HN 1 2 46 1 2 1 1 10 GLY HA3 1 10 GLY HA2 1 2 47 1 1 1 1 12 GLY H 1 12 GLY HN 1 2 47 1 2 1 1 12 GLY HA2 1 12 GLY HA2 1 2 48 1 1 1 1 14 SER H 1 14 SER HN 1 2 48 1 2 1 1 14 SER HA 1 14 SER HA 1 2 49 1 1 1 1 18 VAL H 1 18 VAL HN 1 2 49 1 2 1 1 18 VAL HA 1 18 VAL HA 1 2 50 1 1 1 1 20 ALA H 1 20 ALA HN 1 2 50 1 2 1 1 20 ALA HA 1 20 ALA HA 1 2 51 1 1 1 1 20 ALA HA 1 20 ALA HA 1 2 51 1 2 1 1 21 SER H 1 21 SER HN 1 2 52 1 1 1 1 22 GLY H 1 22 GLY HN 1 2 52 1 2 1 1 22 GLY HA2 1 22 GLY HA2 1 2 53 1 1 1 1 24 THR HA 1 24 THR HA 1 2 53 1 2 1 1 25 CYS H 1 25 CYSH HN 1 2 54 1 1 1 1 27 VAL H 1 27 VAL HN 1 2 54 1 2 1 1 27 VAL HA 1 27 VAL HA 1 2 55 1 1 1 1 31 TYR H 1 31 TYR HN 1 2 55 1 2 1 1 31 TYR HA 1 31 TYR HA 1 2 56 1 1 1 1 8 CYS HA 1 8 CYSH HA 1 2 56 1 2 1 1 8 CYS HB3 1 8 CYSH HB1 1 2 57 1 1 1 1 18 VAL HA 1 18 VAL HA 1 2 57 1 2 1 1 18 VAL HB 1 18 VAL HB 1 2 58 1 1 1 1 30 PRO HA 1 30 PRO HA 1 2 58 1 2 1 1 30 PRO QB 1 30 PRO HB1 1 2 59 1 1 1 1 33 SER HA 1 33 SER HA 1 2 59 1 2 1 1 33 SER QB 1 33 SER HB1 1 2 60 1 1 1 1 2 GLN H 1 2 GLN HN 1 2 60 1 2 1 1 2 GLN QB 1 2 GLN HB1 1 2 61 1 1 1 1 4 HIS H 1 4 HIS HN 1 2 61 1 2 1 1 4 HIS QB 1 4 HIS HB* 1 2 62 1 1 1 1 7 GLN H 1 7 GLN HN 1 2 62 1 2 1 1 7 GLN QB 1 7 GLN HB1 1 2 63 1 1 1 1 11 ILE H 1 11 ILE HN 1 2 63 1 2 1 1 11 ILE HB 1 11 ILE HB 1 2 64 1 1 1 1 13 TYR H 1 13 TYR HN 1 2 64 1 2 1 1 13 TYR QB 1 13 TYR HB1 1 2 65 1 1 1 1 14 SER H 1 14 SER HN 1 2 65 1 2 1 1 14 SER QB 1 14 SER HB1 1 2 66 1 1 1 1 18 VAL H 1 18 VAL HN 1 2 66 1 2 1 1 18 VAL HB 1 18 VAL HB 1 2 67 1 1 1 1 20 ALA H 1 20 ALA HN 1 2 67 1 2 1 1 20 ALA MB 1 20 ALA HB* 1 2 68 1 1 1 1 24 THR H 1 24 THR HN 1 2 68 1 2 1 1 24 THR HB 1 24 THR HB 1 2 69 1 1 1 1 25 CYS H 1 25 CYSH HN 1 2 69 1 2 1 1 25 CYS HB3 1 25 CYSH HB1 1 2 70 1 1 1 1 25 CYS H 1 25 CYSH HN 1 2 70 1 2 1 1 25 CYS HB2 1 25 CYSH HB2 1 2 71 1 1 1 1 26 GLN H 1 26 GLN HN 1 2 71 1 2 1 1 26 GLN HB2 1 26 GLN HB2 1 2 72 1 1 1 1 27 VAL H 1 27 VAL HN 1 2 72 1 2 1 1 27 VAL HB 1 27 VAL HB 1 2 73 1 1 1 1 28 LEU H 1 28 LEU HN 1 2 73 1 2 1 1 28 LEU QB 1 28 LEU HB2 1 2 74 1 1 1 1 32 TYR H 1 32 TYR HN 1 2 74 1 2 1 1 32 TYR HB3 1 32 TYR HB1 1 2 75 1 1 1 1 32 TYR H 1 32 TYR HN 1 2 75 1 2 1 1 32 TYR HB2 1 32 TYR HB2 1 2 76 1 1 1 1 35 CYS H 1 35 CYSH HN 1 2 76 1 2 1 1 35 CYS HB2 1 35 CYSH HB2 1 2 77 1 1 1 1 35 CYS H 1 35 CYSH HN 1 2 77 1 2 1 1 35 CYS HB3 1 35 CYSH HB1 1 2 78 1 1 1 1 36 LEU H 1 36 LEUC HN 1 2 78 1 2 1 1 36 LEU QB 1 36 LEUC HB1 1 2 79 1 1 1 1 7 GLN QE 1 7 GLN HE21 1 2 79 1 2 1 1 7 GLN QG 1 7 GLN HG2 1 2 80 1 1 1 1 29 ASN QB 1 29 ASN HB* 1 2 80 1 2 1 1 29 ASN HD21 1 29 ASN HD21 1 2 81 1 1 1 1 4 HIS HA 1 4 HIS HA 1 2 81 1 2 1 1 4 HIS HD2 1 4 HIS HD2 1 2 82 1 1 1 1 13 TYR QB 1 13 TYR HB1 1 2 82 1 2 1 1 13 TYR QD 1 13 TYR HD* 1 2 83 1 1 1 1 31 TYR HA 1 31 TYR HA 1 2 83 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 84 1 1 1 1 31 TYR HB2 1 31 TYR HB1 1 2 84 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 85 1 1 1 1 31 TYR H 1 31 TYR HN 1 2 85 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 86 1 1 1 1 11 ILE H 1 11 ILE HN 1 2 86 1 2 1 1 11 ILE MG 1 11 ILE HG2* 1 2 87 1 1 1 1 17 THR H 1 17 THR HN 1 2 87 1 2 1 1 17 THR HG1 1 17 THR HG* 1 2 87 1 2 1 1 17 THR MG 1 17 THR HG* 1 2 88 1 1 1 1 18 VAL H 1 18 VAL HN 1 2 88 1 2 1 1 18 VAL QG 1 18 VAL HG** 1 2 89 1 1 1 1 24 THR H 1 24 THR HN 1 2 89 1 2 1 1 24 THR HG1 1 24 THR HG* 1 2 89 1 2 1 1 24 THR MG 1 24 THR HG* 1 2 90 1 1 1 1 27 VAL H 1 27 VAL HN 1 2 90 1 2 1 1 27 VAL QG 1 27 VAL HG2** 1 2 91 1 1 1 1 11 ILE HA 1 11 ILE HA 1 2 91 1 2 1 1 11 ILE MG 1 11 ILE HG2* 1 2 92 1 1 1 1 27 VAL HA 1 27 VAL HA 1 2 92 1 2 1 1 27 VAL QG 1 27 VAL HG1* 1 2 93 1 1 1 1 21 SER H 1 21 SER HN 1 2 93 1 2 1 1 21 SER QB 1 21 SER HB* 1 2 94 1 1 1 1 11 ILE HA 1 11 ILE HA 1 2 94 1 2 1 1 11 ILE QG 1 11 ILE HG11 1 2 95 1 1 1 1 18 VAL HA 1 18 VAL HA 1 2 95 1 2 1 1 18 VAL QG 1 18 VAL HG** 1 2 96 1 1 1 1 30 PRO QB 1 30 PRO HB1 1 2 96 1 2 1 1 30 PRO HG3 1 30 PRO HG1 1 2 97 1 1 1 1 30 PRO HD3 1 30 PRO HD1 1 2 97 1 2 1 1 30 PRO HG2 1 30 PRO HG2 1 2 98 1 1 1 1 30 PRO HD3 1 30 PRO HD1 1 2 98 1 2 1 1 30 PRO HG3 1 30 PRO HG1 1 2 99 1 1 1 1 28 LEU QB 1 28 LEU HB2 1 2 99 1 2 1 1 28 LEU QD 1 28 LEU HD1* 1 2 100 1 1 1 1 8 CYS HA 1 8 CYSH HA 1 2 100 1 2 1 1 8 CYS HB2 1 8 CYSH HB2 1 2 101 1 1 1 1 11 ILE MD 1 11 ILE HD* 1 2 101 1 2 1 1 31 TYR QE 1 31 TYR HE* 1 2 102 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 102 1 2 1 1 31 TYR QE 1 31 TYR HE* 1 2 103 1 1 1 1 17 THR H 1 17 THR HN 1 2 103 1 2 1 1 18 VAL QG 1 18 VAL HG** 1 2 104 1 1 1 1 11 ILE HA 1 11 ILE HA 1 2 104 1 2 1 1 11 ILE MD 1 11 ILE HD* 1 2 105 1 1 1 1 27 VAL HB 1 27 VAL HB 1 2 105 1 2 1 1 30 PRO QB 1 30 PRO HB2 1 2 106 1 1 1 1 24 THR HA 1 24 THR HA 1 2 106 1 2 1 1 24 THR HB 1 24 THR HB 1 2 107 1 1 1 1 16 PRO HA 1 16 PRO HA 1 2 107 1 2 1 1 16 PRO QB 1 16 PRO HB1 1 2 108 1 1 1 1 20 ALA HA 1 20 ALA HA 1 2 108 1 2 1 1 20 ALA MB 1 20 ALA HB* 1 2 109 1 1 1 1 16 PRO HA 1 16 PRO HA 1 2 109 1 2 1 1 16 PRO QG 1 16 PRO HG1 1 2 110 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 110 1 2 1 1 31 TYR HA 1 31 TYR HA 1 2 111 1 1 1 1 33 SER H 1 33 SER HN 1 2 111 1 2 1 1 33 SER QB 1 33 SER HB2 1 2 112 1 1 1 1 36 LEU H 1 36 LEUC HN 1 2 112 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 113 1 1 1 1 33 SER HA 1 33 SER HA 1 2 113 1 2 1 1 34 GLN H 1 34 GLN HN 1 2 114 1 1 1 1 34 GLN H 1 34 GLN HN 1 2 114 1 2 1 1 34 GLN QB 1 34 GLN HB* 1 2 115 1 1 1 1 34 GLN QE 1 34 GLN HE21 1 2 115 1 2 1 1 34 GLN QG 1 34 GLN HG* 1 2 116 1 1 1 1 31 TYR H 1 31 TYR HN 1 2 116 1 2 1 1 31 TYR HB3 1 31 TYR HB2 1 2 117 1 1 1 1 31 TYR HA 1 31 TYR HA 1 2 117 1 2 1 1 32 TYR H 1 32 TYR HN 1 2 118 1 1 1 1 29 ASN H 1 29 ASN HN 1 2 118 1 2 1 1 29 ASN QB 1 29 ASN HB* 1 2 119 1 1 1 1 5 ALA H 1 5 ALA HN 1 2 119 1 2 1 1 5 ALA MB 1 5 ALA HB* 1 2 120 1 1 1 1 5 ALA H 1 5 ALA HN 1 2 120 1 2 1 1 5 ALA HA 1 5 ALA HA 1 2 121 1 1 1 1 5 ALA HA 1 5 ALA HA 1 2 121 1 2 1 1 6 GLY H 1 6 GLY HN 1 2 122 1 1 1 1 30 PRO HD2 1 30 PRO HD2 1 2 122 1 2 1 1 30 PRO HG3 1 30 PRO HG1 1 2 123 1 1 1 1 31 TYR HB3 1 31 TYR HB2 1 2 123 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 124 1 1 1 1 5 ALA MB 1 5 ALA HB* 1 2 124 1 2 1 1 6 GLY H 1 6 GLY HN 1 2 125 1 1 1 1 5 ALA HA 1 5 ALA HA 1 2 125 1 2 1 1 5 ALA MB 1 5 ALA HB* 1 2 126 1 1 1 1 7 GLN HA 1 7 GLN HA 1 2 126 1 2 1 1 7 GLN QG 1 7 GLN HG1 1 2 127 1 1 1 1 6 GLY H 1 6 GLY HN 1 2 127 1 2 1 1 7 GLN H 1 7 GLN HN 1 2 128 1 1 1 1 34 GLN QE 1 34 GLN HE21 1 2 128 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 129 1 1 1 1 1 THR HG1 1 1 THRN HG* 1 2 129 1 1 1 1 1 THR MG 1 1 THRN HG* 1 2 129 1 2 1 1 21 SER H 1 21 SER HN 1 2 130 1 1 1 1 13 TYR QD 1 13 TYR HD* 1 2 130 1 2 1 1 17 THR HG1 1 17 THR HG* 1 2 130 1 2 1 1 17 THR MG 1 17 THR HG* 1 2 131 1 1 1 1 34 GLN QG 1 34 GLN HG* 1 2 131 1 2 1 1 35 CYS H 1 35 CYSH HN 1 2 132 1 1 1 1 28 LEU H 1 28 LEU HN 1 2 132 1 2 1 1 29 ASN H 1 29 ASN HN 1 2 133 1 1 1 1 17 THR H 1 17 THR HN 1 2 133 1 2 1 1 18 VAL HB 1 18 VAL HB 1 2 134 1 1 1 1 3 SER H 1 3 SER HN 1 2 134 1 2 1 1 3 SER QB 1 3 SER HB* 1 2 135 1 1 1 1 33 SER QB 1 33 SER HB1 1 2 135 1 2 1 1 34 GLN H 1 34 GLN HN 1 2 136 1 1 1 1 26 GLN QE 1 26 GLN HE22 1 2 136 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 137 1 1 1 1 26 GLN QE 1 26 GLN HE22 1 2 137 1 2 1 1 36 LEU QB 1 36 LEUC HB1 1 2 138 1 1 1 1 19 CYS H 1 19 CYSH HN 1 2 138 1 2 1 1 19 CYS QB 1 19 CYSH HB2 1 2 139 1 1 1 1 18 VAL HA 1 18 VAL HA 1 2 139 1 2 1 1 19 CYS H 1 19 CYSH HN 1 2 140 1 1 1 1 9 GLY QA 1 9 GLY HA1 1 2 140 1 2 1 1 10 GLY H 1 10 GLY HN 1 2 141 1 1 1 1 29 ASN QB 1 29 ASN HB* 1 2 141 1 2 1 1 30 PRO HD3 1 30 PRO HD1 1 2 142 1 1 1 1 29 ASN QB 1 29 ASN HB* 1 2 142 1 2 1 1 30 PRO HD2 1 30 PRO HD2 1 2 143 1 1 1 1 31 TYR HA 1 31 TYR HA 1 2 143 1 2 1 1 31 TYR HB2 1 31 TYR HB1 1 2 144 1 1 1 1 11 ILE MD 1 11 ILE HD* 1 2 144 1 2 1 1 11 ILE MG 1 11 ILE HG2* 1 2 145 1 1 1 1 24 THR H 1 24 THR HN 1 2 145 1 2 1 1 36 LEU H 1 36 LEUC HN 1 2 146 1 1 1 1 23 THR HB 1 23 THR HB 1 2 146 1 2 1 1 24 THR H 1 24 THR HN 1 2 147 1 1 1 1 23 THR HB 1 23 THR HB 1 2 147 1 2 1 1 23 THR HG1 1 23 THR HG* 1 2 147 1 2 1 1 23 THR MG 1 23 THR HG* 1 2 148 1 1 1 1 34 GLN HA 1 34 GLN HA 1 2 148 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 149 1 1 1 1 15 GLY HA3 1 15 GLY HA1 1 2 149 1 2 1 1 16 PRO QD 1 16 PRO HD1 1 2 150 1 1 1 1 26 GLN H 1 26 GLN HN 1 2 150 1 2 1 1 26 GLN QG 1 26 GLN HG1 1 2 151 1 1 1 1 25 CYS HA 1 25 CYSH HA 1 2 151 1 2 1 1 26 GLN H 1 26 GLN HN 1 2 152 1 1 1 1 2 GLN HA 1 2 GLN HA 1 2 152 1 2 1 1 2 GLN QE 1 2 GLN HE21 1 2 153 1 1 1 1 26 GLN HA 1 26 GLN HA 1 2 153 1 2 1 1 26 GLN QE 1 26 GLN HE22 1 2 154 1 1 1 1 1 THR HA 1 1 THRN HA 1 2 154 1 2 1 1 2 GLN H 1 2 GLN HN 1 2 155 1 1 1 1 1 THR HB 1 1 THRN HB 1 2 155 1 2 1 1 2 GLN H 1 2 GLN HN 1 2 156 1 1 1 1 26 GLN HA 1 26 GLN HA 1 2 156 1 2 1 1 27 VAL H 1 27 VAL HN 1 2 157 1 1 1 1 32 TYR QD 1 32 TYR HD* 1 2 157 1 2 1 1 34 GLN QB 1 34 GLN HB* 1 2 158 1 1 1 1 32 TYR QE 1 32 TYR HE* 1 2 158 1 2 1 1 34 GLN QG 1 34 GLN HG* 1 2 159 1 1 1 1 30 PRO QB 1 30 PRO HB2 1 2 159 1 2 1 1 31 TYR QD 1 31 TYR HD* 1 2 160 1 1 1 1 26 GLN HB3 1 26 GLN HB1 1 2 160 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 161 1 1 1 1 26 GLN HB2 1 26 GLN HB2 1 2 161 1 2 1 1 36 LEU QD 1 36 LEUC HD** 1 2 162 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 162 1 2 1 1 32 TYR HA 1 32 TYR HA 1 2 163 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 163 1 2 1 1 13 TYR QB 1 13 TYR HB2 1 2 164 1 1 1 1 11 ILE MD 1 11 ILE HD* 1 2 164 1 2 1 1 30 PRO HA 1 30 PRO HA 1 2 165 1 1 1 1 34 GLN QB 1 34 GLN HB* 1 2 165 1 2 1 1 34 GLN QG 1 34 GLN HG* 1 2 166 1 1 1 1 26 GLN H 1 26 GLN HN 1 2 166 1 2 1 1 26 GLN HA 1 26 GLN HA 1 2 167 1 1 1 1 22 GLY HA3 1 22 GLY HA1 1 2 167 1 2 1 1 23 THR H 1 23 THR HN 1 2 168 1 1 1 1 17 THR H 1 17 THR HN 1 2 168 1 2 1 1 17 THR HB 1 17 THR HB 1 2 169 1 1 1 1 13 TYR HH 1 13 TYR HH 1 2 169 1 2 1 1 17 THR HB 1 17 THR HB 1 2 170 1 1 1 1 19 CYS QB 1 19 CYSH HB1 1 2 170 1 2 1 1 35 CYS HB3 1 35 CYSH HB1 1 2 171 1 1 1 1 31 TYR HA 1 31 TYR HA 1 2 171 1 2 1 1 31 TYR HB3 1 31 TYR HB2 1 2 172 1 1 1 1 29 ASN H 1 29 ASN HN 1 2 172 1 2 1 1 32 TYR QD 1 32 TYR HD* 1 2 173 1 1 1 1 11 ILE HB 1 11 ILE HB 1 2 173 1 2 1 1 30 PRO HA 1 30 PRO HA 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.543 1.78 2.543 1 2 2 1 . . . . . 3.197 2.131 3.197 1 2 3 1 . . . . . 2.554 1.78 2.554 1 2 4 1 . . . . . 3.0 2.0 3.0 1 2 5 1 . . . . . 6.0 1.78 6.0 1 2 6 1 . . . . . 2.687 1.792 2.687 1 2 7 1 . . . . . 2.441 1.78 2.441 1 2 8 1 . . . . . 3.185 2.123 3.185 1 2 9 1 . . . . . 2.406 1.78 2.406 1 2 10 1 . . . . . 2.395 1.7 2.395 1 2 11 1 . . . . . 3.021 2.014 3.021 1 2 12 1 . . . . . 2.502 1.7 2.502 1 2 13 1 . . . . . 2.511 1.7 2.511 1 2 14 1 . . . . . 2.396 1.7 2.396 1 2 15 1 . . . . . 3.185 2.124 3.185 1 2 16 1 . . . . . 3.744 2.496 3.744 1 2 17 1 . . . . . 3.725 2.484 3.725 1 2 18 1 . . . . . 2.981 1.987 2.981 1 2 19 1 . . . . . 2.956 1.97 2.956 1 2 20 1 . . . . . 3.69 2.46 3.69 1 2 21 1 . . . . . 3.703 2.469 3.703 1 2 22 1 . . . . . . 2.057 3.086 1 2 23 1 . . . . . 3.959 2.639 3.959 1 2 24 1 . . . . . 3.495 2.33 3.495 1 2 25 1 . . . . . 4.317 2.878 4.317 1 2 26 1 . . . . . 4.308 2.872 4.308 1 2 27 1 . . . . . 2.748 2.189 2.748 1 2 28 1 . . . . . 3.737 2.491 3.737 1 2 29 1 . . . . . 2.939 1.959 2.939 1 2 30 1 . . . . . . 2.918 3.318 1 2 31 1 . . . . . 3.768 2.512 3.768 1 2 32 1 . . . . . 6.0 1.78 6.0 1 2 33 1 . . . . . 6.0 1.78 6.0 1 2 34 1 . . . . . 3.466 2.311 3.466 1 2 35 1 . . . . . 3.004 2.003 3.004 1 2 36 1 . . . . . 3.034 2.023 3.034 1 2 37 1 . . . . . 3.712 2.475 3.712 1 2 38 1 . . . . . 4.255 2.836 4.255 1 2 39 1 . . . . . 4.535 3.023 4.535 1 2 40 1 . . . . . 4.029 2.686 4.029 1 2 41 1 . . . . . 3.469 2.313 3.469 1 2 42 1 . . . . . 3.483 2.322 3.483 1 2 43 1 . . . . . 2.985 1.99 2.985 1 2 44 1 . . . . . 2.596 1.731 2.596 1 2 45 1 . . . . . . 2.452 3.417 1 2 46 1 . . . . . 2.487 1.7 2.487 1 2 47 1 . . . . . 2.804 1.869 2.804 1 2 48 1 . . . . . 3.866 2.578 3.866 1 2 49 1 . . . . . 3.293 2.195 3.293 1 2 50 1 . . . . . 3.011 2.007 3.011 1 2 51 1 . . . . . 2.365 1.7 2.365 1 2 52 1 . . . . . 2.638 1.758 2.638 1 2 53 1 . . . . . 2.543 1.7 2.543 1 2 54 1 . . . . . 2.578 1.719 2.578 1 2 55 1 . . . . . 2.792 1.861 2.792 1 2 56 1 . . . . . 2.868 1.912 2.868 1 2 57 1 . . . . . 3.153 2.102 3.153 1 2 58 1 . . . . . 2.465 2.14 2.465 1 2 59 1 . . . . . 3.014 2.009 3.014 1 2 60 1 . . . . . . 2.206 3.309 1 2 61 1 . . . . . 2.899 1.933 2.899 1 2 62 1 . . . . . 2.663 2.021 2.663 1 2 63 1 . . . . . 2.429 1.7 2.429 1 2 64 1 . . . . . 2.575 1.925 2.575 1 2 65 1 . . . . . 3.622 2.576 3.622 1 2 66 1 . . . . . 2.543 1.7 2.543 1 2 67 1 . . . . . 2.495 1.7 2.495 1 2 68 1 . . . . . 4.782 3.188 4.782 1 2 69 1 . . . . . 2.69 1.793 2.69 1 2 70 1 . . . . . 2.809 1.873 2.809 1 2 71 1 . . . . . 2.858 1.905 2.858 1 2 72 1 . . . . . 2.543 1.7 2.543 1 2 73 1 . . . . . . 2.296 2.513 1 2 74 1 . . . . . 3.317 2.211 3.317 1 2 75 1 . . . . . 3.94 2.627 3.94 1 2 76 1 . . . . . 2.733 1.822 2.733 1 2 77 1 . . . . . 3.617 2.412 3.617 1 2 78 1 . . . . . 3.964 2.643 3.964 1 2 79 1 . . . . . . 2.483 3.43 1 2 80 1 . . . . . 3.162 2.108 3.162 1 2 81 1 . . . . . 3.899 2.6 3.899 1 2 82 1 . . . . . . 2.248 3.372 1 2 83 1 . . . . . 3.646 2.43 3.646 1 2 84 1 . . . . . 2.957 1.971 2.957 1 2 85 1 . . . . . 3.171 2.114 3.171 1 2 86 1 . . . . . 4.615 3.076 4.615 1 2 87 1 . . . . . 3.472 2.315 3.472 1 2 88 1 . . . . . 3.295 2.197 3.295 1 2 89 1 . . . . . 6.0 4.034 6.0 1 2 90 1 . . . . . 2.879 1.919 2.879 1 2 91 1 . . . . . 3.092 2.061 3.092 1 2 92 1 . . . . . 2.894 1.936 2.894 1 2 93 1 . . . . . 2.51 1.7 2.51 1 2 94 1 . . . . . . 2.06 2.561 1 2 95 1 . . . . . 3.27 2.18 3.27 1 2 96 1 . . . . . . 2.11 3.165 1 2 97 1 . . . . . 2.945 1.963 2.945 1 2 98 1 . . . . . 3.067 2.045 3.067 1 2 99 1 . . . . . . 2.561 3.686 1 2 100 1 . . . . . 3.535 2.356 3.535 1 2 101 1 . . . . . 6.0 1.78 6.0 1 2 102 1 . . . . . 4.499 2.999 4.499 1 2 103 1 . . . . . 6.0 4.927 6.0 1 2 104 1 . . . . . 3.319 2.213 3.319 1 2 105 1 . . . . . 6.0 1.78 6.0 1 2 106 1 . . . . . 2.597 1.731 2.597 1 2 107 1 . . . . . 2.423 1.7 2.423 1 2 108 1 . . . . . 2.786 1.857 2.786 1 2 109 1 . . . . . 2.914 1.943 2.914 1 2 110 1 . . . . . 3.494 2.33 3.494 1 2 111 1 . . . . . 3.746 2.497 3.746 1 2 112 1 . . . . . 5.976 3.984 5.976 1 2 113 1 . . . . . 3.071 2.047 3.071 1 2 114 1 . . . . . 2.703 1.802 2.703 1 2 115 1 . . . . . 2.962 2.22 2.962 1 2 116 1 . . . . . 4.905 3.27 4.905 1 2 117 1 . . . . . 3.03 2.02 3.03 1 2 118 1 . . . . . 3.476 2.318 3.476 1 2 119 1 . . . . . 2.864 1.909 2.864 1 2 120 1 . . . . . 2.87 1.913 2.87 1 2 121 1 . . . . . 2.537 1.7 2.537 1 2 122 1 . . . . . 3.205 2.137 3.205 1 2 123 1 . . . . . 2.826 1.884 2.826 1 2 124 1 . . . . . 3.984 2.656 3.984 1 2 125 1 . . . . . 2.38 1.7 2.38 1 2 126 1 . . . . . 2.946 1.964 2.946 1 2 127 1 . . . . . 6.0 1.78 6.0 1 2 128 1 . . . . . 6.0 5.993 6.0 1 2 129 1 . . . . . 3.841 2.561 3.841 1 2 130 1 . . . . . 3.761 2.508 3.761 1 2 131 1 . . . . . 3.177 2.118 3.177 1 2 132 1 . . . . . 2.45 1.7 2.45 1 2 133 1 . . . . . 3.36 2.24 3.36 1 2 134 1 . . . . . 3.325 2.216 3.325 1 2 135 1 . . . . . 3.728 2.485 3.728 1 2 136 1 . . . . . 5.436 3.624 5.436 1 2 137 1 . . . . . 4.119 2.746 4.119 1 2 138 1 . . . . . 2.736 1.824 2.736 1 2 139 1 . . . . . 2.811 1.874 2.811 1 2 140 1 . . . . . 3.147 2.098 3.147 1 2 141 1 . . . . . 6.0 1.78 6.0 1 2 142 1 . . . . . 2.659 1.773 2.659 1 2 143 1 . . . . . 3.693 2.462 3.693 1 2 144 1 . . . . . 2.454 1.7 2.454 1 2 145 1 . . . . . 6.0 1.78 6.0 1 2 146 1 . . . . . 6.0 4.215 6.0 1 2 147 1 . . . . . 2.307 1.7 2.307 1 2 148 1 . . . . . 4.188 2.792 4.188 1 2 149 1 . . . . . 3.205 2.137 3.205 1 2 150 1 . . . . . 3.268 2.179 3.268 1 2 151 1 . . . . . 2.594 1.729 2.594 1 2 152 1 . . . . . 2.597 1.732 2.597 1 2 153 1 . . . . . 2.861 1.907 2.861 1 2 154 1 . . . . . 3.28 2.186 3.28 1 2 155 1 . . . . . 4.068 2.712 4.068 1 2 156 1 . . . . . 3.267 2.178 3.267 1 2 157 1 . . . . . 3.452 2.302 3.452 1 2 158 1 . . . . . 3.682 2.454 3.682 1 2 159 1 . . . . . 3.737 2.492 3.737 1 2 160 1 . . . . . 6.0 1.78 6.0 1 2 161 1 . . . . . 3.717 2.478 3.717 1 2 162 1 . . . . . 4.138 2.759 4.138 1 2 163 1 . . . . . 6.0 1.78 6.0 1 2 164 1 . . . . . 6.0 1.78 6.0 1 2 165 1 . . . . . 2.738 1.826 2.738 1 2 166 1 . . . . . 3.479 2.32 3.479 1 2 167 1 . . . . . 3.376 2.251 3.376 1 2 168 1 . . . . . 2.791 1.861 2.791 1 2 169 1 . . . . . 3.561 2.374 3.561 1 2 170 1 . . . . . 6.0 1.78 6.0 1 2 171 1 . . . . . 3.945 2.63 3.945 1 2 172 1 . . . . . 2.911 1.941 2.911 1 2 173 1 . . . . . 6.0 1.78 6.0 1 2 stop_ save_ save_Discover_dihedral_6 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 THR C 1 1 2 GLN N 1 1 2 GLN CA 1 1 2 GLN C -116.99999 -57.0 1 1 THRN C 1 2 GLN N 1 2 GLN CA 1 2 GLN C 1 1 2 . 1 1 3 SER C 1 1 4 HIS N 1 1 4 HIS CA 1 1 4 HIS C -150.99998 -91.0 1 3 SER C 1 4 HIS N 1 4 HIS CA 1 4 HIS C 1 1 3 . 1 1 4 HIS C 1 1 5 ALA N 1 1 5 ALA CA 1 1 5 ALA C -113.0 -53.0 1 4 HIS C 1 5 ALA N 1 5 ALA CA 1 5 ALA C 1 1 4 . 1 1 6 GLY C 1 1 7 GLN N 1 1 7 GLN CA 1 1 7 GLN C -116.99999 -57.0 1 6 GLY C 1 7 GLN N 1 7 GLN CA 1 7 GLN C 1 1 5 . 1 1 7 GLN C 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS C -150.0 -89.99999 1 7 GLN C 1 8 CYSH N 1 8 CYSH CA 1 8 CYSH C 1 1 6 . 1 1 10 GLY C 1 1 11 ILE N 1 1 11 ILE CA 1 1 11 ILE C -111.0 -50.999996 1 10 GLY C 1 11 ILE N 1 11 ILE CA 1 11 ILE C 1 1 7 . 1 1 12 GLY C 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR C -116.99999 -57.0 1 12 GLY C 1 13 TYR N 1 13 TYR CA 1 13 TYR C 1 1 8 . 1 1 13 TYR C 1 1 14 SER N 1 1 14 SER CA 1 1 14 SER C -150.0 -89.99999 1 13 TYR C 1 14 SER N 1 14 SER CA 1 14 SER C 1 1 9 . 1 1 16 PRO C 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C -150.0 -89.99999 1 16 PRO C 1 17 THR N 1 17 THR CA 1 17 THR C 1 1 10 . 1 1 17 THR C 1 1 18 VAL N 1 1 18 VAL CA 1 1 18 VAL C -118.0 -58.0 1 17 THR C 1 18 VAL N 1 18 VAL CA 1 18 VAL C 1 1 11 . 1 1 19 CYS C 1 1 20 ALA N 1 1 20 ALA CA 1 1 20 ALA C -110.0 -50.0 1 19 CYSH C 1 20 ALA N 1 20 ALA CA 1 20 ALA C 1 1 12 . 1 1 20 ALA C 1 1 21 SER N 1 1 21 SER CA 1 1 21 SER C -110.0 -50.0 1 20 ALA C 1 21 SER N 1 21 SER CA 1 21 SER C 1 1 13 . 1 1 23 THR C 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR C -150.99998 -91.0 1 23 THR C 1 24 THR N 1 24 THR CA 1 24 THR C 1 1 14 . 1 1 24 THR C 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C -111.0 -50.999996 1 24 THR C 1 25 CYSH N 1 25 CYSH CA 1 25 CYSH C 1 1 15 . 1 1 25 CYS C 1 1 26 GLN N 1 1 26 GLN CA 1 1 26 GLN C -150.0 -89.99999 1 25 CYSH C 1 26 GLN N 1 26 GLN CA 1 26 GLN C 1 1 16 . 1 1 26 GLN C 1 1 27 VAL N 1 1 27 VAL CA 1 1 27 VAL C -136.0 -76.0 1 26 GLN C 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 1 17 . 1 1 27 VAL C 1 1 28 LEU N 1 1 28 LEU CA 1 1 28 LEU C -150.99998 -91.0 1 27 VAL C 1 28 LEU N 1 28 LEU CA 1 28 LEU C 1 1 18 . 1 1 28 LEU C 1 1 29 ASN N 1 1 29 ASN CA 1 1 29 ASN C -114.0 -53.999996 1 28 LEU C 1 29 ASN N 1 29 ASN CA 1 29 ASN C 1 1 19 . 1 1 31 TYR C 1 1 32 TYR N 1 1 32 TYR CA 1 1 32 TYR C -116.99999 -57.0 1 31 TYR C 1 32 TYR N 1 32 TYR CA 1 32 TYR C 1 1 20 . 1 1 32 TYR C 1 1 33 SER N 1 1 33 SER CA 1 1 33 SER C -150.0 -89.99999 1 32 TYR C 1 33 SER N 1 33 SER CA 1 33 SER C 1 1 21 . 1 1 33 SER C 1 1 34 GLN N 1 1 34 GLN CA 1 1 34 GLN C -111.0 -50.999996 1 33 SER C 1 34 GLN N 1 34 GLN CA 1 34 GLN C 1 1 22 . 1 1 35 CYS C 1 1 36 LEU N 1 1 36 LEU CA 1 1 36 LEU C -150.0 -89.99999 1 35 CYSH C 1 36 LEUC N 1 36 LEUC CA 1 36 LEUC C 1 1 23 . 1 1 7 GLN HA 1 1 7 GLN CA 1 1 7 GLN CB 1 1 7 GLN HB2 168.0 191.99998 1 7 GLN HA 1 7 GLN CA 1 7 GLN CB 1 7 GLN HB2 1 1 24 . 1 1 11 ILE HA 1 1 11 ILE CA 1 1 11 ILE CB 1 1 11 ILE HB 150.0 210.0 1 11 ILE HA 1 11 ILE CA 1 11 ILE CB 1 11 ILE HB 1 1 25 . 1 1 13 TYR HA 1 1 13 TYR CA 1 1 13 TYR CB 1 1 13 TYR HB3 149.0 211.0 1 13 TYR HA 1 13 TYR CA 1 13 TYR CB 1 13 TYR HB1 1 1 26 . 1 1 25 CYS HA 1 1 25 CYS CA 1 1 25 CYS CB 1 1 25 CYS HB2 150.0 210.0 1 25 CYSH HA 1 25 CYSH CA 1 25 CYSH CB 1 25 CYSH HB2 1 1 27 . 1 1 26 GLN HA 1 1 26 GLN CA 1 1 26 GLN CB 1 1 26 GLN HB2 162.0 198.0 1 26 GLN HA 1 26 GLN CA 1 26 GLN CB 1 26 GLN HB2 1 1 28 . 1 1 27 VAL HA 1 1 27 VAL CA 1 1 27 VAL CB 1 1 27 VAL HB 154.0 206.0 1 27 VAL HA 1 27 VAL CA 1 27 VAL CB 1 27 VAL HB 1 1 29 . 1 1 28 LEU HA 1 1 28 LEU CA 1 1 28 LEU CB 1 1 28 LEU HB3 148.0 212.0 1 28 LEU HA 1 28 LEU CA 1 28 LEU CB 1 28 LEU HB1 1 1 30 . 1 1 33 SER HA 1 1 33 SER CA 1 1 33 SER CB 1 1 33 SER HB2 155.0 205.0 1 33 SER HA 1 33 SER CA 1 33 SER CB 1 33 SER HB2 1 1 31 . 1 1 35 CYS HA 1 1 35 CYS CA 1 1 35 CYS CB 1 1 35 CYS HB2 162.99998 197.0 1 35 CYSH HA 1 35 CYSH CA 1 35 CYSH CB 1 35 CYSH HB2 1 1 32 . 1 1 36 LEU HA 1 1 36 LEU CA 1 1 36 LEU CB 1 1 36 LEU HB3 155.0 205.0 1 36 LEUC HA 1 36 LEUC CA 1 36 LEUC CB 1 36 LEUC HB1 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 THR C C -5.781 -4.886 -8.203 1.00 . A A . 1 THR C 1 1 1 2 1 1 1 THR CA C -4.254 -4.697 -8.404 1.00 . A A . 1 THR CA 1 1 1 3 1 1 1 THR CB C -3.957 -3.595 -9.443 1.00 . A A . 1 THR CB 1 1 1 4 1 1 1 THR CG2 C -4.418 -2.210 -8.982 1.00 . A A . 1 THR CG2 1 1 1 5 1 1 1 THR H1 H -3.638 -6.639 -7.966 1.00 . A A . 1 THR H1 1 1 1 6 1 1 1 THR H2 H -3.622 -6.346 -9.600 1.00 . A A . 1 THR H2 1 1 1 7 1 1 1 THR H3 H -2.485 -5.741 -8.587 1.00 . A A . 1 THR H3 1 1 1 8 1 1 1 THR HA H -3.869 -4.334 -7.447 1.00 . A A . 1 THR HA 1 1 1 9 1 1 1 THR HB H -4.436 -3.831 -10.396 1.00 . A A . 1 THR HB 1 1 1 10 1 1 1 THR HG1 H -2.343 -2.703 -10.088 1.00 . A A . 1 THR HG1 1 1 1 11 1 1 1 THR HG21 H -5.493 -2.193 -8.799 1.00 . A A . 1 THR HG21 1 1 1 12 1 1 1 THR HG22 H -3.900 -1.925 -8.065 1.00 . A A . 1 THR HG22 1 1 1 13 1 1 1 THR HG23 H -4.193 -1.467 -9.748 1.00 . A A . 1 THR HG23 1 1 1 14 1 1 1 THR N N -3.479 -5.943 -8.689 1.00 . A A . 1 THR N 1 1 1 15 1 1 1 THR O O -6.285 -4.638 -7.113 1.00 . A A . 1 THR O 1 1 1 16 1 1 1 THR OG1 O -2.562 -3.534 -9.649 1.00 . A A . 1 THR OG1 1 1 1 17 1 1 2 GLN C C -8.437 -6.856 -8.590 1.00 . A A . 2 GLN C 1 1 1 18 1 1 2 GLN CA C -7.991 -5.500 -9.185 1.00 . A A . 2 GLN CA 1 1 1 19 1 1 2 GLN CB C -8.569 -5.305 -10.601 1.00 . A A . 2 GLN CB 1 1 1 20 1 1 2 GLN CD C -10.850 -4.459 -9.764 1.00 . A A . 2 GLN CD 1 1 1 21 1 1 2 GLN CG C -10.106 -5.436 -10.672 1.00 . A A . 2 GLN CG 1 1 1 22 1 1 2 GLN H H -6.085 -5.484 -10.129 1.00 . A A . 2 GLN H 1 1 1 23 1 1 2 GLN HA H -8.406 -4.716 -8.550 1.00 . A A . 2 GLN HA 1 1 1 24 1 1 2 GLN HB2 H -8.289 -4.316 -10.969 1.00 . A A . 2 GLN HB2 1 1 1 25 1 1 2 GLN HB3 H -8.139 -6.046 -11.277 1.00 . A A . 2 GLN HB3 1 1 1 26 1 1 2 GLN HE21 H -10.743 -5.694 -8.138 1.00 . A A . 2 GLN HE21 1 1 1 27 1 1 2 GLN HE22 H -11.559 -4.140 -7.951 1.00 . A A . 2 GLN HE22 1 1 1 28 1 1 2 GLN HG2 H -10.429 -5.238 -11.696 1.00 . A A . 2 GLN HG2 1 1 1 29 1 1 2 GLN HG3 H -10.423 -6.451 -10.430 1.00 . A A . 2 GLN HG3 1 1 1 30 1 1 2 GLN N N -6.525 -5.316 -9.239 1.00 . A A . 2 GLN N 1 1 1 31 1 1 2 GLN NE2 N -11.072 -4.814 -8.515 1.00 . A A . 2 GLN NE2 1 1 1 32 1 1 2 GLN O O -9.296 -6.909 -7.718 1.00 . A A . 2 GLN O 1 1 1 33 1 1 2 GLN OE1 O -11.212 -3.365 -10.160 1.00 . A A . 2 GLN OE1 1 1 1 34 1 1 3 SER C C -7.218 -9.526 -7.284 1.00 . A A . 3 SER C 1 1 1 35 1 1 3 SER CA C -8.044 -9.318 -8.572 1.00 . A A . 3 SER CA 1 1 1 36 1 1 3 SER CB C -7.647 -10.321 -9.673 1.00 . A A . 3 SER CB 1 1 1 37 1 1 3 SER H H -7.212 -7.855 -9.851 1.00 . A A . 3 SER H 1 1 1 38 1 1 3 SER HA H -9.094 -9.487 -8.324 1.00 . A A . 3 SER HA 1 1 1 39 1 1 3 SER HB2 H -7.609 -11.330 -9.252 1.00 . A A . 3 SER HB2 1 1 1 40 1 1 3 SER HB3 H -8.417 -10.310 -10.454 1.00 . A A . 3 SER HB3 1 1 1 41 1 1 3 SER HG H -6.112 -10.671 -10.858 1.00 . A A . 3 SER HG 1 1 1 42 1 1 3 SER N N -7.874 -7.956 -9.100 1.00 . A A . 3 SER N 1 1 1 43 1 1 3 SER O O -7.737 -9.471 -6.174 1.00 . A A . 3 SER O 1 1 1 44 1 1 3 SER OG O -6.370 -9.991 -10.220 1.00 . A A . 3 SER OG 1 1 1 45 1 1 4 HIS C C -4.919 -8.128 -5.788 1.00 . A A . 4 HIS C 1 1 1 46 1 1 4 HIS CA C -4.946 -9.582 -6.324 1.00 . A A . 4 HIS CA 1 1 1 47 1 1 4 HIS CB C -3.556 -10.052 -6.788 1.00 . A A . 4 HIS CB 1 1 1 48 1 1 4 HIS CD2 C -2.023 -10.884 -4.862 1.00 . A A . 4 HIS CD2 1 1 1 49 1 1 4 HIS CE1 C -1.137 -8.957 -4.343 1.00 . A A . 4 HIS CE1 1 1 1 50 1 1 4 HIS CG C -2.509 -9.930 -5.710 1.00 . A A . 4 HIS CG 1 1 1 51 1 1 4 HIS H H -5.576 -9.754 -8.386 1.00 . A A . 4 HIS H 1 1 1 52 1 1 4 HIS HA H -5.261 -10.260 -5.524 1.00 . A A . 4 HIS HA 1 1 1 53 1 1 4 HIS HB2 H -3.609 -11.101 -7.080 1.00 . A A . 4 HIS HB2 1 1 1 54 1 1 4 HIS HB3 H -3.235 -9.470 -7.653 1.00 . A A . 4 HIS HB3 1 1 1 55 1 1 4 HIS HD2 H -2.309 -11.924 -4.848 1.00 . A A . 4 HIS HD2 1 1 1 56 1 1 4 HIS HE1 H -0.549 -8.203 -3.834 1.00 . A A . 4 HIS HE1 1 1 1 57 1 1 4 HIS HE2 H -0.602 -10.692 -3.267 1.00 . A A . 4 HIS HE2 1 1 1 58 1 1 4 HIS N N -5.902 -9.697 -7.430 1.00 . A A . 4 HIS N 1 1 1 59 1 1 4 HIS ND1 N -1.936 -8.701 -5.385 1.00 . A A . 4 HIS ND1 1 1 1 60 1 1 4 HIS NE2 N -1.137 -10.257 -4.011 1.00 . A A . 4 HIS NE2 1 1 1 61 1 1 4 HIS O O -4.429 -7.227 -6.478 1.00 . A A . 4 HIS O 1 1 1 62 1 1 5 ALA C C -4.128 -5.943 -3.671 1.00 . A A . 5 ALA C 1 1 1 63 1 1 5 ALA CA C -5.520 -6.552 -3.978 1.00 . A A . 5 ALA CA 1 1 1 64 1 1 5 ALA CB C -6.380 -6.631 -2.710 1.00 . A A . 5 ALA CB 1 1 1 65 1 1 5 ALA H H -5.921 -8.649 -4.123 1.00 . A A . 5 ALA H 1 1 1 66 1 1 5 ALA HA H -6.036 -5.890 -4.678 1.00 . A A . 5 ALA HA 1 1 1 67 1 1 5 ALA HB1 H -7.394 -6.958 -2.958 1.00 . A A . 5 ALA HB1 1 1 1 68 1 1 5 ALA HB2 H -5.942 -7.337 -2.001 1.00 . A A . 5 ALA HB2 1 1 1 69 1 1 5 ALA HB3 H -6.439 -5.648 -2.235 1.00 . A A . 5 ALA HB3 1 1 1 70 1 1 5 ALA N N -5.472 -7.880 -4.599 1.00 . A A . 5 ALA N 1 1 1 71 1 1 5 ALA O O -3.205 -6.636 -3.247 1.00 . A A . 5 ALA O 1 1 1 72 1 1 6 GLY C C -2.537 -3.467 -2.162 1.00 . A A . 6 GLY C 1 1 1 73 1 1 6 GLY CA C -2.735 -3.888 -3.635 1.00 . A A . 6 GLY CA 1 1 1 74 1 1 6 GLY H H -4.782 -4.133 -4.246 1.00 . A A . 6 GLY H 1 1 1 75 1 1 6 GLY HA2 H -1.874 -4.489 -3.924 1.00 . A A . 6 GLY HA2 1 1 1 76 1 1 6 GLY HA3 H -2.719 -2.998 -4.266 1.00 . A A . 6 GLY HA3 1 1 1 77 1 1 6 GLY N N -3.978 -4.631 -3.898 1.00 . A A . 6 GLY N 1 1 1 78 1 1 6 GLY O O -1.702 -4.030 -1.460 1.00 . A A . 6 GLY O 1 1 1 79 1 1 7 GLN C C -3.325 -2.588 0.864 1.00 . A A . 7 GLN C 1 1 1 80 1 1 7 GLN CA C -3.105 -1.749 -0.429 1.00 . A A . 7 GLN CA 1 1 1 81 1 1 7 GLN CB C -4.035 -0.518 -0.446 1.00 . A A . 7 GLN CB 1 1 1 82 1 1 7 GLN CD C -4.763 1.590 0.818 1.00 . A A . 7 GLN CD 1 1 1 83 1 1 7 GLN CG C -4.006 0.268 0.882 1.00 . A A . 7 GLN CG 1 1 1 84 1 1 7 GLN H H -3.991 -2.099 -2.335 1.00 . A A . 7 GLN H 1 1 1 85 1 1 7 GLN HA H -2.091 -1.344 -0.410 1.00 . A A . 7 GLN HA 1 1 1 86 1 1 7 GLN HB2 H -3.737 0.133 -1.271 1.00 . A A . 7 GLN HB2 1 1 1 87 1 1 7 GLN HB3 H -5.063 -0.842 -0.625 1.00 . A A . 7 GLN HB3 1 1 1 88 1 1 7 GLN HE21 H -5.547 1.379 2.678 1.00 . A A . 7 GLN HE21 1 1 1 89 1 1 7 GLN HE22 H -6.031 2.791 1.720 1.00 . A A . 7 GLN HE22 1 1 1 90 1 1 7 GLN HG2 H -4.460 -0.337 1.665 1.00 . A A . 7 GLN HG2 1 1 1 91 1 1 7 GLN HG3 H -2.981 0.487 1.169 1.00 . A A . 7 GLN HG3 1 1 1 92 1 1 7 GLN N N -3.288 -2.456 -1.709 1.00 . A A . 7 GLN N 1 1 1 93 1 1 7 GLN NE2 N -5.440 1.982 1.878 1.00 . A A . 7 GLN NE2 1 1 1 94 1 1 7 GLN O O -4.461 -2.935 1.175 1.00 . A A . 7 GLN O 1 1 1 95 1 1 7 GLN OE1 O -4.755 2.285 -0.188 1.00 . A A . 7 GLN OE1 1 1 1 96 1 1 8 CYS C C -2.451 -1.545 3.881 1.00 . A A . 8 CYS C 1 1 1 97 1 1 8 CYS CA C -2.358 -2.919 3.145 1.00 . A A . 8 CYS CA 1 1 1 98 1 1 8 CYS CB C -1.192 -3.809 3.631 1.00 . A A . 8 CYS CB 1 1 1 99 1 1 8 CYS H H -1.364 -2.602 1.269 1.00 . A A . 8 CYS H 1 1 1 100 1 1 8 CYS HA H -3.274 -3.464 3.392 1.00 . A A . 8 CYS HA 1 1 1 101 1 1 8 CYS HB2 H -1.268 -3.945 4.709 1.00 . A A . 8 CYS HB2 1 1 1 102 1 1 8 CYS HB3 H -1.276 -4.791 3.165 1.00 . A A . 8 CYS HB3 1 1 1 103 1 1 8 CYS N N -2.276 -2.752 1.680 1.00 . A A . 8 CYS N 1 1 1 104 1 1 8 CYS O O -3.406 -1.275 4.604 1.00 . A A . 8 CYS O 1 1 1 105 1 1 8 CYS SG S 0.484 -3.212 3.276 1.00 . A A . 8 CYS SG 1 1 1 106 1 1 9 GLY C C -0.923 0.778 5.713 1.00 . A A . 9 GLY C 1 1 1 107 1 1 9 GLY CA C -1.407 0.711 4.242 1.00 . A A . 9 GLY CA 1 1 1 108 1 1 9 GLY H H -0.753 -0.928 3.021 1.00 . A A . 9 GLY H 1 1 1 109 1 1 9 GLY HA2 H -0.691 1.276 3.646 1.00 . A A . 9 GLY HA2 1 1 1 110 1 1 9 GLY HA3 H -2.374 1.212 4.173 1.00 . A A . 9 GLY HA3 1 1 1 111 1 1 9 GLY N N -1.494 -0.634 3.637 1.00 . A A . 9 GLY N 1 1 1 112 1 1 9 GLY O O -0.809 -0.241 6.387 1.00 . A A . 9 GLY O 1 1 1 113 1 1 10 GLY C C -0.691 3.433 8.319 1.00 . A A . 10 GLY C 1 1 1 114 1 1 10 GLY CA C -0.084 2.222 7.569 1.00 . A A . 10 GLY CA 1 1 1 115 1 1 10 GLY H H -0.666 2.789 5.596 1.00 . A A . 10 GLY H 1 1 1 116 1 1 10 GLY HA2 H -0.283 1.357 8.202 1.00 . A A . 10 GLY HA2 1 1 1 117 1 1 10 GLY HA3 H 0.998 2.331 7.517 1.00 . A A . 10 GLY HA3 1 1 1 118 1 1 10 GLY N N -0.588 1.987 6.202 1.00 . A A . 10 GLY N 1 1 1 119 1 1 10 GLY O O -1.891 3.462 8.597 1.00 . A A . 10 GLY O 1 1 1 120 1 1 11 ILE C C -1.397 6.370 9.205 1.00 . A A . 11 ILE C 1 1 1 121 1 1 11 ILE CA C -0.184 5.506 9.653 1.00 . A A . 11 ILE CA 1 1 1 122 1 1 11 ILE CB C 1.079 6.357 9.976 1.00 . A A . 11 ILE CB 1 1 1 123 1 1 11 ILE CD1 C 3.559 6.265 10.689 1.00 . A A . 11 ILE CD1 1 1 1 124 1 1 11 ILE CG1 C 2.250 5.482 10.489 1.00 . A A . 11 ILE CG1 1 1 1 125 1 1 11 ILE CG2 C 0.779 7.456 11.018 1.00 . A A . 11 ILE CG2 1 1 1 126 1 1 11 ILE H H 1.074 4.363 8.326 1.00 . A A . 11 ILE H 1 1 1 127 1 1 11 ILE HA H -0.463 5.037 10.598 1.00 . A A . 11 ILE HA 1 1 1 128 1 1 11 ILE HB H 1.393 6.856 9.063 1.00 . A A . 11 ILE HB 1 1 1 129 1 1 11 ILE HD11 H 3.809 6.820 9.783 1.00 . A A . 11 ILE HD11 1 1 1 130 1 1 11 ILE HD12 H 3.480 6.957 11.527 1.00 . A A . 11 ILE HD12 1 1 1 131 1 1 11 ILE HD13 H 4.373 5.572 10.908 1.00 . A A . 11 ILE HD13 1 1 1 132 1 1 11 ILE HG12 H 1.969 5.019 11.434 1.00 . A A . 11 ILE HG12 1 1 1 133 1 1 11 ILE HG13 H 2.464 4.686 9.774 1.00 . A A . 11 ILE HG13 1 1 1 134 1 1 11 ILE HG21 H -0.035 8.103 10.694 1.00 . A A . 11 ILE HG21 1 1 1 135 1 1 11 ILE HG22 H 0.514 7.004 11.973 1.00 . A A . 11 ILE HG22 1 1 1 136 1 1 11 ILE HG23 H 1.648 8.100 11.161 1.00 . A A . 11 ILE HG23 1 1 1 137 1 1 11 ILE N N 0.138 4.418 8.701 1.00 . A A . 11 ILE N 1 1 1 138 1 1 11 ILE O O -1.248 7.407 8.564 1.00 . A A . 11 ILE O 1 1 1 139 1 1 12 GLY C C -4.463 6.175 7.793 1.00 . A A . 12 GLY C 1 1 1 140 1 1 12 GLY CA C -3.898 6.536 9.185 1.00 . A A . 12 GLY CA 1 1 1 141 1 1 12 GLY H H -2.621 4.978 9.927 1.00 . A A . 12 GLY H 1 1 1 142 1 1 12 GLY HA2 H -4.633 6.208 9.921 1.00 . A A . 12 GLY HA2 1 1 1 143 1 1 12 GLY HA3 H -3.819 7.622 9.262 1.00 . A A . 12 GLY HA3 1 1 1 144 1 1 12 GLY N N -2.610 5.912 9.536 1.00 . A A . 12 GLY N 1 1 1 145 1 1 12 GLY O O -5.221 6.951 7.214 1.00 . A A . 12 GLY O 1 1 1 146 1 1 13 TYR C C -5.772 3.554 5.962 1.00 . A A . 13 TYR C 1 1 1 147 1 1 13 TYR CA C -4.566 4.527 5.926 1.00 . A A . 13 TYR CA 1 1 1 148 1 1 13 TYR CB C -3.369 3.917 5.169 1.00 . A A . 13 TYR CB 1 1 1 149 1 1 13 TYR CD1 C -1.867 5.975 5.273 1.00 . A A . 13 TYR CD1 1 1 1 150 1 1 13 TYR CD2 C -2.376 4.995 3.097 1.00 . A A . 13 TYR CD2 1 1 1 151 1 1 13 TYR CE1 C -1.258 7.071 4.628 1.00 . A A . 13 TYR CE1 1 1 1 152 1 1 13 TYR CE2 C -1.694 6.055 2.462 1.00 . A A . 13 TYR CE2 1 1 1 153 1 1 13 TYR CG C -2.460 4.944 4.507 1.00 . A A . 13 TYR CG 1 1 1 154 1 1 13 TYR CZ C -1.139 7.091 3.230 1.00 . A A . 13 TYR CZ 1 1 1 155 1 1 13 TYR H H -3.501 4.405 7.790 1.00 . A A . 13 TYR H 1 1 1 156 1 1 13 TYR HA H -4.892 5.392 5.339 1.00 . A A . 13 TYR HA 1 1 1 157 1 1 13 TYR HB2 H -2.790 3.295 5.851 1.00 . A A . 13 TYR HB2 1 1 1 158 1 1 13 TYR HB3 H -3.752 3.256 4.388 1.00 . A A . 13 TYR HB3 1 1 1 159 1 1 13 TYR HD1 H -1.910 5.956 6.351 1.00 . A A . 13 TYR HD1 1 1 1 160 1 1 13 TYR HD2 H -2.851 4.232 2.497 1.00 . A A . 13 TYR HD2 1 1 1 161 1 1 13 TYR HE1 H -0.906 7.914 5.200 1.00 . A A . 13 TYR HE1 1 1 1 162 1 1 13 TYR HE2 H -1.619 6.082 1.385 1.00 . A A . 13 TYR HE2 1 1 1 163 1 1 13 TYR HH H -0.414 7.943 1.677 1.00 . A A . 13 TYR HH 1 1 1 164 1 1 13 TYR N N -4.125 4.996 7.253 1.00 . A A . 13 TYR N 1 1 1 165 1 1 13 TYR O O -5.955 2.780 6.897 1.00 . A A . 13 TYR O 1 1 1 166 1 1 13 TYR OH O -0.478 8.105 2.619 1.00 . A A . 13 TYR OH 1 1 1 167 1 1 14 SER C C -8.407 2.992 3.291 1.00 . A A . 14 SER C 1 1 1 168 1 1 14 SER CA C -7.782 2.746 4.684 1.00 . A A . 14 SER CA 1 1 1 169 1 1 14 SER CB C -8.809 2.933 5.815 1.00 . A A . 14 SER CB 1 1 1 170 1 1 14 SER H H -6.339 4.255 4.184 1.00 . A A . 14 SER H 1 1 1 171 1 1 14 SER HA H -7.460 1.702 4.707 1.00 . A A . 14 SER HA 1 1 1 172 1 1 14 SER HB2 H -8.432 2.481 6.738 1.00 . A A . 14 SER HB2 1 1 1 173 1 1 14 SER HB3 H -8.975 3.995 6.007 1.00 . A A . 14 SER HB3 1 1 1 174 1 1 14 SER HG H -9.946 1.379 5.389 1.00 . A A . 14 SER HG 1 1 1 175 1 1 14 SER N N -6.596 3.598 4.906 1.00 . A A . 14 SER N 1 1 1 176 1 1 14 SER O O -8.509 2.076 2.476 1.00 . A A . 14 SER O 1 1 1 177 1 1 14 SER OG O -10.049 2.334 5.469 1.00 . A A . 14 SER OG 1 1 1 178 1 1 15 GLY C C -8.203 4.248 0.500 1.00 . A A . 15 GLY C 1 1 1 179 1 1 15 GLY CA C -9.172 4.679 1.630 1.00 . A A . 15 GLY CA 1 1 1 180 1 1 15 GLY H H -8.692 4.941 3.707 1.00 . A A . 15 GLY H 1 1 1 181 1 1 15 GLY HA2 H -10.168 4.276 1.448 1.00 . A A . 15 GLY HA2 1 1 1 182 1 1 15 GLY HA3 H -9.234 5.766 1.612 1.00 . A A . 15 GLY HA3 1 1 1 183 1 1 15 GLY N N -8.760 4.249 2.978 1.00 . A A . 15 GLY N 1 1 1 184 1 1 15 GLY O O -7.006 4.081 0.758 1.00 . A A . 15 GLY O 1 1 1 185 1 1 16 PRO C C -6.807 4.288 -2.410 1.00 . A A . 16 PRO C 1 1 1 186 1 1 16 PRO CA C -7.923 3.396 -1.812 1.00 . A A . 16 PRO CA 1 1 1 187 1 1 16 PRO CB C -9.000 2.983 -2.834 1.00 . A A . 16 PRO CB 1 1 1 188 1 1 16 PRO CD C -10.043 4.346 -1.195 1.00 . A A . 16 PRO CD 1 1 1 189 1 1 16 PRO CG C -10.023 4.113 -2.707 1.00 . A A . 16 PRO CG 1 1 1 190 1 1 16 PRO HA H -7.451 2.485 -1.431 1.00 . A A . 16 PRO HA 1 1 1 191 1 1 16 PRO HB2 H -8.625 2.873 -3.854 1.00 . A A . 16 PRO HB2 1 1 1 192 1 1 16 PRO HB3 H -9.475 2.046 -2.522 1.00 . A A . 16 PRO HB3 1 1 1 193 1 1 16 PRO HD2 H -10.352 5.371 -0.967 1.00 . A A . 16 PRO HD2 1 1 1 194 1 1 16 PRO HD3 H -10.739 3.636 -0.740 1.00 . A A . 16 PRO HD3 1 1 1 195 1 1 16 PRO HG2 H -9.646 5.002 -3.223 1.00 . A A . 16 PRO HG2 1 1 1 196 1 1 16 PRO HG3 H -11.001 3.838 -3.109 1.00 . A A . 16 PRO HG3 1 1 1 197 1 1 16 PRO N N -8.684 4.057 -0.746 1.00 . A A . 16 PRO N 1 1 1 198 1 1 16 PRO O O -6.868 4.700 -3.565 1.00 . A A . 16 PRO O 1 1 1 199 1 1 17 THR C C -3.604 4.338 -3.011 1.00 . A A . 17 THR C 1 1 1 200 1 1 17 THR CA C -4.499 5.232 -2.119 1.00 . A A . 17 THR CA 1 1 1 201 1 1 17 THR CB C -3.708 5.755 -0.901 1.00 . A A . 17 THR CB 1 1 1 202 1 1 17 THR CG2 C -4.532 6.757 -0.084 1.00 . A A . 17 THR CG2 1 1 1 203 1 1 17 THR H H -5.730 4.140 -0.726 1.00 . A A . 17 THR H 1 1 1 204 1 1 17 THR HA H -4.773 6.101 -2.723 1.00 . A A . 17 THR HA 1 1 1 205 1 1 17 THR HB H -2.803 6.273 -1.240 1.00 . A A . 17 THR HB 1 1 1 206 1 1 17 THR HG1 H -4.008 4.021 -0.034 1.00 . A A . 17 THR HG1 1 1 1 207 1 1 17 THR HG21 H -4.847 7.581 -0.725 1.00 . A A . 17 THR HG21 1 1 1 208 1 1 17 THR HG22 H -5.416 6.279 0.337 1.00 . A A . 17 THR HG22 1 1 1 209 1 1 17 THR HG23 H -3.926 7.151 0.732 1.00 . A A . 17 THR HG23 1 1 1 210 1 1 17 THR N N -5.729 4.537 -1.660 1.00 . A A . 17 THR N 1 1 1 211 1 1 17 THR O O -2.392 4.261 -2.846 1.00 . A A . 17 THR O 1 1 1 212 1 1 17 THR OG1 O -3.321 4.698 -0.045 1.00 . A A . 17 THR OG1 1 1 1 213 1 1 18 VAL C C -2.614 2.286 -5.478 1.00 . A A . 18 VAL C 1 1 1 214 1 1 18 VAL CA C -3.733 2.285 -4.402 1.00 . A A . 18 VAL CA 1 1 1 215 1 1 18 VAL CB C -4.950 1.387 -4.745 1.00 . A A . 18 VAL CB 1 1 1 216 1 1 18 VAL CG1 C -5.829 1.903 -5.899 1.00 . A A . 18 VAL CG1 1 1 1 217 1 1 18 VAL CG2 C -4.529 -0.062 -5.038 1.00 . A A . 18 VAL CG2 1 1 1 218 1 1 18 VAL H H -5.195 3.817 -4.076 1.00 . A A . 18 VAL H 1 1 1 219 1 1 18 VAL HA H -3.302 1.791 -3.530 1.00 . A A . 18 VAL HA 1 1 1 220 1 1 18 VAL HB H -5.587 1.359 -3.853 1.00 . A A . 18 VAL HB 1 1 1 221 1 1 18 VAL HG11 H -6.111 2.941 -5.736 1.00 . A A . 18 VAL HG11 1 1 1 222 1 1 18 VAL HG12 H -5.313 1.826 -6.855 1.00 . A A . 18 VAL HG12 1 1 1 223 1 1 18 VAL HG13 H -6.739 1.306 -5.953 1.00 . A A . 18 VAL HG13 1 1 1 224 1 1 18 VAL HG21 H -3.943 -0.455 -4.207 1.00 . A A . 18 VAL HG21 1 1 1 225 1 1 18 VAL HG22 H -5.415 -0.683 -5.169 1.00 . A A . 18 VAL HG22 1 1 1 226 1 1 18 VAL HG23 H -3.932 -0.113 -5.949 1.00 . A A . 18 VAL HG23 1 1 1 227 1 1 18 VAL N N -4.215 3.597 -3.939 1.00 . A A . 18 VAL N 1 1 1 228 1 1 18 VAL O O -2.880 2.214 -6.677 1.00 . A A . 18 VAL O 1 1 1 229 1 1 19 CYS C C -0.583 0.016 -6.018 1.00 . A A . 19 CYS C 1 1 1 230 1 1 19 CYS CA C -0.292 1.541 -5.837 1.00 . A A . 19 CYS CA 1 1 1 231 1 1 19 CYS CB C 1.099 1.813 -5.220 1.00 . A A . 19 CYS CB 1 1 1 232 1 1 19 CYS H H -1.186 2.344 -4.057 1.00 . A A . 19 CYS H 1 1 1 233 1 1 19 CYS HA H -0.287 1.994 -6.831 1.00 . A A . 19 CYS HA 1 1 1 234 1 1 19 CYS HB2 H 1.273 2.888 -5.155 1.00 . A A . 19 CYS HB2 1 1 1 235 1 1 19 CYS HB3 H 1.116 1.402 -4.213 1.00 . A A . 19 CYS HB3 1 1 1 236 1 1 19 CYS N N -1.345 2.209 -5.048 1.00 . A A . 19 CYS N 1 1 1 237 1 1 19 CYS O O -1.360 -0.590 -5.278 1.00 . A A . 19 CYS O 1 1 1 238 1 1 19 CYS SG S 2.480 1.080 -6.166 1.00 . A A . 19 CYS SG 1 1 1 239 1 1 20 ALA C C 0.146 -3.115 -6.371 1.00 . A A . 20 ALA C 1 1 1 240 1 1 20 ALA CA C -0.138 -2.006 -7.439 1.00 . A A . 20 ALA CA 1 1 1 241 1 1 20 ALA CB C 0.694 -2.185 -8.725 1.00 . A A . 20 ALA CB 1 1 1 242 1 1 20 ALA H H 0.595 -0.025 -7.631 1.00 . A A . 20 ALA H 1 1 1 243 1 1 20 ALA HA H -1.184 -2.133 -7.721 1.00 . A A . 20 ALA HA 1 1 1 244 1 1 20 ALA HB1 H 0.392 -1.448 -9.473 1.00 . A A . 20 ALA HB1 1 1 1 245 1 1 20 ALA HB2 H 1.753 -2.041 -8.505 1.00 . A A . 20 ALA HB2 1 1 1 246 1 1 20 ALA HB3 H 0.555 -3.174 -9.162 1.00 . A A . 20 ALA HB3 1 1 1 247 1 1 20 ALA N N 0.016 -0.602 -7.041 1.00 . A A . 20 ALA N 1 1 1 248 1 1 20 ALA O O 0.456 -2.875 -5.203 1.00 . A A . 20 ALA O 1 1 1 249 1 1 21 SER C C 1.457 -5.848 -5.281 1.00 . A A . 21 SER C 1 1 1 250 1 1 21 SER CA C 0.140 -5.641 -6.075 1.00 . A A . 21 SER CA 1 1 1 251 1 1 21 SER CB C -0.024 -6.774 -7.107 1.00 . A A . 21 SER CB 1 1 1 252 1 1 21 SER H H -0.257 -4.449 -7.779 1.00 . A A . 21 SER H 1 1 1 253 1 1 21 SER HA H -0.677 -5.739 -5.359 1.00 . A A . 21 SER HA 1 1 1 254 1 1 21 SER HB2 H 0.616 -6.569 -7.972 1.00 . A A . 21 SER HB2 1 1 1 255 1 1 21 SER HB3 H 0.319 -7.731 -6.698 1.00 . A A . 21 SER HB3 1 1 1 256 1 1 21 SER HG H -1.818 -7.362 -6.713 1.00 . A A . 21 SER HG 1 1 1 257 1 1 21 SER N N -0.009 -4.370 -6.809 1.00 . A A . 21 SER N 1 1 1 258 1 1 21 SER O O 2.357 -6.520 -5.773 1.00 . A A . 21 SER O 1 1 1 259 1 1 21 SER OG O -1.399 -6.885 -7.451 1.00 . A A . 21 SER OG 1 1 1 260 1 1 22 GLY C C 2.753 -7.025 -2.534 1.00 . A A . 22 GLY C 1 1 1 261 1 1 22 GLY CA C 2.676 -5.602 -3.131 1.00 . A A . 22 GLY CA 1 1 1 262 1 1 22 GLY H H 0.741 -4.839 -3.689 1.00 . A A . 22 GLY H 1 1 1 263 1 1 22 GLY HA2 H 3.603 -5.397 -3.671 1.00 . A A . 22 GLY HA2 1 1 1 264 1 1 22 GLY HA3 H 2.619 -4.899 -2.301 1.00 . A A . 22 GLY HA3 1 1 1 265 1 1 22 GLY N N 1.524 -5.380 -4.028 1.00 . A A . 22 GLY N 1 1 1 266 1 1 22 GLY O O 3.828 -7.602 -2.394 1.00 . A A . 22 GLY O 1 1 1 267 1 1 23 THR C C 1.969 -8.998 -0.065 1.00 . A A . 23 THR C 1 1 1 268 1 1 23 THR CA C 1.393 -8.906 -1.492 1.00 . A A . 23 THR CA 1 1 1 269 1 1 23 THR CB C 1.755 -10.132 -2.373 1.00 . A A . 23 THR CB 1 1 1 270 1 1 23 THR CG2 C 3.097 -10.814 -2.085 1.00 . A A . 23 THR CG2 1 1 1 271 1 1 23 THR H H 0.786 -7.011 -2.271 1.00 . A A . 23 THR H 1 1 1 272 1 1 23 THR HA H 0.310 -8.943 -1.358 1.00 . A A . 23 THR HA 1 1 1 273 1 1 23 THR HB H 1.740 -9.833 -3.427 1.00 . A A . 23 THR HB 1 1 1 274 1 1 23 THR HG1 H 0.899 -11.541 -1.323 1.00 . A A . 23 THR HG1 1 1 1 275 1 1 23 THR HG21 H 3.133 -11.184 -1.061 1.00 . A A . 23 THR HG21 1 1 1 276 1 1 23 THR HG22 H 3.217 -11.665 -2.756 1.00 . A A . 23 THR HG22 1 1 1 277 1 1 23 THR HG23 H 3.919 -10.121 -2.255 1.00 . A A . 23 THR HG23 1 1 1 278 1 1 23 THR N N 1.597 -7.599 -2.164 1.00 . A A . 23 THR N 1 1 1 279 1 1 23 THR O O 1.267 -9.386 0.864 1.00 . A A . 23 THR O 1 1 1 280 1 1 23 THR OG1 O 0.787 -11.152 -2.198 1.00 . A A . 23 THR OG1 1 1 1 281 1 1 24 THR C C 3.719 -6.645 1.600 1.00 . A A . 24 THR C 1 1 1 282 1 1 24 THR CA C 3.816 -8.178 1.399 1.00 . A A . 24 THR CA 1 1 1 283 1 1 24 THR CB C 5.267 -8.680 1.545 1.00 . A A . 24 THR CB 1 1 1 284 1 1 24 THR CG2 C 5.414 -10.169 1.213 1.00 . A A . 24 THR CG2 1 1 1 285 1 1 24 THR H H 3.731 -8.324 -0.720 1.00 . A A . 24 THR H 1 1 1 286 1 1 24 THR HA H 3.243 -8.630 2.213 1.00 . A A . 24 THR HA 1 1 1 287 1 1 24 THR HB H 5.577 -8.537 2.584 1.00 . A A . 24 THR HB 1 1 1 288 1 1 24 THR HG1 H 5.979 -8.146 -0.198 1.00 . A A . 24 THR HG1 1 1 1 289 1 1 24 THR HG21 H 4.687 -10.749 1.782 1.00 . A A . 24 THR HG21 1 1 1 290 1 1 24 THR HG22 H 5.255 -10.343 0.151 1.00 . A A . 24 THR HG22 1 1 1 291 1 1 24 THR HG23 H 6.418 -10.499 1.475 1.00 . A A . 24 THR HG23 1 1 1 292 1 1 24 THR N N 3.232 -8.602 0.114 1.00 . A A . 24 THR N 1 1 1 293 1 1 24 THR O O 3.244 -5.916 0.725 1.00 . A A . 24 THR O 1 1 1 294 1 1 24 THR OG1 O 6.150 -7.946 0.728 1.00 . A A . 24 THR OG1 1 1 1 295 1 1 25 CYS C C 4.926 -4.037 3.833 1.00 . A A . 25 CYS C 1 1 1 296 1 1 25 CYS CA C 3.705 -4.858 3.334 1.00 . A A . 25 CYS CA 1 1 1 297 1 1 25 CYS CB C 2.664 -5.140 4.440 1.00 . A A . 25 CYS CB 1 1 1 298 1 1 25 CYS H H 4.538 -6.814 3.427 1.00 . A A . 25 CYS H 1 1 1 299 1 1 25 CYS HA H 3.211 -4.258 2.567 1.00 . A A . 25 CYS HA 1 1 1 300 1 1 25 CYS HB2 H 1.947 -5.883 4.099 1.00 . A A . 25 CYS HB2 1 1 1 301 1 1 25 CYS HB3 H 3.163 -5.537 5.322 1.00 . A A . 25 CYS HB3 1 1 1 302 1 1 25 CYS N N 4.097 -6.168 2.791 1.00 . A A . 25 CYS N 1 1 1 303 1 1 25 CYS O O 5.267 -4.100 5.011 1.00 . A A . 25 CYS O 1 1 1 304 1 1 25 CYS SG S 1.698 -3.713 4.970 1.00 . A A . 25 CYS SG 1 1 1 305 1 1 26 GLN C C 6.580 -1.004 3.266 1.00 . A A . 26 GLN C 1 1 1 306 1 1 26 GLN CA C 6.829 -2.538 3.231 1.00 . A A . 26 GLN CA 1 1 1 307 1 1 26 GLN CB C 8.009 -3.016 2.360 1.00 . A A . 26 GLN CB 1 1 1 308 1 1 26 GLN CD C 10.593 -2.913 2.200 1.00 . A A . 26 GLN CD 1 1 1 309 1 1 26 GLN CG C 9.348 -2.652 3.040 1.00 . A A . 26 GLN CG 1 1 1 310 1 1 26 GLN H H 5.282 -3.355 1.980 1.00 . A A . 26 GLN H 1 1 1 311 1 1 26 GLN HA H 7.134 -2.769 4.255 1.00 . A A . 26 GLN HA 1 1 1 312 1 1 26 GLN HB2 H 7.967 -4.104 2.276 1.00 . A A . 26 GLN HB2 1 1 1 313 1 1 26 GLN HB3 H 7.944 -2.594 1.356 1.00 . A A . 26 GLN HB3 1 1 1 314 1 1 26 GLN HE21 H 10.016 -4.780 1.631 1.00 . A A . 26 GLN HE21 1 1 1 315 1 1 26 GLN HE22 H 11.560 -4.157 1.036 1.00 . A A . 26 GLN HE22 1 1 1 316 1 1 26 GLN HG2 H 9.345 -1.593 3.296 1.00 . A A . 26 GLN HG2 1 1 1 317 1 1 26 GLN HG3 H 9.463 -3.226 3.961 1.00 . A A . 26 GLN HG3 1 1 1 318 1 1 26 GLN N N 5.619 -3.327 2.927 1.00 . A A . 26 GLN N 1 1 1 319 1 1 26 GLN NE2 N 10.726 -4.073 1.592 1.00 . A A . 26 GLN NE2 1 1 1 320 1 1 26 GLN O O 5.975 -0.539 4.224 1.00 . A A . 26 GLN O 1 1 1 321 1 1 26 GLN OE1 O 11.478 -2.081 2.102 1.00 . A A . 26 GLN OE1 1 1 1 322 1 1 27 VAL C C 7.128 1.945 0.870 1.00 . A A . 27 VAL C 1 1 1 323 1 1 27 VAL CA C 6.787 1.272 2.232 1.00 . A A . 27 VAL CA 1 1 1 324 1 1 27 VAL CB C 7.550 1.988 3.383 1.00 . A A . 27 VAL CB 1 1 1 325 1 1 27 VAL CG1 C 9.062 2.066 3.111 1.00 . A A . 27 VAL CG1 1 1 1 326 1 1 27 VAL CG2 C 7.002 3.400 3.648 1.00 . A A . 27 VAL CG2 1 1 1 327 1 1 27 VAL H H 7.496 -0.609 1.499 1.00 . A A . 27 VAL H 1 1 1 328 1 1 27 VAL HA H 5.730 1.428 2.408 1.00 . A A . 27 VAL HA 1 1 1 329 1 1 27 VAL HB H 7.423 1.433 4.314 1.00 . A A . 27 VAL HB 1 1 1 330 1 1 27 VAL HG11 H 9.450 1.071 2.900 1.00 . A A . 27 VAL HG11 1 1 1 331 1 1 27 VAL HG12 H 9.273 2.719 2.262 1.00 . A A . 27 VAL HG12 1 1 1 332 1 1 27 VAL HG13 H 9.584 2.466 3.979 1.00 . A A . 27 VAL HG13 1 1 1 333 1 1 27 VAL HG21 H 5.926 3.366 3.833 1.00 . A A . 27 VAL HG21 1 1 1 334 1 1 27 VAL HG22 H 7.483 3.824 4.528 1.00 . A A . 27 VAL HG22 1 1 1 335 1 1 27 VAL HG23 H 7.202 4.045 2.800 1.00 . A A . 27 VAL HG23 1 1 1 336 1 1 27 VAL N N 7.009 -0.198 2.279 1.00 . A A . 27 VAL N 1 1 1 337 1 1 27 VAL O O 8.125 1.591 0.250 1.00 . A A . 27 VAL O 1 1 1 338 1 1 28 LEU C C 7.371 5.292 0.322 1.00 . A A . 28 LEU C 1 1 1 339 1 1 28 LEU CA C 6.873 4.052 -0.454 1.00 . A A . 28 LEU CA 1 1 1 340 1 1 28 LEU CB C 5.787 4.529 -1.451 1.00 . A A . 28 LEU CB 1 1 1 341 1 1 28 LEU CD1 C 3.833 2.978 -1.061 1.00 . A A . 28 LEU CD1 1 1 1 342 1 1 28 LEU CD2 C 4.084 4.198 -3.227 1.00 . A A . 28 LEU CD2 1 1 1 343 1 1 28 LEU CG C 4.850 3.494 -2.090 1.00 . A A . 28 LEU CG 1 1 1 344 1 1 28 LEU H H 5.542 3.163 1.003 1.00 . A A . 28 LEU H 1 1 1 345 1 1 28 LEU HA H 7.701 3.661 -1.048 1.00 . A A . 28 LEU HA 1 1 1 346 1 1 28 LEU HB2 H 5.136 5.273 -0.989 1.00 . A A . 28 LEU HB2 1 1 1 347 1 1 28 LEU HB3 H 6.321 5.043 -2.251 1.00 . A A . 28 LEU HB3 1 1 1 348 1 1 28 LEU HD11 H 3.540 3.784 -0.395 1.00 . A A . 28 LEU HD11 1 1 1 349 1 1 28 LEU HD12 H 2.954 2.580 -1.562 1.00 . A A . 28 LEU HD12 1 1 1 350 1 1 28 LEU HD13 H 4.257 2.187 -0.455 1.00 . A A . 28 LEU HD13 1 1 1 351 1 1 28 LEU HD21 H 3.533 5.055 -2.839 1.00 . A A . 28 LEU HD21 1 1 1 352 1 1 28 LEU HD22 H 4.782 4.544 -3.991 1.00 . A A . 28 LEU HD22 1 1 1 353 1 1 28 LEU HD23 H 3.379 3.511 -3.692 1.00 . A A . 28 LEU HD23 1 1 1 354 1 1 28 LEU HG H 5.426 2.660 -2.505 1.00 . A A . 28 LEU HG 1 1 1 355 1 1 28 LEU N N 6.395 3.007 0.486 1.00 . A A . 28 LEU N 1 1 1 356 1 1 28 LEU O O 8.519 5.723 0.248 1.00 . A A . 28 LEU O 1 1 1 357 1 1 29 ASN C C 6.032 6.663 3.369 1.00 . A A . 29 ASN C 1 1 1 358 1 1 29 ASN CA C 6.596 7.037 1.971 1.00 . A A . 29 ASN CA 1 1 1 359 1 1 29 ASN CB C 5.863 8.246 1.358 1.00 . A A . 29 ASN CB 1 1 1 360 1 1 29 ASN CG C 6.213 8.529 -0.104 1.00 . A A . 29 ASN CG 1 1 1 361 1 1 29 ASN H H 5.540 5.429 1.082 1.00 . A A . 29 ASN H 1 1 1 362 1 1 29 ASN HA H 7.658 7.279 2.050 1.00 . A A . 29 ASN HA 1 1 1 363 1 1 29 ASN HB2 H 4.786 8.071 1.411 1.00 . A A . 29 ASN HB2 1 1 1 364 1 1 29 ASN HB3 H 6.085 9.143 1.937 1.00 . A A . 29 ASN HB3 1 1 1 365 1 1 29 ASN HD21 H 8.198 8.110 0.114 1.00 . A A . 29 ASN HD21 1 1 1 366 1 1 29 ASN HD22 H 7.624 8.625 -1.470 1.00 . A A . 29 ASN HD22 1 1 1 367 1 1 29 ASN N N 6.440 5.888 1.078 1.00 . A A . 29 ASN N 1 1 1 368 1 1 29 ASN ND2 N 7.472 8.468 -0.488 1.00 . A A . 29 ASN ND2 1 1 1 369 1 1 29 ASN O O 4.985 6.015 3.420 1.00 . A A . 29 ASN O 1 1 1 370 1 1 29 ASN OD1 O 5.348 8.803 -0.918 1.00 . A A . 29 ASN OD1 1 1 1 371 1 1 30 PRO C C 5.044 6.019 6.202 1.00 . A A . 30 PRO C 1 1 1 372 1 1 30 PRO CA C 6.452 6.547 5.848 1.00 . A A . 30 PRO CA 1 1 1 373 1 1 30 PRO CB C 6.912 7.694 6.752 1.00 . A A . 30 PRO CB 1 1 1 374 1 1 30 PRO CD C 7.761 8.038 4.521 1.00 . A A . 30 PRO CD 1 1 1 375 1 1 30 PRO CG C 8.138 8.211 5.997 1.00 . A A . 30 PRO CG 1 1 1 376 1 1 30 PRO HA H 7.144 5.715 6.003 1.00 . A A . 30 PRO HA 1 1 1 377 1 1 30 PRO HB2 H 6.156 8.482 6.798 1.00 . A A . 30 PRO HB2 1 1 1 378 1 1 30 PRO HB3 H 7.154 7.352 7.761 1.00 . A A . 30 PRO HB3 1 1 1 379 1 1 30 PRO HD2 H 7.391 8.987 4.129 1.00 . A A . 30 PRO HD2 1 1 1 380 1 1 30 PRO HD3 H 8.644 7.727 3.959 1.00 . A A . 30 PRO HD3 1 1 1 381 1 1 30 PRO HG2 H 8.365 9.249 6.247 1.00 . A A . 30 PRO HG2 1 1 1 382 1 1 30 PRO HG3 H 8.998 7.581 6.236 1.00 . A A . 30 PRO HG3 1 1 1 383 1 1 30 PRO N N 6.694 7.041 4.484 1.00 . A A . 30 PRO N 1 1 1 384 1 1 30 PRO O O 4.899 4.879 6.633 1.00 . A A . 30 PRO O 1 1 1 385 1 1 31 TYR C C 2.071 5.249 5.535 1.00 . A A . 31 TYR C 1 1 1 386 1 1 31 TYR CA C 2.625 6.423 6.392 1.00 . A A . 31 TYR CA 1 1 1 387 1 1 31 TYR CB C 1.656 7.622 6.301 1.00 . A A . 31 TYR CB 1 1 1 388 1 1 31 TYR CD1 C 2.969 9.067 7.995 1.00 . A A . 31 TYR CD1 1 1 1 389 1 1 31 TYR CD2 C 0.721 9.735 7.316 1.00 . A A . 31 TYR CD2 1 1 1 390 1 1 31 TYR CE1 C 3.019 10.163 8.881 1.00 . A A . 31 TYR CE1 1 1 1 391 1 1 31 TYR CE2 C 0.768 10.820 8.216 1.00 . A A . 31 TYR CE2 1 1 1 392 1 1 31 TYR CG C 1.810 8.837 7.214 1.00 . A A . 31 TYR CG 1 1 1 393 1 1 31 TYR CZ C 1.917 11.029 8.998 1.00 . A A . 31 TYR CZ 1 1 1 394 1 1 31 TYR H H 4.150 7.761 5.688 1.00 . A A . 31 TYR H 1 1 1 395 1 1 31 TYR HA H 2.633 6.069 7.424 1.00 . A A . 31 TYR HA 1 1 1 396 1 1 31 TYR HB2 H 1.616 7.974 5.268 1.00 . A A . 31 TYR HB2 1 1 1 397 1 1 31 TYR HB3 H 0.681 7.208 6.562 1.00 . A A . 31 TYR HB3 1 1 1 398 1 1 31 TYR HD1 H 3.820 8.409 7.950 1.00 . A A . 31 TYR HD1 1 1 1 399 1 1 31 TYR HD2 H -0.168 9.584 6.720 1.00 . A A . 31 TYR HD2 1 1 1 400 1 1 31 TYR HE1 H 3.893 10.333 9.491 1.00 . A A . 31 TYR HE1 1 1 1 401 1 1 31 TYR HE2 H -0.085 11.477 8.315 1.00 . A A . 31 TYR HE2 1 1 1 402 1 1 31 TYR HH H 1.127 12.536 9.882 1.00 . A A . 31 TYR HH 1 1 1 403 1 1 31 TYR N N 3.994 6.831 6.043 1.00 . A A . 31 TYR N 1 1 1 404 1 1 31 TYR O O 1.293 4.423 6.018 1.00 . A A . 31 TYR O 1 1 1 405 1 1 31 TYR OH O 1.963 12.069 9.869 1.00 . A A . 31 TYR OH 1 1 1 406 1 1 32 TYR C C 2.719 2.959 3.141 1.00 . A A . 32 TYR C 1 1 1 407 1 1 32 TYR CA C 1.869 4.253 3.264 1.00 . A A . 32 TYR CA 1 1 1 408 1 1 32 TYR CB C 1.684 5.004 1.926 1.00 . A A . 32 TYR CB 1 1 1 409 1 1 32 TYR CD1 C -0.073 3.306 1.134 1.00 . A A . 32 TYR CD1 1 1 1 410 1 1 32 TYR CD2 C 1.135 4.620 -0.528 1.00 . A A . 32 TYR CD2 1 1 1 411 1 1 32 TYR CE1 C -0.671 2.557 0.103 1.00 . A A . 32 TYR CE1 1 1 1 412 1 1 32 TYR CE2 C 0.540 3.863 -1.560 1.00 . A A . 32 TYR CE2 1 1 1 413 1 1 32 TYR CG C 0.904 4.286 0.828 1.00 . A A . 32 TYR CG 1 1 1 414 1 1 32 TYR CZ C -0.343 2.818 -1.240 1.00 . A A . 32 TYR CZ 1 1 1 415 1 1 32 TYR H H 3.162 5.814 3.942 1.00 . A A . 32 TYR H 1 1 1 416 1 1 32 TYR HA H 0.875 3.977 3.614 1.00 . A A . 32 TYR HA 1 1 1 417 1 1 32 TYR HB2 H 1.169 5.945 2.112 1.00 . A A . 32 TYR HB2 1 1 1 418 1 1 32 TYR HB3 H 2.677 5.262 1.543 1.00 . A A . 32 TYR HB3 1 1 1 419 1 1 32 TYR HD1 H -0.385 3.123 2.148 1.00 . A A . 32 TYR HD1 1 1 1 420 1 1 32 TYR HD2 H 1.834 5.409 -0.779 1.00 . A A . 32 TYR HD2 1 1 1 421 1 1 32 TYR HE1 H -1.368 1.777 0.344 1.00 . A A . 32 TYR HE1 1 1 1 422 1 1 32 TYR HE2 H 0.770 4.072 -2.594 1.00 . A A . 32 TYR HE2 1 1 1 423 1 1 32 TYR HH H -1.780 1.843 -1.952 1.00 . A A . 32 TYR HH 1 1 1 424 1 1 32 TYR N N 2.422 5.192 4.246 1.00 . A A . 32 TYR N 1 1 1 425 1 1 32 TYR O O 3.589 2.862 2.274 1.00 . A A . 32 TYR O 1 1 1 426 1 1 32 TYR OH O -0.881 2.041 -2.214 1.00 . A A . 32 TYR OH 1 1 1 427 1 1 33 SER C C 3.303 -0.283 3.000 1.00 . A A . 33 SER C 1 1 1 428 1 1 33 SER CA C 3.299 0.744 4.176 1.00 . A A . 33 SER CA 1 1 1 429 1 1 33 SER CB C 2.890 0.032 5.489 1.00 . A A . 33 SER CB 1 1 1 430 1 1 33 SER H H 1.821 2.186 4.752 1.00 . A A . 33 SER H 1 1 1 431 1 1 33 SER HA H 4.314 1.117 4.295 1.00 . A A . 33 SER HA 1 1 1 432 1 1 33 SER HB2 H 2.850 0.741 6.315 1.00 . A A . 33 SER HB2 1 1 1 433 1 1 33 SER HB3 H 1.895 -0.418 5.388 1.00 . A A . 33 SER HB3 1 1 1 434 1 1 33 SER HG H 4.506 -1.095 5.207 1.00 . A A . 33 SER HG 1 1 1 435 1 1 33 SER N N 2.467 1.962 4.007 1.00 . A A . 33 SER N 1 1 1 436 1 1 33 SER O O 3.073 -1.473 3.195 1.00 . A A . 33 SER O 1 1 1 437 1 1 33 SER OG O 3.813 -0.974 5.875 1.00 . A A . 33 SER OG 1 1 1 438 1 1 34 GLN C C 4.139 -0.711 -0.558 1.00 . A A . 34 GLN C 1 1 1 439 1 1 34 GLN CA C 3.085 -0.637 0.575 1.00 . A A . 34 GLN CA 1 1 1 440 1 1 34 GLN CB C 1.742 0.019 0.184 1.00 . A A . 34 GLN CB 1 1 1 441 1 1 34 GLN CD C 0.623 -2.056 -0.800 1.00 . A A . 34 GLN CD 1 1 1 442 1 1 34 GLN CG C 0.985 -0.596 -0.995 1.00 . A A . 34 GLN CG 1 1 1 443 1 1 34 GLN H H 3.753 1.111 1.620 1.00 . A A . 34 GLN H 1 1 1 444 1 1 34 GLN HA H 2.898 -1.680 0.842 1.00 . A A . 34 GLN HA 1 1 1 445 1 1 34 GLN HB2 H 1.081 -0.032 1.054 1.00 . A A . 34 GLN HB2 1 1 1 446 1 1 34 GLN HB3 H 1.905 1.077 -0.028 1.00 . A A . 34 GLN HB3 1 1 1 447 1 1 34 GLN HE21 H 1.003 -2.553 -2.742 1.00 . A A . 34 GLN HE21 1 1 1 448 1 1 34 GLN HE22 H 0.287 -3.757 -1.642 1.00 . A A . 34 GLN HE22 1 1 1 449 1 1 34 GLN HG2 H 0.043 -0.068 -1.116 1.00 . A A . 34 GLN HG2 1 1 1 450 1 1 34 GLN HG3 H 1.550 -0.463 -1.904 1.00 . A A . 34 GLN HG3 1 1 1 451 1 1 34 GLN N N 3.512 0.135 1.751 1.00 . A A . 34 GLN N 1 1 1 452 1 1 34 GLN NE2 N 0.751 -2.874 -1.821 1.00 . A A . 34 GLN NE2 1 1 1 453 1 1 34 GLN O O 5.162 -0.042 -0.490 1.00 . A A . 34 GLN O 1 1 1 454 1 1 34 GLN OE1 O 0.173 -2.456 0.260 1.00 . A A . 34 GLN OE1 1 1 1 455 1 1 35 CYS C C 5.908 -1.232 -3.120 1.00 . A A . 35 CYS C 1 1 1 456 1 1 35 CYS CA C 4.363 -1.237 -2.979 1.00 . A A . 35 CYS CA 1 1 1 457 1 1 35 CYS CB C 3.640 0.028 -3.476 1.00 . A A . 35 CYS CB 1 1 1 458 1 1 35 CYS H H 3.078 -2.119 -1.519 1.00 . A A . 35 CYS H 1 1 1 459 1 1 35 CYS HA H 4.003 -2.051 -3.615 1.00 . A A . 35 CYS HA 1 1 1 460 1 1 35 CYS HB2 H 2.621 -0.260 -3.709 1.00 . A A . 35 CYS HB2 1 1 1 461 1 1 35 CYS HB3 H 3.622 0.767 -2.683 1.00 . A A . 35 CYS HB3 1 1 1 462 1 1 35 CYS N N 3.860 -1.494 -1.615 1.00 . A A . 35 CYS N 1 1 1 463 1 1 35 CYS O O 6.562 -0.204 -2.967 1.00 . A A . 35 CYS O 1 1 1 464 1 1 35 CYS SG S 4.215 0.963 -4.905 1.00 . A A . 35 CYS SG 1 1 1 465 1 1 36 LEU C C 8.272 -2.982 -5.013 1.00 . A A . 36 LEU C 1 1 1 466 1 1 36 LEU CA C 7.862 -2.774 -3.530 1.00 . A A . 36 LEU CA 1 1 1 467 1 1 36 LEU CB C 8.147 -4.061 -2.713 1.00 . A A . 36 LEU CB 1 1 1 468 1 1 36 LEU CD1 C 5.928 -4.929 -1.713 1.00 . A A . 36 LEU CD1 1 1 1 469 1 1 36 LEU CD2 C 8.060 -5.297 -0.517 1.00 . A A . 36 LEU CD2 1 1 1 470 1 1 36 LEU CG C 7.313 -4.308 -1.426 1.00 . A A . 36 LEU CG 1 1 1 471 1 1 36 LEU H H 5.828 -3.143 -3.731 1.00 . A A . 36 LEU H 1 1 1 472 1 1 36 LEU HA H 8.476 -1.966 -3.123 1.00 . A A . 36 LEU HA 1 1 1 473 1 1 36 LEU HB2 H 8.019 -4.933 -3.358 1.00 . A A . 36 LEU HB2 1 1 1 474 1 1 36 LEU HB3 H 9.204 -4.019 -2.445 1.00 . A A . 36 LEU HB3 1 1 1 475 1 1 36 LEU HD11 H 6.036 -5.782 -2.384 1.00 . A A . 36 LEU HD11 1 1 1 476 1 1 36 LEU HD12 H 5.469 -5.279 -0.787 1.00 . A A . 36 LEU HD12 1 1 1 477 1 1 36 LEU HD13 H 5.246 -4.214 -2.162 1.00 . A A . 36 LEU HD13 1 1 1 478 1 1 36 LEU HD21 H 9.057 -4.919 -0.296 1.00 . A A . 36 LEU HD21 1 1 1 479 1 1 36 LEU HD22 H 7.517 -5.431 0.419 1.00 . A A . 36 LEU HD22 1 1 1 480 1 1 36 LEU HD23 H 8.151 -6.268 -1.007 1.00 . A A . 36 LEU HD23 1 1 1 481 1 1 36 LEU HG H 7.195 -3.367 -0.883 1.00 . A A . 36 LEU HG 1 1 1 482 1 1 36 LEU N N 6.446 -2.420 -3.408 1.00 . A A . 36 LEU N 1 1 1 483 1 1 36 LEU O O 9.473 -2.799 -5.314 1.00 . A A . 36 LEU O 1 1 1 484 1 1 36 LEU OXT O 7.384 -3.368 -5.814 1.00 . A A . 36 LEU OXT 1 1 2 485 1 1 1 THR C C -6.294 -5.851 -7.600 1.00 . A A . 1 THR C 1 1 2 486 1 1 1 THR CA C -6.203 -5.800 -9.150 1.00 . A A . 1 THR CA 1 1 2 487 1 1 1 THR CB C -5.771 -4.391 -9.598 1.00 . A A . 1 THR CB 1 1 2 488 1 1 1 THR CG2 C -5.552 -4.258 -11.110 1.00 . A A . 1 THR CG2 1 1 2 489 1 1 1 THR H1 H -7.907 -6.987 -9.405 1.00 . A A . 1 THR H1 1 1 2 490 1 1 1 THR H2 H -8.112 -5.379 -9.650 1.00 . A A . 1 THR H2 1 1 2 491 1 1 1 THR H3 H -7.372 -6.279 -10.814 1.00 . A A . 1 THR H3 1 1 2 492 1 1 1 THR HA H -5.437 -6.515 -9.461 1.00 . A A . 1 THR HA 1 1 2 493 1 1 1 THR HB H -4.848 -4.140 -9.076 1.00 . A A . 1 THR HB 1 1 2 494 1 1 1 THR HG1 H -6.494 -2.590 -9.403 1.00 . A A . 1 THR HG1 1 1 2 495 1 1 1 THR HG21 H -4.815 -4.982 -11.452 1.00 . A A . 1 THR HG21 1 1 2 496 1 1 1 THR HG22 H -6.484 -4.392 -11.657 1.00 . A A . 1 THR HG22 1 1 2 497 1 1 1 THR HG23 H -5.177 -3.259 -11.334 1.00 . A A . 1 THR HG23 1 1 2 498 1 1 1 THR N N -7.492 -6.166 -9.817 1.00 . A A . 1 THR N 1 1 2 499 1 1 1 THR O O -7.393 -5.694 -7.074 1.00 . A A . 1 THR O 1 1 2 500 1 1 1 THR OG1 O -6.816 -3.494 -9.287 1.00 . A A . 1 THR OG1 1 1 2 501 1 1 2 GLN C C -4.729 -5.472 -4.438 1.00 . A A . 2 GLN C 1 1 2 502 1 1 2 GLN CA C -5.248 -6.536 -5.446 1.00 . A A . 2 GLN CA 1 1 2 503 1 1 2 GLN CB C -4.494 -7.871 -5.311 1.00 . A A . 2 GLN CB 1 1 2 504 1 1 2 GLN CD C -5.791 -8.513 -3.192 1.00 . A A . 2 GLN CD 1 1 2 505 1 1 2 GLN CG C -4.423 -8.397 -3.861 1.00 . A A . 2 GLN CG 1 1 2 506 1 1 2 GLN H H -4.319 -6.258 -7.353 1.00 . A A . 2 GLN H 1 1 2 507 1 1 2 GLN HA H -6.283 -6.749 -5.162 1.00 . A A . 2 GLN HA 1 1 2 508 1 1 2 GLN HB2 H -4.997 -8.618 -5.931 1.00 . A A . 2 GLN HB2 1 1 2 509 1 1 2 GLN HB3 H -3.473 -7.754 -5.686 1.00 . A A . 2 GLN HB3 1 1 2 510 1 1 2 GLN HE21 H -5.329 -7.200 -1.697 1.00 . A A . 2 GLN HE21 1 1 2 511 1 1 2 GLN HE22 H -6.940 -7.905 -1.716 1.00 . A A . 2 GLN HE22 1 1 2 512 1 1 2 GLN HG2 H -3.978 -9.394 -3.874 1.00 . A A . 2 GLN HG2 1 1 2 513 1 1 2 GLN HG3 H -3.772 -7.754 -3.268 1.00 . A A . 2 GLN HG3 1 1 2 514 1 1 2 GLN N N -5.205 -6.151 -6.875 1.00 . A A . 2 GLN N 1 1 2 515 1 1 2 GLN NE2 N -6.025 -7.792 -2.114 1.00 . A A . 2 GLN NE2 1 1 2 516 1 1 2 GLN O O -3.520 -5.322 -4.268 1.00 . A A . 2 GLN O 1 1 2 517 1 1 2 GLN OE1 O -6.667 -9.211 -3.673 1.00 . A A . 2 GLN OE1 1 1 2 518 1 1 3 SER C C -4.539 -4.315 -1.511 1.00 . A A . 3 SER C 1 1 2 519 1 1 3 SER CA C -5.363 -3.764 -2.699 1.00 . A A . 3 SER CA 1 1 2 520 1 1 3 SER CB C -6.692 -3.147 -2.222 1.00 . A A . 3 SER CB 1 1 2 521 1 1 3 SER H H -6.613 -4.976 -3.917 1.00 . A A . 3 SER H 1 1 2 522 1 1 3 SER HA H -4.790 -2.942 -3.139 1.00 . A A . 3 SER HA 1 1 2 523 1 1 3 SER HB2 H -6.497 -2.355 -1.489 1.00 . A A . 3 SER HB2 1 1 2 524 1 1 3 SER HB3 H -7.211 -2.702 -3.076 1.00 . A A . 3 SER HB3 1 1 2 525 1 1 3 SER HG H -7.081 -4.506 -0.872 1.00 . A A . 3 SER HG 1 1 2 526 1 1 3 SER N N -5.639 -4.769 -3.747 1.00 . A A . 3 SER N 1 1 2 527 1 1 3 SER O O -5.082 -4.702 -0.478 1.00 . A A . 3 SER O 1 1 2 528 1 1 3 SER OG O -7.531 -4.134 -1.646 1.00 . A A . 3 SER OG 1 1 2 529 1 1 4 HIS C C -0.802 -4.498 -1.261 1.00 . A A . 4 HIS C 1 1 2 530 1 1 4 HIS CA C -2.215 -4.953 -0.798 1.00 . A A . 4 HIS CA 1 1 2 531 1 1 4 HIS CB C -2.411 -6.484 -0.736 1.00 . A A . 4 HIS CB 1 1 2 532 1 1 4 HIS CD2 C -2.198 -8.133 1.262 1.00 . A A . 4 HIS CD2 1 1 2 533 1 1 4 HIS CE1 C -0.065 -7.896 1.622 1.00 . A A . 4 HIS CE1 1 1 2 534 1 1 4 HIS CG C -1.703 -7.206 0.381 1.00 . A A . 4 HIS CG 1 1 2 535 1 1 4 HIS H H -2.918 -4.106 -2.632 1.00 . A A . 4 HIS H 1 1 2 536 1 1 4 HIS HA H -2.389 -4.545 0.197 1.00 . A A . 4 HIS HA 1 1 2 537 1 1 4 HIS HB2 H -3.469 -6.694 -0.589 1.00 . A A . 4 HIS HB2 1 1 2 538 1 1 4 HIS HB3 H -2.131 -6.928 -1.687 1.00 . A A . 4 HIS HB3 1 1 2 539 1 1 4 HIS HD2 H -3.216 -8.491 1.297 1.00 . A A . 4 HIS HD2 1 1 2 540 1 1 4 HIS HE1 H 0.917 -8.031 2.050 1.00 . A A . 4 HIS HE1 1 1 2 541 1 1 4 HIS HE2 H -1.166 -9.293 2.744 1.00 . A A . 4 HIS HE2 1 1 2 542 1 1 4 HIS N N -3.223 -4.388 -1.707 1.00 . A A . 4 HIS N 1 1 2 543 1 1 4 HIS ND1 N -0.344 -7.038 0.635 1.00 . A A . 4 HIS ND1 1 1 2 544 1 1 4 HIS NE2 N -1.144 -8.580 2.031 1.00 . A A . 4 HIS NE2 1 1 2 545 1 1 4 HIS O O -0.111 -3.767 -0.554 1.00 . A A . 4 HIS O 1 1 2 546 1 1 5 ALA C C -0.382 -2.709 -3.883 1.00 . A A . 5 ALA C 1 1 2 547 1 1 5 ALA CA C 0.386 -3.970 -3.397 1.00 . A A . 5 ALA CA 1 1 2 548 1 1 5 ALA CB C 0.841 -4.826 -4.591 1.00 . A A . 5 ALA CB 1 1 2 549 1 1 5 ALA H H -1.144 -5.382 -3.010 1.00 . A A . 5 ALA H 1 1 2 550 1 1 5 ALA HA H 1.280 -3.664 -2.842 1.00 . A A . 5 ALA HA 1 1 2 551 1 1 5 ALA HB1 H -0.022 -5.173 -5.158 1.00 . A A . 5 ALA HB1 1 1 2 552 1 1 5 ALA HB2 H 1.485 -4.247 -5.253 1.00 . A A . 5 ALA HB2 1 1 2 553 1 1 5 ALA HB3 H 1.406 -5.690 -4.249 1.00 . A A . 5 ALA HB3 1 1 2 554 1 1 5 ALA N N -0.478 -4.797 -2.532 1.00 . A A . 5 ALA N 1 1 2 555 1 1 5 ALA O O -1.489 -2.823 -4.414 1.00 . A A . 5 ALA O 1 1 2 556 1 1 6 GLY C C -1.356 0.024 -2.420 1.00 . A A . 6 GLY C 1 1 2 557 1 1 6 GLY CA C -0.602 -0.245 -3.737 1.00 . A A . 6 GLY CA 1 1 2 558 1 1 6 GLY H H 1.096 -1.460 -3.283 1.00 . A A . 6 GLY H 1 1 2 559 1 1 6 GLY HA2 H 0.091 0.577 -3.927 1.00 . A A . 6 GLY HA2 1 1 2 560 1 1 6 GLY HA3 H -1.320 -0.257 -4.560 1.00 . A A . 6 GLY HA3 1 1 2 561 1 1 6 GLY N N 0.159 -1.505 -3.673 1.00 . A A . 6 GLY N 1 1 2 562 1 1 6 GLY O O -2.521 -0.343 -2.286 1.00 . A A . 6 GLY O 1 1 2 563 1 1 7 GLN C C -2.259 0.034 0.508 1.00 . A A . 7 GLN C 1 1 2 564 1 1 7 GLN CA C -1.070 0.872 -0.046 1.00 . A A . 7 GLN CA 1 1 2 565 1 1 7 GLN CB C -1.231 2.397 0.155 1.00 . A A . 7 GLN CB 1 1 2 566 1 1 7 GLN CD C -2.323 2.850 2.516 1.00 . A A . 7 GLN CD 1 1 2 567 1 1 7 GLN CG C -1.082 2.891 1.616 1.00 . A A . 7 GLN CG 1 1 2 568 1 1 7 GLN H H 0.309 0.812 -1.661 1.00 . A A . 7 GLN H 1 1 2 569 1 1 7 GLN HA H -0.197 0.602 0.549 1.00 . A A . 7 GLN HA 1 1 2 570 1 1 7 GLN HB2 H -0.439 2.888 -0.411 1.00 . A A . 7 GLN HB2 1 1 2 571 1 1 7 GLN HB3 H -2.165 2.745 -0.274 1.00 . A A . 7 GLN HB3 1 1 2 572 1 1 7 GLN HE21 H -3.590 2.148 1.096 1.00 . A A . 7 GLN HE21 1 1 2 573 1 1 7 GLN HE22 H -4.267 2.483 2.675 1.00 . A A . 7 GLN HE22 1 1 2 574 1 1 7 GLN HG2 H -0.278 2.344 2.111 1.00 . A A . 7 GLN HG2 1 1 2 575 1 1 7 GLN HG3 H -0.788 3.942 1.582 1.00 . A A . 7 GLN HG3 1 1 2 576 1 1 7 GLN N N -0.649 0.591 -1.430 1.00 . A A . 7 GLN N 1 1 2 577 1 1 7 GLN NE2 N -3.500 2.526 2.029 1.00 . A A . 7 GLN NE2 1 1 2 578 1 1 7 GLN O O -3.421 0.414 0.385 1.00 . A A . 7 GLN O 1 1 2 579 1 1 7 GLN OE1 O -2.238 3.108 3.704 1.00 . A A . 7 GLN OE1 1 1 2 580 1 1 8 CYS C C -3.725 -1.030 3.027 1.00 . A A . 8 CYS C 1 1 2 581 1 1 8 CYS CA C -2.820 -1.862 2.067 1.00 . A A . 8 CYS CA 1 1 2 582 1 1 8 CYS CB C -1.944 -2.901 2.808 1.00 . A A . 8 CYS CB 1 1 2 583 1 1 8 CYS H H -0.985 -1.392 1.078 1.00 . A A . 8 CYS H 1 1 2 584 1 1 8 CYS HA H -3.506 -2.425 1.427 1.00 . A A . 8 CYS HA 1 1 2 585 1 1 8 CYS HB2 H -2.521 -3.394 3.589 1.00 . A A . 8 CYS HB2 1 1 2 586 1 1 8 CYS HB3 H -1.643 -3.663 2.092 1.00 . A A . 8 CYS HB3 1 1 2 587 1 1 8 CYS N N -1.937 -1.075 1.186 1.00 . A A . 8 CYS N 1 1 2 588 1 1 8 CYS O O -4.937 -0.970 2.844 1.00 . A A . 8 CYS O 1 1 2 589 1 1 8 CYS SG S -0.389 -2.306 3.529 1.00 . A A . 8 CYS SG 1 1 2 590 1 1 9 GLY C C -3.014 0.709 6.329 1.00 . A A . 9 GLY C 1 1 2 591 1 1 9 GLY CA C -3.876 0.342 5.099 1.00 . A A . 9 GLY CA 1 1 2 592 1 1 9 GLY H H -2.154 -0.514 4.172 1.00 . A A . 9 GLY H 1 1 2 593 1 1 9 GLY HA2 H -4.267 1.263 4.665 1.00 . A A . 9 GLY HA2 1 1 2 594 1 1 9 GLY HA3 H -4.728 -0.245 5.450 1.00 . A A . 9 GLY HA3 1 1 2 595 1 1 9 GLY N N -3.147 -0.413 4.066 1.00 . A A . 9 GLY N 1 1 2 596 1 1 9 GLY O O -3.098 0.053 7.364 1.00 . A A . 9 GLY O 1 1 2 597 1 1 10 GLY C C -1.821 3.469 8.011 1.00 . A A . 10 GLY C 1 1 2 598 1 1 10 GLY CA C -1.270 2.244 7.247 1.00 . A A . 10 GLY CA 1 1 2 599 1 1 10 GLY H H -2.198 2.241 5.319 1.00 . A A . 10 GLY H 1 1 2 600 1 1 10 GLY HA2 H -1.057 1.466 7.981 1.00 . A A . 10 GLY HA2 1 1 2 601 1 1 10 GLY HA3 H -0.325 2.506 6.770 1.00 . A A . 10 GLY HA3 1 1 2 602 1 1 10 GLY N N -2.172 1.742 6.199 1.00 . A A . 10 GLY N 1 1 2 603 1 1 10 GLY O O -2.901 3.411 8.596 1.00 . A A . 10 GLY O 1 1 2 604 1 1 11 ILE C C -2.008 6.927 7.933 1.00 . A A . 11 ILE C 1 1 2 605 1 1 11 ILE CA C -1.438 5.793 8.818 1.00 . A A . 11 ILE CA 1 1 2 606 1 1 11 ILE CB C -0.236 6.251 9.678 1.00 . A A . 11 ILE CB 1 1 2 607 1 1 11 ILE CD1 C 1.505 5.405 11.407 1.00 . A A . 11 ILE CD1 1 1 2 608 1 1 11 ILE CG1 C 0.256 5.087 10.572 1.00 . A A . 11 ILE CG1 1 1 2 609 1 1 11 ILE CG2 C -0.610 7.478 10.531 1.00 . A A . 11 ILE CG2 1 1 2 610 1 1 11 ILE H H -0.248 4.611 7.462 1.00 . A A . 11 ILE H 1 1 2 611 1 1 11 ILE HA H -2.210 5.528 9.547 1.00 . A A . 11 ILE HA 1 1 2 612 1 1 11 ILE HB H 0.564 6.564 9.011 1.00 . A A . 11 ILE HB 1 1 2 613 1 1 11 ILE HD11 H 2.314 5.752 10.766 1.00 . A A . 11 ILE HD11 1 1 2 614 1 1 11 ILE HD12 H 1.288 6.162 12.161 1.00 . A A . 11 ILE HD12 1 1 2 615 1 1 11 ILE HD13 H 1.834 4.502 11.923 1.00 . A A . 11 ILE HD13 1 1 2 616 1 1 11 ILE HG12 H -0.548 4.783 11.244 1.00 . A A . 11 ILE HG12 1 1 2 617 1 1 11 ILE HG13 H 0.512 4.228 9.950 1.00 . A A . 11 ILE HG13 1 1 2 618 1 1 11 ILE HG21 H -0.942 8.303 9.900 1.00 . A A . 11 ILE HG21 1 1 2 619 1 1 11 ILE HG22 H -1.408 7.223 11.231 1.00 . A A . 11 ILE HG22 1 1 2 620 1 1 11 ILE HG23 H 0.255 7.836 11.089 1.00 . A A . 11 ILE HG23 1 1 2 621 1 1 11 ILE N N -1.090 4.594 8.025 1.00 . A A . 11 ILE N 1 1 2 622 1 1 11 ILE O O -1.355 7.396 7.003 1.00 . A A . 11 ILE O 1 1 2 623 1 1 12 GLY C C -4.766 7.714 6.212 1.00 . A A . 12 GLY C 1 1 2 624 1 1 12 GLY CA C -4.006 8.328 7.409 1.00 . A A . 12 GLY CA 1 1 2 625 1 1 12 GLY H H -3.695 6.941 9.017 1.00 . A A . 12 GLY H 1 1 2 626 1 1 12 GLY HA2 H -4.747 8.803 8.054 1.00 . A A . 12 GLY HA2 1 1 2 627 1 1 12 GLY HA3 H -3.345 9.114 7.039 1.00 . A A . 12 GLY HA3 1 1 2 628 1 1 12 GLY N N -3.241 7.363 8.221 1.00 . A A . 12 GLY N 1 1 2 629 1 1 12 GLY O O -5.023 8.392 5.221 1.00 . A A . 12 GLY O 1 1 2 630 1 1 13 TYR C C -6.644 4.474 5.887 1.00 . A A . 13 TYR C 1 1 2 631 1 1 13 TYR CA C -5.826 5.645 5.282 1.00 . A A . 13 TYR CA 1 1 2 632 1 1 13 TYR CB C -4.774 5.151 4.253 1.00 . A A . 13 TYR CB 1 1 2 633 1 1 13 TYR CD1 C -5.874 4.925 1.968 1.00 . A A . 13 TYR CD1 1 1 2 634 1 1 13 TYR CD2 C -4.379 6.813 2.367 1.00 . A A . 13 TYR CD2 1 1 2 635 1 1 13 TYR CE1 C -6.157 5.422 0.677 1.00 . A A . 13 TYR CE1 1 1 2 636 1 1 13 TYR CE2 C -4.624 7.278 1.058 1.00 . A A . 13 TYR CE2 1 1 2 637 1 1 13 TYR CG C -5.005 5.633 2.827 1.00 . A A . 13 TYR CG 1 1 2 638 1 1 13 TYR CZ C -5.514 6.587 0.218 1.00 . A A . 13 TYR CZ 1 1 2 639 1 1 13 TYR H H -4.913 5.954 7.172 1.00 . A A . 13 TYR H 1 1 2 640 1 1 13 TYR HA H -6.554 6.294 4.784 1.00 . A A . 13 TYR HA 1 1 2 641 1 1 13 TYR HB2 H -3.771 5.466 4.549 1.00 . A A . 13 TYR HB2 1 1 2 642 1 1 13 TYR HB3 H -4.741 4.061 4.251 1.00 . A A . 13 TYR HB3 1 1 2 643 1 1 13 TYR HD1 H -6.318 3.998 2.293 1.00 . A A . 13 TYR HD1 1 1 2 644 1 1 13 TYR HD2 H -3.720 7.363 3.022 1.00 . A A . 13 TYR HD2 1 1 2 645 1 1 13 TYR HE1 H -6.863 4.903 0.044 1.00 . A A . 13 TYR HE1 1 1 2 646 1 1 13 TYR HE2 H -4.148 8.178 0.701 1.00 . A A . 13 TYR HE2 1 1 2 647 1 1 13 TYR HH H -6.420 6.510 -1.479 1.00 . A A . 13 TYR HH 1 1 2 648 1 1 13 TYR N N -5.146 6.436 6.317 1.00 . A A . 13 TYR N 1 1 2 649 1 1 13 TYR O O -6.646 4.264 7.096 1.00 . A A . 13 TYR O 1 1 2 650 1 1 13 TYR OH O -5.750 7.038 -1.043 1.00 . A A . 13 TYR OH 1 1 2 651 1 1 14 SER C C -8.745 1.853 4.112 1.00 . A A . 14 SER C 1 1 2 652 1 1 14 SER CA C -8.035 2.443 5.353 1.00 . A A . 14 SER CA 1 1 2 653 1 1 14 SER CB C -9.014 2.593 6.538 1.00 . A A . 14 SER CB 1 1 2 654 1 1 14 SER H H -7.252 3.968 4.064 1.00 . A A . 14 SER H 1 1 2 655 1 1 14 SER HA H -7.281 1.711 5.653 1.00 . A A . 14 SER HA 1 1 2 656 1 1 14 SER HB2 H -8.465 2.733 7.472 1.00 . A A . 14 SER HB2 1 1 2 657 1 1 14 SER HB3 H -9.658 3.462 6.390 1.00 . A A . 14 SER HB3 1 1 2 658 1 1 14 SER HG H -9.269 0.662 6.819 1.00 . A A . 14 SER HG 1 1 2 659 1 1 14 SER N N -7.336 3.709 5.035 1.00 . A A . 14 SER N 1 1 2 660 1 1 14 SER O O -8.568 0.687 3.768 1.00 . A A . 14 SER O 1 1 2 661 1 1 14 SER OG O -9.824 1.436 6.673 1.00 . A A . 14 SER OG 1 1 2 662 1 1 15 GLY C C -8.981 1.987 1.016 1.00 . A A . 15 GLY C 1 1 2 663 1 1 15 GLY CA C -10.065 2.325 2.074 1.00 . A A . 15 GLY CA 1 1 2 664 1 1 15 GLY H H -9.645 3.616 3.739 1.00 . A A . 15 GLY H 1 1 2 665 1 1 15 GLY HA2 H -10.739 1.478 2.222 1.00 . A A . 15 GLY HA2 1 1 2 666 1 1 15 GLY HA3 H -10.658 3.162 1.702 1.00 . A A . 15 GLY HA3 1 1 2 667 1 1 15 GLY N N -9.518 2.679 3.394 1.00 . A A . 15 GLY N 1 1 2 668 1 1 15 GLY O O -7.891 2.562 1.053 1.00 . A A . 15 GLY O 1 1 2 669 1 1 16 PRO C C -7.765 1.567 -1.905 1.00 . A A . 16 PRO C 1 1 2 670 1 1 16 PRO CA C -8.245 0.536 -0.853 1.00 . A A . 16 PRO CA 1 1 2 671 1 1 16 PRO CB C -8.932 -0.676 -1.508 1.00 . A A . 16 PRO CB 1 1 2 672 1 1 16 PRO CD C -10.541 0.426 -0.138 1.00 . A A . 16 PRO CD 1 1 2 673 1 1 16 PRO CG C -10.410 -0.286 -1.483 1.00 . A A . 16 PRO CG 1 1 2 674 1 1 16 PRO HA H -7.379 0.190 -0.282 1.00 . A A . 16 PRO HA 1 1 2 675 1 1 16 PRO HB2 H -8.596 -0.873 -2.525 1.00 . A A . 16 PRO HB2 1 1 2 676 1 1 16 PRO HB3 H -8.790 -1.565 -0.891 1.00 . A A . 16 PRO HB3 1 1 2 677 1 1 16 PRO HD2 H -11.361 1.147 -0.173 1.00 . A A . 16 PRO HD2 1 1 2 678 1 1 16 PRO HD3 H -10.719 -0.308 0.653 1.00 . A A . 16 PRO HD3 1 1 2 679 1 1 16 PRO HG2 H -10.611 0.419 -2.292 1.00 . A A . 16 PRO HG2 1 1 2 680 1 1 16 PRO HG3 H -11.068 -1.151 -1.569 1.00 . A A . 16 PRO HG3 1 1 2 681 1 1 16 PRO N N -9.251 1.065 0.075 1.00 . A A . 16 PRO N 1 1 2 682 1 1 16 PRO O O -8.561 2.344 -2.424 1.00 . A A . 16 PRO O 1 1 2 683 1 1 17 THR C C -4.816 1.628 -4.168 1.00 . A A . 17 THR C 1 1 2 684 1 1 17 THR CA C -5.861 2.396 -3.321 1.00 . A A . 17 THR CA 1 1 2 685 1 1 17 THR CB C -5.341 3.718 -2.727 1.00 . A A . 17 THR CB 1 1 2 686 1 1 17 THR CG2 C -4.245 3.540 -1.672 1.00 . A A . 17 THR CG2 1 1 2 687 1 1 17 THR H H -5.854 0.949 -1.732 1.00 . A A . 17 THR H 1 1 2 688 1 1 17 THR HA H -6.639 2.688 -4.029 1.00 . A A . 17 THR HA 1 1 2 689 1 1 17 THR HB H -6.190 4.217 -2.254 1.00 . A A . 17 THR HB 1 1 2 690 1 1 17 THR HG1 H -4.291 5.229 -3.367 1.00 . A A . 17 THR HG1 1 1 2 691 1 1 17 THR HG21 H -4.587 2.860 -0.892 1.00 . A A . 17 THR HG21 1 1 2 692 1 1 17 THR HG22 H -3.339 3.141 -2.123 1.00 . A A . 17 THR HG22 1 1 2 693 1 1 17 THR HG23 H -4.006 4.501 -1.216 1.00 . A A . 17 THR HG23 1 1 2 694 1 1 17 THR N N -6.471 1.550 -2.261 1.00 . A A . 17 THR N 1 1 2 695 1 1 17 THR O O -3.603 1.785 -4.061 1.00 . A A . 17 THR O 1 1 2 696 1 1 17 THR OG1 O -4.860 4.558 -3.754 1.00 . A A . 17 THR OG1 1 1 2 697 1 1 18 VAL C C -3.740 -0.084 -6.867 1.00 . A A . 18 VAL C 1 1 2 698 1 1 18 VAL CA C -4.561 -0.407 -5.592 1.00 . A A . 18 VAL CA 1 1 2 699 1 1 18 VAL CB C -5.560 -1.551 -5.853 1.00 . A A . 18 VAL CB 1 1 2 700 1 1 18 VAL CG1 C -6.567 -1.242 -6.976 1.00 . A A . 18 VAL CG1 1 1 2 701 1 1 18 VAL CG2 C -4.823 -2.849 -6.184 1.00 . A A . 18 VAL CG2 1 1 2 702 1 1 18 VAL H H -6.325 0.686 -5.059 1.00 . A A . 18 VAL H 1 1 2 703 1 1 18 VAL HA H -3.857 -0.757 -4.832 1.00 . A A . 18 VAL HA 1 1 2 704 1 1 18 VAL HB H -6.125 -1.722 -4.933 1.00 . A A . 18 VAL HB 1 1 2 705 1 1 18 VAL HG11 H -7.058 -0.285 -6.806 1.00 . A A . 18 VAL HG11 1 1 2 706 1 1 18 VAL HG12 H -6.063 -1.204 -7.942 1.00 . A A . 18 VAL HG12 1 1 2 707 1 1 18 VAL HG13 H -7.332 -2.019 -7.007 1.00 . A A . 18 VAL HG13 1 1 2 708 1 1 18 VAL HG21 H -4.044 -3.034 -5.445 1.00 . A A . 18 VAL HG21 1 1 2 709 1 1 18 VAL HG22 H -5.555 -3.649 -6.169 1.00 . A A . 18 VAL HG22 1 1 2 710 1 1 18 VAL HG23 H -4.370 -2.813 -7.170 1.00 . A A . 18 VAL HG23 1 1 2 711 1 1 18 VAL N N -5.320 0.705 -4.993 1.00 . A A . 18 VAL N 1 1 2 712 1 1 18 VAL O O -4.164 0.714 -7.700 1.00 . A A . 18 VAL O 1 1 2 713 1 1 19 CYS C C -2.257 -2.025 -9.261 1.00 . A A . 19 CYS C 1 1 2 714 1 1 19 CYS CA C -1.882 -0.809 -8.361 1.00 . A A . 19 CYS CA 1 1 2 715 1 1 19 CYS CB C -0.376 -0.619 -8.103 1.00 . A A . 19 CYS CB 1 1 2 716 1 1 19 CYS H H -2.318 -1.405 -6.331 1.00 . A A . 19 CYS H 1 1 2 717 1 1 19 CYS HA H -2.175 0.058 -8.958 1.00 . A A . 19 CYS HA 1 1 2 718 1 1 19 CYS HB2 H 0.126 -0.522 -9.064 1.00 . A A . 19 CYS HB2 1 1 2 719 1 1 19 CYS HB3 H -0.220 0.311 -7.558 1.00 . A A . 19 CYS HB3 1 1 2 720 1 1 19 CYS N N -2.612 -0.784 -7.076 1.00 . A A . 19 CYS N 1 1 2 721 1 1 19 CYS O O -3.437 -2.302 -9.471 1.00 . A A . 19 CYS O 1 1 2 722 1 1 19 CYS SG S 0.487 -1.923 -7.191 1.00 . A A . 19 CYS SG 1 1 2 723 1 1 20 ALA C C -1.716 -5.253 -9.760 1.00 . A A . 20 ALA C 1 1 2 724 1 1 20 ALA CA C -1.513 -3.978 -10.623 1.00 . A A . 20 ALA CA 1 1 2 725 1 1 20 ALA CB C -0.358 -4.113 -11.630 1.00 . A A . 20 ALA CB 1 1 2 726 1 1 20 ALA H H -0.331 -2.504 -9.630 1.00 . A A . 20 ALA H 1 1 2 727 1 1 20 ALA HA H -2.419 -3.849 -11.220 1.00 . A A . 20 ALA HA 1 1 2 728 1 1 20 ALA HB1 H -0.320 -3.233 -12.276 1.00 . A A . 20 ALA HB1 1 1 2 729 1 1 20 ALA HB2 H 0.600 -4.202 -11.114 1.00 . A A . 20 ALA HB2 1 1 2 730 1 1 20 ALA HB3 H -0.505 -4.994 -12.258 1.00 . A A . 20 ALA HB3 1 1 2 731 1 1 20 ALA N N -1.287 -2.770 -9.811 1.00 . A A . 20 ALA N 1 1 2 732 1 1 20 ALA O O -2.827 -5.789 -9.671 1.00 . A A . 20 ALA O 1 1 2 733 1 1 21 SER C C 0.813 -7.005 -7.518 1.00 . A A . 21 SER C 1 1 2 734 1 1 21 SER CA C -0.573 -6.888 -8.202 1.00 . A A . 21 SER CA 1 1 2 735 1 1 21 SER CB C -0.925 -8.199 -8.930 1.00 . A A . 21 SER CB 1 1 2 736 1 1 21 SER H H 0.213 -5.193 -9.198 1.00 . A A . 21 SER H 1 1 2 737 1 1 21 SER HA H -1.298 -6.718 -7.403 1.00 . A A . 21 SER HA 1 1 2 738 1 1 21 SER HB2 H -1.829 -8.078 -9.531 1.00 . A A . 21 SER HB2 1 1 2 739 1 1 21 SER HB3 H -0.104 -8.474 -9.601 1.00 . A A . 21 SER HB3 1 1 2 740 1 1 21 SER HG H -1.187 -10.083 -8.407 1.00 . A A . 21 SER HG 1 1 2 741 1 1 21 SER N N -0.641 -5.732 -9.121 1.00 . A A . 21 SER N 1 1 2 742 1 1 21 SER O O 1.675 -6.167 -7.752 1.00 . A A . 21 SER O 1 1 2 743 1 1 21 SER OG O -1.146 -9.225 -7.970 1.00 . A A . 21 SER OG 1 1 2 744 1 1 22 GLY C C 1.924 -8.883 -4.486 1.00 . A A . 22 GLY C 1 1 2 745 1 1 22 GLY CA C 2.212 -8.308 -5.889 1.00 . A A . 22 GLY CA 1 1 2 746 1 1 22 GLY H H 0.243 -8.709 -6.673 1.00 . A A . 22 GLY H 1 1 2 747 1 1 22 GLY HA2 H 2.844 -9.014 -6.430 1.00 . A A . 22 GLY HA2 1 1 2 748 1 1 22 GLY HA3 H 2.790 -7.394 -5.744 1.00 . A A . 22 GLY HA3 1 1 2 749 1 1 22 GLY N N 0.999 -8.037 -6.688 1.00 . A A . 22 GLY N 1 1 2 750 1 1 22 GLY O O 2.674 -9.702 -3.968 1.00 . A A . 22 GLY O 1 1 2 751 1 1 23 THR C C 1.575 -8.245 -1.428 1.00 . A A . 23 THR C 1 1 2 752 1 1 23 THR CA C 0.475 -8.664 -2.436 1.00 . A A . 23 THR CA 1 1 2 753 1 1 23 THR CB C -0.170 -10.038 -2.147 1.00 . A A . 23 THR CB 1 1 2 754 1 1 23 THR CG2 C 0.707 -11.270 -2.400 1.00 . A A . 23 THR CG2 1 1 2 755 1 1 23 THR H H 0.261 -7.806 -4.395 1.00 . A A . 23 THR H 1 1 2 756 1 1 23 THR HA H -0.316 -7.948 -2.240 1.00 . A A . 23 THR HA 1 1 2 757 1 1 23 THR HB H -1.070 -10.137 -2.759 1.00 . A A . 23 THR HB 1 1 2 758 1 1 23 THR HG1 H 0.219 -10.098 -0.259 1.00 . A A . 23 THR HG1 1 1 2 759 1 1 23 THR HG21 H 1.662 -11.192 -1.879 1.00 . A A . 23 THR HG21 1 1 2 760 1 1 23 THR HG22 H 0.183 -12.161 -2.049 1.00 . A A . 23 THR HG22 1 1 2 761 1 1 23 THR HG23 H 0.893 -11.390 -3.468 1.00 . A A . 23 THR HG23 1 1 2 762 1 1 23 THR N N 0.816 -8.456 -3.863 1.00 . A A . 23 THR N 1 1 2 763 1 1 23 THR O O 1.923 -8.970 -0.494 1.00 . A A . 23 THR O 1 1 2 764 1 1 23 THR OG1 O -0.585 -10.093 -0.799 1.00 . A A . 23 THR OG1 1 1 2 765 1 1 24 THR C C 2.905 -5.227 -0.028 1.00 . A A . 24 THR C 1 1 2 766 1 1 24 THR CA C 3.247 -6.428 -0.936 1.00 . A A . 24 THR CA 1 1 2 767 1 1 24 THR CB C 4.288 -6.029 -1.994 1.00 . A A . 24 THR CB 1 1 2 768 1 1 24 THR CG2 C 4.871 -7.263 -2.689 1.00 . A A . 24 THR CG2 1 1 2 769 1 1 24 THR H H 1.761 -6.506 -2.421 1.00 . A A . 24 THR H 1 1 2 770 1 1 24 THR HA H 3.726 -7.169 -0.292 1.00 . A A . 24 THR HA 1 1 2 771 1 1 24 THR HB H 5.107 -5.508 -1.497 1.00 . A A . 24 THR HB 1 1 2 772 1 1 24 THR HG1 H 4.113 -5.330 -3.817 1.00 . A A . 24 THR HG1 1 1 2 773 1 1 24 THR HG21 H 5.239 -7.973 -1.950 1.00 . A A . 24 THR HG21 1 1 2 774 1 1 24 THR HG22 H 4.113 -7.748 -3.297 1.00 . A A . 24 THR HG22 1 1 2 775 1 1 24 THR HG23 H 5.696 -6.981 -3.344 1.00 . A A . 24 THR HG23 1 1 2 776 1 1 24 THR N N 2.083 -7.022 -1.615 1.00 . A A . 24 THR N 1 1 2 777 1 1 24 THR O O 3.329 -4.091 -0.246 1.00 . A A . 24 THR O 1 1 2 778 1 1 24 THR OG1 O 3.673 -5.193 -2.960 1.00 . A A . 24 THR OG1 1 1 2 779 1 1 25 CYS C C 3.449 -4.289 2.927 1.00 . A A . 25 CYS C 1 1 2 780 1 1 25 CYS CA C 2.088 -4.551 2.224 1.00 . A A . 25 CYS CA 1 1 2 781 1 1 25 CYS CB C 1.001 -5.087 3.175 1.00 . A A . 25 CYS CB 1 1 2 782 1 1 25 CYS H H 1.824 -6.410 1.163 1.00 . A A . 25 CYS H 1 1 2 783 1 1 25 CYS HA H 1.726 -3.595 1.833 1.00 . A A . 25 CYS HA 1 1 2 784 1 1 25 CYS HB2 H 0.098 -5.284 2.602 1.00 . A A . 25 CYS HB2 1 1 2 785 1 1 25 CYS HB3 H 1.330 -6.020 3.625 1.00 . A A . 25 CYS HB3 1 1 2 786 1 1 25 CYS N N 2.230 -5.488 1.096 1.00 . A A . 25 CYS N 1 1 2 787 1 1 25 CYS O O 3.704 -4.759 4.033 1.00 . A A . 25 CYS O 1 1 2 788 1 1 25 CYS SG S 0.462 -3.999 4.516 1.00 . A A . 25 CYS SG 1 1 2 789 1 1 26 GLN C C 5.749 -1.907 3.509 1.00 . A A . 26 GLN C 1 1 2 790 1 1 26 GLN CA C 5.706 -3.220 2.678 1.00 . A A . 26 GLN CA 1 1 2 791 1 1 26 GLN CB C 6.616 -3.199 1.420 1.00 . A A . 26 GLN CB 1 1 2 792 1 1 26 GLN CD C 7.987 -5.396 1.659 1.00 . A A . 26 GLN CD 1 1 2 793 1 1 26 GLN CG C 7.990 -3.865 1.645 1.00 . A A . 26 GLN CG 1 1 2 794 1 1 26 GLN H H 4.066 -3.295 1.309 1.00 . A A . 26 GLN H 1 1 2 795 1 1 26 GLN HA H 6.063 -3.999 3.355 1.00 . A A . 26 GLN HA 1 1 2 796 1 1 26 GLN HB2 H 6.143 -3.715 0.578 1.00 . A A . 26 GLN HB2 1 1 2 797 1 1 26 GLN HB3 H 6.768 -2.165 1.101 1.00 . A A . 26 GLN HB3 1 1 2 798 1 1 26 GLN HE21 H 5.998 -5.573 2.029 1.00 . A A . 26 GLN HE21 1 1 2 799 1 1 26 GLN HE22 H 6.952 -7.052 1.851 1.00 . A A . 26 GLN HE22 1 1 2 800 1 1 26 GLN HG2 H 8.650 -3.565 0.828 1.00 . A A . 26 GLN HG2 1 1 2 801 1 1 26 GLN HG3 H 8.439 -3.527 2.577 1.00 . A A . 26 GLN HG3 1 1 2 802 1 1 26 GLN N N 4.348 -3.577 2.240 1.00 . A A . 26 GLN N 1 1 2 803 1 1 26 GLN NE2 N 6.863 -6.051 1.859 1.00 . A A . 26 GLN NE2 1 1 2 804 1 1 26 GLN O O 4.726 -1.438 4.003 1.00 . A A . 26 GLN O 1 1 2 805 1 1 26 GLN OE1 O 9.018 -6.025 1.496 1.00 . A A . 26 GLN OE1 1 1 2 806 1 1 27 VAL C C 8.227 0.866 3.624 1.00 . A A . 27 VAL C 1 1 2 807 1 1 27 VAL CA C 7.103 0.031 4.287 1.00 . A A . 27 VAL CA 1 1 2 808 1 1 27 VAL CB C 7.284 -0.107 5.817 1.00 . A A . 27 VAL CB 1 1 2 809 1 1 27 VAL CG1 C 8.561 -0.859 6.226 1.00 . A A . 27 VAL CG1 1 1 2 810 1 1 27 VAL CG2 C 7.252 1.273 6.501 1.00 . A A . 27 VAL CG2 1 1 2 811 1 1 27 VAL H H 7.745 -1.725 3.250 1.00 . A A . 27 VAL H 1 1 2 812 1 1 27 VAL HA H 6.176 0.586 4.138 1.00 . A A . 27 VAL HA 1 1 2 813 1 1 27 VAL HB H 6.432 -0.675 6.200 1.00 . A A . 27 VAL HB 1 1 2 814 1 1 27 VAL HG11 H 8.608 -1.824 5.722 1.00 . A A . 27 VAL HG11 1 1 2 815 1 1 27 VAL HG12 H 9.452 -0.281 5.979 1.00 . A A . 27 VAL HG12 1 1 2 816 1 1 27 VAL HG13 H 8.540 -1.031 7.301 1.00 . A A . 27 VAL HG13 1 1 2 817 1 1 27 VAL HG21 H 6.323 1.794 6.261 1.00 . A A . 27 VAL HG21 1 1 2 818 1 1 27 VAL HG22 H 7.306 1.154 7.583 1.00 . A A . 27 VAL HG22 1 1 2 819 1 1 27 VAL HG23 H 8.094 1.889 6.182 1.00 . A A . 27 VAL HG23 1 1 2 820 1 1 27 VAL N N 6.929 -1.291 3.656 1.00 . A A . 27 VAL N 1 1 2 821 1 1 27 VAL O O 9.317 0.353 3.383 1.00 . A A . 27 VAL O 1 1 2 822 1 1 28 LEU C C 9.309 4.149 3.906 1.00 . A A . 28 LEU C 1 1 2 823 1 1 28 LEU CA C 8.943 3.120 2.810 1.00 . A A . 28 LEU CA 1 1 2 824 1 1 28 LEU CB C 8.389 3.835 1.560 1.00 . A A . 28 LEU CB 1 1 2 825 1 1 28 LEU CD1 C 7.503 1.805 0.254 1.00 . A A . 28 LEU CD1 1 1 2 826 1 1 28 LEU CD2 C 8.033 3.964 -0.905 1.00 . A A . 28 LEU CD2 1 1 2 827 1 1 28 LEU CG C 8.433 3.028 0.246 1.00 . A A . 28 LEU CG 1 1 2 828 1 1 28 LEU H H 7.004 2.437 3.497 1.00 . A A . 28 LEU H 1 1 2 829 1 1 28 LEU HA H 9.876 2.629 2.519 1.00 . A A . 28 LEU HA 1 1 2 830 1 1 28 LEU HB2 H 7.367 4.169 1.747 1.00 . A A . 28 LEU HB2 1 1 2 831 1 1 28 LEU HB3 H 9.003 4.725 1.395 1.00 . A A . 28 LEU HB3 1 1 2 832 1 1 28 LEU HD11 H 6.503 2.092 0.580 1.00 . A A . 28 LEU HD11 1 1 2 833 1 1 28 LEU HD12 H 7.443 1.376 -0.747 1.00 . A A . 28 LEU HD12 1 1 2 834 1 1 28 LEU HD13 H 7.892 1.033 0.915 1.00 . A A . 28 LEU HD13 1 1 2 835 1 1 28 LEU HD21 H 7.038 4.371 -0.724 1.00 . A A . 28 LEU HD21 1 1 2 836 1 1 28 LEU HD22 H 8.742 4.788 -0.980 1.00 . A A . 28 LEU HD22 1 1 2 837 1 1 28 LEU HD23 H 8.036 3.424 -1.851 1.00 . A A . 28 LEU HD23 1 1 2 838 1 1 28 LEU HG H 9.455 2.686 0.068 1.00 . A A . 28 LEU HG 1 1 2 839 1 1 28 LEU N N 7.957 2.140 3.312 1.00 . A A . 28 LEU N 1 1 2 840 1 1 28 LEU O O 10.453 4.254 4.341 1.00 . A A . 28 LEU O 1 1 2 841 1 1 29 ASN C C 7.146 5.130 6.553 1.00 . A A . 29 ASN C 1 1 2 842 1 1 29 ASN CA C 8.292 5.650 5.635 1.00 . A A . 29 ASN CA 1 1 2 843 1 1 29 ASN CB C 8.211 7.158 5.322 1.00 . A A . 29 ASN CB 1 1 2 844 1 1 29 ASN CG C 6.878 7.551 4.700 1.00 . A A . 29 ASN CG 1 1 2 845 1 1 29 ASN H H 7.402 4.703 3.956 1.00 . A A . 29 ASN H 1 1 2 846 1 1 29 ASN HA H 9.236 5.468 6.154 1.00 . A A . 29 ASN HA 1 1 2 847 1 1 29 ASN HB2 H 8.334 7.738 6.236 1.00 . A A . 29 ASN HB2 1 1 2 848 1 1 29 ASN HB3 H 9.032 7.438 4.658 1.00 . A A . 29 ASN HB3 1 1 2 849 1 1 29 ASN HD21 H 7.676 7.770 2.850 1.00 . A A . 29 ASN HD21 1 1 2 850 1 1 29 ASN HD22 H 5.940 8.035 3.022 1.00 . A A . 29 ASN HD22 1 1 2 851 1 1 29 ASN N N 8.302 4.897 4.370 1.00 . A A . 29 ASN N 1 1 2 852 1 1 29 ASN ND2 N 6.839 7.796 3.405 1.00 . A A . 29 ASN ND2 1 1 2 853 1 1 29 ASN O O 6.246 4.457 6.047 1.00 . A A . 29 ASN O 1 1 2 854 1 1 29 ASN OD1 O 5.867 7.623 5.379 1.00 . A A . 29 ASN OD1 1 1 2 855 1 1 30 PRO C C 4.731 4.778 8.460 1.00 . A A . 30 PRO C 1 1 2 856 1 1 30 PRO CA C 6.223 4.821 8.848 1.00 . A A . 30 PRO CA 1 1 2 857 1 1 30 PRO CB C 6.452 5.602 10.149 1.00 . A A . 30 PRO CB 1 1 2 858 1 1 30 PRO CD C 8.082 6.306 8.557 1.00 . A A . 30 PRO CD 1 1 2 859 1 1 30 PRO CG C 7.927 5.991 10.044 1.00 . A A . 30 PRO CG 1 1 2 860 1 1 30 PRO HA H 6.550 3.792 9.005 1.00 . A A . 30 PRO HA 1 1 2 861 1 1 30 PRO HB2 H 5.843 6.509 10.165 1.00 . A A . 30 PRO HB2 1 1 2 862 1 1 30 PRO HB3 H 6.236 4.996 11.032 1.00 . A A . 30 PRO HB3 1 1 2 863 1 1 30 PRO HD2 H 7.776 7.341 8.387 1.00 . A A . 30 PRO HD2 1 1 2 864 1 1 30 PRO HD3 H 9.120 6.168 8.253 1.00 . A A . 30 PRO HD3 1 1 2 865 1 1 30 PRO HG2 H 8.178 6.842 10.679 1.00 . A A . 30 PRO HG2 1 1 2 866 1 1 30 PRO HG3 H 8.548 5.132 10.310 1.00 . A A . 30 PRO HG3 1 1 2 867 1 1 30 PRO N N 7.146 5.421 7.872 1.00 . A A . 30 PRO N 1 1 2 868 1 1 30 PRO O O 4.033 3.827 8.797 1.00 . A A . 30 PRO O 1 1 2 869 1 1 31 TYR C C 2.493 4.880 6.131 1.00 . A A . 31 TYR C 1 1 2 870 1 1 31 TYR CA C 2.828 5.850 7.302 1.00 . A A . 31 TYR CA 1 1 2 871 1 1 31 TYR CB C 2.468 7.296 6.880 1.00 . A A . 31 TYR CB 1 1 2 872 1 1 31 TYR CD1 C 2.947 8.306 9.216 1.00 . A A . 31 TYR CD1 1 1 2 873 1 1 31 TYR CD2 C 1.849 9.660 7.508 1.00 . A A . 31 TYR CD2 1 1 2 874 1 1 31 TYR CE1 C 2.856 9.388 10.120 1.00 . A A . 31 TYR CE1 1 1 2 875 1 1 31 TYR CE2 C 1.770 10.743 8.410 1.00 . A A . 31 TYR CE2 1 1 2 876 1 1 31 TYR CG C 2.428 8.430 7.905 1.00 . A A . 31 TYR CG 1 1 2 877 1 1 31 TYR CZ C 2.271 10.601 9.715 1.00 . A A . 31 TYR CZ 1 1 2 878 1 1 31 TYR H H 4.834 6.562 7.504 1.00 . A A . 31 TYR H 1 1 2 879 1 1 31 TYR HA H 2.190 5.551 8.132 1.00 . A A . 31 TYR HA 1 1 2 880 1 1 31 TYR HB2 H 3.148 7.598 6.079 1.00 . A A . 31 TYR HB2 1 1 2 881 1 1 31 TYR HB3 H 1.461 7.255 6.455 1.00 . A A . 31 TYR HB3 1 1 2 882 1 1 31 TYR HD1 H 3.418 7.396 9.549 1.00 . A A . 31 TYR HD1 1 1 2 883 1 1 31 TYR HD2 H 1.466 9.774 6.502 1.00 . A A . 31 TYR HD2 1 1 2 884 1 1 31 TYR HE1 H 3.231 9.294 11.127 1.00 . A A . 31 TYR HE1 1 1 2 885 1 1 31 TYR HE2 H 1.326 11.676 8.096 1.00 . A A . 31 TYR HE2 1 1 2 886 1 1 31 TYR HH H 1.772 12.398 10.170 1.00 . A A . 31 TYR HH 1 1 2 887 1 1 31 TYR N N 4.225 5.799 7.759 1.00 . A A . 31 TYR N 1 1 2 888 1 1 31 TYR O O 1.322 4.550 5.934 1.00 . A A . 31 TYR O 1 1 2 889 1 1 31 TYR OH O 2.195 11.644 10.582 1.00 . A A . 31 TYR OH 1 1 2 890 1 1 32 TYR C C 3.847 3.045 3.225 1.00 . A A . 32 TYR C 1 1 2 891 1 1 32 TYR CA C 3.362 4.384 3.839 1.00 . A A . 32 TYR CA 1 1 2 892 1 1 32 TYR CB C 4.162 5.543 3.208 1.00 . A A . 32 TYR CB 1 1 2 893 1 1 32 TYR CD1 C 4.132 5.155 0.684 1.00 . A A . 32 TYR CD1 1 1 2 894 1 1 32 TYR CD2 C 2.935 7.080 1.606 1.00 . A A . 32 TYR CD2 1 1 2 895 1 1 32 TYR CE1 C 3.745 5.546 -0.617 1.00 . A A . 32 TYR CE1 1 1 2 896 1 1 32 TYR CE2 C 2.601 7.495 0.302 1.00 . A A . 32 TYR CE2 1 1 2 897 1 1 32 TYR CG C 3.727 5.925 1.802 1.00 . A A . 32 TYR CG 1 1 2 898 1 1 32 TYR CZ C 2.985 6.718 -0.803 1.00 . A A . 32 TYR CZ 1 1 2 899 1 1 32 TYR H H 4.420 4.697 5.653 1.00 . A A . 32 TYR H 1 1 2 900 1 1 32 TYR HA H 2.309 4.524 3.576 1.00 . A A . 32 TYR HA 1 1 2 901 1 1 32 TYR HB2 H 4.076 6.436 3.831 1.00 . A A . 32 TYR HB2 1 1 2 902 1 1 32 TYR HB3 H 5.226 5.289 3.185 1.00 . A A . 32 TYR HB3 1 1 2 903 1 1 32 TYR HD1 H 4.738 4.268 0.817 1.00 . A A . 32 TYR HD1 1 1 2 904 1 1 32 TYR HD2 H 2.595 7.656 2.454 1.00 . A A . 32 TYR HD2 1 1 2 905 1 1 32 TYR HE1 H 4.033 4.951 -1.468 1.00 . A A . 32 TYR HE1 1 1 2 906 1 1 32 TYR HE2 H 2.051 8.412 0.143 1.00 . A A . 32 TYR HE2 1 1 2 907 1 1 32 TYR HH H 2.879 6.449 -2.705 1.00 . A A . 32 TYR HH 1 1 2 908 1 1 32 TYR N N 3.488 4.521 5.301 1.00 . A A . 32 TYR N 1 1 2 909 1 1 32 TYR O O 5.016 2.675 3.370 1.00 . A A . 32 TYR O 1 1 2 910 1 1 32 TYR OH O 2.626 7.103 -2.055 1.00 . A A . 32 TYR OH 1 1 2 911 1 1 33 SER C C 3.054 1.737 -0.025 1.00 . A A . 33 SER C 1 1 2 912 1 1 33 SER CA C 3.371 1.353 1.441 1.00 . A A . 33 SER CA 1 1 2 913 1 1 33 SER CB C 2.715 0.017 1.812 1.00 . A A . 33 SER CB 1 1 2 914 1 1 33 SER H H 2.095 2.847 2.272 1.00 . A A . 33 SER H 1 1 2 915 1 1 33 SER HA H 4.449 1.181 1.494 1.00 . A A . 33 SER HA 1 1 2 916 1 1 33 SER HB2 H 3.007 -0.253 2.831 1.00 . A A . 33 SER HB2 1 1 2 917 1 1 33 SER HB3 H 1.630 0.109 1.785 1.00 . A A . 33 SER HB3 1 1 2 918 1 1 33 SER HG H 2.715 -1.804 1.015 1.00 . A A . 33 SER HG 1 1 2 919 1 1 33 SER N N 2.997 2.413 2.401 1.00 . A A . 33 SER N 1 1 2 920 1 1 33 SER O O 2.065 2.418 -0.293 1.00 . A A . 33 SER O 1 1 2 921 1 1 33 SER OG O 3.171 -0.964 0.890 1.00 . A A . 33 SER OG 1 1 2 922 1 1 34 GLN C C 3.364 0.519 -3.275 1.00 . A A . 34 GLN C 1 1 2 923 1 1 34 GLN CA C 3.859 1.704 -2.394 1.00 . A A . 34 GLN CA 1 1 2 924 1 1 34 GLN CB C 5.240 2.302 -2.771 1.00 . A A . 34 GLN CB 1 1 2 925 1 1 34 GLN CD C 5.809 2.958 -5.194 1.00 . A A . 34 GLN CD 1 1 2 926 1 1 34 GLN CG C 5.195 3.390 -3.869 1.00 . A A . 34 GLN CG 1 1 2 927 1 1 34 GLN H H 4.621 0.683 -0.665 1.00 . A A . 34 GLN H 1 1 2 928 1 1 34 GLN HA H 3.118 2.495 -2.526 1.00 . A A . 34 GLN HA 1 1 2 929 1 1 34 GLN HB2 H 5.642 2.802 -1.887 1.00 . A A . 34 GLN HB2 1 1 2 930 1 1 34 GLN HB3 H 5.946 1.506 -3.019 1.00 . A A . 34 GLN HB3 1 1 2 931 1 1 34 GLN HE21 H 7.683 3.525 -4.652 1.00 . A A . 34 GLN HE21 1 1 2 932 1 1 34 GLN HE22 H 7.468 2.819 -6.257 1.00 . A A . 34 GLN HE22 1 1 2 933 1 1 34 GLN HG2 H 4.168 3.697 -4.068 1.00 . A A . 34 GLN HG2 1 1 2 934 1 1 34 GLN HG3 H 5.735 4.275 -3.531 1.00 . A A . 34 GLN HG3 1 1 2 935 1 1 34 GLN N N 3.915 1.340 -0.967 1.00 . A A . 34 GLN N 1 1 2 936 1 1 34 GLN NE2 N 7.100 3.146 -5.377 1.00 . A A . 34 GLN NE2 1 1 2 937 1 1 34 GLN O O 2.480 -0.226 -2.854 1.00 . A A . 34 GLN O 1 1 2 938 1 1 34 GLN OE1 O 5.126 2.438 -6.058 1.00 . A A . 34 GLN OE1 1 1 2 939 1 1 35 CYS C C 5.038 -1.622 -5.549 1.00 . A A . 35 CYS C 1 1 2 940 1 1 35 CYS CA C 3.714 -0.837 -5.352 1.00 . A A . 35 CYS CA 1 1 2 941 1 1 35 CYS CB C 3.148 -0.345 -6.693 1.00 . A A . 35 CYS CB 1 1 2 942 1 1 35 CYS H H 4.567 1.018 -4.822 1.00 . A A . 35 CYS H 1 1 2 943 1 1 35 CYS HA H 2.975 -1.517 -4.921 1.00 . A A . 35 CYS HA 1 1 2 944 1 1 35 CYS HB2 H 2.328 0.350 -6.527 1.00 . A A . 35 CYS HB2 1 1 2 945 1 1 35 CYS HB3 H 3.926 0.185 -7.242 1.00 . A A . 35 CYS HB3 1 1 2 946 1 1 35 CYS N N 3.914 0.331 -4.480 1.00 . A A . 35 CYS N 1 1 2 947 1 1 35 CYS O O 5.909 -1.170 -6.293 1.00 . A A . 35 CYS O 1 1 2 948 1 1 35 CYS SG S 2.528 -1.653 -7.773 1.00 . A A . 35 CYS SG 1 1 2 949 1 1 36 LEU C C 5.937 -5.048 -5.513 1.00 . A A . 36 LEU C 1 1 2 950 1 1 36 LEU CA C 6.344 -3.666 -4.927 1.00 . A A . 36 LEU CA 1 1 2 951 1 1 36 LEU CB C 6.973 -3.851 -3.524 1.00 . A A . 36 LEU CB 1 1 2 952 1 1 36 LEU CD1 C 8.205 -1.619 -3.483 1.00 . A A . 36 LEU CD1 1 1 2 953 1 1 36 LEU CD2 C 6.111 -1.899 -2.066 1.00 . A A . 36 LEU CD2 1 1 2 954 1 1 36 LEU CG C 7.333 -2.602 -2.690 1.00 . A A . 36 LEU CG 1 1 2 955 1 1 36 LEU H H 4.421 -3.085 -4.301 1.00 . A A . 36 LEU H 1 1 2 956 1 1 36 LEU HA H 7.115 -3.263 -5.587 1.00 . A A . 36 LEU HA 1 1 2 957 1 1 36 LEU HB2 H 6.304 -4.460 -2.927 1.00 . A A . 36 LEU HB2 1 1 2 958 1 1 36 LEU HB3 H 7.886 -4.437 -3.657 1.00 . A A . 36 LEU HB3 1 1 2 959 1 1 36 LEU HD11 H 9.056 -2.148 -3.914 1.00 . A A . 36 LEU HD11 1 1 2 960 1 1 36 LEU HD12 H 7.631 -1.160 -4.285 1.00 . A A . 36 LEU HD12 1 1 2 961 1 1 36 LEU HD13 H 8.578 -0.835 -2.824 1.00 . A A . 36 LEU HD13 1 1 2 962 1 1 36 LEU HD21 H 5.466 -2.630 -1.574 1.00 . A A . 36 LEU HD21 1 1 2 963 1 1 36 LEU HD22 H 6.439 -1.171 -1.326 1.00 . A A . 36 LEU HD22 1 1 2 964 1 1 36 LEU HD23 H 5.528 -1.368 -2.812 1.00 . A A . 36 LEU HD23 1 1 2 965 1 1 36 LEU HG H 7.933 -2.961 -1.849 1.00 . A A . 36 LEU HG 1 1 2 966 1 1 36 LEU N N 5.195 -2.750 -4.851 1.00 . A A . 36 LEU N 1 1 2 967 1 1 36 LEU O O 4.736 -5.404 -5.393 1.00 . A A . 36 LEU O 1 1 2 968 1 1 36 LEU OXT O 6.834 -5.748 -6.022 1.00 . A A . 36 LEU OXT 1 1 3 969 1 1 1 THR C C -6.331 -5.806 -6.809 1.00 . A A . 1 THR C 1 1 3 970 1 1 1 THR CA C -5.557 -4.802 -7.723 1.00 . A A . 1 THR CA 1 1 3 971 1 1 1 THR CB C -4.751 -5.594 -8.772 1.00 . A A . 1 THR CB 1 1 3 972 1 1 1 THR CG2 C -4.236 -4.729 -9.926 1.00 . A A . 1 THR CG2 1 1 3 973 1 1 1 THR H1 H -5.208 -3.267 -6.318 1.00 . A A . 1 THR H1 1 1 3 974 1 1 1 THR H2 H -3.878 -4.198 -6.619 1.00 . A A . 1 THR H2 1 1 3 975 1 1 1 THR H3 H -4.318 -3.088 -7.684 1.00 . A A . 1 THR H3 1 1 3 976 1 1 1 THR HA H -6.335 -4.269 -8.274 1.00 . A A . 1 THR HA 1 1 3 977 1 1 1 THR HB H -5.370 -6.384 -9.207 1.00 . A A . 1 THR HB 1 1 3 978 1 1 1 THR HG1 H -3.329 -6.939 -8.571 1.00 . A A . 1 THR HG1 1 1 3 979 1 1 1 THR HG21 H -3.761 -3.826 -9.553 1.00 . A A . 1 THR HG21 1 1 3 980 1 1 1 THR HG22 H -3.518 -5.297 -10.519 1.00 . A A . 1 THR HG22 1 1 3 981 1 1 1 THR HG23 H -5.067 -4.435 -10.570 1.00 . A A . 1 THR HG23 1 1 3 982 1 1 1 THR N N -4.707 -3.771 -7.035 1.00 . A A . 1 THR N 1 1 3 983 1 1 1 THR O O -7.383 -5.446 -6.301 1.00 . A A . 1 THR O 1 1 3 984 1 1 1 THR OG1 O -3.659 -6.169 -8.089 1.00 . A A . 1 THR OG1 1 1 3 985 1 1 2 GLN C C -7.547 -8.081 -4.957 1.00 . A A . 2 GLN C 1 1 3 986 1 1 2 GLN CA C -6.642 -8.253 -6.213 1.00 . A A . 2 GLN CA 1 1 3 987 1 1 2 GLN CB C -5.685 -9.469 -6.106 1.00 . A A . 2 GLN CB 1 1 3 988 1 1 2 GLN CD C -5.027 -9.324 -8.610 1.00 . A A . 2 GLN CD 1 1 3 989 1 1 2 GLN CG C -5.434 -10.213 -7.437 1.00 . A A . 2 GLN CG 1 1 3 990 1 1 2 GLN H H -4.940 -7.238 -7.019 1.00 . A A . 2 GLN H 1 1 3 991 1 1 2 GLN HA H -7.338 -8.490 -7.019 1.00 . A A . 2 GLN HA 1 1 3 992 1 1 2 GLN HB2 H -4.729 -9.155 -5.684 1.00 . A A . 2 GLN HB2 1 1 3 993 1 1 2 GLN HB3 H -6.113 -10.214 -5.428 1.00 . A A . 2 GLN HB3 1 1 3 994 1 1 2 GLN HE21 H -6.775 -9.621 -9.575 1.00 . A A . 2 GLN HE21 1 1 3 995 1 1 2 GLN HE22 H -5.561 -8.645 -10.400 1.00 . A A . 2 GLN HE22 1 1 3 996 1 1 2 GLN HG2 H -4.637 -10.941 -7.288 1.00 . A A . 2 GLN HG2 1 1 3 997 1 1 2 GLN HG3 H -6.333 -10.768 -7.709 1.00 . A A . 2 GLN HG3 1 1 3 998 1 1 2 GLN N N -5.867 -7.062 -6.647 1.00 . A A . 2 GLN N 1 1 3 999 1 1 2 GLN NE2 N -5.888 -9.145 -9.591 1.00 . A A . 2 GLN NE2 1 1 3 1000 1 1 2 GLN O O -8.755 -7.917 -5.097 1.00 . A A . 2 GLN O 1 1 3 1001 1 1 2 GLN OE1 O -3.939 -8.769 -8.656 1.00 . A A . 2 GLN OE1 1 1 3 1002 1 1 3 SER C C -7.538 -6.460 -2.019 1.00 . A A . 3 SER C 1 1 3 1003 1 1 3 SER CA C -7.698 -7.928 -2.474 1.00 . A A . 3 SER CA 1 1 3 1004 1 1 3 SER CB C -7.243 -8.943 -1.399 1.00 . A A . 3 SER CB 1 1 3 1005 1 1 3 SER H H -6.011 -8.445 -3.713 1.00 . A A . 3 SER H 1 1 3 1006 1 1 3 SER HA H -8.770 -8.104 -2.615 1.00 . A A . 3 SER HA 1 1 3 1007 1 1 3 SER HB2 H -6.183 -8.819 -1.156 1.00 . A A . 3 SER HB2 1 1 3 1008 1 1 3 SER HB3 H -7.827 -8.787 -0.487 1.00 . A A . 3 SER HB3 1 1 3 1009 1 1 3 SER HG H -7.335 -10.900 -1.138 1.00 . A A . 3 SER HG 1 1 3 1010 1 1 3 SER N N -6.975 -8.160 -3.746 1.00 . A A . 3 SER N 1 1 3 1011 1 1 3 SER O O -8.429 -5.637 -2.184 1.00 . A A . 3 SER O 1 1 3 1012 1 1 3 SER OG O -7.437 -10.272 -1.861 1.00 . A A . 3 SER OG 1 1 3 1013 1 1 4 HIS C C -4.293 -4.837 -2.122 1.00 . A A . 4 HIS C 1 1 3 1014 1 1 4 HIS CA C -5.758 -4.764 -1.616 1.00 . A A . 4 HIS CA 1 1 3 1015 1 1 4 HIS CB C -5.916 -4.056 -0.256 1.00 . A A . 4 HIS CB 1 1 3 1016 1 1 4 HIS CD2 C -6.013 -1.671 0.758 1.00 . A A . 4 HIS CD2 1 1 3 1017 1 1 4 HIS CE1 C -5.661 -0.527 -1.062 1.00 . A A . 4 HIS CE1 1 1 3 1018 1 1 4 HIS CG C -5.827 -2.546 -0.278 1.00 . A A . 4 HIS CG 1 1 3 1019 1 1 4 HIS H H -5.701 -6.867 -1.324 1.00 . A A . 4 HIS H 1 1 3 1020 1 1 4 HIS HA H -6.306 -4.188 -2.365 1.00 . A A . 4 HIS HA 1 1 3 1021 1 1 4 HIS HB2 H -6.906 -4.282 0.140 1.00 . A A . 4 HIS HB2 1 1 3 1022 1 1 4 HIS HB3 H -5.178 -4.441 0.451 1.00 . A A . 4 HIS HB3 1 1 3 1023 1 1 4 HIS HD2 H -6.217 -1.936 1.786 1.00 . A A . 4 HIS HD2 1 1 3 1024 1 1 4 HIS HE1 H -5.538 0.315 -1.730 1.00 . A A . 4 HIS HE1 1 1 3 1025 1 1 4 HIS HE2 H -6.092 0.471 0.753 1.00 . A A . 4 HIS HE2 1 1 3 1026 1 1 4 HIS N N -6.337 -6.117 -1.534 1.00 . A A . 4 HIS N 1 1 3 1027 1 1 4 HIS ND1 N -5.614 -1.808 -1.447 1.00 . A A . 4 HIS ND1 1 1 3 1028 1 1 4 HIS NE2 N -5.937 -0.393 0.244 1.00 . A A . 4 HIS NE2 1 1 3 1029 1 1 4 HIS O O -3.394 -4.149 -1.655 1.00 . A A . 4 HIS O 1 1 3 1030 1 1 5 ALA C C -2.102 -4.772 -4.307 1.00 . A A . 5 ALA C 1 1 3 1031 1 1 5 ALA CA C -2.705 -6.021 -3.628 1.00 . A A . 5 ALA CA 1 1 3 1032 1 1 5 ALA CB C -2.777 -7.214 -4.590 1.00 . A A . 5 ALA CB 1 1 3 1033 1 1 5 ALA H H -4.824 -6.267 -3.430 1.00 . A A . 5 ALA H 1 1 3 1034 1 1 5 ALA HA H -2.069 -6.319 -2.793 1.00 . A A . 5 ALA HA 1 1 3 1035 1 1 5 ALA HB1 H -3.175 -8.091 -4.076 1.00 . A A . 5 ALA HB1 1 1 3 1036 1 1 5 ALA HB2 H -3.411 -6.974 -5.441 1.00 . A A . 5 ALA HB2 1 1 3 1037 1 1 5 ALA HB3 H -1.779 -7.456 -4.956 1.00 . A A . 5 ALA HB3 1 1 3 1038 1 1 5 ALA N N -4.039 -5.747 -3.082 1.00 . A A . 5 ALA N 1 1 3 1039 1 1 5 ALA O O -2.725 -4.214 -5.214 1.00 . A A . 5 ALA O 1 1 3 1040 1 1 6 GLY C C -0.410 -2.156 -2.696 1.00 . A A . 6 GLY C 1 1 3 1041 1 1 6 GLY CA C -0.424 -2.954 -4.016 1.00 . A A . 6 GLY CA 1 1 3 1042 1 1 6 GLY H H -0.554 -4.812 -3.037 1.00 . A A . 6 GLY H 1 1 3 1043 1 1 6 GLY HA2 H 0.605 -3.028 -4.372 1.00 . A A . 6 GLY HA2 1 1 3 1044 1 1 6 GLY HA3 H -1.019 -2.418 -4.758 1.00 . A A . 6 GLY HA3 1 1 3 1045 1 1 6 GLY N N -0.950 -4.309 -3.819 1.00 . A A . 6 GLY N 1 1 3 1046 1 1 6 GLY O O -0.082 -2.716 -1.651 1.00 . A A . 6 GLY O 1 1 3 1047 1 1 7 GLN C C -1.852 -0.332 -0.462 1.00 . A A . 7 GLN C 1 1 3 1048 1 1 7 GLN CA C -0.847 0.053 -1.590 1.00 . A A . 7 GLN CA 1 1 3 1049 1 1 7 GLN CB C -0.994 1.489 -2.137 1.00 . A A . 7 GLN CB 1 1 3 1050 1 1 7 GLN CD C -0.663 4.002 -1.551 1.00 . A A . 7 GLN CD 1 1 3 1051 1 1 7 GLN CG C -0.598 2.548 -1.087 1.00 . A A . 7 GLN CG 1 1 3 1052 1 1 7 GLN H H -1.035 -0.504 -3.641 1.00 . A A . 7 GLN H 1 1 3 1053 1 1 7 GLN HA H 0.122 0.024 -1.099 1.00 . A A . 7 GLN HA 1 1 3 1054 1 1 7 GLN HB2 H -0.328 1.616 -2.995 1.00 . A A . 7 GLN HB2 1 1 3 1055 1 1 7 GLN HB3 H -2.018 1.640 -2.473 1.00 . A A . 7 GLN HB3 1 1 3 1056 1 1 7 GLN HE21 H -0.573 4.738 0.345 1.00 . A A . 7 GLN HE21 1 1 3 1057 1 1 7 GLN HE22 H -0.659 5.890 -0.996 1.00 . A A . 7 GLN HE22 1 1 3 1058 1 1 7 GLN HG2 H -1.208 2.435 -0.194 1.00 . A A . 7 GLN HG2 1 1 3 1059 1 1 7 GLN HG3 H 0.440 2.386 -0.824 1.00 . A A . 7 GLN HG3 1 1 3 1060 1 1 7 GLN N N -0.815 -0.878 -2.735 1.00 . A A . 7 GLN N 1 1 3 1061 1 1 7 GLN NE2 N -0.645 4.949 -0.634 1.00 . A A . 7 GLN NE2 1 1 3 1062 1 1 7 GLN O O -2.833 0.361 -0.205 1.00 . A A . 7 GLN O 1 1 3 1063 1 1 7 GLN OE1 O -0.717 4.319 -2.726 1.00 . A A . 7 GLN OE1 1 1 3 1064 1 1 8 CYS C C -3.055 -1.398 2.379 1.00 . A A . 8 CYS C 1 1 3 1065 1 1 8 CYS CA C -2.323 -2.173 1.251 1.00 . A A . 8 CYS CA 1 1 3 1066 1 1 8 CYS CB C -1.371 -3.214 1.879 1.00 . A A . 8 CYS CB 1 1 3 1067 1 1 8 CYS H H -0.716 -1.895 -0.104 1.00 . A A . 8 CYS H 1 1 3 1068 1 1 8 CYS HA H -3.100 -2.723 0.718 1.00 . A A . 8 CYS HA 1 1 3 1069 1 1 8 CYS HB2 H -1.886 -3.774 2.660 1.00 . A A . 8 CYS HB2 1 1 3 1070 1 1 8 CYS HB3 H -1.038 -3.921 1.121 1.00 . A A . 8 CYS HB3 1 1 3 1071 1 1 8 CYS N N -1.545 -1.425 0.242 1.00 . A A . 8 CYS N 1 1 3 1072 1 1 8 CYS O O -3.844 -2.005 3.099 1.00 . A A . 8 CYS O 1 1 3 1073 1 1 8 CYS SG S 0.111 -2.456 2.599 1.00 . A A . 8 CYS SG 1 1 3 1074 1 1 9 GLY C C -2.487 0.401 5.072 1.00 . A A . 9 GLY C 1 1 3 1075 1 1 9 GLY CA C -3.283 0.641 3.766 1.00 . A A . 9 GLY CA 1 1 3 1076 1 1 9 GLY H H -2.262 0.371 1.876 1.00 . A A . 9 GLY H 1 1 3 1077 1 1 9 GLY HA2 H -3.277 1.705 3.534 1.00 . A A . 9 GLY HA2 1 1 3 1078 1 1 9 GLY HA3 H -4.318 0.353 3.952 1.00 . A A . 9 GLY HA3 1 1 3 1079 1 1 9 GLY N N -2.780 -0.105 2.599 1.00 . A A . 9 GLY N 1 1 3 1080 1 1 9 GLY O O -2.879 -0.404 5.910 1.00 . A A . 9 GLY O 1 1 3 1081 1 1 10 GLY C C -0.973 1.705 7.701 1.00 . A A . 10 GLY C 1 1 3 1082 1 1 10 GLY CA C -0.476 0.982 6.427 1.00 . A A . 10 GLY CA 1 1 3 1083 1 1 10 GLY H H -1.108 1.741 4.508 1.00 . A A . 10 GLY H 1 1 3 1084 1 1 10 GLY HA2 H -0.331 -0.074 6.665 1.00 . A A . 10 GLY HA2 1 1 3 1085 1 1 10 GLY HA3 H 0.503 1.387 6.169 1.00 . A A . 10 GLY HA3 1 1 3 1086 1 1 10 GLY N N -1.358 1.105 5.246 1.00 . A A . 10 GLY N 1 1 3 1087 1 1 10 GLY O O -1.554 1.091 8.590 1.00 . A A . 10 GLY O 1 1 3 1088 1 1 11 ILE C C -1.850 5.149 8.382 1.00 . A A . 11 ILE C 1 1 3 1089 1 1 11 ILE CA C -1.146 3.880 8.925 1.00 . A A . 11 ILE CA 1 1 3 1090 1 1 11 ILE CB C 0.052 4.229 9.849 1.00 . A A . 11 ILE CB 1 1 3 1091 1 1 11 ILE CD1 C 2.036 3.256 11.190 1.00 . A A . 11 ILE CD1 1 1 3 1092 1 1 11 ILE CG1 C 0.851 2.969 10.261 1.00 . A A . 11 ILE CG1 1 1 3 1093 1 1 11 ILE CG2 C -0.457 4.969 11.103 1.00 . A A . 11 ILE CG2 1 1 3 1094 1 1 11 ILE H H -0.191 3.452 7.065 1.00 . A A . 11 ILE H 1 1 3 1095 1 1 11 ILE HA H -1.875 3.340 9.536 1.00 . A A . 11 ILE HA 1 1 3 1096 1 1 11 ILE HB H 0.727 4.895 9.307 1.00 . A A . 11 ILE HB 1 1 3 1097 1 1 11 ILE HD11 H 2.679 4.020 10.754 1.00 . A A . 11 ILE HD11 1 1 3 1098 1 1 11 ILE HD12 H 1.691 3.583 12.170 1.00 . A A . 11 ILE HD12 1 1 3 1099 1 1 11 ILE HD13 H 2.619 2.343 11.322 1.00 . A A . 11 ILE HD13 1 1 3 1100 1 1 11 ILE HG12 H 0.184 2.255 10.747 1.00 . A A . 11 ILE HG12 1 1 3 1101 1 1 11 ILE HG13 H 1.264 2.500 9.367 1.00 . A A . 11 ILE HG13 1 1 3 1102 1 1 11 ILE HG21 H -1.063 5.832 10.832 1.00 . A A . 11 ILE HG21 1 1 3 1103 1 1 11 ILE HG22 H -1.063 4.292 11.708 1.00 . A A . 11 ILE HG22 1 1 3 1104 1 1 11 ILE HG23 H 0.376 5.331 11.705 1.00 . A A . 11 ILE HG23 1 1 3 1105 1 1 11 ILE N N -0.712 3.015 7.809 1.00 . A A . 11 ILE N 1 1 3 1106 1 1 11 ILE O O -1.339 5.800 7.469 1.00 . A A . 11 ILE O 1 1 3 1107 1 1 12 GLY C C -4.556 6.278 7.017 1.00 . A A . 12 GLY C 1 1 3 1108 1 1 12 GLY CA C -3.887 6.584 8.378 1.00 . A A . 12 GLY CA 1 1 3 1109 1 1 12 GLY H H -3.409 4.911 9.632 1.00 . A A . 12 GLY H 1 1 3 1110 1 1 12 GLY HA2 H -4.668 6.775 9.112 1.00 . A A . 12 GLY HA2 1 1 3 1111 1 1 12 GLY HA3 H -3.299 7.498 8.276 1.00 . A A . 12 GLY HA3 1 1 3 1112 1 1 12 GLY N N -3.038 5.494 8.898 1.00 . A A . 12 GLY N 1 1 3 1113 1 1 12 GLY O O -5.777 6.296 6.886 1.00 . A A . 12 GLY O 1 1 3 1114 1 1 13 TYR C C -4.846 4.002 4.856 1.00 . A A . 13 TYR C 1 1 3 1115 1 1 13 TYR CA C -4.183 5.402 4.715 1.00 . A A . 13 TYR CA 1 1 3 1116 1 1 13 TYR CB C -2.966 5.342 3.759 1.00 . A A . 13 TYR CB 1 1 3 1117 1 1 13 TYR CD1 C -3.962 6.516 1.748 1.00 . A A . 13 TYR CD1 1 1 3 1118 1 1 13 TYR CD2 C -1.668 7.055 2.390 1.00 . A A . 13 TYR CD2 1 1 3 1119 1 1 13 TYR CE1 C -3.749 7.127 0.496 1.00 . A A . 13 TYR CE1 1 1 3 1120 1 1 13 TYR CE2 C -1.458 7.647 1.123 1.00 . A A . 13 TYR CE2 1 1 3 1121 1 1 13 TYR CG C -2.896 6.407 2.673 1.00 . A A . 13 TYR CG 1 1 3 1122 1 1 13 TYR CZ C -2.464 7.568 0.143 1.00 . A A . 13 TYR CZ 1 1 3 1123 1 1 13 TYR H H -2.755 6.001 6.202 1.00 . A A . 13 TYR H 1 1 3 1124 1 1 13 TYR HA H -4.936 6.076 4.303 1.00 . A A . 13 TYR HA 1 1 3 1125 1 1 13 TYR HB2 H -2.037 5.342 4.332 1.00 . A A . 13 TYR HB2 1 1 3 1126 1 1 13 TYR HB3 H -2.970 4.395 3.216 1.00 . A A . 13 TYR HB3 1 1 3 1127 1 1 13 TYR HD1 H -4.921 6.065 1.960 1.00 . A A . 13 TYR HD1 1 1 3 1128 1 1 13 TYR HD2 H -0.864 7.047 3.113 1.00 . A A . 13 TYR HD2 1 1 3 1129 1 1 13 TYR HE1 H -4.553 7.210 -0.219 1.00 . A A . 13 TYR HE1 1 1 3 1130 1 1 13 TYR HE2 H -0.509 8.100 0.879 1.00 . A A . 13 TYR HE2 1 1 3 1131 1 1 13 TYR HH H -2.762 7.331 -1.726 1.00 . A A . 13 TYR HH 1 1 3 1132 1 1 13 TYR N N -3.748 5.970 5.999 1.00 . A A . 13 TYR N 1 1 3 1133 1 1 13 TYR O O -4.312 3.125 5.535 1.00 . A A . 13 TYR O 1 1 3 1134 1 1 13 TYR OH O -2.182 7.852 -1.153 1.00 . A A . 13 TYR OH 1 1 3 1135 1 1 14 SER C C -7.474 2.104 2.924 1.00 . A A . 14 SER C 1 1 3 1136 1 1 14 SER CA C -6.728 2.482 4.233 1.00 . A A . 14 SER CA 1 1 3 1137 1 1 14 SER CB C -7.658 2.449 5.466 1.00 . A A . 14 SER CB 1 1 3 1138 1 1 14 SER H H -6.385 4.544 3.689 1.00 . A A . 14 SER H 1 1 3 1139 1 1 14 SER HA H -6.016 1.671 4.394 1.00 . A A . 14 SER HA 1 1 3 1140 1 1 14 SER HB2 H -8.456 3.191 5.382 1.00 . A A . 14 SER HB2 1 1 3 1141 1 1 14 SER HB3 H -8.118 1.460 5.555 1.00 . A A . 14 SER HB3 1 1 3 1142 1 1 14 SER HG H -6.003 2.447 6.536 1.00 . A A . 14 SER HG 1 1 3 1143 1 1 14 SER N N -5.985 3.766 4.184 1.00 . A A . 14 SER N 1 1 3 1144 1 1 14 SER O O -7.337 0.989 2.432 1.00 . A A . 14 SER O 1 1 3 1145 1 1 14 SER OG O -6.929 2.705 6.655 1.00 . A A . 14 SER OG 1 1 3 1146 1 1 15 GLY C C -8.358 2.439 -0.169 1.00 . A A . 15 GLY C 1 1 3 1147 1 1 15 GLY CA C -9.105 2.765 1.153 1.00 . A A . 15 GLY CA 1 1 3 1148 1 1 15 GLY H H -8.367 3.904 2.821 1.00 . A A . 15 GLY H 1 1 3 1149 1 1 15 GLY HA2 H -9.775 1.936 1.378 1.00 . A A . 15 GLY HA2 1 1 3 1150 1 1 15 GLY HA3 H -9.707 3.659 0.988 1.00 . A A . 15 GLY HA3 1 1 3 1151 1 1 15 GLY N N -8.276 3.017 2.352 1.00 . A A . 15 GLY N 1 1 3 1152 1 1 15 GLY O O -7.137 2.263 -0.167 1.00 . A A . 15 GLY O 1 1 3 1153 1 1 16 PRO C C -7.444 2.795 -3.321 1.00 . A A . 16 PRO C 1 1 3 1154 1 1 16 PRO CA C -8.550 1.941 -2.628 1.00 . A A . 16 PRO CA 1 1 3 1155 1 1 16 PRO CB C -9.798 1.847 -3.534 1.00 . A A . 16 PRO CB 1 1 3 1156 1 1 16 PRO CD C -10.523 2.528 -1.391 1.00 . A A . 16 PRO CD 1 1 3 1157 1 1 16 PRO CG C -10.960 1.655 -2.565 1.00 . A A . 16 PRO CG 1 1 3 1158 1 1 16 PRO HA H -8.160 0.927 -2.513 1.00 . A A . 16 PRO HA 1 1 3 1159 1 1 16 PRO HB2 H -9.959 2.794 -4.061 1.00 . A A . 16 PRO HB2 1 1 3 1160 1 1 16 PRO HB3 H -9.726 1.043 -4.270 1.00 . A A . 16 PRO HB3 1 1 3 1161 1 1 16 PRO HD2 H -10.769 3.572 -1.598 1.00 . A A . 16 PRO HD2 1 1 3 1162 1 1 16 PRO HD3 H -11.053 2.205 -0.495 1.00 . A A . 16 PRO HD3 1 1 3 1163 1 1 16 PRO HG2 H -11.916 1.970 -2.990 1.00 . A A . 16 PRO HG2 1 1 3 1164 1 1 16 PRO HG3 H -11.016 0.609 -2.260 1.00 . A A . 16 PRO HG3 1 1 3 1165 1 1 16 PRO N N -9.071 2.383 -1.317 1.00 . A A . 16 PRO N 1 1 3 1166 1 1 16 PRO O O -7.466 2.926 -4.541 1.00 . A A . 16 PRO O 1 1 3 1167 1 1 17 THR C C -4.296 3.251 -4.004 1.00 . A A . 17 THR C 1 1 3 1168 1 1 17 THR CA C -5.285 4.098 -3.160 1.00 . A A . 17 THR CA 1 1 3 1169 1 1 17 THR CB C -4.550 4.824 -1.999 1.00 . A A . 17 THR CB 1 1 3 1170 1 1 17 THR CG2 C -3.979 3.869 -0.942 1.00 . A A . 17 THR CG2 1 1 3 1171 1 1 17 THR H H -6.468 3.177 -1.611 1.00 . A A . 17 THR H 1 1 3 1172 1 1 17 THR HA H -5.664 4.871 -3.828 1.00 . A A . 17 THR HA 1 1 3 1173 1 1 17 THR HB H -5.277 5.470 -1.503 1.00 . A A . 17 THR HB 1 1 3 1174 1 1 17 THR HG1 H -2.796 5.087 -2.815 1.00 . A A . 17 THR HG1 1 1 3 1175 1 1 17 THR HG21 H -3.346 3.117 -1.400 1.00 . A A . 17 THR HG21 1 1 3 1176 1 1 17 THR HG22 H -3.386 4.424 -0.218 1.00 . A A . 17 THR HG22 1 1 3 1177 1 1 17 THR HG23 H -4.772 3.357 -0.403 1.00 . A A . 17 THR HG23 1 1 3 1178 1 1 17 THR N N -6.449 3.340 -2.607 1.00 . A A . 17 THR N 1 1 3 1179 1 1 17 THR O O -3.085 3.429 -3.936 1.00 . A A . 17 THR O 1 1 3 1180 1 1 17 THR OG1 O -3.493 5.657 -2.447 1.00 . A A . 17 THR OG1 1 1 3 1181 1 1 18 VAL C C -3.357 1.158 -6.558 1.00 . A A . 18 VAL C 1 1 3 1182 1 1 18 VAL CA C -4.025 1.079 -5.167 1.00 . A A . 18 VAL CA 1 1 3 1183 1 1 18 VAL CB C -4.913 -0.178 -5.011 1.00 . A A . 18 VAL CB 1 1 3 1184 1 1 18 VAL CG1 C -5.909 -0.379 -6.166 1.00 . A A . 18 VAL CG1 1 1 3 1185 1 1 18 VAL CG2 C -4.052 -1.437 -4.840 1.00 . A A . 18 VAL CG2 1 1 3 1186 1 1 18 VAL H H -5.782 2.277 -4.941 1.00 . A A . 18 VAL H 1 1 3 1187 1 1 18 VAL HA H -3.221 0.970 -4.435 1.00 . A A . 18 VAL HA 1 1 3 1188 1 1 18 VAL HB H -5.499 -0.069 -4.096 1.00 . A A . 18 VAL HB 1 1 3 1189 1 1 18 VAL HG11 H -6.506 0.523 -6.313 1.00 . A A . 18 VAL HG11 1 1 3 1190 1 1 18 VAL HG12 H -5.385 -0.609 -7.094 1.00 . A A . 18 VAL HG12 1 1 3 1191 1 1 18 VAL HG13 H -6.579 -1.207 -5.933 1.00 . A A . 18 VAL HG13 1 1 3 1192 1 1 18 VAL HG21 H -3.364 -1.312 -4.004 1.00 . A A . 18 VAL HG21 1 1 3 1193 1 1 18 VAL HG22 H -4.692 -2.290 -4.617 1.00 . A A . 18 VAL HG22 1 1 3 1194 1 1 18 VAL HG23 H -3.477 -1.633 -5.744 1.00 . A A . 18 VAL HG23 1 1 3 1195 1 1 18 VAL N N -4.786 2.270 -4.773 1.00 . A A . 18 VAL N 1 1 3 1196 1 1 18 VAL O O -3.932 1.651 -7.524 1.00 . A A . 18 VAL O 1 1 3 1197 1 1 19 CYS C C -1.900 -0.844 -8.722 1.00 . A A . 19 CYS C 1 1 3 1198 1 1 19 CYS CA C -1.408 0.395 -7.910 1.00 . A A . 19 CYS CA 1 1 3 1199 1 1 19 CYS CB C 0.090 0.307 -7.531 1.00 . A A . 19 CYS CB 1 1 3 1200 1 1 19 CYS H H -1.746 0.240 -5.808 1.00 . A A . 19 CYS H 1 1 3 1201 1 1 19 CYS HA H -1.535 1.273 -8.549 1.00 . A A . 19 CYS HA 1 1 3 1202 1 1 19 CYS HB2 H 0.706 0.412 -8.422 1.00 . A A . 19 CYS HB2 1 1 3 1203 1 1 19 CYS HB3 H 0.358 1.125 -6.861 1.00 . A A . 19 CYS HB3 1 1 3 1204 1 1 19 CYS N N -2.149 0.596 -6.658 1.00 . A A . 19 CYS N 1 1 3 1205 1 1 19 CYS O O -3.018 -1.348 -8.541 1.00 . A A . 19 CYS O 1 1 3 1206 1 1 19 CYS SG S 0.567 -1.249 -6.728 1.00 . A A . 19 CYS SG 1 1 3 1207 1 1 20 ALA C C -1.124 -3.866 -9.097 1.00 . A A . 20 ALA C 1 1 3 1208 1 1 20 ALA CA C -1.090 -2.724 -10.161 1.00 . A A . 20 ALA CA 1 1 3 1209 1 1 20 ALA CB C 0.064 -2.842 -11.177 1.00 . A A . 20 ALA CB 1 1 3 1210 1 1 20 ALA H H -0.144 -0.888 -9.686 1.00 . A A . 20 ALA H 1 1 3 1211 1 1 20 ALA HA H -2.018 -2.796 -10.730 1.00 . A A . 20 ALA HA 1 1 3 1212 1 1 20 ALA HB1 H 0.032 -2.004 -11.879 1.00 . A A . 20 ALA HB1 1 1 3 1213 1 1 20 ALA HB2 H 1.028 -2.828 -10.662 1.00 . A A . 20 ALA HB2 1 1 3 1214 1 1 20 ALA HB3 H -0.019 -3.760 -11.759 1.00 . A A . 20 ALA HB3 1 1 3 1215 1 1 20 ALA N N -1.016 -1.380 -9.575 1.00 . A A . 20 ALA N 1 1 3 1216 1 1 20 ALA O O -1.721 -3.712 -8.030 1.00 . A A . 20 ALA O 1 1 3 1217 1 1 21 SER C C 0.837 -6.234 -7.643 1.00 . A A . 21 SER C 1 1 3 1218 1 1 21 SER CA C -0.481 -6.174 -8.450 1.00 . A A . 21 SER CA 1 1 3 1219 1 1 21 SER CB C -0.803 -7.489 -9.185 1.00 . A A . 21 SER CB 1 1 3 1220 1 1 21 SER H H -0.031 -5.103 -10.253 1.00 . A A . 21 SER H 1 1 3 1221 1 1 21 SER HA H -1.240 -6.056 -7.678 1.00 . A A . 21 SER HA 1 1 3 1222 1 1 21 SER HB2 H -1.639 -7.336 -9.873 1.00 . A A . 21 SER HB2 1 1 3 1223 1 1 21 SER HB3 H 0.059 -7.817 -9.773 1.00 . A A . 21 SER HB3 1 1 3 1224 1 1 21 SER HG H -2.013 -8.870 -8.439 1.00 . A A . 21 SER HG 1 1 3 1225 1 1 21 SER N N -0.555 -5.041 -9.397 1.00 . A A . 21 SER N 1 1 3 1226 1 1 21 SER O O 1.570 -5.252 -7.576 1.00 . A A . 21 SER O 1 1 3 1227 1 1 21 SER OG O -1.151 -8.482 -8.229 1.00 . A A . 21 SER OG 1 1 3 1228 1 1 22 GLY C C 1.869 -8.300 -4.826 1.00 . A A . 22 GLY C 1 1 3 1229 1 1 22 GLY CA C 2.270 -7.641 -6.152 1.00 . A A . 22 GLY CA 1 1 3 1230 1 1 22 GLY H H 0.432 -8.124 -7.163 1.00 . A A . 22 GLY H 1 1 3 1231 1 1 22 GLY HA2 H 2.944 -8.313 -6.684 1.00 . A A . 22 GLY HA2 1 1 3 1232 1 1 22 GLY HA3 H 2.820 -6.726 -5.918 1.00 . A A . 22 GLY HA3 1 1 3 1233 1 1 22 GLY N N 1.101 -7.377 -7.007 1.00 . A A . 22 GLY N 1 1 3 1234 1 1 22 GLY O O 2.055 -9.499 -4.636 1.00 . A A . 22 GLY O 1 1 3 1235 1 1 23 THR C C 1.814 -7.778 -1.492 1.00 . A A . 23 THR C 1 1 3 1236 1 1 23 THR CA C 0.740 -7.969 -2.585 1.00 . A A . 23 THR CA 1 1 3 1237 1 1 23 THR CB C 0.131 -9.398 -2.546 1.00 . A A . 23 THR CB 1 1 3 1238 1 1 23 THR CG2 C -0.883 -9.576 -1.406 1.00 . A A . 23 THR CG2 1 1 3 1239 1 1 23 THR H H 1.046 -6.595 -4.230 1.00 . A A . 23 THR H 1 1 3 1240 1 1 23 THR HA H -0.066 -7.287 -2.320 1.00 . A A . 23 THR HA 1 1 3 1241 1 1 23 THR HB H 0.924 -10.148 -2.435 1.00 . A A . 23 THR HB 1 1 3 1242 1 1 23 THR HG1 H 0.089 -9.623 -4.444 1.00 . A A . 23 THR HG1 1 1 3 1243 1 1 23 THR HG21 H -1.687 -8.847 -1.500 1.00 . A A . 23 THR HG21 1 1 3 1244 1 1 23 THR HG22 H -1.310 -10.579 -1.444 1.00 . A A . 23 THR HG22 1 1 3 1245 1 1 23 THR HG23 H -0.399 -9.452 -0.438 1.00 . A A . 23 THR HG23 1 1 3 1246 1 1 23 THR N N 1.204 -7.547 -3.939 1.00 . A A . 23 THR N 1 1 3 1247 1 1 23 THR O O 1.954 -8.578 -0.572 1.00 . A A . 23 THR O 1 1 3 1248 1 1 23 THR OG1 O -0.576 -9.642 -3.743 1.00 . A A . 23 THR OG1 1 1 3 1249 1 1 24 THR C C 3.660 -5.216 0.118 1.00 . A A . 24 THR C 1 1 3 1250 1 1 24 THR CA C 3.812 -6.398 -0.865 1.00 . A A . 24 THR CA 1 1 3 1251 1 1 24 THR CB C 4.934 -6.143 -1.895 1.00 . A A . 24 THR CB 1 1 3 1252 1 1 24 THR CG2 C 5.387 -7.458 -2.542 1.00 . A A . 24 THR CG2 1 1 3 1253 1 1 24 THR H H 2.440 -6.106 -2.414 1.00 . A A . 24 THR H 1 1 3 1254 1 1 24 THR HA H 4.117 -7.260 -0.267 1.00 . A A . 24 THR HA 1 1 3 1255 1 1 24 THR HB H 5.802 -5.695 -1.402 1.00 . A A . 24 THR HB 1 1 3 1256 1 1 24 THR HG1 H 4.978 -5.449 -3.721 1.00 . A A . 24 THR HG1 1 1 3 1257 1 1 24 THR HG21 H 5.745 -8.151 -1.782 1.00 . A A . 24 THR HG21 1 1 3 1258 1 1 24 THR HG22 H 4.568 -7.919 -3.088 1.00 . A A . 24 THR HG22 1 1 3 1259 1 1 24 THR HG23 H 6.202 -7.266 -3.239 1.00 . A A . 24 THR HG23 1 1 3 1260 1 1 24 THR N N 2.571 -6.688 -1.599 1.00 . A A . 24 THR N 1 1 3 1261 1 1 24 THR O O 4.014 -4.075 -0.167 1.00 . A A . 24 THR O 1 1 3 1262 1 1 24 THR OG1 O 4.455 -5.278 -2.913 1.00 . A A . 24 THR OG1 1 1 3 1263 1 1 25 CYS C C 4.354 -4.078 3.023 1.00 . A A . 25 CYS C 1 1 3 1264 1 1 25 CYS CA C 2.985 -4.479 2.381 1.00 . A A . 25 CYS CA 1 1 3 1265 1 1 25 CYS CB C 1.917 -4.981 3.377 1.00 . A A . 25 CYS CB 1 1 3 1266 1 1 25 CYS H H 2.889 -6.446 1.510 1.00 . A A . 25 CYS H 1 1 3 1267 1 1 25 CYS HA H 2.584 -3.584 1.897 1.00 . A A . 25 CYS HA 1 1 3 1268 1 1 25 CYS HB2 H 1.209 -5.629 2.859 1.00 . A A . 25 CYS HB2 1 1 3 1269 1 1 25 CYS HB3 H 2.387 -5.570 4.164 1.00 . A A . 25 CYS HB3 1 1 3 1270 1 1 25 CYS N N 3.140 -5.488 1.321 1.00 . A A . 25 CYS N 1 1 3 1271 1 1 25 CYS O O 5.249 -4.907 3.181 1.00 . A A . 25 CYS O 1 1 3 1272 1 1 25 CYS SG S 0.862 -3.739 4.172 1.00 . A A . 25 CYS SG 1 1 3 1273 1 1 26 GLN C C 5.859 -0.911 4.437 1.00 . A A . 26 GLN C 1 1 3 1274 1 1 26 GLN CA C 5.859 -2.128 3.468 1.00 . A A . 26 GLN CA 1 1 3 1275 1 1 26 GLN CB C 6.268 -1.757 2.017 1.00 . A A . 26 GLN CB 1 1 3 1276 1 1 26 GLN CD C 8.855 -1.335 2.159 1.00 . A A . 26 GLN CD 1 1 3 1277 1 1 26 GLN CG C 7.471 -0.810 1.775 1.00 . A A . 26 GLN CG 1 1 3 1278 1 1 26 GLN H H 3.750 -2.178 3.213 1.00 . A A . 26 GLN H 1 1 3 1279 1 1 26 GLN HA H 6.577 -2.839 3.878 1.00 . A A . 26 GLN HA 1 1 3 1280 1 1 26 GLN HB2 H 6.456 -2.690 1.481 1.00 . A A . 26 GLN HB2 1 1 3 1281 1 1 26 GLN HB3 H 5.413 -1.275 1.534 1.00 . A A . 26 GLN HB3 1 1 3 1282 1 1 26 GLN HE21 H 8.201 -3.184 2.693 1.00 . A A . 26 GLN HE21 1 1 3 1283 1 1 26 GLN HE22 H 9.922 -2.814 2.878 1.00 . A A . 26 GLN HE22 1 1 3 1284 1 1 26 GLN HG2 H 7.543 -0.572 0.714 1.00 . A A . 26 GLN HG2 1 1 3 1285 1 1 26 GLN HG3 H 7.306 0.141 2.275 1.00 . A A . 26 GLN HG3 1 1 3 1286 1 1 26 GLN N N 4.545 -2.790 3.334 1.00 . A A . 26 GLN N 1 1 3 1287 1 1 26 GLN NE2 N 8.976 -2.545 2.665 1.00 . A A . 26 GLN NE2 1 1 3 1288 1 1 26 GLN O O 4.825 -0.488 4.947 1.00 . A A . 26 GLN O 1 1 3 1289 1 1 26 GLN OE1 O 9.851 -0.649 2.016 1.00 . A A . 26 GLN OE1 1 1 3 1290 1 1 27 VAL C C 8.236 1.887 4.475 1.00 . A A . 27 VAL C 1 1 3 1291 1 1 27 VAL CA C 7.218 1.020 5.269 1.00 . A A . 27 VAL CA 1 1 3 1292 1 1 27 VAL CB C 7.594 0.887 6.763 1.00 . A A . 27 VAL CB 1 1 3 1293 1 1 27 VAL CG1 C 8.853 0.037 7.043 1.00 . A A . 27 VAL CG1 1 1 3 1294 1 1 27 VAL CG2 C 7.771 2.271 7.413 1.00 . A A . 27 VAL CG2 1 1 3 1295 1 1 27 VAL H H 7.866 -0.777 4.340 1.00 . A A . 27 VAL H 1 1 3 1296 1 1 27 VAL HA H 6.266 1.560 5.237 1.00 . A A . 27 VAL HA 1 1 3 1297 1 1 27 VAL HB H 6.761 0.394 7.269 1.00 . A A . 27 VAL HB 1 1 3 1298 1 1 27 VAL HG11 H 8.765 -0.946 6.583 1.00 . A A . 27 VAL HG11 1 1 3 1299 1 1 27 VAL HG12 H 9.748 0.525 6.661 1.00 . A A . 27 VAL HG12 1 1 3 1300 1 1 27 VAL HG13 H 8.978 -0.096 8.116 1.00 . A A . 27 VAL HG13 1 1 3 1301 1 1 27 VAL HG21 H 6.914 2.900 7.168 1.00 . A A . 27 VAL HG21 1 1 3 1302 1 1 27 VAL HG22 H 7.845 2.166 8.498 1.00 . A A . 27 VAL HG22 1 1 3 1303 1 1 27 VAL HG23 H 8.681 2.751 7.044 1.00 . A A . 27 VAL HG23 1 1 3 1304 1 1 27 VAL N N 7.033 -0.320 4.679 1.00 . A A . 27 VAL N 1 1 3 1305 1 1 27 VAL O O 9.418 1.559 4.441 1.00 . A A . 27 VAL O 1 1 3 1306 1 1 28 LEU C C 8.948 5.060 4.561 1.00 . A A . 28 LEU C 1 1 3 1307 1 1 28 LEU CA C 8.713 4.067 3.394 1.00 . A A . 28 LEU CA 1 1 3 1308 1 1 28 LEU CB C 8.151 4.724 2.110 1.00 . A A . 28 LEU CB 1 1 3 1309 1 1 28 LEU CD1 C 7.973 2.513 0.816 1.00 . A A . 28 LEU CD1 1 1 3 1310 1 1 28 LEU CD2 C 7.931 4.698 -0.406 1.00 . A A . 28 LEU CD2 1 1 3 1311 1 1 28 LEU CG C 8.493 3.956 0.815 1.00 . A A . 28 LEU CG 1 1 3 1312 1 1 28 LEU H H 6.803 3.167 3.821 1.00 . A A . 28 LEU H 1 1 3 1313 1 1 28 LEU HA H 9.697 3.659 3.143 1.00 . A A . 28 LEU HA 1 1 3 1314 1 1 28 LEU HB2 H 7.070 4.851 2.188 1.00 . A A . 28 LEU HB2 1 1 3 1315 1 1 28 LEU HB3 H 8.591 5.719 2.002 1.00 . A A . 28 LEU HB3 1 1 3 1316 1 1 28 LEU HD11 H 6.914 2.487 1.072 1.00 . A A . 28 LEU HD11 1 1 3 1317 1 1 28 LEU HD12 H 8.110 2.065 -0.170 1.00 . A A . 28 LEU HD12 1 1 3 1318 1 1 28 LEU HD13 H 8.541 1.922 1.532 1.00 . A A . 28 LEU HD13 1 1 3 1319 1 1 28 LEU HD21 H 8.349 5.703 -0.462 1.00 . A A . 28 LEU HD21 1 1 3 1320 1 1 28 LEU HD22 H 8.196 4.164 -1.321 1.00 . A A . 28 LEU HD22 1 1 3 1321 1 1 28 LEU HD23 H 6.846 4.766 -0.344 1.00 . A A . 28 LEU HD23 1 1 3 1322 1 1 28 LEU HG H 9.577 3.921 0.711 1.00 . A A . 28 LEU HG 1 1 3 1323 1 1 28 LEU N N 7.803 2.994 3.853 1.00 . A A . 28 LEU N 1 1 3 1324 1 1 28 LEU O O 9.767 4.811 5.442 1.00 . A A . 28 LEU O 1 1 3 1325 1 1 29 ASN C C 6.711 5.866 6.665 1.00 . A A . 29 ASN C 1 1 3 1326 1 1 29 ASN CA C 7.800 6.730 5.952 1.00 . A A . 29 ASN CA 1 1 3 1327 1 1 29 ASN CB C 7.347 8.188 5.716 1.00 . A A . 29 ASN CB 1 1 3 1328 1 1 29 ASN CG C 6.117 8.274 4.820 1.00 . A A . 29 ASN CG 1 1 3 1329 1 1 29 ASN H H 7.526 6.305 3.884 1.00 . A A . 29 ASN H 1 1 3 1330 1 1 29 ASN HA H 8.690 6.758 6.586 1.00 . A A . 29 ASN HA 1 1 3 1331 1 1 29 ASN HB2 H 7.152 8.683 6.669 1.00 . A A . 29 ASN HB2 1 1 3 1332 1 1 29 ASN HB3 H 8.153 8.733 5.224 1.00 . A A . 29 ASN HB3 1 1 3 1333 1 1 29 ASN HD21 H 4.965 9.202 6.226 1.00 . A A . 29 ASN HD21 1 1 3 1334 1 1 29 ASN HD22 H 4.228 8.791 4.678 1.00 . A A . 29 ASN HD22 1 1 3 1335 1 1 29 ASN N N 8.156 6.133 4.657 1.00 . A A . 29 ASN N 1 1 3 1336 1 1 29 ASN ND2 N 5.005 8.780 5.318 1.00 . A A . 29 ASN ND2 1 1 3 1337 1 1 29 ASN O O 5.936 5.197 5.977 1.00 . A A . 29 ASN O 1 1 3 1338 1 1 29 ASN OD1 O 6.144 7.868 3.672 1.00 . A A . 29 ASN OD1 1 1 3 1339 1 1 30 PRO C C 4.122 5.288 8.116 1.00 . A A . 30 PRO C 1 1 3 1340 1 1 30 PRO CA C 5.526 5.169 8.744 1.00 . A A . 30 PRO CA 1 1 3 1341 1 1 30 PRO CB C 5.580 5.703 10.187 1.00 . A A . 30 PRO CB 1 1 3 1342 1 1 30 PRO CD C 7.370 6.679 8.949 1.00 . A A . 30 PRO CD 1 1 3 1343 1 1 30 PRO CG C 6.395 6.995 10.080 1.00 . A A . 30 PRO CG 1 1 3 1344 1 1 30 PRO HA H 5.777 4.108 8.767 1.00 . A A . 30 PRO HA 1 1 3 1345 1 1 30 PRO HB2 H 4.592 5.885 10.621 1.00 . A A . 30 PRO HB2 1 1 3 1346 1 1 30 PRO HB3 H 6.120 4.994 10.818 1.00 . A A . 30 PRO HB3 1 1 3 1347 1 1 30 PRO HD2 H 7.779 7.600 8.538 1.00 . A A . 30 PRO HD2 1 1 3 1348 1 1 30 PRO HD3 H 8.186 6.060 9.329 1.00 . A A . 30 PRO HD3 1 1 3 1349 1 1 30 PRO HG2 H 5.741 7.818 9.782 1.00 . A A . 30 PRO HG2 1 1 3 1350 1 1 30 PRO HG3 H 6.901 7.247 11.014 1.00 . A A . 30 PRO HG3 1 1 3 1351 1 1 30 PRO N N 6.583 5.893 8.011 1.00 . A A . 30 PRO N 1 1 3 1352 1 1 30 PRO O O 3.401 4.302 7.993 1.00 . A A . 30 PRO O 1 1 3 1353 1 1 31 TYR C C 2.417 6.464 5.477 1.00 . A A . 31 TYR C 1 1 3 1354 1 1 31 TYR CA C 2.461 6.757 7.005 1.00 . A A . 31 TYR CA 1 1 3 1355 1 1 31 TYR CB C 2.006 8.189 7.346 1.00 . A A . 31 TYR CB 1 1 3 1356 1 1 31 TYR CD1 C 0.798 8.098 9.591 1.00 . A A . 31 TYR CD1 1 1 3 1357 1 1 31 TYR CD2 C 3.027 9.098 9.490 1.00 . A A . 31 TYR CD2 1 1 3 1358 1 1 31 TYR CE1 C 0.745 8.362 10.978 1.00 . A A . 31 TYR CE1 1 1 3 1359 1 1 31 TYR CE2 C 2.976 9.345 10.878 1.00 . A A . 31 TYR CE2 1 1 3 1360 1 1 31 TYR CG C 1.931 8.488 8.838 1.00 . A A . 31 TYR CG 1 1 3 1361 1 1 31 TYR CZ C 1.833 8.989 11.615 1.00 . A A . 31 TYR CZ 1 1 3 1362 1 1 31 TYR H H 4.374 7.259 7.829 1.00 . A A . 31 TYR H 1 1 3 1363 1 1 31 TYR HA H 1.708 6.095 7.433 1.00 . A A . 31 TYR HA 1 1 3 1364 1 1 31 TYR HB2 H 2.678 8.906 6.869 1.00 . A A . 31 TYR HB2 1 1 3 1365 1 1 31 TYR HB3 H 1.011 8.351 6.925 1.00 . A A . 31 TYR HB3 1 1 3 1366 1 1 31 TYR HD1 H -0.032 7.604 9.105 1.00 . A A . 31 TYR HD1 1 1 3 1367 1 1 31 TYR HD2 H 3.904 9.381 8.927 1.00 . A A . 31 TYR HD2 1 1 3 1368 1 1 31 TYR HE1 H -0.129 8.085 11.548 1.00 . A A . 31 TYR HE1 1 1 3 1369 1 1 31 TYR HE2 H 3.807 9.819 11.381 1.00 . A A . 31 TYR HE2 1 1 3 1370 1 1 31 TYR HH H 0.949 8.959 13.320 1.00 . A A . 31 TYR HH 1 1 3 1371 1 1 31 TYR N N 3.745 6.492 7.671 1.00 . A A . 31 TYR N 1 1 3 1372 1 1 31 TYR O O 1.530 6.966 4.789 1.00 . A A . 31 TYR O 1 1 3 1373 1 1 31 TYR OH O 1.780 9.252 12.946 1.00 . A A . 31 TYR OH 1 1 3 1374 1 1 32 TYR C C 3.779 3.712 3.336 1.00 . A A . 32 TYR C 1 1 3 1375 1 1 32 TYR CA C 3.236 5.156 3.527 1.00 . A A . 32 TYR CA 1 1 3 1376 1 1 32 TYR CB C 3.836 6.193 2.551 1.00 . A A . 32 TYR CB 1 1 3 1377 1 1 32 TYR CD1 C 3.067 5.150 0.339 1.00 . A A . 32 TYR CD1 1 1 3 1378 1 1 32 TYR CD2 C 2.812 7.560 0.666 1.00 . A A . 32 TYR CD2 1 1 3 1379 1 1 32 TYR CE1 C 2.600 5.288 -0.988 1.00 . A A . 32 TYR CE1 1 1 3 1380 1 1 32 TYR CE2 C 2.345 7.689 -0.659 1.00 . A A . 32 TYR CE2 1 1 3 1381 1 1 32 TYR CG C 3.188 6.290 1.171 1.00 . A A . 32 TYR CG 1 1 3 1382 1 1 32 TYR CZ C 2.257 6.557 -1.488 1.00 . A A . 32 TYR CZ 1 1 3 1383 1 1 32 TYR H H 4.102 5.333 5.490 1.00 . A A . 32 TYR H 1 1 3 1384 1 1 32 TYR HA H 2.173 5.108 3.276 1.00 . A A . 32 TYR HA 1 1 3 1385 1 1 32 TYR HB2 H 3.745 7.176 3.013 1.00 . A A . 32 TYR HB2 1 1 3 1386 1 1 32 TYR HB3 H 4.901 6.001 2.418 1.00 . A A . 32 TYR HB3 1 1 3 1387 1 1 32 TYR HD1 H 3.343 4.173 0.704 1.00 . A A . 32 TYR HD1 1 1 3 1388 1 1 32 TYR HD2 H 2.900 8.441 1.287 1.00 . A A . 32 TYR HD2 1 1 3 1389 1 1 32 TYR HE1 H 2.513 4.430 -1.636 1.00 . A A . 32 TYR HE1 1 1 3 1390 1 1 32 TYR HE2 H 2.077 8.660 -1.042 1.00 . A A . 32 TYR HE2 1 1 3 1391 1 1 32 TYR HH H 1.612 7.600 -2.967 1.00 . A A . 32 TYR HH 1 1 3 1392 1 1 32 TYR N N 3.320 5.638 4.922 1.00 . A A . 32 TYR N 1 1 3 1393 1 1 32 TYR O O 4.971 3.477 3.133 1.00 . A A . 32 TYR O 1 1 3 1394 1 1 32 TYR OH O 1.853 6.694 -2.775 1.00 . A A . 32 TYR OH 1 1 3 1395 1 1 33 SER C C 2.629 1.179 1.434 1.00 . A A . 33 SER C 1 1 3 1396 1 1 33 SER CA C 3.044 1.348 2.912 1.00 . A A . 33 SER CA 1 1 3 1397 1 1 33 SER CB C 2.213 0.439 3.826 1.00 . A A . 33 SER CB 1 1 3 1398 1 1 33 SER H H 1.913 3.036 3.549 1.00 . A A . 33 SER H 1 1 3 1399 1 1 33 SER HA H 4.095 1.068 3.014 1.00 . A A . 33 SER HA 1 1 3 1400 1 1 33 SER HB2 H 2.501 0.623 4.866 1.00 . A A . 33 SER HB2 1 1 3 1401 1 1 33 SER HB3 H 1.145 0.641 3.707 1.00 . A A . 33 SER HB3 1 1 3 1402 1 1 33 SER HG H 2.349 -1.444 4.297 1.00 . A A . 33 SER HG 1 1 3 1403 1 1 33 SER N N 2.857 2.740 3.355 1.00 . A A . 33 SER N 1 1 3 1404 1 1 33 SER O O 1.493 1.513 1.097 1.00 . A A . 33 SER O 1 1 3 1405 1 1 33 SER OG O 2.466 -0.910 3.502 1.00 . A A . 33 SER OG 1 1 3 1406 1 1 34 GLN C C 3.273 -0.166 -1.841 1.00 . A A . 34 GLN C 1 1 3 1407 1 1 34 GLN CA C 3.509 1.059 -0.901 1.00 . A A . 34 GLN CA 1 1 3 1408 1 1 34 GLN CB C 4.763 1.895 -1.241 1.00 . A A . 34 GLN CB 1 1 3 1409 1 1 34 GLN CD C 5.918 2.201 -3.541 1.00 . A A . 34 GLN CD 1 1 3 1410 1 1 34 GLN CG C 4.718 2.532 -2.658 1.00 . A A . 34 GLN CG 1 1 3 1411 1 1 34 GLN H H 4.436 0.480 0.931 1.00 . A A . 34 GLN H 1 1 3 1412 1 1 34 GLN HA H 2.662 1.717 -1.110 1.00 . A A . 34 GLN HA 1 1 3 1413 1 1 34 GLN HB2 H 4.849 2.715 -0.524 1.00 . A A . 34 GLN HB2 1 1 3 1414 1 1 34 GLN HB3 H 5.643 1.264 -1.096 1.00 . A A . 34 GLN HB3 1 1 3 1415 1 1 34 GLN HE21 H 4.944 2.711 -5.254 1.00 . A A . 34 GLN HE21 1 1 3 1416 1 1 34 GLN HE22 H 6.577 2.064 -5.385 1.00 . A A . 34 GLN HE22 1 1 3 1417 1 1 34 GLN HG2 H 3.817 2.222 -3.184 1.00 . A A . 34 GLN HG2 1 1 3 1418 1 1 34 GLN HG3 H 4.680 3.616 -2.563 1.00 . A A . 34 GLN HG3 1 1 3 1419 1 1 34 GLN N N 3.555 0.776 0.548 1.00 . A A . 34 GLN N 1 1 3 1420 1 1 34 GLN NE2 N 5.797 2.388 -4.838 1.00 . A A . 34 GLN NE2 1 1 3 1421 1 1 34 GLN O O 2.199 -0.752 -1.818 1.00 . A A . 34 GLN O 1 1 3 1422 1 1 34 GLN OE1 O 6.954 1.754 -3.082 1.00 . A A . 34 GLN OE1 1 1 3 1423 1 1 35 CYS C C 5.232 -1.776 -4.626 1.00 . A A . 35 CYS C 1 1 3 1424 1 1 35 CYS CA C 3.921 -1.287 -3.966 1.00 . A A . 35 CYS CA 1 1 3 1425 1 1 35 CYS CB C 3.061 -0.449 -4.938 1.00 . A A . 35 CYS CB 1 1 3 1426 1 1 35 CYS H H 5.098 -0.030 -2.700 1.00 . A A . 35 CYS H 1 1 3 1427 1 1 35 CYS HA H 3.338 -2.172 -3.689 1.00 . A A . 35 CYS HA 1 1 3 1428 1 1 35 CYS HB2 H 2.111 -0.209 -4.467 1.00 . A A . 35 CYS HB2 1 1 3 1429 1 1 35 CYS HB3 H 3.576 0.482 -5.164 1.00 . A A . 35 CYS HB3 1 1 3 1430 1 1 35 CYS N N 4.192 -0.474 -2.765 1.00 . A A . 35 CYS N 1 1 3 1431 1 1 35 CYS O O 5.835 -1.033 -5.399 1.00 . A A . 35 CYS O 1 1 3 1432 1 1 35 CYS SG S 2.702 -1.236 -6.533 1.00 . A A . 35 CYS SG 1 1 3 1433 1 1 36 LEU C C 6.809 -4.900 -5.421 1.00 . A A . 36 LEU C 1 1 3 1434 1 1 36 LEU CA C 6.968 -3.587 -4.607 1.00 . A A . 36 LEU CA 1 1 3 1435 1 1 36 LEU CB C 7.777 -3.867 -3.316 1.00 . A A . 36 LEU CB 1 1 3 1436 1 1 36 LEU CD1 C 8.219 -1.383 -2.769 1.00 . A A . 36 LEU CD1 1 1 3 1437 1 1 36 LEU CD2 C 6.588 -2.731 -1.333 1.00 . A A . 36 LEU CD2 1 1 3 1438 1 1 36 LEU CG C 7.842 -2.770 -2.227 1.00 . A A . 36 LEU CG 1 1 3 1439 1 1 36 LEU H H 5.067 -3.557 -3.690 1.00 . A A . 36 LEU H 1 1 3 1440 1 1 36 LEU HA H 7.545 -2.895 -5.221 1.00 . A A . 36 LEU HA 1 1 3 1441 1 1 36 LEU HB2 H 7.396 -4.773 -2.845 1.00 . A A . 36 LEU HB2 1 1 3 1442 1 1 36 LEU HB3 H 8.800 -4.080 -3.628 1.00 . A A . 36 LEU HB3 1 1 3 1443 1 1 36 LEU HD11 H 9.132 -1.456 -3.363 1.00 . A A . 36 LEU HD11 1 1 3 1444 1 1 36 LEU HD12 H 7.430 -0.972 -3.388 1.00 . A A . 36 LEU HD12 1 1 3 1445 1 1 36 LEU HD13 H 8.398 -0.696 -1.941 1.00 . A A . 36 LEU HD13 1 1 3 1446 1 1 36 LEU HD21 H 5.653 -2.732 -1.882 1.00 . A A . 36 LEU HD21 1 1 3 1447 1 1 36 LEU HD22 H 6.589 -3.603 -0.680 1.00 . A A . 36 LEU HD22 1 1 3 1448 1 1 36 LEU HD23 H 6.592 -1.836 -0.724 1.00 . A A . 36 LEU HD23 1 1 3 1449 1 1 36 LEU HG H 8.660 -3.052 -1.559 1.00 . A A . 36 LEU HG 1 1 3 1450 1 1 36 LEU N N 5.670 -2.985 -4.270 1.00 . A A . 36 LEU N 1 1 3 1451 1 1 36 LEU O O 5.821 -5.622 -5.191 1.00 . A A . 36 LEU O 1 1 3 1452 1 1 36 LEU OXT O 7.719 -5.184 -6.242 1.00 . A A . 36 LEU OXT 1 1 4 1453 1 1 1 THR C C -3.989 -8.019 -11.864 1.00 . A A . 1 THR C 1 1 4 1454 1 1 1 THR CA C -2.744 -8.039 -12.788 1.00 . A A . 1 THR CA 1 1 4 1455 1 1 1 THR CB C -1.482 -8.134 -11.894 1.00 . A A . 1 THR CB 1 1 4 1456 1 1 1 THR CG2 C -0.191 -8.351 -12.692 1.00 . A A . 1 THR CG2 1 1 4 1457 1 1 1 THR H1 H -3.516 -6.688 -14.198 1.00 . A A . 1 THR H1 1 1 4 1458 1 1 1 THR H2 H -2.500 -6.043 -13.081 1.00 . A A . 1 THR H2 1 1 4 1459 1 1 1 THR H3 H -1.881 -6.912 -14.332 1.00 . A A . 1 THR H3 1 1 4 1460 1 1 1 THR HA H -2.805 -8.937 -13.407 1.00 . A A . 1 THR HA 1 1 4 1461 1 1 1 THR HB H -1.586 -8.959 -11.179 1.00 . A A . 1 THR HB 1 1 4 1462 1 1 1 THR HG1 H -0.502 -6.916 -10.706 1.00 . A A . 1 THR HG1 1 1 4 1463 1 1 1 THR HG21 H -0.261 -9.250 -13.305 1.00 . A A . 1 THR HG21 1 1 4 1464 1 1 1 THR HG22 H 0.034 -7.495 -13.329 1.00 . A A . 1 THR HG22 1 1 4 1465 1 1 1 THR HG23 H 0.644 -8.482 -11.998 1.00 . A A . 1 THR HG23 1 1 4 1466 1 1 1 THR N N -2.657 -6.843 -13.687 1.00 . A A . 1 THR N 1 1 4 1467 1 1 1 THR O O -4.515 -6.944 -11.591 1.00 . A A . 1 THR O 1 1 4 1468 1 1 1 THR OG1 O -1.340 -6.912 -11.194 1.00 . A A . 1 THR OG1 1 1 4 1469 1 1 2 GLN C C -4.956 -8.667 -8.980 1.00 . A A . 2 GLN C 1 1 4 1470 1 1 2 GLN CA C -5.484 -9.247 -10.313 1.00 . A A . 2 GLN CA 1 1 4 1471 1 1 2 GLN CB C -5.932 -10.716 -10.156 1.00 . A A . 2 GLN CB 1 1 4 1472 1 1 2 GLN CD C -8.053 -10.074 -8.855 1.00 . A A . 2 GLN CD 1 1 4 1473 1 1 2 GLN CG C -6.827 -10.979 -8.924 1.00 . A A . 2 GLN CG 1 1 4 1474 1 1 2 GLN H H -4.042 -10.050 -11.648 1.00 . A A . 2 GLN H 1 1 4 1475 1 1 2 GLN HA H -6.362 -8.672 -10.619 1.00 . A A . 2 GLN HA 1 1 4 1476 1 1 2 GLN HB2 H -6.480 -11.006 -11.055 1.00 . A A . 2 GLN HB2 1 1 4 1477 1 1 2 GLN HB3 H -5.058 -11.367 -10.071 1.00 . A A . 2 GLN HB3 1 1 4 1478 1 1 2 GLN HE21 H -7.520 -9.174 -7.071 1.00 . A A . 2 GLN HE21 1 1 4 1479 1 1 2 GLN HE22 H -9.043 -8.724 -7.819 1.00 . A A . 2 GLN HE22 1 1 4 1480 1 1 2 GLN HG2 H -7.189 -12.006 -8.970 1.00 . A A . 2 GLN HG2 1 1 4 1481 1 1 2 GLN HG3 H -6.248 -10.884 -8.004 1.00 . A A . 2 GLN HG3 1 1 4 1482 1 1 2 GLN N N -4.462 -9.173 -11.376 1.00 . A A . 2 GLN N 1 1 4 1483 1 1 2 GLN NE2 N -8.181 -9.243 -7.838 1.00 . A A . 2 GLN NE2 1 1 4 1484 1 1 2 GLN O O -4.050 -9.248 -8.386 1.00 . A A . 2 GLN O 1 1 4 1485 1 1 2 GLN OE1 O -8.889 -10.078 -9.742 1.00 . A A . 2 GLN OE1 1 1 4 1486 1 1 3 SER C C -5.418 -7.648 -6.028 1.00 . A A . 3 SER C 1 1 4 1487 1 1 3 SER CA C -5.038 -6.853 -7.297 1.00 . A A . 3 SER CA 1 1 4 1488 1 1 3 SER CB C -5.531 -5.396 -7.254 1.00 . A A . 3 SER CB 1 1 4 1489 1 1 3 SER H H -6.239 -7.110 -9.058 1.00 . A A . 3 SER H 1 1 4 1490 1 1 3 SER HA H -3.954 -6.780 -7.332 1.00 . A A . 3 SER HA 1 1 4 1491 1 1 3 SER HB2 H -5.374 -4.931 -8.229 1.00 . A A . 3 SER HB2 1 1 4 1492 1 1 3 SER HB3 H -6.598 -5.351 -7.009 1.00 . A A . 3 SER HB3 1 1 4 1493 1 1 3 SER HG H -4.806 -3.728 -6.431 1.00 . A A . 3 SER HG 1 1 4 1494 1 1 3 SER N N -5.479 -7.518 -8.534 1.00 . A A . 3 SER N 1 1 4 1495 1 1 3 SER O O -6.601 -7.874 -5.778 1.00 . A A . 3 SER O 1 1 4 1496 1 1 3 SER OG O -4.771 -4.687 -6.284 1.00 . A A . 3 SER OG 1 1 4 1497 1 1 4 HIS C C -4.391 -7.842 -2.812 1.00 . A A . 4 HIS C 1 1 4 1498 1 1 4 HIS CA C -4.566 -8.829 -3.994 1.00 . A A . 4 HIS CA 1 1 4 1499 1 1 4 HIS CB C -3.585 -10.016 -3.985 1.00 . A A . 4 HIS CB 1 1 4 1500 1 1 4 HIS CD2 C -4.212 -11.950 -2.352 1.00 . A A . 4 HIS CD2 1 1 4 1501 1 1 4 HIS CE1 C -3.004 -11.283 -0.661 1.00 . A A . 4 HIS CE1 1 1 4 1502 1 1 4 HIS CG C -3.562 -10.796 -2.697 1.00 . A A . 4 HIS CG 1 1 4 1503 1 1 4 HIS H H -3.482 -8.019 -5.647 1.00 . A A . 4 HIS H 1 1 4 1504 1 1 4 HIS HA H -5.571 -9.249 -3.908 1.00 . A A . 4 HIS HA 1 1 4 1505 1 1 4 HIS HB2 H -3.862 -10.694 -4.795 1.00 . A A . 4 HIS HB2 1 1 4 1506 1 1 4 HIS HB3 H -2.574 -9.661 -4.193 1.00 . A A . 4 HIS HB3 1 1 4 1507 1 1 4 HIS HD2 H -4.885 -12.511 -2.982 1.00 . A A . 4 HIS HD2 1 1 4 1508 1 1 4 HIS HE1 H -2.541 -11.249 0.315 1.00 . A A . 4 HIS HE1 1 1 4 1509 1 1 4 HIS HE2 H -4.167 -13.029 -0.496 1.00 . A A . 4 HIS HE2 1 1 4 1510 1 1 4 HIS N N -4.420 -8.139 -5.286 1.00 . A A . 4 HIS N 1 1 4 1511 1 1 4 HIS ND1 N -2.782 -10.383 -1.621 1.00 . A A . 4 HIS ND1 1 1 4 1512 1 1 4 HIS NE2 N -3.854 -12.245 -1.049 1.00 . A A . 4 HIS NE2 1 1 4 1513 1 1 4 HIS O O -5.359 -7.483 -2.144 1.00 . A A . 4 HIS O 1 1 4 1514 1 1 5 ALA C C -1.850 -5.237 -2.487 1.00 . A A . 5 ALA C 1 1 4 1515 1 1 5 ALA CA C -2.859 -6.173 -1.782 1.00 . A A . 5 ALA CA 1 1 4 1516 1 1 5 ALA CB C -2.384 -6.602 -0.384 1.00 . A A . 5 ALA CB 1 1 4 1517 1 1 5 ALA H H -2.416 -7.770 -3.132 1.00 . A A . 5 ALA H 1 1 4 1518 1 1 5 ALA HA H -3.775 -5.601 -1.615 1.00 . A A . 5 ALA HA 1 1 4 1519 1 1 5 ALA HB1 H -3.078 -7.327 0.047 1.00 . A A . 5 ALA HB1 1 1 4 1520 1 1 5 ALA HB2 H -1.389 -7.041 -0.423 1.00 . A A . 5 ALA HB2 1 1 4 1521 1 1 5 ALA HB3 H -2.341 -5.728 0.268 1.00 . A A . 5 ALA HB3 1 1 4 1522 1 1 5 ALA N N -3.164 -7.347 -2.607 1.00 . A A . 5 ALA N 1 1 4 1523 1 1 5 ALA O O -0.658 -5.536 -2.543 1.00 . A A . 5 ALA O 1 1 4 1524 1 1 6 GLY C C -1.423 -2.019 -2.096 1.00 . A A . 6 GLY C 1 1 4 1525 1 1 6 GLY CA C -1.549 -2.927 -3.340 1.00 . A A . 6 GLY CA 1 1 4 1526 1 1 6 GLY H H -3.349 -4.028 -3.045 1.00 . A A . 6 GLY H 1 1 4 1527 1 1 6 GLY HA2 H -0.550 -3.189 -3.692 1.00 . A A . 6 GLY HA2 1 1 4 1528 1 1 6 GLY HA3 H -2.060 -2.393 -4.142 1.00 . A A . 6 GLY HA3 1 1 4 1529 1 1 6 GLY N N -2.347 -4.127 -3.045 1.00 . A A . 6 GLY N 1 1 4 1530 1 1 6 GLY O O -1.284 -2.526 -0.985 1.00 . A A . 6 GLY O 1 1 4 1531 1 1 7 GLN C C -2.540 0.049 -0.006 1.00 . A A . 7 GLN C 1 1 4 1532 1 1 7 GLN CA C -1.520 0.294 -1.153 1.00 . A A . 7 GLN CA 1 1 4 1533 1 1 7 GLN CB C -1.586 1.720 -1.740 1.00 . A A . 7 GLN CB 1 1 4 1534 1 1 7 GLN CD C -1.461 4.241 -1.208 1.00 . A A . 7 GLN CD 1 1 4 1535 1 1 7 GLN CG C -1.341 2.814 -0.674 1.00 . A A . 7 GLN CG 1 1 4 1536 1 1 7 GLN H H -1.626 -0.337 -3.188 1.00 . A A . 7 GLN H 1 1 4 1537 1 1 7 GLN HA H -0.540 0.226 -0.684 1.00 . A A . 7 GLN HA 1 1 4 1538 1 1 7 GLN HB2 H -0.814 1.822 -2.507 1.00 . A A . 7 GLN HB2 1 1 4 1539 1 1 7 GLN HB3 H -2.558 1.874 -2.207 1.00 . A A . 7 GLN HB3 1 1 4 1540 1 1 7 GLN HE21 H -1.823 5.041 0.633 1.00 . A A . 7 GLN HE21 1 1 4 1541 1 1 7 GLN HE22 H -1.827 6.128 -0.758 1.00 . A A . 7 GLN HE22 1 1 4 1542 1 1 7 GLN HG2 H -2.044 2.712 0.151 1.00 . A A . 7 GLN HG2 1 1 4 1543 1 1 7 GLN HG3 H -0.339 2.702 -0.268 1.00 . A A . 7 GLN HG3 1 1 4 1544 1 1 7 GLN N N -1.567 -0.691 -2.252 1.00 . A A . 7 GLN N 1 1 4 1545 1 1 7 GLN NE2 N -1.699 5.214 -0.348 1.00 . A A . 7 GLN NE2 1 1 4 1546 1 1 7 GLN O O -3.568 0.715 0.092 1.00 . A A . 7 GLN O 1 1 4 1547 1 1 7 GLN OE1 O -1.332 4.506 -2.392 1.00 . A A . 7 GLN OE1 1 1 4 1548 1 1 8 CYS C C -2.927 0.181 3.062 1.00 . A A . 8 CYS C 1 1 4 1549 1 1 8 CYS CA C -2.843 -1.103 2.203 1.00 . A A . 8 CYS CA 1 1 4 1550 1 1 8 CYS CB C -2.040 -2.193 2.941 1.00 . A A . 8 CYS CB 1 1 4 1551 1 1 8 CYS H H -1.431 -1.475 0.628 1.00 . A A . 8 CYS H 1 1 4 1552 1 1 8 CYS HA H -3.861 -1.469 2.052 1.00 . A A . 8 CYS HA 1 1 4 1553 1 1 8 CYS HB2 H -2.459 -2.335 3.938 1.00 . A A . 8 CYS HB2 1 1 4 1554 1 1 8 CYS HB3 H -2.114 -3.137 2.405 1.00 . A A . 8 CYS HB3 1 1 4 1555 1 1 8 CYS N N -2.211 -0.881 0.894 1.00 . A A . 8 CYS N 1 1 4 1556 1 1 8 CYS O O -3.936 0.446 3.712 1.00 . A A . 8 CYS O 1 1 4 1557 1 1 8 CYS SG S -0.271 -1.826 3.140 1.00 . A A . 8 CYS SG 1 1 4 1558 1 1 9 GLY C C -0.792 1.597 5.295 1.00 . A A . 9 GLY C 1 1 4 1559 1 1 9 GLY CA C -1.596 2.025 4.044 1.00 . A A . 9 GLY CA 1 1 4 1560 1 1 9 GLY H H -1.072 0.690 2.472 1.00 . A A . 9 GLY H 1 1 4 1561 1 1 9 GLY HA2 H -1.040 2.779 3.499 1.00 . A A . 9 GLY HA2 1 1 4 1562 1 1 9 GLY HA3 H -2.531 2.472 4.365 1.00 . A A . 9 GLY HA3 1 1 4 1563 1 1 9 GLY N N -1.837 0.957 3.080 1.00 . A A . 9 GLY N 1 1 4 1564 1 1 9 GLY O O -0.776 0.430 5.682 1.00 . A A . 9 GLY O 1 1 4 1565 1 1 10 GLY C C 0.079 3.163 8.316 1.00 . A A . 10 GLY C 1 1 4 1566 1 1 10 GLY CA C 0.693 2.365 7.150 1.00 . A A . 10 GLY CA 1 1 4 1567 1 1 10 GLY H H -0.169 3.486 5.550 1.00 . A A . 10 GLY H 1 1 4 1568 1 1 10 GLY HA2 H 0.726 1.316 7.455 1.00 . A A . 10 GLY HA2 1 1 4 1569 1 1 10 GLY HA3 H 1.723 2.681 6.978 1.00 . A A . 10 GLY HA3 1 1 4 1570 1 1 10 GLY N N -0.067 2.548 5.899 1.00 . A A . 10 GLY N 1 1 4 1571 1 1 10 GLY O O -1.109 3.036 8.603 1.00 . A A . 10 GLY O 1 1 4 1572 1 1 11 ILE C C -0.634 6.019 9.364 1.00 . A A . 11 ILE C 1 1 4 1573 1 1 11 ILE CA C 0.288 4.940 9.999 1.00 . A A . 11 ILE CA 1 1 4 1574 1 1 11 ILE CB C 1.404 5.578 10.863 1.00 . A A . 11 ILE CB 1 1 4 1575 1 1 11 ILE CD1 C 3.580 5.149 12.160 1.00 . A A . 11 ILE CD1 1 1 4 1576 1 1 11 ILE CG1 C 2.384 4.523 11.428 1.00 . A A . 11 ILE CG1 1 1 4 1577 1 1 11 ILE CG2 C 0.767 6.365 12.027 1.00 . A A . 11 ILE CG2 1 1 4 1578 1 1 11 ILE H H 1.803 4.169 8.664 1.00 . A A . 11 ILE H 1 1 4 1579 1 1 11 ILE HA H -0.314 4.333 10.679 1.00 . A A . 11 ILE HA 1 1 4 1580 1 1 11 ILE HB H 1.972 6.266 10.232 1.00 . A A . 11 ILE HB 1 1 4 1581 1 1 11 ILE HD11 H 4.058 5.893 11.522 1.00 . A A . 11 ILE HD11 1 1 4 1582 1 1 11 ILE HD12 H 3.267 5.620 13.089 1.00 . A A . 11 ILE HD12 1 1 4 1583 1 1 11 ILE HD13 H 4.307 4.372 12.401 1.00 . A A . 11 ILE HD13 1 1 4 1584 1 1 11 ILE HG12 H 1.856 3.854 12.109 1.00 . A A . 11 ILE HG12 1 1 4 1585 1 1 11 ILE HG13 H 2.792 3.926 10.611 1.00 . A A . 11 ILE HG13 1 1 4 1586 1 1 11 ILE HG21 H 0.066 7.114 11.662 1.00 . A A . 11 ILE HG21 1 1 4 1587 1 1 11 ILE HG22 H 0.231 5.681 12.687 1.00 . A A . 11 ILE HG22 1 1 4 1588 1 1 11 ILE HG23 H 1.523 6.890 12.608 1.00 . A A . 11 ILE HG23 1 1 4 1589 1 1 11 ILE N N 0.846 4.038 8.974 1.00 . A A . 11 ILE N 1 1 4 1590 1 1 11 ILE O O -0.280 6.644 8.366 1.00 . A A . 11 ILE O 1 1 4 1591 1 1 12 GLY C C -3.405 7.306 8.169 1.00 . A A . 12 GLY C 1 1 4 1592 1 1 12 GLY CA C -2.734 7.348 9.563 1.00 . A A . 12 GLY CA 1 1 4 1593 1 1 12 GLY H H -2.060 5.685 10.741 1.00 . A A . 12 GLY H 1 1 4 1594 1 1 12 GLY HA2 H -3.535 7.386 10.301 1.00 . A A . 12 GLY HA2 1 1 4 1595 1 1 12 GLY HA3 H -2.186 8.290 9.628 1.00 . A A . 12 GLY HA3 1 1 4 1596 1 1 12 GLY N N -1.821 6.250 9.940 1.00 . A A . 12 GLY N 1 1 4 1597 1 1 12 GLY O O -4.071 8.267 7.794 1.00 . A A . 12 GLY O 1 1 4 1598 1 1 13 TYR C C -4.457 4.719 5.806 1.00 . A A . 13 TYR C 1 1 4 1599 1 1 13 TYR CA C -3.752 6.087 6.017 1.00 . A A . 13 TYR CA 1 1 4 1600 1 1 13 TYR CB C -2.548 6.308 5.062 1.00 . A A . 13 TYR CB 1 1 4 1601 1 1 13 TYR CD1 C -3.925 6.653 2.929 1.00 . A A . 13 TYR CD1 1 1 4 1602 1 1 13 TYR CD2 C -1.859 7.917 3.210 1.00 . A A . 13 TYR CD2 1 1 4 1603 1 1 13 TYR CE1 C -4.001 7.095 1.591 1.00 . A A . 13 TYR CE1 1 1 4 1604 1 1 13 TYR CE2 C -1.919 8.314 1.853 1.00 . A A . 13 TYR CE2 1 1 4 1605 1 1 13 TYR CG C -2.817 7.012 3.733 1.00 . A A . 13 TYR CG 1 1 4 1606 1 1 13 TYR CZ C -2.949 7.835 1.026 1.00 . A A . 13 TYR CZ 1 1 4 1607 1 1 13 TYR H H -2.717 5.454 7.781 1.00 . A A . 13 TYR H 1 1 4 1608 1 1 13 TYR HA H -4.480 6.877 5.813 1.00 . A A . 13 TYR HA 1 1 4 1609 1 1 13 TYR HB2 H -1.790 6.896 5.585 1.00 . A A . 13 TYR HB2 1 1 4 1610 1 1 13 TYR HB3 H -2.080 5.347 4.837 1.00 . A A . 13 TYR HB3 1 1 4 1611 1 1 13 TYR HD1 H -4.711 6.024 3.320 1.00 . A A . 13 TYR HD1 1 1 4 1612 1 1 13 TYR HD2 H -1.046 8.268 3.832 1.00 . A A . 13 TYR HD2 1 1 4 1613 1 1 13 TYR HE1 H -4.857 6.845 0.991 1.00 . A A . 13 TYR HE1 1 1 4 1614 1 1 13 TYR HE2 H -1.152 8.945 1.433 1.00 . A A . 13 TYR HE2 1 1 4 1615 1 1 13 TYR HH H -3.537 7.485 -0.789 1.00 . A A . 13 TYR HH 1 1 4 1616 1 1 13 TYR N N -3.267 6.214 7.405 1.00 . A A . 13 TYR N 1 1 4 1617 1 1 13 TYR O O -3.828 3.682 5.980 1.00 . A A . 13 TYR O 1 1 4 1618 1 1 13 TYR OH O -2.905 8.046 -0.317 1.00 . A A . 13 TYR OH 1 1 4 1619 1 1 14 SER C C -7.920 3.694 4.634 1.00 . A A . 14 SER C 1 1 4 1620 1 1 14 SER CA C -6.579 3.469 5.379 1.00 . A A . 14 SER CA 1 1 4 1621 1 1 14 SER CB C -6.829 2.909 6.795 1.00 . A A . 14 SER CB 1 1 4 1622 1 1 14 SER H H -6.223 5.591 5.396 1.00 . A A . 14 SER H 1 1 4 1623 1 1 14 SER HA H -6.022 2.703 4.832 1.00 . A A . 14 SER HA 1 1 4 1624 1 1 14 SER HB2 H -5.895 2.503 7.191 1.00 . A A . 14 SER HB2 1 1 4 1625 1 1 14 SER HB3 H -7.160 3.708 7.463 1.00 . A A . 14 SER HB3 1 1 4 1626 1 1 14 SER HG H -8.668 2.267 6.582 1.00 . A A . 14 SER HG 1 1 4 1627 1 1 14 SER N N -5.760 4.699 5.481 1.00 . A A . 14 SER N 1 1 4 1628 1 1 14 SER O O -8.868 4.218 5.217 1.00 . A A . 14 SER O 1 1 4 1629 1 1 14 SER OG O -7.807 1.881 6.779 1.00 . A A . 14 SER OG 1 1 4 1630 1 1 15 GLY C C -9.034 3.300 1.015 1.00 . A A . 15 GLY C 1 1 4 1631 1 1 15 GLY CA C -9.239 3.470 2.539 1.00 . A A . 15 GLY CA 1 1 4 1632 1 1 15 GLY H H -7.220 2.849 2.939 1.00 . A A . 15 GLY H 1 1 4 1633 1 1 15 GLY HA2 H -9.976 2.737 2.869 1.00 . A A . 15 GLY HA2 1 1 4 1634 1 1 15 GLY HA3 H -9.640 4.469 2.719 1.00 . A A . 15 GLY HA3 1 1 4 1635 1 1 15 GLY N N -8.019 3.311 3.354 1.00 . A A . 15 GLY N 1 1 4 1636 1 1 15 GLY O O -8.025 2.733 0.588 1.00 . A A . 15 GLY O 1 1 4 1637 1 1 16 PRO C C -8.693 4.555 -1.896 1.00 . A A . 16 PRO C 1 1 4 1638 1 1 16 PRO CA C -9.889 3.767 -1.294 1.00 . A A . 16 PRO CA 1 1 4 1639 1 1 16 PRO CB C -11.259 4.282 -1.777 1.00 . A A . 16 PRO CB 1 1 4 1640 1 1 16 PRO CD C -11.297 4.244 0.591 1.00 . A A . 16 PRO CD 1 1 4 1641 1 1 16 PRO CG C -12.197 3.964 -0.612 1.00 . A A . 16 PRO CG 1 1 4 1642 1 1 16 PRO HA H -9.802 2.728 -1.623 1.00 . A A . 16 PRO HA 1 1 4 1643 1 1 16 PRO HB2 H -11.238 5.370 -1.895 1.00 . A A . 16 PRO HB2 1 1 4 1644 1 1 16 PRO HB3 H -11.577 3.823 -2.716 1.00 . A A . 16 PRO HB3 1 1 4 1645 1 1 16 PRO HD2 H -11.264 5.318 0.786 1.00 . A A . 16 PRO HD2 1 1 4 1646 1 1 16 PRO HD3 H -11.685 3.725 1.470 1.00 . A A . 16 PRO HD3 1 1 4 1647 1 1 16 PRO HG2 H -13.095 4.586 -0.612 1.00 . A A . 16 PRO HG2 1 1 4 1648 1 1 16 PRO HG3 H -12.477 2.909 -0.633 1.00 . A A . 16 PRO HG3 1 1 4 1649 1 1 16 PRO N N -9.974 3.789 0.176 1.00 . A A . 16 PRO N 1 1 4 1650 1 1 16 PRO O O -8.865 5.593 -2.524 1.00 . A A . 16 PRO O 1 1 4 1651 1 1 17 THR C C -5.369 3.518 -3.049 1.00 . A A . 17 THR C 1 1 4 1652 1 1 17 THR CA C -6.206 4.577 -2.296 1.00 . A A . 17 THR CA 1 1 4 1653 1 1 17 THR CB C -5.384 5.207 -1.150 1.00 . A A . 17 THR CB 1 1 4 1654 1 1 17 THR CG2 C -4.913 4.168 -0.119 1.00 . A A . 17 THR CG2 1 1 4 1655 1 1 17 THR H H -7.404 3.226 -1.131 1.00 . A A . 17 THR H 1 1 4 1656 1 1 17 THR HA H -6.405 5.363 -3.027 1.00 . A A . 17 THR HA 1 1 4 1657 1 1 17 THR HB H -6.023 5.946 -0.659 1.00 . A A . 17 THR HB 1 1 4 1658 1 1 17 THR HG1 H -3.732 5.255 -2.179 1.00 . A A . 17 THR HG1 1 1 4 1659 1 1 17 THR HG21 H -4.395 3.346 -0.608 1.00 . A A . 17 THR HG21 1 1 4 1660 1 1 17 THR HG22 H -4.227 4.612 0.597 1.00 . A A . 17 THR HG22 1 1 4 1661 1 1 17 THR HG23 H -5.755 3.759 0.434 1.00 . A A . 17 THR HG23 1 1 4 1662 1 1 17 THR N N -7.471 4.040 -1.732 1.00 . A A . 17 THR N 1 1 4 1663 1 1 17 THR O O -4.169 3.690 -3.249 1.00 . A A . 17 THR O 1 1 4 1664 1 1 17 THR OG1 O -4.242 5.883 -1.639 1.00 . A A . 17 THR OG1 1 1 4 1665 1 1 18 VAL C C -4.608 1.086 -5.125 1.00 . A A . 18 VAL C 1 1 4 1666 1 1 18 VAL CA C -5.290 1.122 -3.734 1.00 . A A . 18 VAL CA 1 1 4 1667 1 1 18 VAL CB C -6.240 -0.078 -3.509 1.00 . A A . 18 VAL CB 1 1 4 1668 1 1 18 VAL CG1 C -7.325 -0.217 -4.591 1.00 . A A . 18 VAL CG1 1 1 4 1669 1 1 18 VAL CG2 C -5.468 -1.402 -3.375 1.00 . A A . 18 VAL CG2 1 1 4 1670 1 1 18 VAL H H -6.980 2.351 -3.293 1.00 . A A . 18 VAL H 1 1 4 1671 1 1 18 VAL HA H -4.506 1.013 -2.982 1.00 . A A . 18 VAL HA 1 1 4 1672 1 1 18 VAL HB H -6.748 0.080 -2.555 1.00 . A A . 18 VAL HB 1 1 4 1673 1 1 18 VAL HG11 H -7.899 0.707 -4.681 1.00 . A A . 18 VAL HG11 1 1 4 1674 1 1 18 VAL HG12 H -6.884 -0.455 -5.561 1.00 . A A . 18 VAL HG12 1 1 4 1675 1 1 18 VAL HG13 H -8.007 -1.022 -4.315 1.00 . A A . 18 VAL HG13 1 1 4 1676 1 1 18 VAL HG21 H -4.714 -1.322 -2.590 1.00 . A A . 18 VAL HG21 1 1 4 1677 1 1 18 VAL HG22 H -6.158 -2.202 -3.106 1.00 . A A . 18 VAL HG22 1 1 4 1678 1 1 18 VAL HG23 H -4.981 -1.668 -4.313 1.00 . A A . 18 VAL HG23 1 1 4 1679 1 1 18 VAL N N -5.980 2.379 -3.405 1.00 . A A . 18 VAL N 1 1 4 1680 1 1 18 VAL O O -5.117 1.601 -6.117 1.00 . A A . 18 VAL O 1 1 4 1681 1 1 19 CYS C C -3.050 -1.127 -7.126 1.00 . A A . 19 CYS C 1 1 4 1682 1 1 19 CYS CA C -2.629 0.169 -6.370 1.00 . A A . 19 CYS CA 1 1 4 1683 1 1 19 CYS CB C -1.173 0.142 -5.852 1.00 . A A . 19 CYS CB 1 1 4 1684 1 1 19 CYS H H -3.166 -0.013 -4.322 1.00 . A A . 19 CYS H 1 1 4 1685 1 1 19 CYS HA H -2.729 1.007 -7.063 1.00 . A A . 19 CYS HA 1 1 4 1686 1 1 19 CYS HB2 H -0.951 1.107 -5.390 1.00 . A A . 19 CYS HB2 1 1 4 1687 1 1 19 CYS HB3 H -1.095 -0.616 -5.081 1.00 . A A . 19 CYS HB3 1 1 4 1688 1 1 19 CYS N N -3.454 0.419 -5.181 1.00 . A A . 19 CYS N 1 1 4 1689 1 1 19 CYS O O -3.919 -1.890 -6.692 1.00 . A A . 19 CYS O 1 1 4 1690 1 1 19 CYS SG S 0.214 -0.188 -6.974 1.00 . A A . 19 CYS SG 1 1 4 1691 1 1 20 ALA C C -1.709 -3.802 -7.824 1.00 . A A . 20 ALA C 1 1 4 1692 1 1 20 ALA CA C -2.298 -2.763 -8.823 1.00 . A A . 20 ALA CA 1 1 4 1693 1 1 20 ALA CB C -1.479 -2.678 -10.122 1.00 . A A . 20 ALA CB 1 1 4 1694 1 1 20 ALA H H -1.739 -0.721 -8.584 1.00 . A A . 20 ALA H 1 1 4 1695 1 1 20 ALA HA H -3.307 -3.091 -9.079 1.00 . A A . 20 ALA HA 1 1 4 1696 1 1 20 ALA HB1 H -1.921 -1.944 -10.798 1.00 . A A . 20 ALA HB1 1 1 4 1697 1 1 20 ALA HB2 H -0.453 -2.375 -9.897 1.00 . A A . 20 ALA HB2 1 1 4 1698 1 1 20 ALA HB3 H -1.459 -3.648 -10.620 1.00 . A A . 20 ALA HB3 1 1 4 1699 1 1 20 ALA N N -2.397 -1.409 -8.260 1.00 . A A . 20 ALA N 1 1 4 1700 1 1 20 ALA O O -1.333 -3.465 -6.705 1.00 . A A . 20 ALA O 1 1 4 1701 1 1 21 SER C C 0.232 -6.124 -6.825 1.00 . A A . 21 SER C 1 1 4 1702 1 1 21 SER CA C -1.242 -6.161 -7.283 1.00 . A A . 21 SER CA 1 1 4 1703 1 1 21 SER CB C -1.536 -7.542 -7.892 1.00 . A A . 21 SER CB 1 1 4 1704 1 1 21 SER H H -1.916 -5.310 -9.152 1.00 . A A . 21 SER H 1 1 4 1705 1 1 21 SER HA H -1.866 -6.040 -6.393 1.00 . A A . 21 SER HA 1 1 4 1706 1 1 21 SER HB2 H -2.309 -7.457 -8.656 1.00 . A A . 21 SER HB2 1 1 4 1707 1 1 21 SER HB3 H -0.643 -7.953 -8.376 1.00 . A A . 21 SER HB3 1 1 4 1708 1 1 21 SER HG H -2.448 -9.162 -7.257 1.00 . A A . 21 SER HG 1 1 4 1709 1 1 21 SER N N -1.648 -5.083 -8.212 1.00 . A A . 21 SER N 1 1 4 1710 1 1 21 SER O O 1.100 -5.744 -7.605 1.00 . A A . 21 SER O 1 1 4 1711 1 1 21 SER OG O -1.973 -8.416 -6.863 1.00 . A A . 21 SER OG 1 1 4 1712 1 1 22 GLY C C 1.826 -7.974 -3.975 1.00 . A A . 22 GLY C 1 1 4 1713 1 1 22 GLY CA C 1.813 -6.842 -5.023 1.00 . A A . 22 GLY CA 1 1 4 1714 1 1 22 GLY H H -0.321 -6.935 -5.087 1.00 . A A . 22 GLY H 1 1 4 1715 1 1 22 GLY HA2 H 2.542 -7.078 -5.802 1.00 . A A . 22 GLY HA2 1 1 4 1716 1 1 22 GLY HA3 H 2.132 -5.920 -4.534 1.00 . A A . 22 GLY HA3 1 1 4 1717 1 1 22 GLY N N 0.481 -6.627 -5.614 1.00 . A A . 22 GLY N 1 1 4 1718 1 1 22 GLY O O 2.629 -8.899 -4.042 1.00 . A A . 22 GLY O 1 1 4 1719 1 1 23 THR C C 1.865 -8.375 -0.720 1.00 . A A . 23 THR C 1 1 4 1720 1 1 23 THR CA C 0.821 -8.768 -1.796 1.00 . A A . 23 THR CA 1 1 4 1721 1 1 23 THR CB C 0.784 -10.281 -2.148 1.00 . A A . 23 THR CB 1 1 4 1722 1 1 23 THR CG2 C 0.541 -11.217 -0.956 1.00 . A A . 23 THR CG2 1 1 4 1723 1 1 23 THR H H 0.316 -7.078 -3.023 1.00 . A A . 23 THR H 1 1 4 1724 1 1 23 THR HA H -0.142 -8.559 -1.338 1.00 . A A . 23 THR HA 1 1 4 1725 1 1 23 THR HB H 1.710 -10.592 -2.638 1.00 . A A . 23 THR HB 1 1 4 1726 1 1 23 THR HG1 H -1.116 -10.433 -2.508 1.00 . A A . 23 THR HG1 1 1 4 1727 1 1 23 THR HG21 H -0.169 -10.774 -0.258 1.00 . A A . 23 THR HG21 1 1 4 1728 1 1 23 THR HG22 H 0.151 -12.175 -1.303 1.00 . A A . 23 THR HG22 1 1 4 1729 1 1 23 THR HG23 H 1.476 -11.418 -0.434 1.00 . A A . 23 THR HG23 1 1 4 1730 1 1 23 THR N N 0.900 -7.906 -3.004 1.00 . A A . 23 THR N 1 1 4 1731 1 1 23 THR O O 2.280 -9.173 0.115 1.00 . A A . 23 THR O 1 1 4 1732 1 1 23 THR OG1 O -0.303 -10.516 -3.022 1.00 . A A . 23 THR OG1 1 1 4 1733 1 1 24 THR C C 3.241 -5.264 0.652 1.00 . A A . 24 THR C 1 1 4 1734 1 1 24 THR CA C 3.503 -6.569 -0.117 1.00 . A A . 24 THR CA 1 1 4 1735 1 1 24 THR CB C 4.576 -6.362 -1.206 1.00 . A A . 24 THR CB 1 1 4 1736 1 1 24 THR CG2 C 5.072 -7.708 -1.750 1.00 . A A . 24 THR CG2 1 1 4 1737 1 1 24 THR H H 1.887 -6.520 -1.462 1.00 . A A . 24 THR H 1 1 4 1738 1 1 24 THR HA H 3.913 -7.273 0.609 1.00 . A A . 24 THR HA 1 1 4 1739 1 1 24 THR HB H 5.439 -5.828 -0.792 1.00 . A A . 24 THR HB 1 1 4 1740 1 1 24 THR HG1 H 4.538 -5.787 -3.071 1.00 . A A . 24 THR HG1 1 1 4 1741 1 1 24 THR HG21 H 5.497 -8.308 -0.947 1.00 . A A . 24 THR HG21 1 1 4 1742 1 1 24 THR HG22 H 4.257 -8.264 -2.204 1.00 . A A . 24 THR HG22 1 1 4 1743 1 1 24 THR HG23 H 5.837 -7.549 -2.510 1.00 . A A . 24 THR HG23 1 1 4 1744 1 1 24 THR N N 2.276 -7.102 -0.733 1.00 . A A . 24 THR N 1 1 4 1745 1 1 24 THR O O 3.659 -4.177 0.258 1.00 . A A . 24 THR O 1 1 4 1746 1 1 24 THR OG1 O 4.018 -5.605 -2.264 1.00 . A A . 24 THR OG1 1 1 4 1747 1 1 25 CYS C C 3.602 -3.756 3.466 1.00 . A A . 25 CYS C 1 1 4 1748 1 1 25 CYS CA C 2.334 -4.229 2.709 1.00 . A A . 25 CYS CA 1 1 4 1749 1 1 25 CYS CB C 1.149 -4.583 3.628 1.00 . A A . 25 CYS CB 1 1 4 1750 1 1 25 CYS H H 2.286 -6.293 2.089 1.00 . A A . 25 CYS H 1 1 4 1751 1 1 25 CYS HA H 2.017 -3.388 2.089 1.00 . A A . 25 CYS HA 1 1 4 1752 1 1 25 CYS HB2 H 0.323 -4.957 3.021 1.00 . A A . 25 CYS HB2 1 1 4 1753 1 1 25 CYS HB3 H 1.446 -5.366 4.327 1.00 . A A . 25 CYS HB3 1 1 4 1754 1 1 25 CYS N N 2.592 -5.370 1.817 1.00 . A A . 25 CYS N 1 1 4 1755 1 1 25 CYS O O 3.638 -3.736 4.697 1.00 . A A . 25 CYS O 1 1 4 1756 1 1 25 CYS SG S 0.491 -3.201 4.596 1.00 . A A . 25 CYS SG 1 1 4 1757 1 1 26 GLN C C 6.073 -1.302 2.848 1.00 . A A . 26 GLN C 1 1 4 1758 1 1 26 GLN CA C 5.892 -2.794 3.226 1.00 . A A . 26 GLN CA 1 1 4 1759 1 1 26 GLN CB C 7.070 -3.763 2.925 1.00 . A A . 26 GLN CB 1 1 4 1760 1 1 26 GLN CD C 9.144 -2.321 2.409 1.00 . A A . 26 GLN CD 1 1 4 1761 1 1 26 GLN CG C 8.112 -3.312 1.877 1.00 . A A . 26 GLN CG 1 1 4 1762 1 1 26 GLN H H 4.497 -3.354 1.714 1.00 . A A . 26 GLN H 1 1 4 1763 1 1 26 GLN HA H 5.835 -2.775 4.316 1.00 . A A . 26 GLN HA 1 1 4 1764 1 1 26 GLN HB2 H 7.601 -3.984 3.855 1.00 . A A . 26 GLN HB2 1 1 4 1765 1 1 26 GLN HB3 H 6.671 -4.724 2.599 1.00 . A A . 26 GLN HB3 1 1 4 1766 1 1 26 GLN HE21 H 9.505 -1.515 0.575 1.00 . A A . 26 GLN HE21 1 1 4 1767 1 1 26 GLN HE22 H 10.230 -0.746 1.990 1.00 . A A . 26 GLN HE22 1 1 4 1768 1 1 26 GLN HG2 H 8.672 -4.177 1.528 1.00 . A A . 26 GLN HG2 1 1 4 1769 1 1 26 GLN HG3 H 7.594 -2.874 1.031 1.00 . A A . 26 GLN HG3 1 1 4 1770 1 1 26 GLN N N 4.638 -3.355 2.718 1.00 . A A . 26 GLN N 1 1 4 1771 1 1 26 GLN NE2 N 9.743 -1.518 1.553 1.00 . A A . 26 GLN NE2 1 1 4 1772 1 1 26 GLN O O 5.330 -0.715 2.058 1.00 . A A . 26 GLN O 1 1 4 1773 1 1 26 GLN OE1 O 9.360 -2.209 3.608 1.00 . A A . 26 GLN OE1 1 1 4 1774 1 1 27 VAL C C 8.035 1.580 2.829 1.00 . A A . 27 VAL C 1 1 4 1775 1 1 27 VAL CA C 7.082 0.784 3.761 1.00 . A A . 27 VAL CA 1 1 4 1776 1 1 27 VAL CB C 7.412 0.950 5.270 1.00 . A A . 27 VAL CB 1 1 4 1777 1 1 27 VAL CG1 C 8.813 1.507 5.578 1.00 . A A . 27 VAL CG1 1 1 4 1778 1 1 27 VAL CG2 C 6.333 1.775 5.980 1.00 . A A . 27 VAL CG2 1 1 4 1779 1 1 27 VAL H H 7.714 -1.224 4.000 1.00 . A A . 27 VAL H 1 1 4 1780 1 1 27 VAL HA H 6.079 1.183 3.585 1.00 . A A . 27 VAL HA 1 1 4 1781 1 1 27 VAL HB H 7.365 -0.024 5.771 1.00 . A A . 27 VAL HB 1 1 4 1782 1 1 27 VAL HG11 H 9.563 0.891 5.080 1.00 . A A . 27 VAL HG11 1 1 4 1783 1 1 27 VAL HG12 H 8.900 2.537 5.233 1.00 . A A . 27 VAL HG12 1 1 4 1784 1 1 27 VAL HG13 H 8.995 1.478 6.651 1.00 . A A . 27 VAL HG13 1 1 4 1785 1 1 27 VAL HG21 H 5.359 1.307 5.832 1.00 . A A . 27 VAL HG21 1 1 4 1786 1 1 27 VAL HG22 H 6.546 1.810 7.049 1.00 . A A . 27 VAL HG22 1 1 4 1787 1 1 27 VAL HG23 H 6.308 2.780 5.569 1.00 . A A . 27 VAL HG23 1 1 4 1788 1 1 27 VAL N N 7.037 -0.659 3.502 1.00 . A A . 27 VAL N 1 1 4 1789 1 1 27 VAL O O 9.114 1.112 2.466 1.00 . A A . 27 VAL O 1 1 4 1790 1 1 28 LEU C C 9.080 4.724 3.147 1.00 . A A . 28 LEU C 1 1 4 1791 1 1 28 LEU CA C 8.580 3.858 1.965 1.00 . A A . 28 LEU CA 1 1 4 1792 1 1 28 LEU CB C 7.851 4.710 0.898 1.00 . A A . 28 LEU CB 1 1 4 1793 1 1 28 LEU CD1 C 7.216 2.663 -0.512 1.00 . A A . 28 LEU CD1 1 1 4 1794 1 1 28 LEU CD2 C 6.972 4.975 -1.444 1.00 . A A . 28 LEU CD2 1 1 4 1795 1 1 28 LEU CG C 7.800 4.081 -0.509 1.00 . A A . 28 LEU CG 1 1 4 1796 1 1 28 LEU H H 6.749 3.106 2.805 1.00 . A A . 28 LEU H 1 1 4 1797 1 1 28 LEU HA H 9.461 3.410 1.493 1.00 . A A . 28 LEU HA 1 1 4 1798 1 1 28 LEU HB2 H 6.836 4.940 1.233 1.00 . A A . 28 LEU HB2 1 1 4 1799 1 1 28 LEU HB3 H 8.380 5.662 0.795 1.00 . A A . 28 LEU HB3 1 1 4 1800 1 1 28 LEU HD11 H 6.272 2.643 0.030 1.00 . A A . 28 LEU HD11 1 1 4 1801 1 1 28 LEU HD12 H 7.043 2.333 -1.537 1.00 . A A . 28 LEU HD12 1 1 4 1802 1 1 28 LEU HD13 H 7.913 1.964 -0.053 1.00 . A A . 28 LEU HD13 1 1 4 1803 1 1 28 LEU HD21 H 7.410 5.971 -1.503 1.00 . A A . 28 LEU HD21 1 1 4 1804 1 1 28 LEU HD22 H 6.952 4.547 -2.446 1.00 . A A . 28 LEU HD22 1 1 4 1805 1 1 28 LEU HD23 H 5.949 5.059 -1.081 1.00 . A A . 28 LEU HD23 1 1 4 1806 1 1 28 LEU HG H 8.815 4.027 -0.906 1.00 . A A . 28 LEU HG 1 1 4 1807 1 1 28 LEU N N 7.668 2.824 2.496 1.00 . A A . 28 LEU N 1 1 4 1808 1 1 28 LEU O O 10.237 4.664 3.550 1.00 . A A . 28 LEU O 1 1 4 1809 1 1 29 ASN C C 6.934 5.460 5.873 1.00 . A A . 29 ASN C 1 1 4 1810 1 1 29 ASN CA C 8.205 5.967 5.134 1.00 . A A . 29 ASN CA 1 1 4 1811 1 1 29 ASN CB C 8.256 7.507 5.117 1.00 . A A . 29 ASN CB 1 1 4 1812 1 1 29 ASN CG C 9.459 8.054 4.351 1.00 . A A . 29 ASN CG 1 1 4 1813 1 1 29 ASN H H 7.240 5.463 3.327 1.00 . A A . 29 ASN H 1 1 4 1814 1 1 29 ASN HA H 9.098 5.579 5.633 1.00 . A A . 29 ASN HA 1 1 4 1815 1 1 29 ASN HB2 H 7.341 7.902 4.673 1.00 . A A . 29 ASN HB2 1 1 4 1816 1 1 29 ASN HB3 H 8.321 7.871 6.142 1.00 . A A . 29 ASN HB3 1 1 4 1817 1 1 29 ASN HD21 H 8.502 7.981 2.564 1.00 . A A . 29 ASN HD21 1 1 4 1818 1 1 29 ASN HD22 H 10.168 8.571 2.581 1.00 . A A . 29 ASN HD22 1 1 4 1819 1 1 29 ASN N N 8.155 5.478 3.750 1.00 . A A . 29 ASN N 1 1 4 1820 1 1 29 ASN ND2 N 9.347 8.224 3.047 1.00 . A A . 29 ASN ND2 1 1 4 1821 1 1 29 ASN O O 5.919 5.289 5.204 1.00 . A A . 29 ASN O 1 1 4 1822 1 1 29 ASN OD1 O 10.495 8.359 4.918 1.00 . A A . 29 ASN OD1 1 1 4 1823 1 1 30 PRO C C 4.373 5.348 7.575 1.00 . A A . 30 PRO C 1 1 4 1824 1 1 30 PRO CA C 5.762 4.804 7.996 1.00 . A A . 30 PRO CA 1 1 4 1825 1 1 30 PRO CB C 6.128 5.156 9.442 1.00 . A A . 30 PRO CB 1 1 4 1826 1 1 30 PRO CD C 8.090 5.418 8.085 1.00 . A A . 30 PRO CD 1 1 4 1827 1 1 30 PRO CG C 7.643 4.931 9.465 1.00 . A A . 30 PRO CG 1 1 4 1828 1 1 30 PRO HA H 5.705 3.718 7.934 1.00 . A A . 30 PRO HA 1 1 4 1829 1 1 30 PRO HB2 H 5.913 6.208 9.649 1.00 . A A . 30 PRO HB2 1 1 4 1830 1 1 30 PRO HB3 H 5.611 4.523 10.166 1.00 . A A . 30 PRO HB3 1 1 4 1831 1 1 30 PRO HD2 H 8.350 6.477 8.141 1.00 . A A . 30 PRO HD2 1 1 4 1832 1 1 30 PRO HD3 H 8.958 4.837 7.760 1.00 . A A . 30 PRO HD3 1 1 4 1833 1 1 30 PRO HG2 H 8.135 5.473 10.275 1.00 . A A . 30 PRO HG2 1 1 4 1834 1 1 30 PRO HG3 H 7.850 3.862 9.567 1.00 . A A . 30 PRO HG3 1 1 4 1835 1 1 30 PRO N N 6.937 5.244 7.208 1.00 . A A . 30 PRO N 1 1 4 1836 1 1 30 PRO O O 3.363 4.647 7.673 1.00 . A A . 30 PRO O 1 1 4 1837 1 1 31 TYR C C 3.489 7.138 4.809 1.00 . A A . 31 TYR C 1 1 4 1838 1 1 31 TYR CA C 3.223 7.209 6.345 1.00 . A A . 31 TYR CA 1 1 4 1839 1 1 31 TYR CB C 3.081 8.678 6.815 1.00 . A A . 31 TYR CB 1 1 4 1840 1 1 31 TYR CD1 C 4.435 9.061 8.934 1.00 . A A . 31 TYR CD1 1 1 4 1841 1 1 31 TYR CD2 C 1.998 8.984 9.107 1.00 . A A . 31 TYR CD2 1 1 4 1842 1 1 31 TYR CE1 C 4.528 9.223 10.333 1.00 . A A . 31 TYR CE1 1 1 4 1843 1 1 31 TYR CE2 C 2.096 9.169 10.504 1.00 . A A . 31 TYR CE2 1 1 4 1844 1 1 31 TYR CG C 3.168 8.914 8.319 1.00 . A A . 31 TYR CG 1 1 4 1845 1 1 31 TYR CZ C 3.361 9.257 11.114 1.00 . A A . 31 TYR CZ 1 1 4 1846 1 1 31 TYR H H 5.200 7.097 7.084 1.00 . A A . 31 TYR H 1 1 4 1847 1 1 31 TYR HA H 2.281 6.717 6.587 1.00 . A A . 31 TYR HA 1 1 4 1848 1 1 31 TYR HB2 H 3.871 9.281 6.358 1.00 . A A . 31 TYR HB2 1 1 4 1849 1 1 31 TYR HB3 H 2.132 9.065 6.436 1.00 . A A . 31 TYR HB3 1 1 4 1850 1 1 31 TYR HD1 H 5.335 9.048 8.337 1.00 . A A . 31 TYR HD1 1 1 4 1851 1 1 31 TYR HD2 H 1.027 8.901 8.638 1.00 . A A . 31 TYR HD2 1 1 4 1852 1 1 31 TYR HE1 H 5.491 9.331 10.808 1.00 . A A . 31 TYR HE1 1 1 4 1853 1 1 31 TYR HE2 H 1.200 9.238 11.099 1.00 . A A . 31 TYR HE2 1 1 4 1854 1 1 31 TYR HH H 2.595 9.376 12.874 1.00 . A A . 31 TYR HH 1 1 4 1855 1 1 31 TYR N N 4.331 6.591 7.083 1.00 . A A . 31 TYR N 1 1 4 1856 1 1 31 TYR O O 4.175 7.996 4.261 1.00 . A A . 31 TYR O 1 1 4 1857 1 1 31 TYR OH O 3.459 9.369 12.464 1.00 . A A . 31 TYR OH 1 1 4 1858 1 1 32 TYR C C 2.797 3.647 4.001 1.00 . A A . 32 TYR C 1 1 4 1859 1 1 32 TYR CA C 2.115 5.029 4.282 1.00 . A A . 32 TYR CA 1 1 4 1860 1 1 32 TYR CB C 0.835 5.326 3.459 1.00 . A A . 32 TYR CB 1 1 4 1861 1 1 32 TYR CD1 C 1.331 4.680 1.033 1.00 . A A . 32 TYR CD1 1 1 4 1862 1 1 32 TYR CD2 C 1.067 7.042 1.594 1.00 . A A . 32 TYR CD2 1 1 4 1863 1 1 32 TYR CE1 C 1.657 5.037 -0.294 1.00 . A A . 32 TYR CE1 1 1 4 1864 1 1 32 TYR CE2 C 1.342 7.389 0.255 1.00 . A A . 32 TYR CE2 1 1 4 1865 1 1 32 TYR CG C 1.046 5.682 1.988 1.00 . A A . 32 TYR CG 1 1 4 1866 1 1 32 TYR CZ C 1.675 6.391 -0.677 1.00 . A A . 32 TYR CZ 1 1 4 1867 1 1 32 TYR H H 3.345 6.279 3.084 1.00 . A A . 32 TYR H 1 1 4 1868 1 1 32 TYR HA H 1.819 4.994 5.331 1.00 . A A . 32 TYR HA 1 1 4 1869 1 1 32 TYR HB2 H 0.123 4.514 3.529 1.00 . A A . 32 TYR HB2 1 1 4 1870 1 1 32 TYR HB3 H 0.341 6.172 3.936 1.00 . A A . 32 TYR HB3 1 1 4 1871 1 1 32 TYR HD1 H 1.280 3.638 1.301 1.00 . A A . 32 TYR HD1 1 1 4 1872 1 1 32 TYR HD2 H 0.878 7.825 2.315 1.00 . A A . 32 TYR HD2 1 1 4 1873 1 1 32 TYR HE1 H 1.866 4.277 -1.029 1.00 . A A . 32 TYR HE1 1 1 4 1874 1 1 32 TYR HE2 H 1.309 8.424 -0.049 1.00 . A A . 32 TYR HE2 1 1 4 1875 1 1 32 TYR HH H 1.928 7.691 -2.057 1.00 . A A . 32 TYR HH 1 1 4 1876 1 1 32 TYR N N 3.015 6.166 4.030 1.00 . A A . 32 TYR N 1 1 4 1877 1 1 32 TYR O O 4.009 3.503 4.135 1.00 . A A . 32 TYR O 1 1 4 1878 1 1 32 TYR OH O 2.032 6.745 -1.938 1.00 . A A . 32 TYR OH 1 1 4 1879 1 1 33 SER C C 1.937 0.864 1.796 1.00 . A A . 33 SER C 1 1 4 1880 1 1 33 SER CA C 2.566 1.293 3.147 1.00 . A A . 33 SER CA 1 1 4 1881 1 1 33 SER CB C 2.370 0.248 4.256 1.00 . A A . 33 SER CB 1 1 4 1882 1 1 33 SER H H 1.063 2.776 3.451 1.00 . A A . 33 SER H 1 1 4 1883 1 1 33 SER HA H 3.642 1.365 2.978 1.00 . A A . 33 SER HA 1 1 4 1884 1 1 33 SER HB2 H 2.866 0.590 5.168 1.00 . A A . 33 SER HB2 1 1 4 1885 1 1 33 SER HB3 H 1.314 0.108 4.468 1.00 . A A . 33 SER HB3 1 1 4 1886 1 1 33 SER HG H 2.841 -1.649 4.543 1.00 . A A . 33 SER HG 1 1 4 1887 1 1 33 SER N N 2.045 2.613 3.591 1.00 . A A . 33 SER N 1 1 4 1888 1 1 33 SER O O 0.727 1.048 1.610 1.00 . A A . 33 SER O 1 1 4 1889 1 1 33 SER OG O 2.928 -0.984 3.847 1.00 . A A . 33 SER OG 1 1 4 1890 1 1 34 GLN C C 2.337 -0.553 -1.526 1.00 . A A . 34 GLN C 1 1 4 1891 1 1 34 GLN CA C 2.532 0.708 -0.625 1.00 . A A . 34 GLN CA 1 1 4 1892 1 1 34 GLN CB C 3.604 1.715 -1.105 1.00 . A A . 34 GLN CB 1 1 4 1893 1 1 34 GLN CD C 4.304 1.785 -3.608 1.00 . A A . 34 GLN CD 1 1 4 1894 1 1 34 GLN CG C 3.360 2.298 -2.525 1.00 . A A . 34 GLN CG 1 1 4 1895 1 1 34 GLN H H 3.700 0.196 1.113 1.00 . A A . 34 GLN H 1 1 4 1896 1 1 34 GLN HA H 1.589 1.250 -0.738 1.00 . A A . 34 GLN HA 1 1 4 1897 1 1 34 GLN HB2 H 3.593 2.561 -0.415 1.00 . A A . 34 GLN HB2 1 1 4 1898 1 1 34 GLN HB3 H 4.592 1.260 -1.011 1.00 . A A . 34 GLN HB3 1 1 4 1899 1 1 34 GLN HE21 H 3.315 2.734 -5.117 1.00 . A A . 34 GLN HE21 1 1 4 1900 1 1 34 GLN HE22 H 4.717 1.734 -5.524 1.00 . A A . 34 GLN HE22 1 1 4 1901 1 1 34 GLN HG2 H 2.334 2.107 -2.843 1.00 . A A . 34 GLN HG2 1 1 4 1902 1 1 34 GLN HG3 H 3.507 3.376 -2.498 1.00 . A A . 34 GLN HG3 1 1 4 1903 1 1 34 GLN N N 2.763 0.456 0.816 1.00 . A A . 34 GLN N 1 1 4 1904 1 1 34 GLN NE2 N 4.088 2.151 -4.855 1.00 . A A . 34 GLN NE2 1 1 4 1905 1 1 34 GLN O O 1.308 -1.206 -1.421 1.00 . A A . 34 GLN O 1 1 4 1906 1 1 34 GLN OE1 O 5.226 1.033 -3.348 1.00 . A A . 34 GLN OE1 1 1 4 1907 1 1 35 CYS C C 4.252 -2.218 -4.332 1.00 . A A . 35 CYS C 1 1 4 1908 1 1 35 CYS CA C 2.948 -1.722 -3.648 1.00 . A A . 35 CYS CA 1 1 4 1909 1 1 35 CYS CB C 2.057 -0.929 -4.624 1.00 . A A . 35 CYS CB 1 1 4 1910 1 1 35 CYS H H 4.079 -0.298 -2.524 1.00 . A A . 35 CYS H 1 1 4 1911 1 1 35 CYS HA H 2.396 -2.605 -3.311 1.00 . A A . 35 CYS HA 1 1 4 1912 1 1 35 CYS HB2 H 1.227 -0.492 -4.074 1.00 . A A . 35 CYS HB2 1 1 4 1913 1 1 35 CYS HB3 H 2.630 -0.116 -5.060 1.00 . A A . 35 CYS HB3 1 1 4 1914 1 1 35 CYS N N 3.214 -0.825 -2.502 1.00 . A A . 35 CYS N 1 1 4 1915 1 1 35 CYS O O 4.686 -1.616 -5.317 1.00 . A A . 35 CYS O 1 1 4 1916 1 1 35 CYS SG S 1.277 -1.795 -6.005 1.00 . A A . 35 CYS SG 1 1 4 1917 1 1 36 LEU C C 6.235 -5.135 -4.861 1.00 . A A . 36 LEU C 1 1 4 1918 1 1 36 LEU CA C 6.228 -3.745 -4.166 1.00 . A A . 36 LEU CA 1 1 4 1919 1 1 36 LEU CB C 7.135 -3.778 -2.916 1.00 . A A . 36 LEU CB 1 1 4 1920 1 1 36 LEU CD1 C 7.595 -1.260 -3.035 1.00 . A A . 36 LEU CD1 1 1 4 1921 1 1 36 LEU CD2 C 6.162 -2.186 -1.141 1.00 . A A . 36 LEU CD2 1 1 4 1922 1 1 36 LEU CG C 7.318 -2.464 -2.120 1.00 . A A . 36 LEU CG 1 1 4 1923 1 1 36 LEU H H 4.424 -3.771 -3.038 1.00 . A A . 36 LEU H 1 1 4 1924 1 1 36 LEU HA H 6.677 -3.061 -4.888 1.00 . A A . 36 LEU HA 1 1 4 1925 1 1 36 LEU HB2 H 6.768 -4.550 -2.238 1.00 . A A . 36 LEU HB2 1 1 4 1926 1 1 36 LEU HB3 H 8.125 -4.092 -3.253 1.00 . A A . 36 LEU HB3 1 1 4 1927 1 1 36 LEU HD11 H 8.427 -1.488 -3.704 1.00 . A A . 36 LEU HD11 1 1 4 1928 1 1 36 LEU HD12 H 6.722 -1.027 -3.640 1.00 . A A . 36 LEU HD12 1 1 4 1929 1 1 36 LEU HD13 H 7.850 -0.380 -2.444 1.00 . A A . 36 LEU HD13 1 1 4 1930 1 1 36 LEU HD21 H 5.931 -3.082 -0.563 1.00 . A A . 36 LEU HD21 1 1 4 1931 1 1 36 LEU HD22 H 6.430 -1.384 -0.454 1.00 . A A . 36 LEU HD22 1 1 4 1932 1 1 36 LEU HD23 H 5.270 -1.887 -1.672 1.00 . A A . 36 LEU HD23 1 1 4 1933 1 1 36 LEU HG H 8.208 -2.604 -1.504 1.00 . A A . 36 LEU HG 1 1 4 1934 1 1 36 LEU N N 4.885 -3.263 -3.785 1.00 . A A . 36 LEU N 1 1 4 1935 1 1 36 LEU O O 7.151 -5.354 -5.696 1.00 . A A . 36 LEU O 1 1 4 1936 1 1 36 LEU OXT O 5.378 -5.973 -4.525 1.00 . A A . 36 LEU OXT 1 1 5 1937 1 1 1 THR C C -6.378 -7.331 -9.494 1.00 . A A . 1 THR C 1 1 5 1938 1 1 1 THR CA C -4.848 -7.122 -9.494 1.00 . A A . 1 THR CA 1 1 5 1939 1 1 1 THR CB C -4.511 -6.018 -8.466 1.00 . A A . 1 THR CB 1 1 5 1940 1 1 1 THR CG2 C -5.035 -4.620 -8.815 1.00 . A A . 1 THR CG2 1 1 5 1941 1 1 1 THR H1 H -4.514 -7.572 -11.495 1.00 . A A . 1 THR H1 1 1 5 1942 1 1 1 THR H2 H -4.658 -5.972 -11.202 1.00 . A A . 1 THR H2 1 1 5 1943 1 1 1 THR H3 H -3.251 -6.779 -10.804 1.00 . A A . 1 THR H3 1 1 5 1944 1 1 1 THR HA H -4.389 -8.048 -9.147 1.00 . A A . 1 THR HA 1 1 5 1945 1 1 1 THR HB H -3.432 -5.941 -8.362 1.00 . A A . 1 THR HB 1 1 5 1946 1 1 1 THR HG1 H -4.590 -5.864 -6.527 1.00 . A A . 1 THR HG1 1 1 5 1947 1 1 1 THR HG21 H -4.639 -4.274 -9.770 1.00 . A A . 1 THR HG21 1 1 5 1948 1 1 1 THR HG22 H -6.127 -4.607 -8.841 1.00 . A A . 1 THR HG22 1 1 5 1949 1 1 1 THR HG23 H -4.709 -3.922 -8.040 1.00 . A A . 1 THR HG23 1 1 5 1950 1 1 1 THR N N -4.270 -6.837 -10.848 1.00 . A A . 1 THR N 1 1 5 1951 1 1 1 THR O O -7.043 -6.761 -10.355 1.00 . A A . 1 THR O 1 1 5 1952 1 1 1 THR OG1 O -5.054 -6.367 -7.215 1.00 . A A . 1 THR OG1 1 1 5 1953 1 1 2 GLN C C -8.405 -7.498 -6.674 1.00 . A A . 2 GLN C 1 1 5 1954 1 1 2 GLN CA C -8.325 -8.032 -8.125 1.00 . A A . 2 GLN CA 1 1 5 1955 1 1 2 GLN CB C -9.009 -9.397 -8.357 1.00 . A A . 2 GLN CB 1 1 5 1956 1 1 2 GLN CD C -10.969 -9.299 -6.697 1.00 . A A . 2 GLN CD 1 1 5 1957 1 1 2 GLN CG C -10.541 -9.356 -8.161 1.00 . A A . 2 GLN CG 1 1 5 1958 1 1 2 GLN H H -6.282 -8.612 -7.944 1.00 . A A . 2 GLN H 1 1 5 1959 1 1 2 GLN HA H -8.865 -7.310 -8.743 1.00 . A A . 2 GLN HA 1 1 5 1960 1 1 2 GLN HB2 H -8.827 -9.689 -9.396 1.00 . A A . 2 GLN HB2 1 1 5 1961 1 1 2 GLN HB3 H -8.568 -10.166 -7.717 1.00 . A A . 2 GLN HB3 1 1 5 1962 1 1 2 GLN HE21 H -11.511 -7.334 -6.779 1.00 . A A . 2 GLN HE21 1 1 5 1963 1 1 2 GLN HE22 H -11.719 -8.191 -5.253 1.00 . A A . 2 GLN HE22 1 1 5 1964 1 1 2 GLN HG2 H -10.964 -8.513 -8.712 1.00 . A A . 2 GLN HG2 1 1 5 1965 1 1 2 GLN HG3 H -10.965 -10.270 -8.574 1.00 . A A . 2 GLN HG3 1 1 5 1966 1 1 2 GLN N N -6.922 -8.117 -8.558 1.00 . A A . 2 GLN N 1 1 5 1967 1 1 2 GLN NE2 N -11.447 -8.167 -6.220 1.00 . A A . 2 GLN NE2 1 1 5 1968 1 1 2 GLN O O -8.752 -6.341 -6.454 1.00 . A A . 2 GLN O 1 1 5 1969 1 1 2 GLN OE1 O -10.854 -10.265 -5.964 1.00 . A A . 2 GLN OE1 1 1 5 1970 1 1 3 SER C C -6.251 -7.868 -3.931 1.00 . A A . 3 SER C 1 1 5 1971 1 1 3 SER CA C -7.757 -7.936 -4.296 1.00 . A A . 3 SER CA 1 1 5 1972 1 1 3 SER CB C -8.483 -8.926 -3.371 1.00 . A A . 3 SER CB 1 1 5 1973 1 1 3 SER H H -7.861 -9.293 -5.925 1.00 . A A . 3 SER H 1 1 5 1974 1 1 3 SER HA H -8.168 -6.942 -4.096 1.00 . A A . 3 SER HA 1 1 5 1975 1 1 3 SER HB2 H -8.465 -8.557 -2.338 1.00 . A A . 3 SER HB2 1 1 5 1976 1 1 3 SER HB3 H -9.531 -9.009 -3.679 1.00 . A A . 3 SER HB3 1 1 5 1977 1 1 3 SER HG H -7.162 -10.265 -2.793 1.00 . A A . 3 SER HG 1 1 5 1978 1 1 3 SER N N -8.023 -8.324 -5.695 1.00 . A A . 3 SER N 1 1 5 1979 1 1 3 SER O O -5.903 -7.515 -2.806 1.00 . A A . 3 SER O 1 1 5 1980 1 1 3 SER OG O -7.865 -10.205 -3.450 1.00 . A A . 3 SER OG 1 1 5 1981 1 1 4 HIS C C -3.369 -6.756 -4.425 1.00 . A A . 4 HIS C 1 1 5 1982 1 1 4 HIS CA C -3.887 -8.189 -4.689 1.00 . A A . 4 HIS CA 1 1 5 1983 1 1 4 HIS CB C -3.206 -8.824 -5.922 1.00 . A A . 4 HIS CB 1 1 5 1984 1 1 4 HIS CD2 C -3.669 -11.374 -6.154 1.00 . A A . 4 HIS CD2 1 1 5 1985 1 1 4 HIS CE1 C -5.367 -11.225 -7.518 1.00 . A A . 4 HIS CE1 1 1 5 1986 1 1 4 HIS CG C -3.895 -10.057 -6.443 1.00 . A A . 4 HIS CG 1 1 5 1987 1 1 4 HIS H H -5.698 -8.491 -5.762 1.00 . A A . 4 HIS H 1 1 5 1988 1 1 4 HIS HA H -3.646 -8.818 -3.828 1.00 . A A . 4 HIS HA 1 1 5 1989 1 1 4 HIS HB2 H -3.168 -8.113 -6.746 1.00 . A A . 4 HIS HB2 1 1 5 1990 1 1 4 HIS HB3 H -2.176 -9.072 -5.663 1.00 . A A . 4 HIS HB3 1 1 5 1991 1 1 4 HIS HD2 H -2.907 -11.756 -5.487 1.00 . A A . 4 HIS HD2 1 1 5 1992 1 1 4 HIS HE1 H -6.191 -11.505 -8.157 1.00 . A A . 4 HIS HE1 1 1 5 1993 1 1 4 HIS HE2 H -4.712 -13.113 -6.839 1.00 . A A . 4 HIS HE2 1 1 5 1994 1 1 4 HIS N N -5.347 -8.203 -4.863 1.00 . A A . 4 HIS N 1 1 5 1995 1 1 4 HIS ND1 N -4.987 -9.959 -7.313 1.00 . A A . 4 HIS ND1 1 1 5 1996 1 1 4 HIS NE2 N -4.610 -12.108 -6.848 1.00 . A A . 4 HIS NE2 1 1 5 1997 1 1 4 HIS O O -3.096 -6.009 -5.365 1.00 . A A . 4 HIS O 1 1 5 1998 1 1 5 ALA C C -1.723 -4.361 -3.423 1.00 . A A . 5 ALA C 1 1 5 1999 1 1 5 ALA CA C -2.973 -4.982 -2.744 1.00 . A A . 5 ALA CA 1 1 5 2000 1 1 5 ALA CB C -2.845 -4.947 -1.214 1.00 . A A . 5 ALA CB 1 1 5 2001 1 1 5 ALA H H -3.671 -6.984 -2.462 1.00 . A A . 5 ALA H 1 1 5 2002 1 1 5 ALA HA H -3.838 -4.371 -3.010 1.00 . A A . 5 ALA HA 1 1 5 2003 1 1 5 ALA HB1 H -3.738 -5.369 -0.752 1.00 . A A . 5 ALA HB1 1 1 5 2004 1 1 5 ALA HB2 H -1.972 -5.514 -0.883 1.00 . A A . 5 ALA HB2 1 1 5 2005 1 1 5 ALA HB3 H -2.735 -3.915 -0.878 1.00 . A A . 5 ALA HB3 1 1 5 2006 1 1 5 ALA N N -3.299 -6.350 -3.157 1.00 . A A . 5 ALA N 1 1 5 2007 1 1 5 ALA O O -0.701 -5.016 -3.592 1.00 . A A . 5 ALA O 1 1 5 2008 1 1 6 GLY C C -0.229 -1.475 -2.761 1.00 . A A . 6 GLY C 1 1 5 2009 1 1 6 GLY CA C -0.609 -2.254 -4.033 1.00 . A A . 6 GLY CA 1 1 5 2010 1 1 6 GLY H H -2.685 -2.622 -3.638 1.00 . A A . 6 GLY H 1 1 5 2011 1 1 6 GLY HA2 H 0.246 -2.865 -4.332 1.00 . A A . 6 GLY HA2 1 1 5 2012 1 1 6 GLY HA3 H -0.823 -1.575 -4.853 1.00 . A A . 6 GLY HA3 1 1 5 2013 1 1 6 GLY N N -1.799 -3.076 -3.783 1.00 . A A . 6 GLY N 1 1 5 2014 1 1 6 GLY O O 0.212 -2.054 -1.779 1.00 . A A . 6 GLY O 1 1 5 2015 1 1 7 GLN C C -1.656 0.129 -0.524 1.00 . A A . 7 GLN C 1 1 5 2016 1 1 7 GLN CA C -0.487 0.578 -1.441 1.00 . A A . 7 GLN CA 1 1 5 2017 1 1 7 GLN CB C -0.482 2.084 -1.763 1.00 . A A . 7 GLN CB 1 1 5 2018 1 1 7 GLN CD C -0.565 4.474 -0.890 1.00 . A A . 7 GLN CD 1 1 5 2019 1 1 7 GLN CG C -0.245 3.013 -0.561 1.00 . A A . 7 GLN CG 1 1 5 2020 1 1 7 GLN H H -0.938 0.270 -3.508 1.00 . A A . 7 GLN H 1 1 5 2021 1 1 7 GLN HA H 0.445 0.358 -0.921 1.00 . A A . 7 GLN HA 1 1 5 2022 1 1 7 GLN HB2 H 0.274 2.302 -2.523 1.00 . A A . 7 GLN HB2 1 1 5 2023 1 1 7 GLN HB3 H -1.449 2.335 -2.169 1.00 . A A . 7 GLN HB3 1 1 5 2024 1 1 7 GLN HE21 H -2.182 4.514 0.309 1.00 . A A . 7 GLN HE21 1 1 5 2025 1 1 7 GLN HE22 H -1.710 6.029 -0.488 1.00 . A A . 7 GLN HE22 1 1 5 2026 1 1 7 GLN HG2 H -0.846 2.692 0.289 1.00 . A A . 7 GLN HG2 1 1 5 2027 1 1 7 GLN HG3 H 0.800 2.964 -0.267 1.00 . A A . 7 GLN HG3 1 1 5 2028 1 1 7 GLN N N -0.512 -0.169 -2.708 1.00 . A A . 7 GLN N 1 1 5 2029 1 1 7 GLN NE2 N -1.534 5.075 -0.229 1.00 . A A . 7 GLN NE2 1 1 5 2030 1 1 7 GLN O O -2.804 0.516 -0.732 1.00 . A A . 7 GLN O 1 1 5 2031 1 1 7 GLN OE1 O 0.042 5.093 -1.754 1.00 . A A . 7 GLN OE1 1 1 5 2032 1 1 8 CYS C C -3.113 -0.294 2.281 1.00 . A A . 8 CYS C 1 1 5 2033 1 1 8 CYS CA C -2.328 -1.318 1.416 1.00 . A A . 8 CYS CA 1 1 5 2034 1 1 8 CYS CB C -1.555 -2.305 2.308 1.00 . A A . 8 CYS CB 1 1 5 2035 1 1 8 CYS H H -0.435 -1.126 0.428 1.00 . A A . 8 CYS H 1 1 5 2036 1 1 8 CYS HA H -3.075 -1.895 0.867 1.00 . A A . 8 CYS HA 1 1 5 2037 1 1 8 CYS HB2 H -2.210 -2.706 3.081 1.00 . A A . 8 CYS HB2 1 1 5 2038 1 1 8 CYS HB3 H -1.209 -3.140 1.698 1.00 . A A . 8 CYS HB3 1 1 5 2039 1 1 8 CYS N N -1.374 -0.746 0.446 1.00 . A A . 8 CYS N 1 1 5 2040 1 1 8 CYS O O -4.284 -0.509 2.582 1.00 . A A . 8 CYS O 1 1 5 2041 1 1 8 CYS SG S -0.089 -1.609 3.117 1.00 . A A . 8 CYS SG 1 1 5 2042 1 1 9 GLY C C -2.161 1.394 5.138 1.00 . A A . 9 GLY C 1 1 5 2043 1 1 9 GLY CA C -2.909 1.663 3.814 1.00 . A A . 9 GLY CA 1 1 5 2044 1 1 9 GLY H H -1.491 0.859 2.413 1.00 . A A . 9 GLY H 1 1 5 2045 1 1 9 GLY HA2 H -2.755 2.695 3.502 1.00 . A A . 9 GLY HA2 1 1 5 2046 1 1 9 GLY HA3 H -3.977 1.540 3.999 1.00 . A A . 9 GLY HA3 1 1 5 2047 1 1 9 GLY N N -2.442 0.773 2.735 1.00 . A A . 9 GLY N 1 1 5 2048 1 1 9 GLY O O -2.453 0.426 5.834 1.00 . A A . 9 GLY O 1 1 5 2049 1 1 10 GLY C C -0.743 2.619 7.932 1.00 . A A . 10 GLY C 1 1 5 2050 1 1 10 GLY CA C -0.246 2.009 6.603 1.00 . A A . 10 GLY CA 1 1 5 2051 1 1 10 GLY H H -0.999 3.006 4.849 1.00 . A A . 10 GLY H 1 1 5 2052 1 1 10 GLY HA2 H -0.083 0.941 6.761 1.00 . A A . 10 GLY HA2 1 1 5 2053 1 1 10 GLY HA3 H 0.725 2.444 6.362 1.00 . A A . 10 GLY HA3 1 1 5 2054 1 1 10 GLY N N -1.144 2.212 5.450 1.00 . A A . 10 GLY N 1 1 5 2055 1 1 10 GLY O O -1.350 1.938 8.752 1.00 . A A . 10 GLY O 1 1 5 2056 1 1 11 ILE C C -1.414 6.030 8.968 1.00 . A A . 11 ILE C 1 1 5 2057 1 1 11 ILE CA C -0.826 4.658 9.376 1.00 . A A . 11 ILE CA 1 1 5 2058 1 1 11 ILE CB C 0.385 4.800 10.334 1.00 . A A . 11 ILE CB 1 1 5 2059 1 1 11 ILE CD1 C 2.255 3.517 11.564 1.00 . A A . 11 ILE CD1 1 1 5 2060 1 1 11 ILE CG1 C 1.013 3.427 10.670 1.00 . A A . 11 ILE CG1 1 1 5 2061 1 1 11 ILE CG2 C -0.037 5.539 11.619 1.00 . A A . 11 ILE CG2 1 1 5 2062 1 1 11 ILE H H 0.086 4.400 7.467 1.00 . A A . 11 ILE H 1 1 5 2063 1 1 11 ILE HA H -1.604 4.114 9.918 1.00 . A A . 11 ILE HA 1 1 5 2064 1 1 11 ILE HB H 1.149 5.400 9.843 1.00 . A A . 11 ILE HB 1 1 5 2065 1 1 11 ILE HD11 H 2.970 4.220 11.135 1.00 . A A . 11 ILE HD11 1 1 5 2066 1 1 11 ILE HD12 H 1.988 3.835 12.571 1.00 . A A . 11 ILE HD12 1 1 5 2067 1 1 11 ILE HD13 H 2.727 2.535 11.627 1.00 . A A . 11 ILE HD13 1 1 5 2068 1 1 11 ILE HG12 H 0.271 2.788 11.150 1.00 . A A . 11 ILE HG12 1 1 5 2069 1 1 11 ILE HG13 H 1.338 2.944 9.747 1.00 . A A . 11 ILE HG13 1 1 5 2070 1 1 11 ILE HG21 H -0.483 6.505 11.385 1.00 . A A . 11 ILE HG21 1 1 5 2071 1 1 11 ILE HG22 H -0.761 4.937 12.169 1.00 . A A . 11 ILE HG22 1 1 5 2072 1 1 11 ILE HG23 H 0.827 5.729 12.256 1.00 . A A . 11 ILE HG23 1 1 5 2073 1 1 11 ILE N N -0.445 3.903 8.167 1.00 . A A . 11 ILE N 1 1 5 2074 1 1 11 ILE O O -0.796 6.775 8.213 1.00 . A A . 11 ILE O 1 1 5 2075 1 1 12 GLY C C -3.991 7.283 7.480 1.00 . A A . 12 GLY C 1 1 5 2076 1 1 12 GLY CA C -3.376 7.527 8.876 1.00 . A A . 12 GLY CA 1 1 5 2077 1 1 12 GLY H H -3.117 5.712 9.999 1.00 . A A . 12 GLY H 1 1 5 2078 1 1 12 GLY HA2 H -4.184 7.750 9.572 1.00 . A A . 12 GLY HA2 1 1 5 2079 1 1 12 GLY HA3 H -2.729 8.405 8.830 1.00 . A A . 12 GLY HA3 1 1 5 2080 1 1 12 GLY N N -2.637 6.363 9.397 1.00 . A A . 12 GLY N 1 1 5 2081 1 1 12 GLY O O -5.201 7.402 7.300 1.00 . A A . 12 GLY O 1 1 5 2082 1 1 13 TYR C C -4.448 4.945 5.470 1.00 . A A . 13 TYR C 1 1 5 2083 1 1 13 TYR CA C -3.679 6.273 5.246 1.00 . A A . 13 TYR CA 1 1 5 2084 1 1 13 TYR CB C -2.512 6.048 4.262 1.00 . A A . 13 TYR CB 1 1 5 2085 1 1 13 TYR CD1 C -3.339 7.376 2.266 1.00 . A A . 13 TYR CD1 1 1 5 2086 1 1 13 TYR CD2 C -1.083 7.800 3.100 1.00 . A A . 13 TYR CD2 1 1 5 2087 1 1 13 TYR CE1 C -3.072 8.181 1.138 1.00 . A A . 13 TYR CE1 1 1 5 2088 1 1 13 TYR CE2 C -0.796 8.547 1.937 1.00 . A A . 13 TYR CE2 1 1 5 2089 1 1 13 TYR CG C -2.326 7.142 3.226 1.00 . A A . 13 TYR CG 1 1 5 2090 1 1 13 TYR CZ C -1.786 8.721 0.954 1.00 . A A . 13 TYR CZ 1 1 5 2091 1 1 13 TYR H H -2.188 6.819 6.711 1.00 . A A . 13 TYR H 1 1 5 2092 1 1 13 TYR HA H -4.380 6.987 4.804 1.00 . A A . 13 TYR HA 1 1 5 2093 1 1 13 TYR HB2 H -1.585 5.869 4.810 1.00 . A A . 13 TYR HB2 1 1 5 2094 1 1 13 TYR HB3 H -2.695 5.142 3.677 1.00 . A A . 13 TYR HB3 1 1 5 2095 1 1 13 TYR HD1 H -4.316 6.925 2.386 1.00 . A A . 13 TYR HD1 1 1 5 2096 1 1 13 TYR HD2 H -0.347 7.715 3.885 1.00 . A A . 13 TYR HD2 1 1 5 2097 1 1 13 TYR HE1 H -3.855 8.375 0.420 1.00 . A A . 13 TYR HE1 1 1 5 2098 1 1 13 TYR HE2 H 0.177 8.989 1.796 1.00 . A A . 13 TYR HE2 1 1 5 2099 1 1 13 TYR HH H -2.288 9.536 -0.711 1.00 . A A . 13 TYR HH 1 1 5 2100 1 1 13 TYR N N -3.180 6.871 6.498 1.00 . A A . 13 TYR N 1 1 5 2101 1 1 13 TYR O O -3.951 4.040 6.139 1.00 . A A . 13 TYR O 1 1 5 2102 1 1 13 TYR OH O -1.501 9.413 -0.179 1.00 . A A . 13 TYR OH 1 1 5 2103 1 1 14 SER C C -7.397 3.416 3.711 1.00 . A A . 14 SER C 1 1 5 2104 1 1 14 SER CA C -6.502 3.618 4.958 1.00 . A A . 14 SER CA 1 1 5 2105 1 1 14 SER CB C -7.338 3.713 6.246 1.00 . A A . 14 SER CB 1 1 5 2106 1 1 14 SER H H -5.979 5.583 4.317 1.00 . A A . 14 SER H 1 1 5 2107 1 1 14 SER HA H -5.875 2.725 5.030 1.00 . A A . 14 SER HA 1 1 5 2108 1 1 14 SER HB2 H -6.660 3.687 7.104 1.00 . A A . 14 SER HB2 1 1 5 2109 1 1 14 SER HB3 H -7.876 4.667 6.278 1.00 . A A . 14 SER HB3 1 1 5 2110 1 1 14 SER HG H -9.080 2.849 5.929 1.00 . A A . 14 SER HG 1 1 5 2111 1 1 14 SER N N -5.636 4.809 4.869 1.00 . A A . 14 SER N 1 1 5 2112 1 1 14 SER O O -7.597 4.337 2.918 1.00 . A A . 14 SER O 1 1 5 2113 1 1 14 SER OG O -8.246 2.627 6.355 1.00 . A A . 14 SER OG 1 1 5 2114 1 1 15 GLY C C -8.149 1.675 1.053 1.00 . A A . 15 GLY C 1 1 5 2115 1 1 15 GLY CA C -8.844 1.854 2.426 1.00 . A A . 15 GLY CA 1 1 5 2116 1 1 15 GLY H H -7.771 1.532 4.268 1.00 . A A . 15 GLY H 1 1 5 2117 1 1 15 GLY HA2 H -9.314 0.903 2.679 1.00 . A A . 15 GLY HA2 1 1 5 2118 1 1 15 GLY HA3 H -9.621 2.615 2.344 1.00 . A A . 15 GLY HA3 1 1 5 2119 1 1 15 GLY N N -7.965 2.216 3.548 1.00 . A A . 15 GLY N 1 1 5 2120 1 1 15 GLY O O -6.924 1.568 0.983 1.00 . A A . 15 GLY O 1 1 5 2121 1 1 16 PRO C C -7.464 2.176 -2.093 1.00 . A A . 16 PRO C 1 1 5 2122 1 1 16 PRO CA C -8.422 1.195 -1.379 1.00 . A A . 16 PRO CA 1 1 5 2123 1 1 16 PRO CB C -9.681 0.917 -2.223 1.00 . A A . 16 PRO CB 1 1 5 2124 1 1 16 PRO CD C -10.381 1.569 -0.052 1.00 . A A . 16 PRO CD 1 1 5 2125 1 1 16 PRO CG C -10.753 0.610 -1.182 1.00 . A A . 16 PRO CG 1 1 5 2126 1 1 16 PRO HA H -7.886 0.249 -1.267 1.00 . A A . 16 PRO HA 1 1 5 2127 1 1 16 PRO HB2 H -9.995 1.814 -2.770 1.00 . A A . 16 PRO HB2 1 1 5 2128 1 1 16 PRO HB3 H -9.526 0.103 -2.934 1.00 . A A . 16 PRO HB3 1 1 5 2129 1 1 16 PRO HD2 H -10.762 2.569 -0.270 1.00 . A A . 16 PRO HD2 1 1 5 2130 1 1 16 PRO HD3 H -10.822 1.211 0.879 1.00 . A A . 16 PRO HD3 1 1 5 2131 1 1 16 PRO HG2 H -11.763 0.778 -1.560 1.00 . A A . 16 PRO HG2 1 1 5 2132 1 1 16 PRO HG3 H -10.646 -0.422 -0.845 1.00 . A A . 16 PRO HG3 1 1 5 2133 1 1 16 PRO N N -8.922 1.595 -0.052 1.00 . A A . 16 PRO N 1 1 5 2134 1 1 16 PRO O O -7.725 2.592 -3.221 1.00 . A A . 16 PRO O 1 1 5 2135 1 1 17 THR C C -4.494 2.610 -3.297 1.00 . A A . 17 THR C 1 1 5 2136 1 1 17 THR CA C -5.279 3.340 -2.173 1.00 . A A . 17 THR CA 1 1 5 2137 1 1 17 THR CB C -4.355 3.988 -1.114 1.00 . A A . 17 THR CB 1 1 5 2138 1 1 17 THR CG2 C -5.150 4.804 -0.090 1.00 . A A . 17 THR CG2 1 1 5 2139 1 1 17 THR H H -6.113 2.138 -0.585 1.00 . A A . 17 THR H 1 1 5 2140 1 1 17 THR HA H -5.782 4.172 -2.670 1.00 . A A . 17 THR HA 1 1 5 2141 1 1 17 THR HB H -3.668 4.657 -1.636 1.00 . A A . 17 THR HB 1 1 5 2142 1 1 17 THR HG1 H -3.537 2.223 -0.796 1.00 . A A . 17 THR HG1 1 1 5 2143 1 1 17 THR HG21 H -5.804 5.521 -0.584 1.00 . A A . 17 THR HG21 1 1 5 2144 1 1 17 THR HG22 H -5.752 4.146 0.538 1.00 . A A . 17 THR HG22 1 1 5 2145 1 1 17 THR HG23 H -4.452 5.343 0.546 1.00 . A A . 17 THR HG23 1 1 5 2146 1 1 17 THR N N -6.303 2.495 -1.518 1.00 . A A . 17 THR N 1 1 5 2147 1 1 17 THR O O -3.282 2.731 -3.421 1.00 . A A . 17 THR O 1 1 5 2148 1 1 17 THR OG1 O -3.610 3.073 -0.336 1.00 . A A . 17 THR OG1 1 1 5 2149 1 1 18 VAL C C -3.676 0.881 -6.038 1.00 . A A . 18 VAL C 1 1 5 2150 1 1 18 VAL CA C -4.591 0.629 -4.803 1.00 . A A . 18 VAL CA 1 1 5 2151 1 1 18 VAL CB C -5.732 -0.376 -5.080 1.00 . A A . 18 VAL CB 1 1 5 2152 1 1 18 VAL CG1 C -6.705 0.113 -6.166 1.00 . A A . 18 VAL CG1 1 1 5 2153 1 1 18 VAL CG2 C -5.204 -1.776 -5.429 1.00 . A A . 18 VAL CG2 1 1 5 2154 1 1 18 VAL H H -6.177 1.860 -4.052 1.00 . A A . 18 VAL H 1 1 5 2155 1 1 18 VAL HA H -3.956 0.153 -4.053 1.00 . A A . 18 VAL HA 1 1 5 2156 1 1 18 VAL HB H -6.306 -0.486 -4.155 1.00 . A A . 18 VAL HB 1 1 5 2157 1 1 18 VAL HG11 H -7.107 1.094 -5.904 1.00 . A A . 18 VAL HG11 1 1 5 2158 1 1 18 VAL HG12 H -6.198 0.187 -7.128 1.00 . A A . 18 VAL HG12 1 1 5 2159 1 1 18 VAL HG13 H -7.536 -0.587 -6.260 1.00 . A A . 18 VAL HG13 1 1 5 2160 1 1 18 VAL HG21 H -4.509 -2.117 -4.661 1.00 . A A . 18 VAL HG21 1 1 5 2161 1 1 18 VAL HG22 H -6.036 -2.481 -5.482 1.00 . A A . 18 VAL HG22 1 1 5 2162 1 1 18 VAL HG23 H -4.698 -1.767 -6.393 1.00 . A A . 18 VAL HG23 1 1 5 2163 1 1 18 VAL N N -5.169 1.805 -4.123 1.00 . A A . 18 VAL N 1 1 5 2164 1 1 18 VAL O O -3.894 1.778 -6.846 1.00 . A A . 18 VAL O 1 1 5 2165 1 1 19 CYS C C -1.506 -1.452 -7.853 1.00 . A A . 19 CYS C 1 1 5 2166 1 1 19 CYS CA C -1.648 -0.020 -7.260 1.00 . A A . 19 CYS CA 1 1 5 2167 1 1 19 CYS CB C -0.360 0.644 -6.703 1.00 . A A . 19 CYS CB 1 1 5 2168 1 1 19 CYS H H -2.619 -0.722 -5.511 1.00 . A A . 19 CYS H 1 1 5 2169 1 1 19 CYS HA H -1.989 0.572 -8.112 1.00 . A A . 19 CYS HA 1 1 5 2170 1 1 19 CYS HB2 H -0.493 1.722 -6.811 1.00 . A A . 19 CYS HB2 1 1 5 2171 1 1 19 CYS HB3 H -0.267 0.455 -5.637 1.00 . A A . 19 CYS HB3 1 1 5 2172 1 1 19 CYS N N -2.654 0.026 -6.184 1.00 . A A . 19 CYS N 1 1 5 2173 1 1 19 CYS O O -2.243 -2.366 -7.476 1.00 . A A . 19 CYS O 1 1 5 2174 1 1 19 CYS SG S 1.288 0.287 -7.382 1.00 . A A . 19 CYS SG 1 1 5 2175 1 1 20 ALA C C -0.142 -4.143 -8.603 1.00 . A A . 20 ALA C 1 1 5 2176 1 1 20 ALA CA C -0.335 -2.907 -9.521 1.00 . A A . 20 ALA CA 1 1 5 2177 1 1 20 ALA CB C 0.863 -2.682 -10.458 1.00 . A A . 20 ALA CB 1 1 5 2178 1 1 20 ALA H H -0.098 -0.835 -9.145 1.00 . A A . 20 ALA H 1 1 5 2179 1 1 20 ALA HA H -1.205 -3.131 -10.144 1.00 . A A . 20 ALA HA 1 1 5 2180 1 1 20 ALA HB1 H 0.641 -1.865 -11.149 1.00 . A A . 20 ALA HB1 1 1 5 2181 1 1 20 ALA HB2 H 1.754 -2.423 -9.881 1.00 . A A . 20 ALA HB2 1 1 5 2182 1 1 20 ALA HB3 H 1.079 -3.576 -11.046 1.00 . A A . 20 ALA HB3 1 1 5 2183 1 1 20 ALA N N -0.626 -1.637 -8.844 1.00 . A A . 20 ALA N 1 1 5 2184 1 1 20 ALA O O -0.085 -4.045 -7.385 1.00 . A A . 20 ALA O 1 1 5 2185 1 1 21 SER C C 0.423 -7.253 -7.580 1.00 . A A . 21 SER C 1 1 5 2186 1 1 21 SER CA C -0.494 -6.636 -8.669 1.00 . A A . 21 SER CA 1 1 5 2187 1 1 21 SER CB C -0.685 -7.620 -9.848 1.00 . A A . 21 SER CB 1 1 5 2188 1 1 21 SER H H -0.066 -5.270 -10.233 1.00 . A A . 21 SER H 1 1 5 2189 1 1 21 SER HA H -1.447 -6.518 -8.164 1.00 . A A . 21 SER HA 1 1 5 2190 1 1 21 SER HB2 H 0.308 -7.832 -10.261 1.00 . A A . 21 SER HB2 1 1 5 2191 1 1 21 SER HB3 H -1.087 -8.568 -9.477 1.00 . A A . 21 SER HB3 1 1 5 2192 1 1 21 SER HG H -1.057 -7.141 -11.709 1.00 . A A . 21 SER HG 1 1 5 2193 1 1 21 SER N N -0.117 -5.325 -9.232 1.00 . A A . 21 SER N 1 1 5 2194 1 1 21 SER O O 0.647 -8.459 -7.610 1.00 . A A . 21 SER O 1 1 5 2195 1 1 21 SER OG O -1.543 -7.101 -10.872 1.00 . A A . 21 SER OG 1 1 5 2196 1 1 22 GLY C C 1.326 -7.895 -4.556 1.00 . A A . 22 GLY C 1 1 5 2197 1 1 22 GLY CA C 1.855 -6.869 -5.579 1.00 . A A . 22 GLY CA 1 1 5 2198 1 1 22 GLY H H 0.611 -5.499 -6.610 1.00 . A A . 22 GLY H 1 1 5 2199 1 1 22 GLY HA2 H 2.774 -7.227 -6.048 1.00 . A A . 22 GLY HA2 1 1 5 2200 1 1 22 GLY HA3 H 2.107 -5.966 -5.020 1.00 . A A . 22 GLY HA3 1 1 5 2201 1 1 22 GLY N N 0.895 -6.468 -6.613 1.00 . A A . 22 GLY N 1 1 5 2202 1 1 22 GLY O O 1.910 -8.951 -4.349 1.00 . A A . 22 GLY O 1 1 5 2203 1 1 23 THR C C 0.852 -7.642 -1.389 1.00 . A A . 23 THR C 1 1 5 2204 1 1 23 THR CA C -0.163 -7.952 -2.514 1.00 . A A . 23 THR CA 1 1 5 2205 1 1 23 THR CB C -0.770 -9.368 -2.428 1.00 . A A . 23 THR CB 1 1 5 2206 1 1 23 THR CG2 C 0.218 -10.538 -2.380 1.00 . A A . 23 THR CG2 1 1 5 2207 1 1 23 THR H H -0.145 -6.647 -4.185 1.00 . A A . 23 THR H 1 1 5 2208 1 1 23 THR HA H -0.978 -7.278 -2.259 1.00 . A A . 23 THR HA 1 1 5 2209 1 1 23 THR HB H -1.444 -9.517 -3.272 1.00 . A A . 23 THR HB 1 1 5 2210 1 1 23 THR HG1 H -0.925 -9.325 -0.503 1.00 . A A . 23 THR HG1 1 1 5 2211 1 1 23 THR HG21 H 1.038 -10.334 -1.692 1.00 . A A . 23 THR HG21 1 1 5 2212 1 1 23 THR HG22 H -0.293 -11.440 -2.045 1.00 . A A . 23 THR HG22 1 1 5 2213 1 1 23 THR HG23 H 0.623 -10.739 -3.369 1.00 . A A . 23 THR HG23 1 1 5 2214 1 1 23 THR N N 0.229 -7.537 -3.881 1.00 . A A . 23 THR N 1 1 5 2215 1 1 23 THR O O 0.772 -8.208 -0.298 1.00 . A A . 23 THR O 1 1 5 2216 1 1 23 THR OG1 O -1.536 -9.441 -1.245 1.00 . A A . 23 THR OG1 1 1 5 2217 1 1 24 THR C C 2.514 -4.952 -0.002 1.00 . A A . 24 THR C 1 1 5 2218 1 1 24 THR CA C 2.858 -6.251 -0.762 1.00 . A A . 24 THR CA 1 1 5 2219 1 1 24 THR CB C 4.145 -6.070 -1.593 1.00 . A A . 24 THR CB 1 1 5 2220 1 1 24 THR CG2 C 4.786 -7.432 -1.884 1.00 . A A . 24 THR CG2 1 1 5 2221 1 1 24 THR H H 1.754 -6.255 -2.541 1.00 . A A . 24 THR H 1 1 5 2222 1 1 24 THR HA H 3.060 -7.025 -0.018 1.00 . A A . 24 THR HA 1 1 5 2223 1 1 24 THR HB H 4.865 -5.463 -1.034 1.00 . A A . 24 THR HB 1 1 5 2224 1 1 24 THR HG1 H 4.735 -5.396 -3.297 1.00 . A A . 24 THR HG1 1 1 5 2225 1 1 24 THR HG21 H 4.994 -7.952 -0.951 1.00 . A A . 24 THR HG21 1 1 5 2226 1 1 24 THR HG22 H 4.127 -8.036 -2.504 1.00 . A A . 24 THR HG22 1 1 5 2227 1 1 24 THR HG23 H 5.730 -7.287 -2.408 1.00 . A A . 24 THR HG23 1 1 5 2228 1 1 24 THR N N 1.767 -6.704 -1.637 1.00 . A A . 24 THR N 1 1 5 2229 1 1 24 THR O O 2.002 -3.990 -0.565 1.00 . A A . 24 THR O 1 1 5 2230 1 1 24 THR OG1 O 3.874 -5.461 -2.844 1.00 . A A . 24 THR OG1 1 1 5 2231 1 1 25 CYS C C 3.800 -3.344 2.905 1.00 . A A . 25 CYS C 1 1 5 2232 1 1 25 CYS CA C 2.487 -3.837 2.245 1.00 . A A . 25 CYS CA 1 1 5 2233 1 1 25 CYS CB C 1.431 -4.345 3.252 1.00 . A A . 25 CYS CB 1 1 5 2234 1 1 25 CYS H H 3.134 -5.795 1.704 1.00 . A A . 25 CYS H 1 1 5 2235 1 1 25 CYS HA H 2.066 -2.983 1.712 1.00 . A A . 25 CYS HA 1 1 5 2236 1 1 25 CYS HB2 H 0.601 -4.772 2.693 1.00 . A A . 25 CYS HB2 1 1 5 2237 1 1 25 CYS HB3 H 1.862 -5.133 3.867 1.00 . A A . 25 CYS HB3 1 1 5 2238 1 1 25 CYS N N 2.758 -4.945 1.314 1.00 . A A . 25 CYS N 1 1 5 2239 1 1 25 CYS O O 4.030 -3.591 4.090 1.00 . A A . 25 CYS O 1 1 5 2240 1 1 25 CYS SG S 0.668 -3.158 4.388 1.00 . A A . 25 CYS SG 1 1 5 2241 1 1 26 GLN C C 6.404 -0.882 2.718 1.00 . A A . 26 GLN C 1 1 5 2242 1 1 26 GLN CA C 6.070 -2.391 2.511 1.00 . A A . 26 GLN CA 1 1 5 2243 1 1 26 GLN CB C 6.932 -3.064 1.429 1.00 . A A . 26 GLN CB 1 1 5 2244 1 1 26 GLN CD C 8.965 -3.438 2.908 1.00 . A A . 26 GLN CD 1 1 5 2245 1 1 26 GLN CG C 8.443 -2.848 1.602 1.00 . A A . 26 GLN CG 1 1 5 2246 1 1 26 GLN H H 4.407 -2.495 1.173 1.00 . A A . 26 GLN H 1 1 5 2247 1 1 26 GLN HA H 6.294 -2.897 3.454 1.00 . A A . 26 GLN HA 1 1 5 2248 1 1 26 GLN HB2 H 6.731 -4.139 1.442 1.00 . A A . 26 GLN HB2 1 1 5 2249 1 1 26 GLN HB3 H 6.633 -2.682 0.453 1.00 . A A . 26 GLN HB3 1 1 5 2250 1 1 26 GLN HE21 H 9.395 -5.202 2.040 1.00 . A A . 26 GLN HE21 1 1 5 2251 1 1 26 GLN HE22 H 9.729 -5.054 3.776 1.00 . A A . 26 GLN HE22 1 1 5 2252 1 1 26 GLN HG2 H 8.955 -3.317 0.759 1.00 . A A . 26 GLN HG2 1 1 5 2253 1 1 26 GLN HG3 H 8.679 -1.782 1.576 1.00 . A A . 26 GLN HG3 1 1 5 2254 1 1 26 GLN N N 4.674 -2.676 2.137 1.00 . A A . 26 GLN N 1 1 5 2255 1 1 26 GLN NE2 N 9.416 -4.678 2.900 1.00 . A A . 26 GLN NE2 1 1 5 2256 1 1 26 GLN O O 6.019 -0.018 1.936 1.00 . A A . 26 GLN O 1 1 5 2257 1 1 26 GLN OE1 O 8.939 -2.800 3.951 1.00 . A A . 26 GLN OE1 1 1 5 2258 1 1 27 VAL C C 8.304 1.721 3.388 1.00 . A A . 27 VAL C 1 1 5 2259 1 1 27 VAL CA C 7.335 0.860 4.249 1.00 . A A . 27 VAL CA 1 1 5 2260 1 1 27 VAL CB C 7.732 0.869 5.743 1.00 . A A . 27 VAL CB 1 1 5 2261 1 1 27 VAL CG1 C 9.091 0.203 6.032 1.00 . A A . 27 VAL CG1 1 1 5 2262 1 1 27 VAL CG2 C 7.730 2.303 6.316 1.00 . A A . 27 VAL CG2 1 1 5 2263 1 1 27 VAL H H 7.539 -1.286 4.325 1.00 . A A . 27 VAL H 1 1 5 2264 1 1 27 VAL HA H 6.358 1.344 4.203 1.00 . A A . 27 VAL HA 1 1 5 2265 1 1 27 VAL HB H 6.971 0.318 6.300 1.00 . A A . 27 VAL HB 1 1 5 2266 1 1 27 VAL HG11 H 9.082 -0.826 5.676 1.00 . A A . 27 VAL HG11 1 1 5 2267 1 1 27 VAL HG12 H 9.898 0.740 5.538 1.00 . A A . 27 VAL HG12 1 1 5 2268 1 1 27 VAL HG13 H 9.291 0.195 7.101 1.00 . A A . 27 VAL HG13 1 1 5 2269 1 1 27 VAL HG21 H 6.782 2.789 6.085 1.00 . A A . 27 VAL HG21 1 1 5 2270 1 1 27 VAL HG22 H 7.853 2.273 7.399 1.00 . A A . 27 VAL HG22 1 1 5 2271 1 1 27 VAL HG23 H 8.547 2.888 5.892 1.00 . A A . 27 VAL HG23 1 1 5 2272 1 1 27 VAL N N 7.124 -0.533 3.792 1.00 . A A . 27 VAL N 1 1 5 2273 1 1 27 VAL O O 9.440 1.324 3.133 1.00 . A A . 27 VAL O 1 1 5 2274 1 1 28 LEU C C 9.092 4.982 3.828 1.00 . A A . 28 LEU C 1 1 5 2275 1 1 28 LEU CA C 8.801 4.054 2.626 1.00 . A A . 28 LEU CA 1 1 5 2276 1 1 28 LEU CB C 8.189 4.860 1.457 1.00 . A A . 28 LEU CB 1 1 5 2277 1 1 28 LEU CD1 C 7.645 2.897 -0.052 1.00 . A A . 28 LEU CD1 1 1 5 2278 1 1 28 LEU CD2 C 7.958 5.182 -1.030 1.00 . A A . 28 LEU CD2 1 1 5 2279 1 1 28 LEU CG C 8.411 4.216 0.076 1.00 . A A . 28 LEU CG 1 1 5 2280 1 1 28 LEU H H 6.916 3.161 3.171 1.00 . A A . 28 LEU H 1 1 5 2281 1 1 28 LEU HA H 9.764 3.661 2.286 1.00 . A A . 28 LEU HA 1 1 5 2282 1 1 28 LEU HB2 H 7.123 5.031 1.618 1.00 . A A . 28 LEU HB2 1 1 5 2283 1 1 28 LEU HB3 H 8.674 5.840 1.419 1.00 . A A . 28 LEU HB3 1 1 5 2284 1 1 28 LEU HD11 H 6.611 3.052 0.250 1.00 . A A . 28 LEU HD11 1 1 5 2285 1 1 28 LEU HD12 H 7.677 2.543 -1.081 1.00 . A A . 28 LEU HD12 1 1 5 2286 1 1 28 LEU HD13 H 8.088 2.125 0.574 1.00 . A A . 28 LEU HD13 1 1 5 2287 1 1 28 LEU HD21 H 8.516 6.116 -0.967 1.00 . A A . 28 LEU HD21 1 1 5 2288 1 1 28 LEU HD22 H 8.144 4.740 -2.010 1.00 . A A . 28 LEU HD22 1 1 5 2289 1 1 28 LEU HD23 H 6.893 5.395 -0.935 1.00 . A A . 28 LEU HD23 1 1 5 2290 1 1 28 LEU HG H 9.473 4.018 -0.066 1.00 . A A . 28 LEU HG 1 1 5 2291 1 1 28 LEU N N 7.896 2.953 3.032 1.00 . A A . 28 LEU N 1 1 5 2292 1 1 28 LEU O O 10.228 5.146 4.263 1.00 . A A . 28 LEU O 1 1 5 2293 1 1 29 ASN C C 6.735 5.596 6.475 1.00 . A A . 29 ASN C 1 1 5 2294 1 1 29 ASN CA C 7.977 6.165 5.727 1.00 . A A . 29 ASN CA 1 1 5 2295 1 1 29 ASN CB C 7.974 7.704 5.606 1.00 . A A . 29 ASN CB 1 1 5 2296 1 1 29 ASN CG C 6.646 8.243 5.093 1.00 . A A . 29 ASN CG 1 1 5 2297 1 1 29 ASN H H 7.140 5.368 3.947 1.00 . A A . 29 ASN H 1 1 5 2298 1 1 29 ASN HA H 8.869 5.872 6.288 1.00 . A A . 29 ASN HA 1 1 5 2299 1 1 29 ASN HB2 H 8.146 8.153 6.585 1.00 . A A . 29 ASN HB2 1 1 5 2300 1 1 29 ASN HB3 H 8.792 8.028 4.960 1.00 . A A . 29 ASN HB3 1 1 5 2301 1 1 29 ASN HD21 H 7.235 8.220 3.151 1.00 . A A . 29 ASN HD21 1 1 5 2302 1 1 29 ASN HD22 H 5.596 8.765 3.505 1.00 . A A . 29 ASN HD22 1 1 5 2303 1 1 29 ASN N N 8.030 5.573 4.384 1.00 . A A . 29 ASN N 1 1 5 2304 1 1 29 ASN ND2 N 6.497 8.433 3.798 1.00 . A A . 29 ASN ND2 1 1 5 2305 1 1 29 ASN O O 5.747 5.262 5.816 1.00 . A A . 29 ASN O 1 1 5 2306 1 1 29 ASN OD1 O 5.727 8.476 5.862 1.00 . A A . 29 ASN OD1 1 1 5 2307 1 1 30 PRO C C 4.248 5.180 8.234 1.00 . A A . 30 PRO C 1 1 5 2308 1 1 30 PRO CA C 5.697 4.747 8.560 1.00 . A A . 30 PRO CA 1 1 5 2309 1 1 30 PRO CB C 6.066 4.904 10.044 1.00 . A A . 30 PRO CB 1 1 5 2310 1 1 30 PRO CD C 7.751 5.983 8.730 1.00 . A A . 30 PRO CD 1 1 5 2311 1 1 30 PRO CG C 7.023 6.100 10.067 1.00 . A A . 30 PRO CG 1 1 5 2312 1 1 30 PRO HA H 5.763 3.685 8.310 1.00 . A A . 30 PRO HA 1 1 5 2313 1 1 30 PRO HB2 H 5.200 5.067 10.692 1.00 . A A . 30 PRO HB2 1 1 5 2314 1 1 30 PRO HB3 H 6.602 4.014 10.382 1.00 . A A . 30 PRO HB3 1 1 5 2315 1 1 30 PRO HD2 H 8.137 6.959 8.443 1.00 . A A . 30 PRO HD2 1 1 5 2316 1 1 30 PRO HD3 H 8.576 5.270 8.815 1.00 . A A . 30 PRO HD3 1 1 5 2317 1 1 30 PRO HG2 H 6.441 7.027 10.094 1.00 . A A . 30 PRO HG2 1 1 5 2318 1 1 30 PRO HG3 H 7.707 6.067 10.920 1.00 . A A . 30 PRO HG3 1 1 5 2319 1 1 30 PRO N N 6.746 5.464 7.816 1.00 . A A . 30 PRO N 1 1 5 2320 1 1 30 PRO O O 3.345 4.347 8.220 1.00 . A A . 30 PRO O 1 1 5 2321 1 1 31 TYR C C 2.155 6.507 6.166 1.00 . A A . 31 TYR C 1 1 5 2322 1 1 31 TYR CA C 2.703 6.985 7.532 1.00 . A A . 31 TYR CA 1 1 5 2323 1 1 31 TYR CB C 2.675 8.510 7.717 1.00 . A A . 31 TYR CB 1 1 5 2324 1 1 31 TYR CD1 C 1.730 8.746 10.052 1.00 . A A . 31 TYR CD1 1 1 5 2325 1 1 31 TYR CD2 C 4.110 9.182 9.706 1.00 . A A . 31 TYR CD2 1 1 5 2326 1 1 31 TYR CE1 C 1.913 8.866 11.446 1.00 . A A . 31 TYR CE1 1 1 5 2327 1 1 31 TYR CE2 C 4.288 9.301 11.102 1.00 . A A . 31 TYR CE2 1 1 5 2328 1 1 31 TYR CG C 2.828 8.912 9.175 1.00 . A A . 31 TYR CG 1 1 5 2329 1 1 31 TYR CZ C 3.189 9.138 11.966 1.00 . A A . 31 TYR CZ 1 1 5 2330 1 1 31 TYR H H 4.799 7.099 7.915 1.00 . A A . 31 TYR H 1 1 5 2331 1 1 31 TYR HA H 1.978 6.591 8.240 1.00 . A A . 31 TYR HA 1 1 5 2332 1 1 31 TYR HB2 H 3.453 8.972 7.106 1.00 . A A . 31 TYR HB2 1 1 5 2333 1 1 31 TYR HB3 H 1.715 8.890 7.361 1.00 . A A . 31 TYR HB3 1 1 5 2334 1 1 31 TYR HD1 H 0.758 8.486 9.658 1.00 . A A . 31 TYR HD1 1 1 5 2335 1 1 31 TYR HD2 H 4.963 9.263 9.045 1.00 . A A . 31 TYR HD2 1 1 5 2336 1 1 31 TYR HE1 H 1.081 8.728 12.118 1.00 . A A . 31 TYR HE1 1 1 5 2337 1 1 31 TYR HE2 H 5.269 9.503 11.504 1.00 . A A . 31 TYR HE2 1 1 5 2338 1 1 31 TYR HH H 4.278 9.414 13.527 1.00 . A A . 31 TYR HH 1 1 5 2339 1 1 31 TYR N N 4.021 6.461 7.922 1.00 . A A . 31 TYR N 1 1 5 2340 1 1 31 TYR O O 0.949 6.592 5.934 1.00 . A A . 31 TYR O 1 1 5 2341 1 1 31 TYR OH O 3.363 9.235 13.309 1.00 . A A . 31 TYR OH 1 1 5 2342 1 1 32 TYR C C 3.293 3.936 3.678 1.00 . A A . 32 TYR C 1 1 5 2343 1 1 32 TYR CA C 2.444 5.155 4.131 1.00 . A A . 32 TYR CA 1 1 5 2344 1 1 32 TYR CB C 1.859 6.072 3.027 1.00 . A A . 32 TYR CB 1 1 5 2345 1 1 32 TYR CD1 C 2.529 5.057 0.795 1.00 . A A . 32 TYR CD1 1 1 5 2346 1 1 32 TYR CD2 C 2.637 7.477 1.088 1.00 . A A . 32 TYR CD2 1 1 5 2347 1 1 32 TYR CE1 C 2.670 5.226 -0.598 1.00 . A A . 32 TYR CE1 1 1 5 2348 1 1 32 TYR CE2 C 2.730 7.640 -0.310 1.00 . A A . 32 TYR CE2 1 1 5 2349 1 1 32 TYR CG C 2.516 6.183 1.656 1.00 . A A . 32 TYR CG 1 1 5 2350 1 1 32 TYR CZ C 2.703 6.516 -1.151 1.00 . A A . 32 TYR CZ 1 1 5 2351 1 1 32 TYR H H 3.966 5.871 5.485 1.00 . A A . 32 TYR H 1 1 5 2352 1 1 32 TYR HA H 1.542 4.693 4.544 1.00 . A A . 32 TYR HA 1 1 5 2353 1 1 32 TYR HB2 H 0.839 5.735 2.817 1.00 . A A . 32 TYR HB2 1 1 5 2354 1 1 32 TYR HB3 H 1.774 7.078 3.441 1.00 . A A . 32 TYR HB3 1 1 5 2355 1 1 32 TYR HD1 H 2.348 4.066 1.184 1.00 . A A . 32 TYR HD1 1 1 5 2356 1 1 32 TYR HD2 H 2.557 8.351 1.721 1.00 . A A . 32 TYR HD2 1 1 5 2357 1 1 32 TYR HE1 H 2.658 4.368 -1.250 1.00 . A A . 32 TYR HE1 1 1 5 2358 1 1 32 TYR HE2 H 2.770 8.629 -0.738 1.00 . A A . 32 TYR HE2 1 1 5 2359 1 1 32 TYR HH H 1.754 6.553 -2.802 1.00 . A A . 32 TYR HH 1 1 5 2360 1 1 32 TYR N N 2.974 5.926 5.272 1.00 . A A . 32 TYR N 1 1 5 2361 1 1 32 TYR O O 4.454 4.042 3.284 1.00 . A A . 32 TYR O 1 1 5 2362 1 1 32 TYR OH O 2.660 6.665 -2.505 1.00 . A A . 32 TYR OH 1 1 5 2363 1 1 33 SER C C 2.632 1.123 1.859 1.00 . A A . 33 SER C 1 1 5 2364 1 1 33 SER CA C 3.123 1.447 3.293 1.00 . A A . 33 SER CA 1 1 5 2365 1 1 33 SER CB C 2.644 0.420 4.325 1.00 . A A . 33 SER CB 1 1 5 2366 1 1 33 SER H H 1.698 2.797 4.058 1.00 . A A . 33 SER H 1 1 5 2367 1 1 33 SER HA H 4.212 1.432 3.304 1.00 . A A . 33 SER HA 1 1 5 2368 1 1 33 SER HB2 H 3.054 0.675 5.308 1.00 . A A . 33 SER HB2 1 1 5 2369 1 1 33 SER HB3 H 1.555 0.421 4.392 1.00 . A A . 33 SER HB3 1 1 5 2370 1 1 33 SER HG H 3.006 -1.501 4.627 1.00 . A A . 33 SER HG 1 1 5 2371 1 1 33 SER N N 2.651 2.761 3.736 1.00 . A A . 33 SER N 1 1 5 2372 1 1 33 SER O O 1.438 1.249 1.569 1.00 . A A . 33 SER O 1 1 5 2373 1 1 33 SER OG O 3.106 -0.845 3.925 1.00 . A A . 33 SER OG 1 1 5 2374 1 1 34 GLN C C 3.584 -0.516 -1.233 1.00 . A A . 34 GLN C 1 1 5 2375 1 1 34 GLN CA C 3.429 0.856 -0.513 1.00 . A A . 34 GLN CA 1 1 5 2376 1 1 34 GLN CB C 4.437 1.907 -1.043 1.00 . A A . 34 GLN CB 1 1 5 2377 1 1 34 GLN CD C 5.225 3.432 -2.963 1.00 . A A . 34 GLN CD 1 1 5 2378 1 1 34 GLN CG C 4.287 2.305 -2.533 1.00 . A A . 34 GLN CG 1 1 5 2379 1 1 34 GLN H H 4.491 0.653 1.304 1.00 . A A . 34 GLN H 1 1 5 2380 1 1 34 GLN HA H 2.439 1.242 -0.755 1.00 . A A . 34 GLN HA 1 1 5 2381 1 1 34 GLN HB2 H 4.332 2.816 -0.444 1.00 . A A . 34 GLN HB2 1 1 5 2382 1 1 34 GLN HB3 H 5.441 1.510 -0.887 1.00 . A A . 34 GLN HB3 1 1 5 2383 1 1 34 GLN HE21 H 3.810 4.933 -2.906 1.00 . A A . 34 GLN HE21 1 1 5 2384 1 1 34 GLN HE22 H 5.452 5.330 -3.378 1.00 . A A . 34 GLN HE22 1 1 5 2385 1 1 34 GLN HG2 H 4.553 1.465 -3.170 1.00 . A A . 34 GLN HG2 1 1 5 2386 1 1 34 GLN HG3 H 3.260 2.591 -2.749 1.00 . A A . 34 GLN HG3 1 1 5 2387 1 1 34 GLN N N 3.561 0.817 0.949 1.00 . A A . 34 GLN N 1 1 5 2388 1 1 34 GLN NE2 N 4.762 4.662 -3.087 1.00 . A A . 34 GLN NE2 1 1 5 2389 1 1 34 GLN O O 4.082 -1.503 -0.695 1.00 . A A . 34 GLN O 1 1 5 2390 1 1 34 GLN OE1 O 6.390 3.217 -3.240 1.00 . A A . 34 GLN OE1 1 1 5 2391 1 1 35 CYS C C 4.636 -1.981 -3.988 1.00 . A A . 35 CYS C 1 1 5 2392 1 1 35 CYS CA C 3.215 -1.456 -3.610 1.00 . A A . 35 CYS CA 1 1 5 2393 1 1 35 CYS CB C 2.575 -0.654 -4.770 1.00 . A A . 35 CYS CB 1 1 5 2394 1 1 35 CYS H H 2.728 0.388 -2.728 1.00 . A A . 35 CYS H 1 1 5 2395 1 1 35 CYS HA H 2.596 -2.321 -3.364 1.00 . A A . 35 CYS HA 1 1 5 2396 1 1 35 CYS HB2 H 1.695 -0.125 -4.405 1.00 . A A . 35 CYS HB2 1 1 5 2397 1 1 35 CYS HB3 H 3.287 0.103 -5.096 1.00 . A A . 35 CYS HB3 1 1 5 2398 1 1 35 CYS N N 3.152 -0.491 -2.498 1.00 . A A . 35 CYS N 1 1 5 2399 1 1 35 CYS O O 4.985 -1.971 -5.168 1.00 . A A . 35 CYS O 1 1 5 2400 1 1 35 CYS SG S 1.965 -1.444 -6.274 1.00 . A A . 35 CYS SG 1 1 5 2401 1 1 36 LEU C C 6.835 -4.455 -2.778 1.00 . A A . 36 LEU C 1 1 5 2402 1 1 36 LEU CA C 6.808 -2.949 -3.148 1.00 . A A . 36 LEU CA 1 1 5 2403 1 1 36 LEU CB C 7.799 -2.118 -2.296 1.00 . A A . 36 LEU CB 1 1 5 2404 1 1 36 LEU CD1 C 7.356 0.067 -3.554 1.00 . A A . 36 LEU CD1 1 1 5 2405 1 1 36 LEU CD2 C 9.299 -0.144 -1.977 1.00 . A A . 36 LEU CD2 1 1 5 2406 1 1 36 LEU CG C 8.414 -0.889 -2.990 1.00 . A A . 36 LEU CG 1 1 5 2407 1 1 36 LEU H H 5.053 -2.402 -2.071 1.00 . A A . 36 LEU H 1 1 5 2408 1 1 36 LEU HA H 7.146 -2.903 -4.184 1.00 . A A . 36 LEU HA 1 1 5 2409 1 1 36 LEU HB2 H 7.298 -1.792 -1.386 1.00 . A A . 36 LEU HB2 1 1 5 2410 1 1 36 LEU HB3 H 8.635 -2.756 -2.004 1.00 . A A . 36 LEU HB3 1 1 5 2411 1 1 36 LEU HD11 H 6.606 0.280 -2.793 1.00 . A A . 36 LEU HD11 1 1 5 2412 1 1 36 LEU HD12 H 7.823 1.000 -3.870 1.00 . A A . 36 LEU HD12 1 1 5 2413 1 1 36 LEU HD13 H 6.878 -0.380 -4.424 1.00 . A A . 36 LEU HD13 1 1 5 2414 1 1 36 LEU HD21 H 10.065 -0.815 -1.587 1.00 . A A . 36 LEU HD21 1 1 5 2415 1 1 36 LEU HD22 H 9.787 0.705 -2.457 1.00 . A A . 36 LEU HD22 1 1 5 2416 1 1 36 LEU HD23 H 8.695 0.219 -1.145 1.00 . A A . 36 LEU HD23 1 1 5 2417 1 1 36 LEU HG H 9.046 -1.230 -3.814 1.00 . A A . 36 LEU HG 1 1 5 2418 1 1 36 LEU N N 5.445 -2.391 -3.004 1.00 . A A . 36 LEU N 1 1 5 2419 1 1 36 LEU O O 6.450 -5.265 -3.653 1.00 . A A . 36 LEU O 1 1 5 2420 1 1 36 LEU OXT O 7.187 -4.784 -1.622 1.00 . A A . 36 LEU OXT 1 1 6 2421 1 1 1 THR C C -7.164 -10.341 -10.116 1.00 . A A . 1 THR C 1 1 6 2422 1 1 1 THR CA C -6.082 -10.135 -11.213 1.00 . A A . 1 THR CA 1 1 6 2423 1 1 1 THR CB C -5.002 -9.112 -10.779 1.00 . A A . 1 THR CB 1 1 6 2424 1 1 1 THR CG2 C -5.586 -7.738 -10.427 1.00 . A A . 1 THR CG2 1 1 6 2425 1 1 1 THR H1 H -7.375 -10.477 -12.791 1.00 . A A . 1 THR H1 1 1 6 2426 1 1 1 THR H2 H -7.073 -8.893 -12.566 1.00 . A A . 1 THR H2 1 1 6 2427 1 1 1 THR H3 H -5.929 -9.850 -13.288 1.00 . A A . 1 THR H3 1 1 6 2428 1 1 1 THR HA H -5.581 -11.101 -11.310 1.00 . A A . 1 THR HA 1 1 6 2429 1 1 1 THR HB H -4.275 -8.989 -11.591 1.00 . A A . 1 THR HB 1 1 6 2430 1 1 1 THR HG1 H -3.486 -9.090 -9.548 1.00 . A A . 1 THR HG1 1 1 6 2431 1 1 1 THR HG21 H -6.182 -7.341 -11.250 1.00 . A A . 1 THR HG21 1 1 6 2432 1 1 1 THR HG22 H -6.207 -7.804 -9.530 1.00 . A A . 1 THR HG22 1 1 6 2433 1 1 1 THR HG23 H -4.774 -7.035 -10.227 1.00 . A A . 1 THR HG23 1 1 6 2434 1 1 1 THR N N -6.643 -9.811 -12.569 1.00 . A A . 1 THR N 1 1 6 2435 1 1 1 THR O O -8.344 -10.248 -10.451 1.00 . A A . 1 THR O 1 1 6 2436 1 1 1 THR OG1 O -4.308 -9.594 -9.652 1.00 . A A . 1 THR OG1 1 1 6 2437 1 1 2 GLN C C -7.244 -10.136 -6.451 1.00 . A A . 2 GLN C 1 1 6 2438 1 1 2 GLN CA C -7.722 -10.860 -7.728 1.00 . A A . 2 GLN CA 1 1 6 2439 1 1 2 GLN CB C -7.931 -12.373 -7.499 1.00 . A A . 2 GLN CB 1 1 6 2440 1 1 2 GLN CD C -10.272 -12.617 -8.561 1.00 . A A . 2 GLN CD 1 1 6 2441 1 1 2 GLN CG C -8.808 -13.059 -8.571 1.00 . A A . 2 GLN CG 1 1 6 2442 1 1 2 GLN H H -5.801 -10.637 -8.679 1.00 . A A . 2 GLN H 1 1 6 2443 1 1 2 GLN HA H -8.691 -10.408 -7.940 1.00 . A A . 2 GLN HA 1 1 6 2444 1 1 2 GLN HB2 H -6.952 -12.865 -7.470 1.00 . A A . 2 GLN HB2 1 1 6 2445 1 1 2 GLN HB3 H -8.406 -12.532 -6.527 1.00 . A A . 2 GLN HB3 1 1 6 2446 1 1 2 GLN HE21 H -9.920 -10.962 -9.692 1.00 . A A . 2 GLN HE21 1 1 6 2447 1 1 2 GLN HE22 H -11.579 -11.282 -9.166 1.00 . A A . 2 GLN HE22 1 1 6 2448 1 1 2 GLN HG2 H -8.386 -12.902 -9.563 1.00 . A A . 2 GLN HG2 1 1 6 2449 1 1 2 GLN HG3 H -8.797 -14.130 -8.367 1.00 . A A . 2 GLN HG3 1 1 6 2450 1 1 2 GLN N N -6.800 -10.645 -8.865 1.00 . A A . 2 GLN N 1 1 6 2451 1 1 2 GLN NE2 N -10.607 -11.526 -9.221 1.00 . A A . 2 GLN NE2 1 1 6 2452 1 1 2 GLN O O -7.924 -9.246 -5.945 1.00 . A A . 2 GLN O 1 1 6 2453 1 1 2 GLN OE1 O -11.129 -13.255 -7.978 1.00 . A A . 2 GLN OE1 1 1 6 2454 1 1 3 SER C C -4.867 -8.243 -5.757 1.00 . A A . 3 SER C 1 1 6 2455 1 1 3 SER CA C -5.247 -9.585 -5.084 1.00 . A A . 3 SER CA 1 1 6 2456 1 1 3 SER CB C -3.995 -10.372 -4.649 1.00 . A A . 3 SER CB 1 1 6 2457 1 1 3 SER H H -5.508 -11.181 -6.444 1.00 . A A . 3 SER H 1 1 6 2458 1 1 3 SER HA H -5.831 -9.363 -4.188 1.00 . A A . 3 SER HA 1 1 6 2459 1 1 3 SER HB2 H -3.379 -9.777 -3.960 1.00 . A A . 3 SER HB2 1 1 6 2460 1 1 3 SER HB3 H -4.296 -11.283 -4.124 1.00 . A A . 3 SER HB3 1 1 6 2461 1 1 3 SER HG H -2.747 -9.937 -6.079 1.00 . A A . 3 SER HG 1 1 6 2462 1 1 3 SER N N -6.026 -10.440 -5.993 1.00 . A A . 3 SER N 1 1 6 2463 1 1 3 SER O O -3.704 -7.980 -6.044 1.00 . A A . 3 SER O 1 1 6 2464 1 1 3 SER OG O -3.238 -10.723 -5.801 1.00 . A A . 3 SER OG 1 1 6 2465 1 1 4 HIS C C -4.921 -5.091 -6.077 1.00 . A A . 4 HIS C 1 1 6 2466 1 1 4 HIS CA C -5.718 -6.170 -6.853 1.00 . A A . 4 HIS CA 1 1 6 2467 1 1 4 HIS CB C -7.118 -5.699 -7.301 1.00 . A A . 4 HIS CB 1 1 6 2468 1 1 4 HIS CD2 C -8.062 -4.376 -9.345 1.00 . A A . 4 HIS CD2 1 1 6 2469 1 1 4 HIS CE1 C -6.524 -2.829 -9.430 1.00 . A A . 4 HIS CE1 1 1 6 2470 1 1 4 HIS CG C -7.139 -4.621 -8.362 1.00 . A A . 4 HIS CG 1 1 6 2471 1 1 4 HIS H H -6.801 -7.726 -5.842 1.00 . A A . 4 HIS H 1 1 6 2472 1 1 4 HIS HA H -5.160 -6.397 -7.761 1.00 . A A . 4 HIS HA 1 1 6 2473 1 1 4 HIS HB2 H -7.662 -6.554 -7.701 1.00 . A A . 4 HIS HB2 1 1 6 2474 1 1 4 HIS HB3 H -7.667 -5.328 -6.435 1.00 . A A . 4 HIS HB3 1 1 6 2475 1 1 4 HIS HD2 H -8.964 -4.943 -9.521 1.00 . A A . 4 HIS HD2 1 1 6 2476 1 1 4 HIS HE1 H -5.970 -1.947 -9.726 1.00 . A A . 4 HIS HE1 1 1 6 2477 1 1 4 HIS HE2 H -8.154 -2.751 -10.754 1.00 . A A . 4 HIS HE2 1 1 6 2478 1 1 4 HIS N N -5.868 -7.417 -6.088 1.00 . A A . 4 HIS N 1 1 6 2479 1 1 4 HIS ND1 N -6.146 -3.651 -8.450 1.00 . A A . 4 HIS ND1 1 1 6 2480 1 1 4 HIS NE2 N -7.669 -3.225 -10.006 1.00 . A A . 4 HIS NE2 1 1 6 2481 1 1 4 HIS O O -3.929 -4.563 -6.569 1.00 . A A . 4 HIS O 1 1 6 2482 1 1 5 ALA C C -3.286 -4.138 -3.557 1.00 . A A . 5 ALA C 1 1 6 2483 1 1 5 ALA CA C -4.737 -3.793 -3.973 1.00 . A A . 5 ALA CA 1 1 6 2484 1 1 5 ALA CB C -5.629 -3.583 -2.740 1.00 . A A . 5 ALA CB 1 1 6 2485 1 1 5 ALA H H -6.137 -5.317 -4.496 1.00 . A A . 5 ALA H 1 1 6 2486 1 1 5 ALA HA H -4.723 -2.843 -4.513 1.00 . A A . 5 ALA HA 1 1 6 2487 1 1 5 ALA HB1 H -6.625 -3.260 -3.040 1.00 . A A . 5 ALA HB1 1 1 6 2488 1 1 5 ALA HB2 H -5.714 -4.505 -2.162 1.00 . A A . 5 ALA HB2 1 1 6 2489 1 1 5 ALA HB3 H -5.194 -2.815 -2.101 1.00 . A A . 5 ALA HB3 1 1 6 2490 1 1 5 ALA N N -5.354 -4.793 -4.847 1.00 . A A . 5 ALA N 1 1 6 2491 1 1 5 ALA O O -3.060 -5.004 -2.711 1.00 . A A . 5 ALA O 1 1 6 2492 1 1 6 GLY C C -0.884 -2.722 -2.153 1.00 . A A . 6 GLY C 1 1 6 2493 1 1 6 GLY CA C -0.943 -3.353 -3.560 1.00 . A A . 6 GLY CA 1 1 6 2494 1 1 6 GLY H H -2.537 -2.816 -4.888 1.00 . A A . 6 GLY H 1 1 6 2495 1 1 6 GLY HA2 H -0.530 -4.358 -3.535 1.00 . A A . 6 GLY HA2 1 1 6 2496 1 1 6 GLY HA3 H -0.329 -2.750 -4.228 1.00 . A A . 6 GLY HA3 1 1 6 2497 1 1 6 GLY N N -2.307 -3.409 -4.097 1.00 . A A . 6 GLY N 1 1 6 2498 1 1 6 GLY O O -0.477 -3.361 -1.187 1.00 . A A . 6 GLY O 1 1 6 2499 1 1 7 GLN C C -2.166 -1.277 0.349 1.00 . A A . 7 GLN C 1 1 6 2500 1 1 7 GLN CA C -1.349 -0.657 -0.816 1.00 . A A . 7 GLN CA 1 1 6 2501 1 1 7 GLN CB C -1.844 0.761 -1.165 1.00 . A A . 7 GLN CB 1 1 6 2502 1 1 7 GLN CD C -2.868 2.798 0.063 1.00 . A A . 7 GLN CD 1 1 6 2503 1 1 7 GLN CG C -1.747 1.758 0.016 1.00 . A A . 7 GLN CG 1 1 6 2504 1 1 7 GLN H H -1.736 -1.069 -2.880 1.00 . A A . 7 GLN H 1 1 6 2505 1 1 7 GLN HA H -0.321 -0.554 -0.471 1.00 . A A . 7 GLN HA 1 1 6 2506 1 1 7 GLN HB2 H -1.265 1.167 -1.998 1.00 . A A . 7 GLN HB2 1 1 6 2507 1 1 7 GLN HB3 H -2.887 0.665 -1.474 1.00 . A A . 7 GLN HB3 1 1 6 2508 1 1 7 GLN HE21 H -2.296 3.487 1.886 1.00 . A A . 7 GLN HE21 1 1 6 2509 1 1 7 GLN HE22 H -3.749 4.180 1.153 1.00 . A A . 7 GLN HE22 1 1 6 2510 1 1 7 GLN HG2 H -1.788 1.229 0.966 1.00 . A A . 7 GLN HG2 1 1 6 2511 1 1 7 GLN HG3 H -0.791 2.279 -0.026 1.00 . A A . 7 GLN HG3 1 1 6 2512 1 1 7 GLN N N -1.348 -1.470 -2.044 1.00 . A A . 7 GLN N 1 1 6 2513 1 1 7 GLN NE2 N -2.952 3.565 1.132 1.00 . A A . 7 GLN NE2 1 1 6 2514 1 1 7 GLN O O -3.289 -0.858 0.619 1.00 . A A . 7 GLN O 1 1 6 2515 1 1 7 GLN OE1 O -3.687 2.942 -0.835 1.00 . A A . 7 GLN OE1 1 1 6 2516 1 1 8 CYS C C -2.873 -1.919 3.282 1.00 . A A . 8 CYS C 1 1 6 2517 1 1 8 CYS CA C -2.120 -2.859 2.297 1.00 . A A . 8 CYS CA 1 1 6 2518 1 1 8 CYS CB C -0.961 -3.556 3.024 1.00 . A A . 8 CYS CB 1 1 6 2519 1 1 8 CYS H H -0.735 -2.616 0.663 1.00 . A A . 8 CYS H 1 1 6 2520 1 1 8 CYS HA H -2.829 -3.629 1.989 1.00 . A A . 8 CYS HA 1 1 6 2521 1 1 8 CYS HB2 H -1.337 -4.026 3.933 1.00 . A A . 8 CYS HB2 1 1 6 2522 1 1 8 CYS HB3 H -0.535 -4.335 2.391 1.00 . A A . 8 CYS HB3 1 1 6 2523 1 1 8 CYS N N -1.580 -2.232 1.074 1.00 . A A . 8 CYS N 1 1 6 2524 1 1 8 CYS O O -3.862 -2.324 3.887 1.00 . A A . 8 CYS O 1 1 6 2525 1 1 8 CYS SG S 0.389 -2.442 3.493 1.00 . A A . 8 CYS SG 1 1 6 2526 1 1 9 GLY C C -1.966 0.370 5.736 1.00 . A A . 9 GLY C 1 1 6 2527 1 1 9 GLY CA C -2.858 0.278 4.474 1.00 . A A . 9 GLY CA 1 1 6 2528 1 1 9 GLY H H -1.577 -0.444 2.912 1.00 . A A . 9 GLY H 1 1 6 2529 1 1 9 GLY HA2 H -2.899 1.244 3.971 1.00 . A A . 9 GLY HA2 1 1 6 2530 1 1 9 GLY HA3 H -3.874 0.033 4.789 1.00 . A A . 9 GLY HA3 1 1 6 2531 1 1 9 GLY N N -2.367 -0.694 3.485 1.00 . A A . 9 GLY N 1 1 6 2532 1 1 9 GLY O O -2.024 -0.490 6.612 1.00 . A A . 9 GLY O 1 1 6 2533 1 1 10 GLY C C -0.555 2.714 7.945 1.00 . A A . 10 GLY C 1 1 6 2534 1 1 10 GLY CA C -0.149 1.612 6.939 1.00 . A A . 10 GLY CA 1 1 6 2535 1 1 10 GLY H H -1.196 2.105 5.115 1.00 . A A . 10 GLY H 1 1 6 2536 1 1 10 GLY HA2 H -0.026 0.693 7.516 1.00 . A A . 10 GLY HA2 1 1 6 2537 1 1 10 GLY HA3 H 0.828 1.847 6.518 1.00 . A A . 10 GLY HA3 1 1 6 2538 1 1 10 GLY N N -1.102 1.395 5.822 1.00 . A A . 10 GLY N 1 1 6 2539 1 1 10 GLY O O -1.689 3.185 7.916 1.00 . A A . 10 GLY O 1 1 6 2540 1 1 11 ILE C C -0.836 5.260 9.618 1.00 . A A . 11 ILE C 1 1 6 2541 1 1 11 ILE CA C 0.058 4.035 9.991 1.00 . A A . 11 ILE CA 1 1 6 2542 1 1 11 ILE CB C 1.360 4.477 10.726 1.00 . A A . 11 ILE CB 1 1 6 2543 1 1 11 ILE CD1 C 3.628 3.731 11.694 1.00 . A A . 11 ILE CD1 1 1 6 2544 1 1 11 ILE CG1 C 2.251 3.291 11.173 1.00 . A A . 11 ILE CG1 1 1 6 2545 1 1 11 ILE CG2 C 1.005 5.321 11.972 1.00 . A A . 11 ILE CG2 1 1 6 2546 1 1 11 ILE H H 1.272 2.726 8.791 1.00 . A A . 11 ILE H 1 1 6 2547 1 1 11 ILE HA H -0.497 3.444 10.719 1.00 . A A . 11 ILE HA 1 1 6 2548 1 1 11 ILE HB H 1.942 5.102 10.046 1.00 . A A . 11 ILE HB 1 1 6 2549 1 1 11 ILE HD11 H 4.127 4.350 10.948 1.00 . A A . 11 ILE HD11 1 1 6 2550 1 1 11 ILE HD12 H 3.540 4.289 12.624 1.00 . A A . 11 ILE HD12 1 1 6 2551 1 1 11 ILE HD13 H 4.244 2.853 11.885 1.00 . A A . 11 ILE HD13 1 1 6 2552 1 1 11 ILE HG12 H 1.742 2.718 11.949 1.00 . A A . 11 ILE HG12 1 1 6 2553 1 1 11 ILE HG13 H 2.441 2.627 10.330 1.00 . A A . 11 ILE HG13 1 1 6 2554 1 1 11 ILE HG21 H 0.392 6.182 11.712 1.00 . A A . 11 ILE HG21 1 1 6 2555 1 1 11 ILE HG22 H 0.458 4.711 12.692 1.00 . A A . 11 ILE HG22 1 1 6 2556 1 1 11 ILE HG23 H 1.901 5.710 12.454 1.00 . A A . 11 ILE HG23 1 1 6 2557 1 1 11 ILE N N 0.347 3.123 8.853 1.00 . A A . 11 ILE N 1 1 6 2558 1 1 11 ILE O O -0.343 6.288 9.167 1.00 . A A . 11 ILE O 1 1 6 2559 1 1 12 GLY C C -3.721 6.301 8.116 1.00 . A A . 12 GLY C 1 1 6 2560 1 1 12 GLY CA C -3.145 6.218 9.552 1.00 . A A . 12 GLY CA 1 1 6 2561 1 1 12 GLY H H -2.488 4.272 10.174 1.00 . A A . 12 GLY H 1 1 6 2562 1 1 12 GLY HA2 H -3.991 6.053 10.216 1.00 . A A . 12 GLY HA2 1 1 6 2563 1 1 12 GLY HA3 H -2.718 7.192 9.799 1.00 . A A . 12 GLY HA3 1 1 6 2564 1 1 12 GLY N N -2.156 5.161 9.833 1.00 . A A . 12 GLY N 1 1 6 2565 1 1 12 GLY O O -4.362 7.297 7.785 1.00 . A A . 12 GLY O 1 1 6 2566 1 1 13 TYR C C -4.746 3.960 5.449 1.00 . A A . 13 TYR C 1 1 6 2567 1 1 13 TYR CA C -3.994 5.251 5.871 1.00 . A A . 13 TYR CA 1 1 6 2568 1 1 13 TYR CB C -2.794 5.557 4.948 1.00 . A A . 13 TYR CB 1 1 6 2569 1 1 13 TYR CD1 C -4.162 6.207 2.903 1.00 . A A . 13 TYR CD1 1 1 6 2570 1 1 13 TYR CD2 C -2.465 7.764 3.720 1.00 . A A . 13 TYR CD2 1 1 6 2571 1 1 13 TYR CE1 C -4.553 7.154 1.933 1.00 . A A . 13 TYR CE1 1 1 6 2572 1 1 13 TYR CE2 C -2.822 8.681 2.707 1.00 . A A . 13 TYR CE2 1 1 6 2573 1 1 13 TYR CG C -3.112 6.508 3.802 1.00 . A A . 13 TYR CG 1 1 6 2574 1 1 13 TYR CZ C -3.857 8.368 1.812 1.00 . A A . 13 TYR CZ 1 1 6 2575 1 1 13 TYR H H -2.986 4.495 7.607 1.00 . A A . 13 TYR H 1 1 6 2576 1 1 13 TYR HA H -4.704 6.068 5.732 1.00 . A A . 13 TYR HA 1 1 6 2577 1 1 13 TYR HB2 H -1.990 5.997 5.542 1.00 . A A . 13 TYR HB2 1 1 6 2578 1 1 13 TYR HB3 H -2.388 4.635 4.532 1.00 . A A . 13 TYR HB3 1 1 6 2579 1 1 13 TYR HD1 H -4.677 5.258 2.959 1.00 . A A . 13 TYR HD1 1 1 6 2580 1 1 13 TYR HD2 H -1.699 8.031 4.434 1.00 . A A . 13 TYR HD2 1 1 6 2581 1 1 13 TYR HE1 H -5.359 6.933 1.252 1.00 . A A . 13 TYR HE1 1 1 6 2582 1 1 13 TYR HE2 H -2.314 9.628 2.624 1.00 . A A . 13 TYR HE2 1 1 6 2583 1 1 13 TYR HH H -4.902 8.882 0.282 1.00 . A A . 13 TYR HH 1 1 6 2584 1 1 13 TYR N N -3.555 5.265 7.278 1.00 . A A . 13 TYR N 1 1 6 2585 1 1 13 TYR O O -4.147 2.895 5.323 1.00 . A A . 13 TYR O 1 1 6 2586 1 1 13 TYR OH O -4.181 9.228 0.811 1.00 . A A . 13 TYR OH 1 1 6 2587 1 1 14 SER C C -7.735 3.328 3.417 1.00 . A A . 14 SER C 1 1 6 2588 1 1 14 SER CA C -6.964 3.000 4.722 1.00 . A A . 14 SER CA 1 1 6 2589 1 1 14 SER CB C -7.949 2.640 5.852 1.00 . A A . 14 SER CB 1 1 6 2590 1 1 14 SER H H -6.456 4.971 5.416 1.00 . A A . 14 SER H 1 1 6 2591 1 1 14 SER HA H -6.386 2.094 4.506 1.00 . A A . 14 SER HA 1 1 6 2592 1 1 14 SER HB2 H -8.638 3.469 6.043 1.00 . A A . 14 SER HB2 1 1 6 2593 1 1 14 SER HB3 H -8.542 1.766 5.559 1.00 . A A . 14 SER HB3 1 1 6 2594 1 1 14 SER HG H -6.482 1.790 6.841 1.00 . A A . 14 SER HG 1 1 6 2595 1 1 14 SER N N -6.055 4.079 5.181 1.00 . A A . 14 SER N 1 1 6 2596 1 1 14 SER O O -8.124 2.428 2.679 1.00 . A A . 14 SER O 1 1 6 2597 1 1 14 SER OG O -7.244 2.345 7.045 1.00 . A A . 14 SER OG 1 1 6 2598 1 1 15 GLY C C -7.527 4.797 0.632 1.00 . A A . 15 GLY C 1 1 6 2599 1 1 15 GLY CA C -8.497 5.055 1.815 1.00 . A A . 15 GLY CA 1 1 6 2600 1 1 15 GLY H H -7.661 5.309 3.775 1.00 . A A . 15 GLY H 1 1 6 2601 1 1 15 GLY HA2 H -9.446 4.546 1.639 1.00 . A A . 15 GLY HA2 1 1 6 2602 1 1 15 GLY HA3 H -8.693 6.126 1.868 1.00 . A A . 15 GLY HA3 1 1 6 2603 1 1 15 GLY N N -7.975 4.613 3.119 1.00 . A A . 15 GLY N 1 1 6 2604 1 1 15 GLY O O -6.315 4.682 0.836 1.00 . A A . 15 GLY O 1 1 6 2605 1 1 16 PRO C C -6.225 5.470 -2.217 1.00 . A A . 16 PRO C 1 1 6 2606 1 1 16 PRO CA C -7.224 4.372 -1.783 1.00 . A A . 16 PRO CA 1 1 6 2607 1 1 16 PRO CB C -8.245 4.048 -2.887 1.00 . A A . 16 PRO CB 1 1 6 2608 1 1 16 PRO CD C -9.434 4.848 -0.986 1.00 . A A . 16 PRO CD 1 1 6 2609 1 1 16 PRO CG C -9.438 4.930 -2.512 1.00 . A A . 16 PRO CG 1 1 6 2610 1 1 16 PRO HA H -6.666 3.453 -1.578 1.00 . A A . 16 PRO HA 1 1 6 2611 1 1 16 PRO HB2 H -7.875 4.261 -3.894 1.00 . A A . 16 PRO HB2 1 1 6 2612 1 1 16 PRO HB3 H -8.535 2.998 -2.823 1.00 . A A . 16 PRO HB3 1 1 6 2613 1 1 16 PRO HD2 H -9.911 5.729 -0.556 1.00 . A A . 16 PRO HD2 1 1 6 2614 1 1 16 PRO HD3 H -9.972 3.950 -0.679 1.00 . A A . 16 PRO HD3 1 1 6 2615 1 1 16 PRO HG2 H -9.239 5.957 -2.829 1.00 . A A . 16 PRO HG2 1 1 6 2616 1 1 16 PRO HG3 H -10.375 4.586 -2.950 1.00 . A A . 16 PRO HG3 1 1 6 2617 1 1 16 PRO N N -8.031 4.723 -0.613 1.00 . A A . 16 PRO N 1 1 6 2618 1 1 16 PRO O O -6.599 6.481 -2.805 1.00 . A A . 16 PRO O 1 1 6 2619 1 1 17 THR C C -2.978 4.564 -3.326 1.00 . A A . 17 THR C 1 1 6 2620 1 1 17 THR CA C -3.797 5.756 -2.780 1.00 . A A . 17 THR CA 1 1 6 2621 1 1 17 THR CB C -2.987 6.771 -1.952 1.00 . A A . 17 THR CB 1 1 6 2622 1 1 17 THR CG2 C -2.563 6.245 -0.583 1.00 . A A . 17 THR CG2 1 1 6 2623 1 1 17 THR H H -4.730 4.411 -1.420 1.00 . A A . 17 THR H 1 1 6 2624 1 1 17 THR HA H -4.158 6.298 -3.659 1.00 . A A . 17 THR HA 1 1 6 2625 1 1 17 THR HB H -3.633 7.639 -1.792 1.00 . A A . 17 THR HB 1 1 6 2626 1 1 17 THR HG1 H -1.432 7.924 -2.167 1.00 . A A . 17 THR HG1 1 1 6 2627 1 1 17 THR HG21 H -3.434 5.880 -0.053 1.00 . A A . 17 THR HG21 1 1 6 2628 1 1 17 THR HG22 H -1.852 5.428 -0.684 1.00 . A A . 17 THR HG22 1 1 6 2629 1 1 17 THR HG23 H -2.122 7.049 -0.001 1.00 . A A . 17 THR HG23 1 1 6 2630 1 1 17 THR N N -4.934 5.221 -1.998 1.00 . A A . 17 THR N 1 1 6 2631 1 1 17 THR O O -1.840 4.296 -2.936 1.00 . A A . 17 THR O 1 1 6 2632 1 1 17 THR OG1 O -1.831 7.194 -2.648 1.00 . A A . 17 THR OG1 1 1 6 2633 1 1 18 VAL C C -2.771 1.832 -5.575 1.00 . A A . 18 VAL C 1 1 6 2634 1 1 18 VAL CA C -3.474 2.309 -4.279 1.00 . A A . 18 VAL CA 1 1 6 2635 1 1 18 VAL CB C -4.816 1.583 -4.001 1.00 . A A . 18 VAL CB 1 1 6 2636 1 1 18 VAL CG1 C -5.965 1.960 -4.955 1.00 . A A . 18 VAL CG1 1 1 6 2637 1 1 18 VAL CG2 C -4.664 0.052 -3.993 1.00 . A A . 18 VAL CG2 1 1 6 2638 1 1 18 VAL H H -4.551 4.130 -4.459 1.00 . A A . 18 VAL H 1 1 6 2639 1 1 18 VAL HA H -2.838 2.001 -3.450 1.00 . A A . 18 VAL HA 1 1 6 2640 1 1 18 VAL HB H -5.129 1.873 -2.995 1.00 . A A . 18 VAL HB 1 1 6 2641 1 1 18 VAL HG11 H -6.125 3.037 -4.967 1.00 . A A . 18 VAL HG11 1 1 6 2642 1 1 18 VAL HG12 H -5.754 1.623 -5.969 1.00 . A A . 18 VAL HG12 1 1 6 2643 1 1 18 VAL HG13 H -6.886 1.481 -4.617 1.00 . A A . 18 VAL HG13 1 1 6 2644 1 1 18 VAL HG21 H -3.816 -0.251 -3.382 1.00 . A A . 18 VAL HG21 1 1 6 2645 1 1 18 VAL HG22 H -5.565 -0.404 -3.583 1.00 . A A . 18 VAL HG22 1 1 6 2646 1 1 18 VAL HG23 H -4.521 -0.320 -5.006 1.00 . A A . 18 VAL HG23 1 1 6 2647 1 1 18 VAL N N -3.662 3.764 -4.160 1.00 . A A . 18 VAL N 1 1 6 2648 1 1 18 VAL O O -3.295 1.960 -6.679 1.00 . A A . 18 VAL O 1 1 6 2649 1 1 19 CYS C C -1.598 -0.855 -6.858 1.00 . A A . 19 CYS C 1 1 6 2650 1 1 19 CYS CA C -0.872 0.454 -6.446 1.00 . A A . 19 CYS CA 1 1 6 2651 1 1 19 CYS CB C 0.510 0.140 -5.860 1.00 . A A . 19 CYS CB 1 1 6 2652 1 1 19 CYS H H -1.205 1.239 -4.487 1.00 . A A . 19 CYS H 1 1 6 2653 1 1 19 CYS HA H -0.742 1.081 -7.330 1.00 . A A . 19 CYS HA 1 1 6 2654 1 1 19 CYS HB2 H 1.005 1.067 -5.569 1.00 . A A . 19 CYS HB2 1 1 6 2655 1 1 19 CYS HB3 H 0.354 -0.447 -4.958 1.00 . A A . 19 CYS HB3 1 1 6 2656 1 1 19 CYS N N -1.588 1.228 -5.418 1.00 . A A . 19 CYS N 1 1 6 2657 1 1 19 CYS O O -2.404 -1.393 -6.097 1.00 . A A . 19 CYS O 1 1 6 2658 1 1 19 CYS SG S 1.700 -0.754 -6.893 1.00 . A A . 19 CYS SG 1 1 6 2659 1 1 20 ALA C C -1.251 -3.932 -7.815 1.00 . A A . 20 ALA C 1 1 6 2660 1 1 20 ALA CA C -1.790 -2.673 -8.554 1.00 . A A . 20 ALA CA 1 1 6 2661 1 1 20 ALA CB C -1.531 -2.722 -10.071 1.00 . A A . 20 ALA CB 1 1 6 2662 1 1 20 ALA H H -0.595 -0.898 -8.596 1.00 . A A . 20 ALA H 1 1 6 2663 1 1 20 ALA HA H -2.874 -2.688 -8.412 1.00 . A A . 20 ALA HA 1 1 6 2664 1 1 20 ALA HB1 H -1.917 -1.819 -10.547 1.00 . A A . 20 ALA HB1 1 1 6 2665 1 1 20 ALA HB2 H -0.460 -2.800 -10.269 1.00 . A A . 20 ALA HB2 1 1 6 2666 1 1 20 ALA HB3 H -2.036 -3.578 -10.521 1.00 . A A . 20 ALA HB3 1 1 6 2667 1 1 20 ALA N N -1.282 -1.387 -8.046 1.00 . A A . 20 ALA N 1 1 6 2668 1 1 20 ALA O O -0.606 -3.850 -6.771 1.00 . A A . 20 ALA O 1 1 6 2669 1 1 21 SER C C 0.067 -6.866 -7.365 1.00 . A A . 21 SER C 1 1 6 2670 1 1 21 SER CA C -1.380 -6.411 -7.672 1.00 . A A . 21 SER CA 1 1 6 2671 1 1 21 SER CB C -2.181 -7.507 -8.406 1.00 . A A . 21 SER CB 1 1 6 2672 1 1 21 SER H H -2.017 -5.125 -9.242 1.00 . A A . 21 SER H 1 1 6 2673 1 1 21 SER HA H -1.878 -6.307 -6.703 1.00 . A A . 21 SER HA 1 1 6 2674 1 1 21 SER HB2 H -2.094 -8.440 -7.844 1.00 . A A . 21 SER HB2 1 1 6 2675 1 1 21 SER HB3 H -3.227 -7.209 -8.412 1.00 . A A . 21 SER HB3 1 1 6 2676 1 1 21 SER HG H -0.816 -7.896 -9.733 1.00 . A A . 21 SER HG 1 1 6 2677 1 1 21 SER N N -1.528 -5.122 -8.366 1.00 . A A . 21 SER N 1 1 6 2678 1 1 21 SER O O 0.629 -7.665 -8.114 1.00 . A A . 21 SER O 1 1 6 2679 1 1 21 SER OG O -1.772 -7.729 -9.746 1.00 . A A . 21 SER OG 1 1 6 2680 1 1 22 GLY C C 1.396 -7.468 -4.083 1.00 . A A . 22 GLY C 1 1 6 2681 1 1 22 GLY CA C 1.763 -7.000 -5.513 1.00 . A A . 22 GLY CA 1 1 6 2682 1 1 22 GLY H H 0.109 -5.655 -5.784 1.00 . A A . 22 GLY H 1 1 6 2683 1 1 22 GLY HA2 H 2.177 -7.844 -6.068 1.00 . A A . 22 GLY HA2 1 1 6 2684 1 1 22 GLY HA3 H 2.548 -6.244 -5.435 1.00 . A A . 22 GLY HA3 1 1 6 2685 1 1 22 GLY N N 0.610 -6.414 -6.226 1.00 . A A . 22 GLY N 1 1 6 2686 1 1 22 GLY O O 1.480 -8.646 -3.747 1.00 . A A . 22 GLY O 1 1 6 2687 1 1 23 THR C C 1.466 -6.967 -0.816 1.00 . A A . 23 THR C 1 1 6 2688 1 1 23 THR CA C 0.389 -6.707 -1.895 1.00 . A A . 23 THR CA 1 1 6 2689 1 1 23 THR CB C -0.791 -7.721 -1.875 1.00 . A A . 23 THR CB 1 1 6 2690 1 1 23 THR CG2 C -1.656 -7.582 -0.614 1.00 . A A . 23 THR CG2 1 1 6 2691 1 1 23 THR H H 1.031 -5.577 -3.600 1.00 . A A . 23 THR H 1 1 6 2692 1 1 23 THR HA H -0.043 -5.749 -1.620 1.00 . A A . 23 THR HA 1 1 6 2693 1 1 23 THR HB H -0.394 -8.738 -1.943 1.00 . A A . 23 THR HB 1 1 6 2694 1 1 23 THR HG1 H -2.220 -6.726 -2.773 1.00 . A A . 23 THR HG1 1 1 6 2695 1 1 23 THR HG21 H -2.059 -6.570 -0.554 1.00 . A A . 23 THR HG21 1 1 6 2696 1 1 23 THR HG22 H -2.481 -8.293 -0.657 1.00 . A A . 23 THR HG22 1 1 6 2697 1 1 23 THR HG23 H -1.088 -7.785 0.293 1.00 . A A . 23 THR HG23 1 1 6 2698 1 1 23 THR N N 0.963 -6.517 -3.248 1.00 . A A . 23 THR N 1 1 6 2699 1 1 23 THR O O 1.342 -7.842 0.039 1.00 . A A . 23 THR O 1 1 6 2700 1 1 23 THR OG1 O -1.698 -7.523 -2.950 1.00 . A A . 23 THR OG1 1 1 6 2701 1 1 24 THR C C 3.878 -5.017 0.901 1.00 . A A . 24 THR C 1 1 6 2702 1 1 24 THR CA C 3.759 -6.235 -0.038 1.00 . A A . 24 THR CA 1 1 6 2703 1 1 24 THR CB C 4.984 -6.327 -0.971 1.00 . A A . 24 THR CB 1 1 6 2704 1 1 24 THR CG2 C 5.040 -7.673 -1.703 1.00 . A A . 24 THR CG2 1 1 6 2705 1 1 24 THR H H 2.587 -5.503 -1.611 1.00 . A A . 24 THR H 1 1 6 2706 1 1 24 THR HA H 3.762 -7.140 0.575 1.00 . A A . 24 THR HA 1 1 6 2707 1 1 24 THR HB H 5.912 -6.194 -0.401 1.00 . A A . 24 THR HB 1 1 6 2708 1 1 24 THR HG1 H 5.800 -5.368 -2.399 1.00 . A A . 24 THR HG1 1 1 6 2709 1 1 24 THR HG21 H 5.091 -8.496 -0.990 1.00 . A A . 24 THR HG21 1 1 6 2710 1 1 24 THR HG22 H 4.160 -7.801 -2.333 1.00 . A A . 24 THR HG22 1 1 6 2711 1 1 24 THR HG23 H 5.927 -7.701 -2.338 1.00 . A A . 24 THR HG23 1 1 6 2712 1 1 24 THR N N 2.536 -6.168 -0.855 1.00 . A A . 24 THR N 1 1 6 2713 1 1 24 THR O O 4.228 -3.913 0.489 1.00 . A A . 24 THR O 1 1 6 2714 1 1 24 THR OG1 O 4.923 -5.337 -1.974 1.00 . A A . 24 THR OG1 1 1 6 2715 1 1 25 CYS C C 4.690 -3.423 3.682 1.00 . A A . 25 CYS C 1 1 6 2716 1 1 25 CYS CA C 3.389 -4.104 3.168 1.00 . A A . 25 CYS CA 1 1 6 2717 1 1 25 CYS CB C 2.476 -4.623 4.300 1.00 . A A . 25 CYS CB 1 1 6 2718 1 1 25 CYS H H 3.250 -6.118 2.446 1.00 . A A . 25 CYS H 1 1 6 2719 1 1 25 CYS HA H 2.865 -3.306 2.645 1.00 . A A . 25 CYS HA 1 1 6 2720 1 1 25 CYS HB2 H 1.780 -5.365 3.907 1.00 . A A . 25 CYS HB2 1 1 6 2721 1 1 25 CYS HB3 H 3.075 -5.097 5.076 1.00 . A A . 25 CYS HB3 1 1 6 2722 1 1 25 CYS N N 3.565 -5.197 2.191 1.00 . A A . 25 CYS N 1 1 6 2723 1 1 25 CYS O O 4.803 -3.092 4.864 1.00 . A A . 25 CYS O 1 1 6 2724 1 1 25 CYS SG S 1.416 -3.398 5.111 1.00 . A A . 25 CYS SG 1 1 6 2725 1 1 26 GLN C C 6.514 -0.826 2.465 1.00 . A A . 26 GLN C 1 1 6 2726 1 1 26 GLN CA C 6.799 -2.260 2.996 1.00 . A A . 26 GLN CA 1 1 6 2727 1 1 26 GLN CB C 8.035 -2.965 2.395 1.00 . A A . 26 GLN CB 1 1 6 2728 1 1 26 GLN CD C 9.889 -1.782 3.819 1.00 . A A . 26 GLN CD 1 1 6 2729 1 1 26 GLN CG C 9.376 -2.189 2.433 1.00 . A A . 26 GLN CG 1 1 6 2730 1 1 26 GLN H H 5.405 -3.359 1.823 1.00 . A A . 26 GLN H 1 1 6 2731 1 1 26 GLN HA H 6.972 -2.152 4.068 1.00 . A A . 26 GLN HA 1 1 6 2732 1 1 26 GLN HB2 H 8.170 -3.913 2.922 1.00 . A A . 26 GLN HB2 1 1 6 2733 1 1 26 GLN HB3 H 7.826 -3.213 1.352 1.00 . A A . 26 GLN HB3 1 1 6 2734 1 1 26 GLN HE21 H 8.847 -3.204 4.811 1.00 . A A . 26 GLN HE21 1 1 6 2735 1 1 26 GLN HE22 H 9.924 -2.148 5.746 1.00 . A A . 26 GLN HE22 1 1 6 2736 1 1 26 GLN HG2 H 10.148 -2.816 1.979 1.00 . A A . 26 GLN HG2 1 1 6 2737 1 1 26 GLN HG3 H 9.306 -1.292 1.814 1.00 . A A . 26 GLN HG3 1 1 6 2738 1 1 26 GLN N N 5.642 -3.144 2.785 1.00 . A A . 26 GLN N 1 1 6 2739 1 1 26 GLN NE2 N 9.490 -2.438 4.887 1.00 . A A . 26 GLN NE2 1 1 6 2740 1 1 26 GLN O O 5.527 -0.582 1.772 1.00 . A A . 26 GLN O 1 1 6 2741 1 1 26 GLN OE1 O 10.653 -0.845 3.968 1.00 . A A . 26 GLN OE1 1 1 6 2742 1 1 27 VAL C C 7.823 2.624 2.346 1.00 . A A . 27 VAL C 1 1 6 2743 1 1 27 VAL CA C 6.869 1.574 2.970 1.00 . A A . 27 VAL CA 1 1 6 2744 1 1 27 VAL CB C 6.571 1.878 4.455 1.00 . A A . 27 VAL CB 1 1 6 2745 1 1 27 VAL CG1 C 7.776 1.661 5.394 1.00 . A A . 27 VAL CG1 1 1 6 2746 1 1 27 VAL CG2 C 6.068 3.318 4.631 1.00 . A A . 27 VAL CG2 1 1 6 2747 1 1 27 VAL H H 8.149 -0.073 3.373 1.00 . A A . 27 VAL H 1 1 6 2748 1 1 27 VAL HA H 5.922 1.688 2.438 1.00 . A A . 27 VAL HA 1 1 6 2749 1 1 27 VAL HB H 5.765 1.214 4.778 1.00 . A A . 27 VAL HB 1 1 6 2750 1 1 27 VAL HG11 H 8.118 0.629 5.354 1.00 . A A . 27 VAL HG11 1 1 6 2751 1 1 27 VAL HG12 H 8.598 2.321 5.119 1.00 . A A . 27 VAL HG12 1 1 6 2752 1 1 27 VAL HG13 H 7.484 1.880 6.420 1.00 . A A . 27 VAL HG13 1 1 6 2753 1 1 27 VAL HG21 H 5.280 3.542 3.911 1.00 . A A . 27 VAL HG21 1 1 6 2754 1 1 27 VAL HG22 H 5.674 3.438 5.641 1.00 . A A . 27 VAL HG22 1 1 6 2755 1 1 27 VAL HG23 H 6.894 4.015 4.489 1.00 . A A . 27 VAL HG23 1 1 6 2756 1 1 27 VAL N N 7.308 0.171 2.875 1.00 . A A . 27 VAL N 1 1 6 2757 1 1 27 VAL O O 9.038 2.538 2.482 1.00 . A A . 27 VAL O 1 1 6 2758 1 1 28 LEU C C 8.215 5.790 2.603 1.00 . A A . 28 LEU C 1 1 6 2759 1 1 28 LEU CA C 7.919 4.923 1.352 1.00 . A A . 28 LEU CA 1 1 6 2760 1 1 28 LEU CB C 7.024 5.685 0.344 1.00 . A A . 28 LEU CB 1 1 6 2761 1 1 28 LEU CD1 C 6.978 3.737 -1.319 1.00 . A A . 28 LEU CD1 1 1 6 2762 1 1 28 LEU CD2 C 6.144 5.993 -1.990 1.00 . A A . 28 LEU CD2 1 1 6 2763 1 1 28 LEU CG C 7.168 5.243 -1.123 1.00 . A A . 28 LEU CG 1 1 6 2764 1 1 28 LEU H H 6.245 3.620 1.617 1.00 . A A . 28 LEU H 1 1 6 2765 1 1 28 LEU HA H 8.876 4.702 0.868 1.00 . A A . 28 LEU HA 1 1 6 2766 1 1 28 LEU HB2 H 5.976 5.607 0.644 1.00 . A A . 28 LEU HB2 1 1 6 2767 1 1 28 LEU HB3 H 7.287 6.746 0.366 1.00 . A A . 28 LEU HB3 1 1 6 2768 1 1 28 LEU HD11 H 5.993 3.427 -0.972 1.00 . A A . 28 LEU HD11 1 1 6 2769 1 1 28 LEU HD12 H 7.078 3.507 -2.379 1.00 . A A . 28 LEU HD12 1 1 6 2770 1 1 28 LEU HD13 H 7.745 3.177 -0.787 1.00 . A A . 28 LEU HD13 1 1 6 2771 1 1 28 LEU HD21 H 6.307 7.068 -1.922 1.00 . A A . 28 LEU HD21 1 1 6 2772 1 1 28 LEU HD22 H 6.243 5.692 -3.034 1.00 . A A . 28 LEU HD22 1 1 6 2773 1 1 28 LEU HD23 H 5.129 5.768 -1.661 1.00 . A A . 28 LEU HD23 1 1 6 2774 1 1 28 LEU HG H 8.170 5.502 -1.466 1.00 . A A . 28 LEU HG 1 1 6 2775 1 1 28 LEU N N 7.244 3.667 1.731 1.00 . A A . 28 LEU N 1 1 6 2776 1 1 28 LEU O O 9.339 5.849 3.092 1.00 . A A . 28 LEU O 1 1 6 2777 1 1 29 ASN C C 6.230 6.465 5.437 1.00 . A A . 29 ASN C 1 1 6 2778 1 1 29 ASN CA C 7.172 7.173 4.415 1.00 . A A . 29 ASN CA 1 1 6 2779 1 1 29 ASN CB C 6.753 8.635 4.159 1.00 . A A . 29 ASN CB 1 1 6 2780 1 1 29 ASN CG C 5.344 8.760 3.579 1.00 . A A . 29 ASN CG 1 1 6 2781 1 1 29 ASN H H 6.307 6.421 2.633 1.00 . A A . 29 ASN H 1 1 6 2782 1 1 29 ASN HA H 8.188 7.212 4.808 1.00 . A A . 29 ASN HA 1 1 6 2783 1 1 29 ASN HB2 H 6.827 9.193 5.095 1.00 . A A . 29 ASN HB2 1 1 6 2784 1 1 29 ASN HB3 H 7.446 9.086 3.448 1.00 . A A . 29 ASN HB3 1 1 6 2785 1 1 29 ASN HD21 H 4.721 10.068 5.014 1.00 . A A . 29 ASN HD21 1 1 6 2786 1 1 29 ASN HD22 H 3.560 9.555 3.789 1.00 . A A . 29 ASN HD22 1 1 6 2787 1 1 29 ASN N N 7.185 6.460 3.133 1.00 . A A . 29 ASN N 1 1 6 2788 1 1 29 ASN ND2 N 4.477 9.534 4.201 1.00 . A A . 29 ASN ND2 1 1 6 2789 1 1 29 ASN O O 5.103 6.131 5.065 1.00 . A A . 29 ASN O 1 1 6 2790 1 1 29 ASN OD1 O 5.009 8.155 2.573 1.00 . A A . 29 ASN OD1 1 1 6 2791 1 1 30 PRO C C 4.335 5.708 7.752 1.00 . A A . 30 PRO C 1 1 6 2792 1 1 30 PRO CA C 5.874 5.555 7.754 1.00 . A A . 30 PRO CA 1 1 6 2793 1 1 30 PRO CB C 6.500 6.025 9.070 1.00 . A A . 30 PRO CB 1 1 6 2794 1 1 30 PRO CD C 7.932 6.676 7.255 1.00 . A A . 30 PRO CD 1 1 6 2795 1 1 30 PRO CG C 7.976 6.150 8.692 1.00 . A A . 30 PRO CG 1 1 6 2796 1 1 30 PRO HA H 6.090 4.490 7.653 1.00 . A A . 30 PRO HA 1 1 6 2797 1 1 30 PRO HB2 H 6.109 7.007 9.354 1.00 . A A . 30 PRO HB2 1 1 6 2798 1 1 30 PRO HB3 H 6.340 5.314 9.882 1.00 . A A . 30 PRO HB3 1 1 6 2799 1 1 30 PRO HD2 H 7.991 7.766 7.263 1.00 . A A . 30 PRO HD2 1 1 6 2800 1 1 30 PRO HD3 H 8.775 6.257 6.699 1.00 . A A . 30 PRO HD3 1 1 6 2801 1 1 30 PRO HG2 H 8.524 6.815 9.364 1.00 . A A . 30 PRO HG2 1 1 6 2802 1 1 30 PRO HG3 H 8.434 5.156 8.709 1.00 . A A . 30 PRO HG3 1 1 6 2803 1 1 30 PRO N N 6.644 6.257 6.710 1.00 . A A . 30 PRO N 1 1 6 2804 1 1 30 PRO O O 3.620 4.754 8.047 1.00 . A A . 30 PRO O 1 1 6 2805 1 1 31 TYR C C 1.579 6.761 6.150 1.00 . A A . 31 TYR C 1 1 6 2806 1 1 31 TYR CA C 2.380 7.214 7.406 1.00 . A A . 31 TYR CA 1 1 6 2807 1 1 31 TYR CB C 2.195 8.696 7.790 1.00 . A A . 31 TYR CB 1 1 6 2808 1 1 31 TYR CD1 C 1.502 8.750 10.232 1.00 . A A . 31 TYR CD1 1 1 6 2809 1 1 31 TYR CD2 C 3.814 9.302 9.672 1.00 . A A . 31 TYR CD2 1 1 6 2810 1 1 31 TYR CE1 C 1.807 8.866 11.605 1.00 . A A . 31 TYR CE1 1 1 6 2811 1 1 31 TYR CE2 C 4.113 9.427 11.047 1.00 . A A . 31 TYR CE2 1 1 6 2812 1 1 31 TYR CG C 2.502 8.974 9.257 1.00 . A A . 31 TYR CG 1 1 6 2813 1 1 31 TYR CZ C 3.108 9.209 12.008 1.00 . A A . 31 TYR CZ 1 1 6 2814 1 1 31 TYR H H 4.463 7.627 7.173 1.00 . A A . 31 TYR H 1 1 6 2815 1 1 31 TYR HA H 1.911 6.638 8.203 1.00 . A A . 31 TYR HA 1 1 6 2816 1 1 31 TYR HB2 H 2.813 9.326 7.146 1.00 . A A . 31 TYR HB2 1 1 6 2817 1 1 31 TYR HB3 H 1.157 8.985 7.613 1.00 . A A . 31 TYR HB3 1 1 6 2818 1 1 31 TYR HD1 H 0.501 8.480 9.930 1.00 . A A . 31 TYR HD1 1 1 6 2819 1 1 31 TYR HD2 H 4.594 9.447 8.937 1.00 . A A . 31 TYR HD2 1 1 6 2820 1 1 31 TYR HE1 H 1.047 8.684 12.349 1.00 . A A . 31 TYR HE1 1 1 6 2821 1 1 31 TYR HE2 H 5.114 9.680 11.362 1.00 . A A . 31 TYR HE2 1 1 6 2822 1 1 31 TYR HH H 4.302 9.596 13.466 1.00 . A A . 31 TYR HH 1 1 6 2823 1 1 31 TYR N N 3.820 6.901 7.428 1.00 . A A . 31 TYR N 1 1 6 2824 1 1 31 TYR O O 0.460 7.219 5.932 1.00 . A A . 31 TYR O 1 1 6 2825 1 1 31 TYR OH O 3.392 9.332 13.330 1.00 . A A . 31 TYR OH 1 1 6 2826 1 1 32 TYR C C 2.085 3.369 4.653 1.00 . A A . 32 TYR C 1 1 6 2827 1 1 32 TYR CA C 1.276 4.684 4.820 1.00 . A A . 32 TYR CA 1 1 6 2828 1 1 32 TYR CB C 0.411 5.122 3.605 1.00 . A A . 32 TYR CB 1 1 6 2829 1 1 32 TYR CD1 C 1.757 4.484 1.531 1.00 . A A . 32 TYR CD1 1 1 6 2830 1 1 32 TYR CD2 C 0.466 6.541 1.509 1.00 . A A . 32 TYR CD2 1 1 6 2831 1 1 32 TYR CE1 C 1.651 4.403 0.129 1.00 . A A . 32 TYR CE1 1 1 6 2832 1 1 32 TYR CE2 C 0.513 6.540 0.093 1.00 . A A . 32 TYR CE2 1 1 6 2833 1 1 32 TYR CG C 1.033 5.467 2.247 1.00 . A A . 32 TYR CG 1 1 6 2834 1 1 32 TYR CZ C 0.997 5.412 -0.592 1.00 . A A . 32 TYR CZ 1 1 6 2835 1 1 32 TYR H H 3.068 5.577 5.541 1.00 . A A . 32 TYR H 1 1 6 2836 1 1 32 TYR HA H 0.552 4.426 5.599 1.00 . A A . 32 TYR HA 1 1 6 2837 1 1 32 TYR HB2 H -0.311 4.326 3.414 1.00 . A A . 32 TYR HB2 1 1 6 2838 1 1 32 TYR HB3 H -0.177 5.979 3.926 1.00 . A A . 32 TYR HB3 1 1 6 2839 1 1 32 TYR HD1 H 2.400 3.780 2.027 1.00 . A A . 32 TYR HD1 1 1 6 2840 1 1 32 TYR HD2 H -0.060 7.332 2.025 1.00 . A A . 32 TYR HD2 1 1 6 2841 1 1 32 TYR HE1 H 2.037 3.550 -0.395 1.00 . A A . 32 TYR HE1 1 1 6 2842 1 1 32 TYR HE2 H 0.141 7.383 -0.465 1.00 . A A . 32 TYR HE2 1 1 6 2843 1 1 32 TYR HH H -0.068 5.515 -2.213 1.00 . A A . 32 TYR HH 1 1 6 2844 1 1 32 TYR N N 2.087 5.785 5.381 1.00 . A A . 32 TYR N 1 1 6 2845 1 1 32 TYR O O 3.130 3.200 5.270 1.00 . A A . 32 TYR O 1 1 6 2846 1 1 32 TYR OH O 0.823 5.270 -1.934 1.00 . A A . 32 TYR OH 1 1 6 2847 1 1 33 SER C C 1.990 0.800 1.935 1.00 . A A . 33 SER C 1 1 6 2848 1 1 33 SER CA C 2.446 1.290 3.336 1.00 . A A . 33 SER CA 1 1 6 2849 1 1 33 SER CB C 2.508 0.181 4.391 1.00 . A A . 33 SER CB 1 1 6 2850 1 1 33 SER H H 0.738 2.570 3.381 1.00 . A A . 33 SER H 1 1 6 2851 1 1 33 SER HA H 3.465 1.657 3.199 1.00 . A A . 33 SER HA 1 1 6 2852 1 1 33 SER HB2 H 2.985 0.576 5.292 1.00 . A A . 33 SER HB2 1 1 6 2853 1 1 33 SER HB3 H 1.502 -0.146 4.656 1.00 . A A . 33 SER HB3 1 1 6 2854 1 1 33 SER HG H 3.582 -1.461 4.600 1.00 . A A . 33 SER HG 1 1 6 2855 1 1 33 SER N N 1.619 2.410 3.844 1.00 . A A . 33 SER N 1 1 6 2856 1 1 33 SER O O 0.816 0.977 1.598 1.00 . A A . 33 SER O 1 1 6 2857 1 1 33 SER OG O 3.280 -0.886 3.883 1.00 . A A . 33 SER OG 1 1 6 2858 1 1 34 GLN C C 2.836 -1.009 -1.149 1.00 . A A . 34 GLN C 1 1 6 2859 1 1 34 GLN CA C 2.783 0.360 -0.395 1.00 . A A . 34 GLN CA 1 1 6 2860 1 1 34 GLN CB C 3.763 1.413 -0.968 1.00 . A A . 34 GLN CB 1 1 6 2861 1 1 34 GLN CD C 4.477 2.326 -3.279 1.00 . A A . 34 GLN CD 1 1 6 2862 1 1 34 GLN CG C 3.332 1.864 -2.390 1.00 . A A . 34 GLN CG 1 1 6 2863 1 1 34 GLN H H 3.810 0.061 1.475 1.00 . A A . 34 GLN H 1 1 6 2864 1 1 34 GLN HA H 1.791 0.747 -0.640 1.00 . A A . 34 GLN HA 1 1 6 2865 1 1 34 GLN HB2 H 3.802 2.289 -0.322 1.00 . A A . 34 GLN HB2 1 1 6 2866 1 1 34 GLN HB3 H 4.775 1.004 -0.962 1.00 . A A . 34 GLN HB3 1 1 6 2867 1 1 34 GLN HE21 H 3.410 3.860 -4.083 1.00 . A A . 34 GLN HE21 1 1 6 2868 1 1 34 GLN HE22 H 5.064 3.601 -4.657 1.00 . A A . 34 GLN HE22 1 1 6 2869 1 1 34 GLN HG2 H 2.859 1.048 -2.926 1.00 . A A . 34 GLN HG2 1 1 6 2870 1 1 34 GLN HG3 H 2.590 2.656 -2.321 1.00 . A A . 34 GLN HG3 1 1 6 2871 1 1 34 GLN N N 2.912 0.323 1.080 1.00 . A A . 34 GLN N 1 1 6 2872 1 1 34 GLN NE2 N 4.283 3.364 -4.069 1.00 . A A . 34 GLN NE2 1 1 6 2873 1 1 34 GLN O O 1.843 -1.729 -1.147 1.00 . A A . 34 GLN O 1 1 6 2874 1 1 34 GLN OE1 O 5.545 1.743 -3.293 1.00 . A A . 34 GLN OE1 1 1 6 2875 1 1 35 CYS C C 5.225 -2.305 -3.811 1.00 . A A . 35 CYS C 1 1 6 2876 1 1 35 CYS CA C 3.832 -2.134 -3.149 1.00 . A A . 35 CYS CA 1 1 6 2877 1 1 35 CYS CB C 2.839 -1.480 -4.130 1.00 . A A . 35 CYS CB 1 1 6 2878 1 1 35 CYS H H 4.701 -0.688 -1.852 1.00 . A A . 35 CYS H 1 1 6 2879 1 1 35 CYS HA H 3.461 -3.125 -2.872 1.00 . A A . 35 CYS HA 1 1 6 2880 1 1 35 CYS HB2 H 1.907 -1.267 -3.613 1.00 . A A . 35 CYS HB2 1 1 6 2881 1 1 35 CYS HB3 H 3.257 -0.535 -4.467 1.00 . A A . 35 CYS HB3 1 1 6 2882 1 1 35 CYS N N 3.884 -1.272 -1.949 1.00 . A A . 35 CYS N 1 1 6 2883 1 1 35 CYS O O 5.497 -1.688 -4.843 1.00 . A A . 35 CYS O 1 1 6 2884 1 1 35 CYS SG S 2.332 -2.371 -5.614 1.00 . A A . 35 CYS SG 1 1 6 2885 1 1 36 LEU C C 8.031 -4.717 -3.399 1.00 . A A . 36 LEU C 1 1 6 2886 1 1 36 LEU CA C 7.526 -3.258 -3.571 1.00 . A A . 36 LEU CA 1 1 6 2887 1 1 36 LEU CB C 8.446 -2.254 -2.820 1.00 . A A . 36 LEU CB 1 1 6 2888 1 1 36 LEU CD1 C 7.124 -1.310 -0.863 1.00 . A A . 36 LEU CD1 1 1 6 2889 1 1 36 LEU CD2 C 8.803 0.122 -1.989 1.00 . A A . 36 LEU CD2 1 1 6 2890 1 1 36 LEU CG C 7.776 -0.996 -2.219 1.00 . A A . 36 LEU CG 1 1 6 2891 1 1 36 LEU H H 5.786 -3.620 -2.394 1.00 . A A . 36 LEU H 1 1 6 2892 1 1 36 LEU HA H 7.616 -3.046 -4.638 1.00 . A A . 36 LEU HA 1 1 6 2893 1 1 36 LEU HB2 H 8.966 -2.770 -2.011 1.00 . A A . 36 LEU HB2 1 1 6 2894 1 1 36 LEU HB3 H 9.210 -1.932 -3.530 1.00 . A A . 36 LEU HB3 1 1 6 2895 1 1 36 LEU HD11 H 6.460 -2.173 -0.905 1.00 . A A . 36 LEU HD11 1 1 6 2896 1 1 36 LEU HD12 H 7.903 -1.517 -0.135 1.00 . A A . 36 LEU HD12 1 1 6 2897 1 1 36 LEU HD13 H 6.552 -0.447 -0.533 1.00 . A A . 36 LEU HD13 1 1 6 2898 1 1 36 LEU HD21 H 9.622 -0.234 -1.361 1.00 . A A . 36 LEU HD21 1 1 6 2899 1 1 36 LEU HD22 H 9.208 0.460 -2.944 1.00 . A A . 36 LEU HD22 1 1 6 2900 1 1 36 LEU HD23 H 8.321 0.968 -1.499 1.00 . A A . 36 LEU HD23 1 1 6 2901 1 1 36 LEU HG H 7.028 -0.603 -2.910 1.00 . A A . 36 LEU HG 1 1 6 2902 1 1 36 LEU N N 6.110 -3.087 -3.193 1.00 . A A . 36 LEU N 1 1 6 2903 1 1 36 LEU O O 8.930 -5.118 -4.166 1.00 . A A . 36 LEU O 1 1 6 2904 1 1 36 LEU OXT O 7.510 -5.413 -2.493 1.00 . A A . 36 LEU OXT 1 1 7 2905 1 1 1 THR C C -6.615 -7.853 -8.997 1.00 . A A . 1 THR C 1 1 7 2906 1 1 1 THR CA C -5.656 -7.205 -10.025 1.00 . A A . 1 THR CA 1 1 7 2907 1 1 1 THR CB C -4.768 -6.118 -9.376 1.00 . A A . 1 THR CB 1 1 7 2908 1 1 1 THR CG2 C -5.543 -4.966 -8.729 1.00 . A A . 1 THR CG2 1 1 7 2909 1 1 1 THR H1 H -6.869 -7.513 -11.644 1.00 . A A . 1 THR H1 1 1 7 2910 1 1 1 THR H2 H -6.961 -5.981 -11.081 1.00 . A A . 1 THR H2 1 1 7 2911 1 1 1 THR H3 H -5.648 -6.457 -11.982 1.00 . A A . 1 THR H3 1 1 7 2912 1 1 1 THR HA H -4.979 -8.011 -10.319 1.00 . A A . 1 THR HA 1 1 7 2913 1 1 1 THR HB H -4.094 -5.699 -10.128 1.00 . A A . 1 THR HB 1 1 7 2914 1 1 1 THR HG1 H -3.315 -6.079 -8.084 1.00 . A A . 1 THR HG1 1 1 7 2915 1 1 1 THR HG21 H -6.177 -4.484 -9.470 1.00 . A A . 1 THR HG21 1 1 7 2916 1 1 1 THR HG22 H -6.152 -5.311 -7.889 1.00 . A A . 1 THR HG22 1 1 7 2917 1 1 1 THR HG23 H -4.835 -4.225 -8.349 1.00 . A A . 1 THR HG23 1 1 7 2918 1 1 1 THR N N -6.323 -6.740 -11.282 1.00 . A A . 1 THR N 1 1 7 2919 1 1 1 THR O O -7.820 -7.901 -9.244 1.00 . A A . 1 THR O 1 1 7 2920 1 1 1 THR OG1 O -3.973 -6.725 -8.391 1.00 . A A . 1 THR OG1 1 1 7 2921 1 1 2 GLN C C -6.324 -8.974 -5.522 1.00 . A A . 2 GLN C 1 1 7 2922 1 1 2 GLN CA C -6.742 -9.325 -6.972 1.00 . A A . 2 GLN CA 1 1 7 2923 1 1 2 GLN CB C -6.339 -10.778 -7.337 1.00 . A A . 2 GLN CB 1 1 7 2924 1 1 2 GLN CD C -7.097 -11.121 -9.824 1.00 . A A . 2 GLN CD 1 1 7 2925 1 1 2 GLN CG C -7.274 -11.484 -8.347 1.00 . A A . 2 GLN CG 1 1 7 2926 1 1 2 GLN H H -5.112 -8.184 -7.713 1.00 . A A . 2 GLN H 1 1 7 2927 1 1 2 GLN HA H -7.829 -9.230 -7.041 1.00 . A A . 2 GLN HA 1 1 7 2928 1 1 2 GLN HB2 H -5.306 -10.814 -7.695 1.00 . A A . 2 GLN HB2 1 1 7 2929 1 1 2 GLN HB3 H -6.375 -11.384 -6.424 1.00 . A A . 2 GLN HB3 1 1 7 2930 1 1 2 GLN HE21 H -8.607 -12.349 -10.383 1.00 . A A . 2 GLN HE21 1 1 7 2931 1 1 2 GLN HE22 H -7.780 -11.455 -11.654 1.00 . A A . 2 GLN HE22 1 1 7 2932 1 1 2 GLN HG2 H -7.100 -12.559 -8.269 1.00 . A A . 2 GLN HG2 1 1 7 2933 1 1 2 GLN HG3 H -8.310 -11.294 -8.072 1.00 . A A . 2 GLN HG3 1 1 7 2934 1 1 2 GLN N N -6.085 -8.407 -7.908 1.00 . A A . 2 GLN N 1 1 7 2935 1 1 2 GLN NE2 N -7.916 -11.686 -10.687 1.00 . A A . 2 GLN NE2 1 1 7 2936 1 1 2 GLN O O -5.129 -8.927 -5.240 1.00 . A A . 2 GLN O 1 1 7 2937 1 1 2 GLN OE1 O -6.248 -10.339 -10.230 1.00 . A A . 2 GLN OE1 1 1 7 2938 1 1 3 SER C C -6.739 -6.544 -3.395 1.00 . A A . 3 SER C 1 1 7 2939 1 1 3 SER CA C -7.078 -8.059 -3.308 1.00 . A A . 3 SER CA 1 1 7 2940 1 1 3 SER CB C -6.063 -8.846 -2.441 1.00 . A A . 3 SER CB 1 1 7 2941 1 1 3 SER H H -8.238 -8.779 -4.954 1.00 . A A . 3 SER H 1 1 7 2942 1 1 3 SER HA H -8.039 -8.119 -2.792 1.00 . A A . 3 SER HA 1 1 7 2943 1 1 3 SER HB2 H -6.285 -8.689 -1.382 1.00 . A A . 3 SER HB2 1 1 7 2944 1 1 3 SER HB3 H -6.151 -9.918 -2.640 1.00 . A A . 3 SER HB3 1 1 7 2945 1 1 3 SER HG H -4.503 -8.501 -3.590 1.00 . A A . 3 SER HG 1 1 7 2946 1 1 3 SER N N -7.288 -8.706 -4.626 1.00 . A A . 3 SER N 1 1 7 2947 1 1 3 SER O O -6.582 -6.004 -4.493 1.00 . A A . 3 SER O 1 1 7 2948 1 1 3 SER OG O -4.722 -8.422 -2.650 1.00 . A A . 3 SER OG 1 1 7 2949 1 1 4 HIS C C -4.511 -4.520 -2.430 1.00 . A A . 4 HIS C 1 1 7 2950 1 1 4 HIS CA C -6.045 -4.484 -2.212 1.00 . A A . 4 HIS CA 1 1 7 2951 1 1 4 HIS CB C -6.476 -3.761 -0.921 1.00 . A A . 4 HIS CB 1 1 7 2952 1 1 4 HIS CD2 C -6.324 -1.375 0.123 1.00 . A A . 4 HIS CD2 1 1 7 2953 1 1 4 HIS CE1 C -5.278 -0.400 -1.519 1.00 . A A . 4 HIS CE1 1 1 7 2954 1 1 4 HIS CG C -6.126 -2.290 -0.877 1.00 . A A . 4 HIS CG 1 1 7 2955 1 1 4 HIS H H -6.737 -6.333 -1.382 1.00 . A A . 4 HIS H 1 1 7 2956 1 1 4 HIS HA H -6.471 -3.907 -3.037 1.00 . A A . 4 HIS HA 1 1 7 2957 1 1 4 HIS HB2 H -7.557 -3.837 -0.812 1.00 . A A . 4 HIS HB2 1 1 7 2958 1 1 4 HIS HB3 H -6.010 -4.247 -0.061 1.00 . A A . 4 HIS HB3 1 1 7 2959 1 1 4 HIS HD2 H -6.769 -1.573 1.087 1.00 . A A . 4 HIS HD2 1 1 7 2960 1 1 4 HIS HE1 H -4.779 0.355 -2.099 1.00 . A A . 4 HIS HE1 1 1 7 2961 1 1 4 HIS HE2 H -5.708 0.693 0.225 1.00 . A A . 4 HIS HE2 1 1 7 2962 1 1 4 HIS N N -6.617 -5.845 -2.255 1.00 . A A . 4 HIS N 1 1 7 2963 1 1 4 HIS ND1 N -5.511 -1.643 -1.950 1.00 . A A . 4 HIS ND1 1 1 7 2964 1 1 4 HIS NE2 N -5.769 -0.178 -0.293 1.00 . A A . 4 HIS NE2 1 1 7 2965 1 1 4 HIS O O -3.707 -4.257 -1.536 1.00 . A A . 4 HIS O 1 1 7 2966 1 1 5 ALA C C -1.946 -3.773 -4.148 1.00 . A A . 5 ALA C 1 1 7 2967 1 1 5 ALA CA C -2.734 -5.102 -4.069 1.00 . A A . 5 ALA CA 1 1 7 2968 1 1 5 ALA CB C -2.747 -5.841 -5.415 1.00 . A A . 5 ALA CB 1 1 7 2969 1 1 5 ALA H H -4.854 -5.144 -4.295 1.00 . A A . 5 ALA H 1 1 7 2970 1 1 5 ALA HA H -2.254 -5.765 -3.351 1.00 . A A . 5 ALA HA 1 1 7 2971 1 1 5 ALA HB1 H -3.288 -6.786 -5.329 1.00 . A A . 5 ALA HB1 1 1 7 2972 1 1 5 ALA HB2 H -3.236 -5.220 -6.167 1.00 . A A . 5 ALA HB2 1 1 7 2973 1 1 5 ALA HB3 H -1.725 -6.053 -5.734 1.00 . A A . 5 ALA HB3 1 1 7 2974 1 1 5 ALA N N -4.117 -4.910 -3.644 1.00 . A A . 5 ALA N 1 1 7 2975 1 1 5 ALA O O -2.077 -3.031 -5.120 1.00 . A A . 5 ALA O 1 1 7 2976 1 1 6 GLY C C -0.204 -1.638 -1.693 1.00 . A A . 6 GLY C 1 1 7 2977 1 1 6 GLY CA C -0.220 -2.321 -3.071 1.00 . A A . 6 GLY CA 1 1 7 2978 1 1 6 GLY H H -1.148 -4.093 -2.333 1.00 . A A . 6 GLY H 1 1 7 2979 1 1 6 GLY HA2 H 0.793 -2.673 -3.274 1.00 . A A . 6 GLY HA2 1 1 7 2980 1 1 6 GLY HA3 H -0.483 -1.579 -3.828 1.00 . A A . 6 GLY HA3 1 1 7 2981 1 1 6 GLY N N -1.127 -3.478 -3.134 1.00 . A A . 6 GLY N 1 1 7 2982 1 1 6 GLY O O 0.118 -2.263 -0.688 1.00 . A A . 6 GLY O 1 1 7 2983 1 1 7 GLN C C -2.037 -0.139 0.434 1.00 . A A . 7 GLN C 1 1 7 2984 1 1 7 GLN CA C -0.789 0.364 -0.344 1.00 . A A . 7 GLN CA 1 1 7 2985 1 1 7 GLN CB C -0.744 1.873 -0.657 1.00 . A A . 7 GLN CB 1 1 7 2986 1 1 7 GLN CD C -0.744 4.285 0.179 1.00 . A A . 7 GLN CD 1 1 7 2987 1 1 7 GLN CG C -0.996 2.822 0.535 1.00 . A A . 7 GLN CG 1 1 7 2988 1 1 7 GLN H H -0.927 0.089 -2.457 1.00 . A A . 7 GLN H 1 1 7 2989 1 1 7 GLN HA H 0.071 0.167 0.304 1.00 . A A . 7 GLN HA 1 1 7 2990 1 1 7 GLN HB2 H 0.251 2.086 -1.057 1.00 . A A . 7 GLN HB2 1 1 7 2991 1 1 7 GLN HB3 H -1.460 2.099 -1.442 1.00 . A A . 7 GLN HB3 1 1 7 2992 1 1 7 GLN HE21 H -0.795 4.907 2.111 1.00 . A A . 7 GLN HE21 1 1 7 2993 1 1 7 GLN HE22 H -0.539 6.121 0.858 1.00 . A A . 7 GLN HE22 1 1 7 2994 1 1 7 GLN HG2 H -2.028 2.749 0.870 1.00 . A A . 7 GLN HG2 1 1 7 2995 1 1 7 GLN HG3 H -0.366 2.549 1.375 1.00 . A A . 7 GLN HG3 1 1 7 2996 1 1 7 GLN N N -0.609 -0.364 -1.612 1.00 . A A . 7 GLN N 1 1 7 2997 1 1 7 GLN NE2 N -0.705 5.174 1.149 1.00 . A A . 7 GLN NE2 1 1 7 2998 1 1 7 GLN O O -3.039 0.552 0.598 1.00 . A A . 7 GLN O 1 1 7 2999 1 1 7 GLN OE1 O -0.595 4.665 -0.976 1.00 . A A . 7 GLN OE1 1 1 7 3000 1 1 8 CYS C C -3.782 -1.493 2.710 1.00 . A A . 8 CYS C 1 1 7 3001 1 1 8 CYS CA C -2.978 -2.192 1.575 1.00 . A A . 8 CYS CA 1 1 7 3002 1 1 8 CYS CB C -2.300 -3.496 2.046 1.00 . A A . 8 CYS CB 1 1 7 3003 1 1 8 CYS H H -1.086 -1.857 0.666 1.00 . A A . 8 CYS H 1 1 7 3004 1 1 8 CYS HA H -3.699 -2.467 0.802 1.00 . A A . 8 CYS HA 1 1 7 3005 1 1 8 CYS HB2 H -3.074 -4.170 2.415 1.00 . A A . 8 CYS HB2 1 1 7 3006 1 1 8 CYS HB3 H -1.811 -3.983 1.201 1.00 . A A . 8 CYS HB3 1 1 7 3007 1 1 8 CYS N N -1.944 -1.381 0.918 1.00 . A A . 8 CYS N 1 1 7 3008 1 1 8 CYS O O -4.956 -1.789 2.927 1.00 . A A . 8 CYS O 1 1 7 3009 1 1 8 CYS SG S -1.067 -3.351 3.378 1.00 . A A . 8 CYS SG 1 1 7 3010 1 1 9 GLY C C -2.508 0.708 5.467 1.00 . A A . 9 GLY C 1 1 7 3011 1 1 9 GLY CA C -3.657 0.121 4.623 1.00 . A A . 9 GLY CA 1 1 7 3012 1 1 9 GLY H H -2.179 -0.431 3.177 1.00 . A A . 9 GLY H 1 1 7 3013 1 1 9 GLY HA2 H -4.334 0.917 4.308 1.00 . A A . 9 GLY HA2 1 1 7 3014 1 1 9 GLY HA3 H -4.221 -0.569 5.254 1.00 . A A . 9 GLY HA3 1 1 7 3015 1 1 9 GLY N N -3.136 -0.585 3.446 1.00 . A A . 9 GLY N 1 1 7 3016 1 1 9 GLY O O -1.936 0.019 6.309 1.00 . A A . 9 GLY O 1 1 7 3017 1 1 10 GLY C C -1.520 3.097 7.398 1.00 . A A . 10 GLY C 1 1 7 3018 1 1 10 GLY CA C -1.052 2.642 5.996 1.00 . A A . 10 GLY CA 1 1 7 3019 1 1 10 GLY H H -2.712 2.521 4.614 1.00 . A A . 10 GLY H 1 1 7 3020 1 1 10 GLY HA2 H -0.176 1.993 6.073 1.00 . A A . 10 GLY HA2 1 1 7 3021 1 1 10 GLY HA3 H -0.758 3.538 5.446 1.00 . A A . 10 GLY HA3 1 1 7 3022 1 1 10 GLY N N -2.116 1.965 5.222 1.00 . A A . 10 GLY N 1 1 7 3023 1 1 10 GLY O O -2.712 3.336 7.567 1.00 . A A . 10 GLY O 1 1 7 3024 1 1 11 ILE C C -1.731 5.237 9.569 1.00 . A A . 11 ILE C 1 1 7 3025 1 1 11 ILE CA C -0.963 3.883 9.718 1.00 . A A . 11 ILE CA 1 1 7 3026 1 1 11 ILE CB C 0.304 4.054 10.621 1.00 . A A . 11 ILE CB 1 1 7 3027 1 1 11 ILE CD1 C 2.344 2.967 11.762 1.00 . A A . 11 ILE CD1 1 1 7 3028 1 1 11 ILE CG1 C 1.082 2.745 10.908 1.00 . A A . 11 ILE CG1 1 1 7 3029 1 1 11 ILE CG2 C -0.046 4.695 11.986 1.00 . A A . 11 ILE CG2 1 1 7 3030 1 1 11 ILE H H 0.323 2.984 8.235 1.00 . A A . 11 ILE H 1 1 7 3031 1 1 11 ILE HA H -1.629 3.197 10.246 1.00 . A A . 11 ILE HA 1 1 7 3032 1 1 11 ILE HB H 0.987 4.729 10.103 1.00 . A A . 11 ILE HB 1 1 7 3033 1 1 11 ILE HD11 H 2.937 3.780 11.346 1.00 . A A . 11 ILE HD11 1 1 7 3034 1 1 11 ILE HD12 H 2.090 3.203 12.794 1.00 . A A . 11 ILE HD12 1 1 7 3035 1 1 11 ILE HD13 H 2.953 2.063 11.775 1.00 . A A . 11 ILE HD13 1 1 7 3036 1 1 11 ILE HG12 H 0.438 2.037 11.431 1.00 . A A . 11 ILE HG12 1 1 7 3037 1 1 11 ILE HG13 H 1.398 2.294 9.967 1.00 . A A . 11 ILE HG13 1 1 7 3038 1 1 11 ILE HG21 H -0.606 5.621 11.891 1.00 . A A . 11 ILE HG21 1 1 7 3039 1 1 11 ILE HG22 H -0.633 3.997 12.584 1.00 . A A . 11 ILE HG22 1 1 7 3040 1 1 11 ILE HG23 H 0.859 4.955 12.532 1.00 . A A . 11 ILE HG23 1 1 7 3041 1 1 11 ILE N N -0.631 3.274 8.397 1.00 . A A . 11 ILE N 1 1 7 3042 1 1 11 ILE O O -1.138 6.307 9.622 1.00 . A A . 11 ILE O 1 1 7 3043 1 1 12 GLY C C -4.471 6.343 7.608 1.00 . A A . 12 GLY C 1 1 7 3044 1 1 12 GLY CA C -3.898 6.361 9.039 1.00 . A A . 12 GLY CA 1 1 7 3045 1 1 12 GLY H H -3.409 4.281 9.116 1.00 . A A . 12 GLY H 1 1 7 3046 1 1 12 GLY HA2 H -4.735 6.343 9.736 1.00 . A A . 12 GLY HA2 1 1 7 3047 1 1 12 GLY HA3 H -3.372 7.305 9.181 1.00 . A A . 12 GLY HA3 1 1 7 3048 1 1 12 GLY N N -3.050 5.200 9.349 1.00 . A A . 12 GLY N 1 1 7 3049 1 1 12 GLY O O -5.670 6.543 7.416 1.00 . A A . 12 GLY O 1 1 7 3050 1 1 13 TYR C C -4.817 4.568 4.960 1.00 . A A . 13 TYR C 1 1 7 3051 1 1 13 TYR CA C -4.115 5.936 5.191 1.00 . A A . 13 TYR CA 1 1 7 3052 1 1 13 TYR CB C -2.983 6.268 4.188 1.00 . A A . 13 TYR CB 1 1 7 3053 1 1 13 TYR CD1 C -4.549 6.121 2.133 1.00 . A A . 13 TYR CD1 1 1 7 3054 1 1 13 TYR CD2 C -2.625 7.621 2.056 1.00 . A A . 13 TYR CD2 1 1 7 3055 1 1 13 TYR CE1 C -4.886 6.487 0.814 1.00 . A A . 13 TYR CE1 1 1 7 3056 1 1 13 TYR CE2 C -2.961 7.975 0.728 1.00 . A A . 13 TYR CE2 1 1 7 3057 1 1 13 TYR CG C -3.407 6.676 2.768 1.00 . A A . 13 TYR CG 1 1 7 3058 1 1 13 TYR CZ C -4.084 7.397 0.109 1.00 . A A . 13 TYR CZ 1 1 7 3059 1 1 13 TYR H H -2.692 5.846 6.811 1.00 . A A . 13 TYR H 1 1 7 3060 1 1 13 TYR HA H -4.865 6.714 5.016 1.00 . A A . 13 TYR HA 1 1 7 3061 1 1 13 TYR HB2 H -2.432 7.115 4.608 1.00 . A A . 13 TYR HB2 1 1 7 3062 1 1 13 TYR HB3 H -2.281 5.436 4.122 1.00 . A A . 13 TYR HB3 1 1 7 3063 1 1 13 TYR HD1 H -5.198 5.419 2.631 1.00 . A A . 13 TYR HD1 1 1 7 3064 1 1 13 TYR HD2 H -1.761 8.075 2.524 1.00 . A A . 13 TYR HD2 1 1 7 3065 1 1 13 TYR HE1 H -5.758 6.060 0.341 1.00 . A A . 13 TYR HE1 1 1 7 3066 1 1 13 TYR HE2 H -2.362 8.683 0.180 1.00 . A A . 13 TYR HE2 1 1 7 3067 1 1 13 TYR HH H -5.132 7.172 -1.488 1.00 . A A . 13 TYR HH 1 1 7 3068 1 1 13 TYR N N -3.647 6.077 6.585 1.00 . A A . 13 TYR N 1 1 7 3069 1 1 13 TYR O O -4.317 3.679 4.266 1.00 . A A . 13 TYR O 1 1 7 3070 1 1 13 TYR OH O -4.399 7.710 -1.174 1.00 . A A . 13 TYR OH 1 1 7 3071 1 1 14 SER C C -7.952 3.500 4.260 1.00 . A A . 14 SER C 1 1 7 3072 1 1 14 SER CA C -6.948 3.308 5.421 1.00 . A A . 14 SER CA 1 1 7 3073 1 1 14 SER CB C -7.693 3.165 6.765 1.00 . A A . 14 SER CB 1 1 7 3074 1 1 14 SER H H -6.286 5.210 6.135 1.00 . A A . 14 SER H 1 1 7 3075 1 1 14 SER HA H -6.396 2.381 5.246 1.00 . A A . 14 SER HA 1 1 7 3076 1 1 14 SER HB2 H -8.113 4.130 7.059 1.00 . A A . 14 SER HB2 1 1 7 3077 1 1 14 SER HB3 H -8.518 2.453 6.664 1.00 . A A . 14 SER HB3 1 1 7 3078 1 1 14 SER HG H -7.245 2.686 8.626 1.00 . A A . 14 SER HG 1 1 7 3079 1 1 14 SER N N -6.022 4.445 5.525 1.00 . A A . 14 SER N 1 1 7 3080 1 1 14 SER O O -9.092 3.903 4.493 1.00 . A A . 14 SER O 1 1 7 3081 1 1 14 SER OG O -6.805 2.696 7.770 1.00 . A A . 14 SER OG 1 1 7 3082 1 1 15 GLY C C -7.904 3.145 0.444 1.00 . A A . 15 GLY C 1 1 7 3083 1 1 15 GLY CA C -8.445 3.481 1.854 1.00 . A A . 15 GLY CA 1 1 7 3084 1 1 15 GLY H H -6.616 2.897 2.856 1.00 . A A . 15 GLY H 1 1 7 3085 1 1 15 GLY HA2 H -9.359 2.905 2.003 1.00 . A A . 15 GLY HA2 1 1 7 3086 1 1 15 GLY HA3 H -8.700 4.543 1.856 1.00 . A A . 15 GLY HA3 1 1 7 3087 1 1 15 GLY N N -7.556 3.239 3.006 1.00 . A A . 15 GLY N 1 1 7 3088 1 1 15 GLY O O -6.859 2.502 0.304 1.00 . A A . 15 GLY O 1 1 7 3089 1 1 16 PRO C C -6.867 3.964 -2.399 1.00 . A A . 16 PRO C 1 1 7 3090 1 1 16 PRO CA C -8.253 3.394 -2.021 1.00 . A A . 16 PRO CA 1 1 7 3091 1 1 16 PRO CB C -9.374 4.064 -2.832 1.00 . A A . 16 PRO CB 1 1 7 3092 1 1 16 PRO CD C -9.957 4.176 -0.529 1.00 . A A . 16 PRO CD 1 1 7 3093 1 1 16 PRO CG C -10.584 3.956 -1.906 1.00 . A A . 16 PRO CG 1 1 7 3094 1 1 16 PRO HA H -8.282 2.321 -2.229 1.00 . A A . 16 PRO HA 1 1 7 3095 1 1 16 PRO HB2 H -9.151 5.124 -2.992 1.00 . A A . 16 PRO HB2 1 1 7 3096 1 1 16 PRO HB3 H -9.542 3.580 -3.794 1.00 . A A . 16 PRO HB3 1 1 7 3097 1 1 16 PRO HD2 H -9.858 5.245 -0.331 1.00 . A A . 16 PRO HD2 1 1 7 3098 1 1 16 PRO HD3 H -10.591 3.722 0.237 1.00 . A A . 16 PRO HD3 1 1 7 3099 1 1 16 PRO HG2 H -11.362 4.689 -2.136 1.00 . A A . 16 PRO HG2 1 1 7 3100 1 1 16 PRO HG3 H -10.999 2.949 -1.965 1.00 . A A . 16 PRO HG3 1 1 7 3101 1 1 16 PRO N N -8.630 3.572 -0.615 1.00 . A A . 16 PRO N 1 1 7 3102 1 1 16 PRO O O -6.582 5.132 -2.144 1.00 . A A . 16 PRO O 1 1 7 3103 1 1 17 THR C C -3.950 2.083 -3.943 1.00 . A A . 17 THR C 1 1 7 3104 1 1 17 THR CA C -4.656 3.396 -3.520 1.00 . A A . 17 THR CA 1 1 7 3105 1 1 17 THR CB C -3.817 4.251 -2.543 1.00 . A A . 17 THR CB 1 1 7 3106 1 1 17 THR CG2 C -3.849 3.750 -1.095 1.00 . A A . 17 THR CG2 1 1 7 3107 1 1 17 THR H H -6.374 2.186 -3.144 1.00 . A A . 17 THR H 1 1 7 3108 1 1 17 THR HA H -4.738 3.989 -4.433 1.00 . A A . 17 THR HA 1 1 7 3109 1 1 17 THR HB H -4.198 5.275 -2.552 1.00 . A A . 17 THR HB 1 1 7 3110 1 1 17 THR HG1 H -1.898 4.533 -2.284 1.00 . A A . 17 THR HG1 1 1 7 3111 1 1 17 THR HG21 H -3.507 2.721 -1.028 1.00 . A A . 17 THR HG21 1 1 7 3112 1 1 17 THR HG22 H -3.237 4.398 -0.478 1.00 . A A . 17 THR HG22 1 1 7 3113 1 1 17 THR HG23 H -4.854 3.791 -0.689 1.00 . A A . 17 THR HG23 1 1 7 3114 1 1 17 THR N N -6.030 3.126 -3.024 1.00 . A A . 17 THR N 1 1 7 3115 1 1 17 THR O O -3.008 1.592 -3.324 1.00 . A A . 17 THR O 1 1 7 3116 1 1 17 THR OG1 O -2.488 4.331 -3.018 1.00 . A A . 17 THR OG1 1 1 7 3117 1 1 18 VAL C C -3.286 0.110 -6.754 1.00 . A A . 18 VAL C 1 1 7 3118 1 1 18 VAL CA C -4.138 0.092 -5.457 1.00 . A A . 18 VAL CA 1 1 7 3119 1 1 18 VAL CB C -5.440 -0.733 -5.600 1.00 . A A . 18 VAL CB 1 1 7 3120 1 1 18 VAL CG1 C -6.316 -0.286 -6.783 1.00 . A A . 18 VAL CG1 1 1 7 3121 1 1 18 VAL CG2 C -5.163 -2.240 -5.693 1.00 . A A . 18 VAL CG2 1 1 7 3122 1 1 18 VAL H H -5.220 1.937 -5.484 1.00 . A A . 18 VAL H 1 1 7 3123 1 1 18 VAL HA H -3.541 -0.400 -4.684 1.00 . A A . 18 VAL HA 1 1 7 3124 1 1 18 VAL HB H -6.024 -0.586 -4.688 1.00 . A A . 18 VAL HB 1 1 7 3125 1 1 18 VAL HG11 H -6.511 0.785 -6.731 1.00 . A A . 18 VAL HG11 1 1 7 3126 1 1 18 VAL HG12 H -5.823 -0.511 -7.729 1.00 . A A . 18 VAL HG12 1 1 7 3127 1 1 18 VAL HG13 H -7.268 -0.815 -6.753 1.00 . A A . 18 VAL HG13 1 1 7 3128 1 1 18 VAL HG21 H -4.626 -2.557 -4.801 1.00 . A A . 18 VAL HG21 1 1 7 3129 1 1 18 VAL HG22 H -6.102 -2.791 -5.745 1.00 . A A . 18 VAL HG22 1 1 7 3130 1 1 18 VAL HG23 H -4.565 -2.474 -6.574 1.00 . A A . 18 VAL HG23 1 1 7 3131 1 1 18 VAL N N -4.491 1.448 -4.991 1.00 . A A . 18 VAL N 1 1 7 3132 1 1 18 VAL O O -3.518 0.932 -7.639 1.00 . A A . 18 VAL O 1 1 7 3133 1 1 19 CYS C C -1.716 -2.076 -8.963 1.00 . A A . 19 CYS C 1 1 7 3134 1 1 19 CYS CA C -1.377 -0.886 -8.015 1.00 . A A . 19 CYS CA 1 1 7 3135 1 1 19 CYS CB C 0.064 -0.891 -7.457 1.00 . A A . 19 CYS CB 1 1 7 3136 1 1 19 CYS H H -2.206 -1.466 -6.122 1.00 . A A . 19 CYS H 1 1 7 3137 1 1 19 CYS HA H -1.452 0.014 -8.634 1.00 . A A . 19 CYS HA 1 1 7 3138 1 1 19 CYS HB2 H 0.781 -0.755 -8.266 1.00 . A A . 19 CYS HB2 1 1 7 3139 1 1 19 CYS HB3 H 0.189 -0.046 -6.779 1.00 . A A . 19 CYS HB3 1 1 7 3140 1 1 19 CYS N N -2.300 -0.786 -6.869 1.00 . A A . 19 CYS N 1 1 7 3141 1 1 19 CYS O O -2.884 -2.375 -9.221 1.00 . A A . 19 CYS O 1 1 7 3142 1 1 19 CYS SG S 0.547 -2.377 -6.532 1.00 . A A . 19 CYS SG 1 1 7 3143 1 1 20 ALA C C -1.108 -5.244 -9.420 1.00 . A A . 20 ALA C 1 1 7 3144 1 1 20 ALA CA C -0.846 -3.990 -10.301 1.00 . A A . 20 ALA CA 1 1 7 3145 1 1 20 ALA CB C 0.384 -4.115 -11.219 1.00 . A A . 20 ALA CB 1 1 7 3146 1 1 20 ALA H H 0.232 -2.482 -9.250 1.00 . A A . 20 ALA H 1 1 7 3147 1 1 20 ALA HA H -1.718 -3.888 -10.950 1.00 . A A . 20 ALA HA 1 1 7 3148 1 1 20 ALA HB1 H 0.526 -3.186 -11.775 1.00 . A A . 20 ALA HB1 1 1 7 3149 1 1 20 ALA HB2 H 1.284 -4.310 -10.631 1.00 . A A . 20 ALA HB2 1 1 7 3150 1 1 20 ALA HB3 H 0.246 -4.918 -11.945 1.00 . A A . 20 ALA HB3 1 1 7 3151 1 1 20 ALA N N -0.700 -2.765 -9.504 1.00 . A A . 20 ALA N 1 1 7 3152 1 1 20 ALA O O -1.750 -5.155 -8.377 1.00 . A A . 20 ALA O 1 1 7 3153 1 1 21 SER C C 0.470 -8.179 -8.431 1.00 . A A . 21 SER C 1 1 7 3154 1 1 21 SER CA C -0.827 -7.716 -9.135 1.00 . A A . 21 SER CA 1 1 7 3155 1 1 21 SER CB C -1.328 -8.780 -10.125 1.00 . A A . 21 SER CB 1 1 7 3156 1 1 21 SER H H -0.153 -6.466 -10.714 1.00 . A A . 21 SER H 1 1 7 3157 1 1 21 SER HA H -1.602 -7.633 -8.374 1.00 . A A . 21 SER HA 1 1 7 3158 1 1 21 SER HB2 H -1.486 -9.733 -9.610 1.00 . A A . 21 SER HB2 1 1 7 3159 1 1 21 SER HB3 H -2.282 -8.469 -10.555 1.00 . A A . 21 SER HB3 1 1 7 3160 1 1 21 SER HG H 0.483 -9.112 -10.782 1.00 . A A . 21 SER HG 1 1 7 3161 1 1 21 SER N N -0.665 -6.432 -9.846 1.00 . A A . 21 SER N 1 1 7 3162 1 1 21 SER O O 1.366 -8.714 -9.080 1.00 . A A . 21 SER O 1 1 7 3163 1 1 21 SER OG O -0.391 -8.949 -11.172 1.00 . A A . 21 SER OG 1 1 7 3164 1 1 22 GLY C C 1.348 -8.475 -4.770 1.00 . A A . 22 GLY C 1 1 7 3165 1 1 22 GLY CA C 1.695 -8.373 -6.266 1.00 . A A . 22 GLY CA 1 1 7 3166 1 1 22 GLY H H -0.253 -7.566 -6.663 1.00 . A A . 22 GLY H 1 1 7 3167 1 1 22 GLY HA2 H 2.094 -9.336 -6.593 1.00 . A A . 22 GLY HA2 1 1 7 3168 1 1 22 GLY HA3 H 2.485 -7.627 -6.374 1.00 . A A . 22 GLY HA3 1 1 7 3169 1 1 22 GLY N N 0.547 -7.989 -7.110 1.00 . A A . 22 GLY N 1 1 7 3170 1 1 22 GLY O O 1.684 -9.448 -4.102 1.00 . A A . 22 GLY O 1 1 7 3171 1 1 23 THR C C 1.395 -7.287 -1.826 1.00 . A A . 23 THR C 1 1 7 3172 1 1 23 THR CA C 0.222 -7.379 -2.828 1.00 . A A . 23 THR CA 1 1 7 3173 1 1 23 THR CB C -0.834 -8.466 -2.490 1.00 . A A . 23 THR CB 1 1 7 3174 1 1 23 THR CG2 C -1.642 -8.184 -1.213 1.00 . A A . 23 THR CG2 1 1 7 3175 1 1 23 THR H H 0.448 -6.682 -4.842 1.00 . A A . 23 THR H 1 1 7 3176 1 1 23 THR HA H -0.272 -6.416 -2.719 1.00 . A A . 23 THR HA 1 1 7 3177 1 1 23 THR HB H -0.339 -9.437 -2.396 1.00 . A A . 23 THR HB 1 1 7 3178 1 1 23 THR HG1 H -2.598 -8.944 -3.174 1.00 . A A . 23 THR HG1 1 1 7 3179 1 1 23 THR HG21 H -2.146 -7.219 -1.284 1.00 . A A . 23 THR HG21 1 1 7 3180 1 1 23 THR HG22 H -2.396 -8.960 -1.073 1.00 . A A . 23 THR HG22 1 1 7 3181 1 1 23 THR HG23 H -1.011 -8.188 -0.327 1.00 . A A . 23 THR HG23 1 1 7 3182 1 1 23 THR N N 0.660 -7.458 -4.240 1.00 . A A . 23 THR N 1 1 7 3183 1 1 23 THR O O 1.283 -7.658 -0.661 1.00 . A A . 23 THR O 1 1 7 3184 1 1 23 THR OG1 O -1.803 -8.529 -3.526 1.00 . A A . 23 THR OG1 1 1 7 3185 1 1 24 THR C C 3.076 -4.730 -0.862 1.00 . A A . 24 THR C 1 1 7 3186 1 1 24 THR CA C 3.541 -6.085 -1.430 1.00 . A A . 24 THR CA 1 1 7 3187 1 1 24 THR CB C 4.843 -5.893 -2.227 1.00 . A A . 24 THR CB 1 1 7 3188 1 1 24 THR CG2 C 5.484 -7.238 -2.581 1.00 . A A . 24 THR CG2 1 1 7 3189 1 1 24 THR H H 2.562 -6.439 -3.245 1.00 . A A . 24 THR H 1 1 7 3190 1 1 24 THR HA H 3.753 -6.757 -0.593 1.00 . A A . 24 THR HA 1 1 7 3191 1 1 24 THR HB H 5.555 -5.320 -1.622 1.00 . A A . 24 THR HB 1 1 7 3192 1 1 24 THR HG1 H 5.463 -5.022 -3.824 1.00 . A A . 24 THR HG1 1 1 7 3193 1 1 24 THR HG21 H 5.696 -7.803 -1.674 1.00 . A A . 24 THR HG21 1 1 7 3194 1 1 24 THR HG22 H 4.822 -7.815 -3.222 1.00 . A A . 24 THR HG22 1 1 7 3195 1 1 24 THR HG23 H 6.421 -7.057 -3.107 1.00 . A A . 24 THR HG23 1 1 7 3196 1 1 24 THR N N 2.508 -6.699 -2.272 1.00 . A A . 24 THR N 1 1 7 3197 1 1 24 THR O O 2.299 -4.006 -1.486 1.00 . A A . 24 THR O 1 1 7 3198 1 1 24 THR OG1 O 4.587 -5.210 -3.438 1.00 . A A . 24 THR OG1 1 1 7 3199 1 1 25 CYS C C 4.187 -2.920 2.176 1.00 . A A . 25 CYS C 1 1 7 3200 1 1 25 CYS CA C 3.052 -3.304 1.187 1.00 . A A . 25 CYS CA 1 1 7 3201 1 1 25 CYS CB C 1.712 -3.708 1.851 1.00 . A A . 25 CYS CB 1 1 7 3202 1 1 25 CYS H H 4.150 -5.085 0.783 1.00 . A A . 25 CYS H 1 1 7 3203 1 1 25 CYS HA H 2.854 -2.442 0.546 1.00 . A A . 25 CYS HA 1 1 7 3204 1 1 25 CYS HB2 H 1.077 -4.183 1.102 1.00 . A A . 25 CYS HB2 1 1 7 3205 1 1 25 CYS HB3 H 1.900 -4.440 2.636 1.00 . A A . 25 CYS HB3 1 1 7 3206 1 1 25 CYS N N 3.506 -4.432 0.366 1.00 . A A . 25 CYS N 1 1 7 3207 1 1 25 CYS O O 4.236 -3.409 3.306 1.00 . A A . 25 CYS O 1 1 7 3208 1 1 25 CYS SG S 0.693 -2.384 2.558 1.00 . A A . 25 CYS SG 1 1 7 3209 1 1 26 GLN C C 6.753 -0.407 2.748 1.00 . A A . 26 GLN C 1 1 7 3210 1 1 26 GLN CA C 6.469 -1.884 2.348 1.00 . A A . 26 GLN CA 1 1 7 3211 1 1 26 GLN CB C 7.494 -2.419 1.333 1.00 . A A . 26 GLN CB 1 1 7 3212 1 1 26 GLN CD C 9.240 -3.112 3.052 1.00 . A A . 26 GLN CD 1 1 7 3213 1 1 26 GLN CG C 8.966 -2.332 1.770 1.00 . A A . 26 GLN CG 1 1 7 3214 1 1 26 GLN H H 5.029 -1.767 0.774 1.00 . A A . 26 GLN H 1 1 7 3215 1 1 26 GLN HA H 6.544 -2.490 3.255 1.00 . A A . 26 GLN HA 1 1 7 3216 1 1 26 GLN HB2 H 7.266 -3.466 1.120 1.00 . A A . 26 GLN HB2 1 1 7 3217 1 1 26 GLN HB3 H 7.381 -1.854 0.409 1.00 . A A . 26 GLN HB3 1 1 7 3218 1 1 26 GLN HE21 H 9.810 -4.768 2.045 1.00 . A A . 26 GLN HE21 1 1 7 3219 1 1 26 GLN HE22 H 9.834 -4.851 3.814 1.00 . A A . 26 GLN HE22 1 1 7 3220 1 1 26 GLN HG2 H 9.591 -2.726 0.963 1.00 . A A . 26 GLN HG2 1 1 7 3221 1 1 26 GLN HG3 H 9.257 -1.292 1.929 1.00 . A A . 26 GLN HG3 1 1 7 3222 1 1 26 GLN N N 5.149 -2.102 1.725 1.00 . A A . 26 GLN N 1 1 7 3223 1 1 26 GLN NE2 N 9.684 -4.352 2.955 1.00 . A A . 26 GLN NE2 1 1 7 3224 1 1 26 GLN O O 6.409 0.526 2.027 1.00 . A A . 26 GLN O 1 1 7 3225 1 1 26 GLN OE1 O 9.030 -2.617 4.150 1.00 . A A . 26 GLN OE1 1 1 7 3226 1 1 27 VAL C C 8.463 2.155 3.712 1.00 . A A . 27 VAL C 1 1 7 3227 1 1 27 VAL CA C 7.548 1.180 4.509 1.00 . A A . 27 VAL CA 1 1 7 3228 1 1 27 VAL CB C 7.982 1.057 5.989 1.00 . A A . 27 VAL CB 1 1 7 3229 1 1 27 VAL CG1 C 9.355 0.389 6.200 1.00 . A A . 27 VAL CG1 1 1 7 3230 1 1 27 VAL CG2 C 7.976 2.434 6.687 1.00 . A A . 27 VAL CG2 1 1 7 3231 1 1 27 VAL H H 7.730 -0.968 4.415 1.00 . A A . 27 VAL H 1 1 7 3232 1 1 27 VAL HA H 6.555 1.634 4.539 1.00 . A A . 27 VAL HA 1 1 7 3233 1 1 27 VAL HB H 7.240 0.446 6.506 1.00 . A A . 27 VAL HB 1 1 7 3234 1 1 27 VAL HG11 H 9.383 -0.579 5.704 1.00 . A A . 27 VAL HG11 1 1 7 3235 1 1 27 VAL HG12 H 10.158 1.009 5.803 1.00 . A A . 27 VAL HG12 1 1 7 3236 1 1 27 VAL HG13 H 9.539 0.235 7.261 1.00 . A A . 27 VAL HG13 1 1 7 3237 1 1 27 VAL HG21 H 7.009 2.913 6.537 1.00 . A A . 27 VAL HG21 1 1 7 3238 1 1 27 VAL HG22 H 8.143 2.312 7.759 1.00 . A A . 27 VAL HG22 1 1 7 3239 1 1 27 VAL HG23 H 8.762 3.076 6.283 1.00 . A A . 27 VAL HG23 1 1 7 3240 1 1 27 VAL N N 7.369 -0.166 3.913 1.00 . A A . 27 VAL N 1 1 7 3241 1 1 27 VAL O O 9.648 1.883 3.527 1.00 . A A . 27 VAL O 1 1 7 3242 1 1 28 LEU C C 8.961 5.436 4.218 1.00 . A A . 28 LEU C 1 1 7 3243 1 1 28 LEU CA C 8.778 4.519 2.986 1.00 . A A . 28 LEU CA 1 1 7 3244 1 1 28 LEU CB C 8.153 5.300 1.810 1.00 . A A . 28 LEU CB 1 1 7 3245 1 1 28 LEU CD1 C 7.697 3.336 0.258 1.00 . A A . 28 LEU CD1 1 1 7 3246 1 1 28 LEU CD2 C 8.005 5.640 -0.678 1.00 . A A . 28 LEU CD2 1 1 7 3247 1 1 28 LEU CG C 8.434 4.669 0.432 1.00 . A A . 28 LEU CG 1 1 7 3248 1 1 28 LEU H H 6.946 3.454 3.402 1.00 . A A . 28 LEU H 1 1 7 3249 1 1 28 LEU HA H 9.780 4.210 2.676 1.00 . A A . 28 LEU HA 1 1 7 3250 1 1 28 LEU HB2 H 7.077 5.421 1.950 1.00 . A A . 28 LEU HB2 1 1 7 3251 1 1 28 LEU HB3 H 8.596 6.300 1.791 1.00 . A A . 28 LEU HB3 1 1 7 3252 1 1 28 LEU HD11 H 6.654 3.451 0.550 1.00 . A A . 28 LEU HD11 1 1 7 3253 1 1 28 LEU HD12 H 7.750 3.018 -0.783 1.00 . A A . 28 LEU HD12 1 1 7 3254 1 1 28 LEU HD13 H 8.155 2.558 0.866 1.00 . A A . 28 LEU HD13 1 1 7 3255 1 1 28 LEU HD21 H 8.555 6.577 -0.593 1.00 . A A . 28 LEU HD21 1 1 7 3256 1 1 28 LEU HD22 H 8.219 5.206 -1.656 1.00 . A A . 28 LEU HD22 1 1 7 3257 1 1 28 LEU HD23 H 6.936 5.845 -0.610 1.00 . A A . 28 LEU HD23 1 1 7 3258 1 1 28 LEU HG H 9.504 4.492 0.326 1.00 . A A . 28 LEU HG 1 1 7 3259 1 1 28 LEU N N 7.952 3.340 3.332 1.00 . A A . 28 LEU N 1 1 7 3260 1 1 28 LEU O O 10.070 5.777 4.621 1.00 . A A . 28 LEU O 1 1 7 3261 1 1 29 ASN C C 6.541 5.637 6.907 1.00 . A A . 29 ASN C 1 1 7 3262 1 1 29 ASN CA C 7.744 6.332 6.205 1.00 . A A . 29 ASN CA 1 1 7 3263 1 1 29 ASN CB C 7.674 7.875 6.157 1.00 . A A . 29 ASN CB 1 1 7 3264 1 1 29 ASN CG C 6.390 8.393 5.524 1.00 . A A . 29 ASN CG 1 1 7 3265 1 1 29 ASN H H 6.982 5.459 4.430 1.00 . A A . 29 ASN H 1 1 7 3266 1 1 29 ASN HA H 8.645 6.055 6.759 1.00 . A A . 29 ASN HA 1 1 7 3267 1 1 29 ASN HB2 H 7.734 8.291 7.162 1.00 . A A . 29 ASN HB2 1 1 7 3268 1 1 29 ASN HB3 H 8.536 8.259 5.607 1.00 . A A . 29 ASN HB3 1 1 7 3269 1 1 29 ASN HD21 H 7.149 8.341 3.645 1.00 . A A . 29 ASN HD21 1 1 7 3270 1 1 29 ASN HD22 H 5.492 8.913 3.841 1.00 . A A . 29 ASN HD22 1 1 7 3271 1 1 29 ASN N N 7.841 5.811 4.837 1.00 . A A . 29 ASN N 1 1 7 3272 1 1 29 ASN ND2 N 6.354 8.564 4.218 1.00 . A A . 29 ASN ND2 1 1 7 3273 1 1 29 ASN O O 5.654 5.140 6.212 1.00 . A A . 29 ASN O 1 1 7 3274 1 1 29 ASN OD1 O 5.406 8.637 6.206 1.00 . A A . 29 ASN OD1 1 1 7 3275 1 1 30 PRO C C 4.018 4.930 8.564 1.00 . A A . 30 PRO C 1 1 7 3276 1 1 30 PRO CA C 5.503 4.681 8.937 1.00 . A A . 30 PRO CA 1 1 7 3277 1 1 30 PRO CB C 5.828 4.804 10.435 1.00 . A A . 30 PRO CB 1 1 7 3278 1 1 30 PRO CD C 7.463 6.063 9.189 1.00 . A A . 30 PRO CD 1 1 7 3279 1 1 30 PRO CG C 6.765 6.013 10.544 1.00 . A A . 30 PRO CG 1 1 7 3280 1 1 30 PRO HA H 5.706 3.647 8.646 1.00 . A A . 30 PRO HA 1 1 7 3281 1 1 30 PRO HB2 H 4.943 4.934 11.061 1.00 . A A . 30 PRO HB2 1 1 7 3282 1 1 30 PRO HB3 H 6.367 3.911 10.760 1.00 . A A . 30 PRO HB3 1 1 7 3283 1 1 30 PRO HD2 H 7.762 7.087 8.975 1.00 . A A . 30 PRO HD2 1 1 7 3284 1 1 30 PRO HD3 H 8.345 5.418 9.202 1.00 . A A . 30 PRO HD3 1 1 7 3285 1 1 30 PRO HG2 H 6.172 6.922 10.689 1.00 . A A . 30 PRO HG2 1 1 7 3286 1 1 30 PRO HG3 H 7.477 5.908 11.367 1.00 . A A . 30 PRO HG3 1 1 7 3287 1 1 30 PRO N N 6.491 5.532 8.249 1.00 . A A . 30 PRO N 1 1 7 3288 1 1 30 PRO O O 3.228 3.989 8.499 1.00 . A A . 30 PRO O 1 1 7 3289 1 1 31 TYR C C 2.035 6.206 6.259 1.00 . A A . 31 TYR C 1 1 7 3290 1 1 31 TYR CA C 2.311 6.567 7.754 1.00 . A A . 31 TYR CA 1 1 7 3291 1 1 31 TYR CB C 2.086 8.061 8.086 1.00 . A A . 31 TYR CB 1 1 7 3292 1 1 31 TYR CD1 C 1.240 8.263 10.490 1.00 . A A . 31 TYR CD1 1 1 7 3293 1 1 31 TYR CD2 C 3.566 8.821 10.027 1.00 . A A . 31 TYR CD2 1 1 7 3294 1 1 31 TYR CE1 C 1.499 8.313 11.877 1.00 . A A . 31 TYR CE1 1 1 7 3295 1 1 31 TYR CE2 C 3.808 8.936 11.416 1.00 . A A . 31 TYR CE2 1 1 7 3296 1 1 31 TYR CG C 2.292 8.424 9.559 1.00 . A A . 31 TYR CG 1 1 7 3297 1 1 31 TYR CZ C 2.788 8.635 12.336 1.00 . A A . 31 TYR CZ 1 1 7 3298 1 1 31 TYR H H 4.325 6.908 8.366 1.00 . A A . 31 TYR H 1 1 7 3299 1 1 31 TYR HA H 1.557 6.012 8.314 1.00 . A A . 31 TYR HA 1 1 7 3300 1 1 31 TYR HB2 H 2.764 8.661 7.475 1.00 . A A . 31 TYR HB2 1 1 7 3301 1 1 31 TYR HB3 H 1.065 8.330 7.803 1.00 . A A . 31 TYR HB3 1 1 7 3302 1 1 31 TYR HD1 H 0.230 8.126 10.144 1.00 . A A . 31 TYR HD1 1 1 7 3303 1 1 31 TYR HD2 H 4.361 9.031 9.324 1.00 . A A . 31 TYR HD2 1 1 7 3304 1 1 31 TYR HE1 H 0.704 8.111 12.579 1.00 . A A . 31 TYR HE1 1 1 7 3305 1 1 31 TYR HE2 H 4.774 9.250 11.781 1.00 . A A . 31 TYR HE2 1 1 7 3306 1 1 31 TYR HH H 2.274 8.371 14.165 1.00 . A A . 31 TYR HH 1 1 7 3307 1 1 31 TYR N N 3.644 6.177 8.256 1.00 . A A . 31 TYR N 1 1 7 3308 1 1 31 TYR O O 0.883 6.208 5.826 1.00 . A A . 31 TYR O 1 1 7 3309 1 1 31 TYR OH O 3.044 8.653 13.669 1.00 . A A . 31 TYR OH 1 1 7 3310 1 1 32 TYR C C 3.804 4.057 3.813 1.00 . A A . 32 TYR C 1 1 7 3311 1 1 32 TYR CA C 3.012 5.374 4.080 1.00 . A A . 32 TYR CA 1 1 7 3312 1 1 32 TYR CB C 3.416 6.504 3.100 1.00 . A A . 32 TYR CB 1 1 7 3313 1 1 32 TYR CD1 C 2.404 5.240 1.133 1.00 . A A . 32 TYR CD1 1 1 7 3314 1 1 32 TYR CD2 C 2.504 7.672 1.021 1.00 . A A . 32 TYR CD2 1 1 7 3315 1 1 32 TYR CE1 C 2.187 5.175 -0.255 1.00 . A A . 32 TYR CE1 1 1 7 3316 1 1 32 TYR CE2 C 2.165 7.608 -0.352 1.00 . A A . 32 TYR CE2 1 1 7 3317 1 1 32 TYR CG C 2.700 6.476 1.753 1.00 . A A . 32 TYR CG 1 1 7 3318 1 1 32 TYR CZ C 2.071 6.360 -0.996 1.00 . A A . 32 TYR CZ 1 1 7 3319 1 1 32 TYR H H 3.976 5.825 5.927 1.00 . A A . 32 TYR H 1 1 7 3320 1 1 32 TYR HA H 1.963 5.159 3.862 1.00 . A A . 32 TYR HA 1 1 7 3321 1 1 32 TYR HB2 H 3.260 7.478 3.567 1.00 . A A . 32 TYR HB2 1 1 7 3322 1 1 32 TYR HB3 H 4.485 6.434 2.868 1.00 . A A . 32 TYR HB3 1 1 7 3323 1 1 32 TYR HD1 H 2.276 4.343 1.714 1.00 . A A . 32 TYR HD1 1 1 7 3324 1 1 32 TYR HD2 H 2.623 8.630 1.511 1.00 . A A . 32 TYR HD2 1 1 7 3325 1 1 32 TYR HE1 H 2.028 4.215 -0.724 1.00 . A A . 32 TYR HE1 1 1 7 3326 1 1 32 TYR HE2 H 1.959 8.513 -0.904 1.00 . A A . 32 TYR HE2 1 1 7 3327 1 1 32 TYR HH H 1.151 5.612 -2.471 1.00 . A A . 32 TYR HH 1 1 7 3328 1 1 32 TYR N N 3.070 5.845 5.479 1.00 . A A . 32 TYR N 1 1 7 3329 1 1 32 TYR O O 4.980 4.064 3.438 1.00 . A A . 32 TYR O 1 1 7 3330 1 1 32 TYR OH O 1.832 6.276 -2.329 1.00 . A A . 32 TYR OH 1 1 7 3331 1 1 33 SER C C 3.034 1.508 1.830 1.00 . A A . 33 SER C 1 1 7 3332 1 1 33 SER CA C 3.498 1.633 3.313 1.00 . A A . 33 SER CA 1 1 7 3333 1 1 33 SER CB C 2.932 0.506 4.181 1.00 . A A . 33 SER CB 1 1 7 3334 1 1 33 SER H H 2.175 2.992 4.296 1.00 . A A . 33 SER H 1 1 7 3335 1 1 33 SER HA H 4.581 1.544 3.341 1.00 . A A . 33 SER HA 1 1 7 3336 1 1 33 SER HB2 H 3.314 0.588 5.203 1.00 . A A . 33 SER HB2 1 1 7 3337 1 1 33 SER HB3 H 1.841 0.559 4.207 1.00 . A A . 33 SER HB3 1 1 7 3338 1 1 33 SER HG H 3.793 -1.278 4.239 1.00 . A A . 33 SER HG 1 1 7 3339 1 1 33 SER N N 3.111 2.917 3.927 1.00 . A A . 33 SER N 1 1 7 3340 1 1 33 SER O O 1.909 1.894 1.523 1.00 . A A . 33 SER O 1 1 7 3341 1 1 33 SER OG O 3.314 -0.720 3.612 1.00 . A A . 33 SER OG 1 1 7 3342 1 1 34 GLN C C 3.962 -0.150 -1.379 1.00 . A A . 34 GLN C 1 1 7 3343 1 1 34 GLN CA C 3.693 1.152 -0.567 1.00 . A A . 34 GLN CA 1 1 7 3344 1 1 34 GLN CB C 4.572 2.328 -1.054 1.00 . A A . 34 GLN CB 1 1 7 3345 1 1 34 GLN CD C 5.107 4.027 -2.901 1.00 . A A . 34 GLN CD 1 1 7 3346 1 1 34 GLN CG C 4.342 2.761 -2.519 1.00 . A A . 34 GLN CG 1 1 7 3347 1 1 34 GLN H H 4.778 0.708 1.227 1.00 . A A . 34 GLN H 1 1 7 3348 1 1 34 GLN HA H 2.655 1.419 -0.770 1.00 . A A . 34 GLN HA 1 1 7 3349 1 1 34 GLN HB2 H 4.379 3.194 -0.416 1.00 . A A . 34 GLN HB2 1 1 7 3350 1 1 34 GLN HB3 H 5.618 2.040 -0.931 1.00 . A A . 34 GLN HB3 1 1 7 3351 1 1 34 GLN HE21 H 3.445 5.235 -2.974 1.00 . A A . 34 GLN HE21 1 1 7 3352 1 1 34 GLN HE22 H 5.010 5.921 -3.396 1.00 . A A . 34 GLN HE22 1 1 7 3353 1 1 34 GLN HG2 H 4.704 1.990 -3.198 1.00 . A A . 34 GLN HG2 1 1 7 3354 1 1 34 GLN HG3 H 3.280 2.918 -2.696 1.00 . A A . 34 GLN HG3 1 1 7 3355 1 1 34 GLN N N 3.879 1.038 0.899 1.00 . A A . 34 GLN N 1 1 7 3356 1 1 34 GLN NE2 N 4.440 5.147 -3.107 1.00 . A A . 34 GLN NE2 1 1 7 3357 1 1 34 GLN O O 4.581 -1.095 -0.892 1.00 . A A . 34 GLN O 1 1 7 3358 1 1 34 GLN OE1 O 6.315 4.021 -3.053 1.00 . A A . 34 GLN OE1 1 1 7 3359 1 1 35 CYS C C 5.143 -1.465 -4.107 1.00 . A A . 35 CYS C 1 1 7 3360 1 1 35 CYS CA C 3.675 -1.254 -3.638 1.00 . A A . 35 CYS CA 1 1 7 3361 1 1 35 CYS CB C 2.728 -0.934 -4.813 1.00 . A A . 35 CYS CB 1 1 7 3362 1 1 35 CYS H H 2.990 0.635 -2.932 1.00 . A A . 35 CYS H 1 1 7 3363 1 1 35 CYS HA H 3.348 -2.201 -3.202 1.00 . A A . 35 CYS HA 1 1 7 3364 1 1 35 CYS HB2 H 1.719 -0.801 -4.432 1.00 . A A . 35 CYS HB2 1 1 7 3365 1 1 35 CYS HB3 H 3.030 0.001 -5.283 1.00 . A A . 35 CYS HB3 1 1 7 3366 1 1 35 CYS N N 3.494 -0.182 -2.637 1.00 . A A . 35 CYS N 1 1 7 3367 1 1 35 CYS O O 5.461 -1.238 -5.274 1.00 . A A . 35 CYS O 1 1 7 3368 1 1 35 CYS SG S 2.639 -2.167 -6.142 1.00 . A A . 35 CYS SG 1 1 7 3369 1 1 36 LEU C C 7.472 -3.884 -3.102 1.00 . A A . 36 LEU C 1 1 7 3370 1 1 36 LEU CA C 7.387 -2.367 -3.425 1.00 . A A . 36 LEU CA 1 1 7 3371 1 1 36 LEU CB C 8.363 -1.546 -2.554 1.00 . A A . 36 LEU CB 1 1 7 3372 1 1 36 LEU CD1 C 7.639 0.736 -3.531 1.00 . A A . 36 LEU CD1 1 1 7 3373 1 1 36 LEU CD2 C 9.549 0.549 -1.921 1.00 . A A . 36 LEU CD2 1 1 7 3374 1 1 36 LEU CG C 8.797 -0.156 -3.062 1.00 . A A . 36 LEU CG 1 1 7 3375 1 1 36 LEU H H 5.645 -2.015 -2.253 1.00 . A A . 36 LEU H 1 1 7 3376 1 1 36 LEU HA H 7.676 -2.253 -4.471 1.00 . A A . 36 LEU HA 1 1 7 3377 1 1 36 LEU HB2 H 7.910 -1.426 -1.574 1.00 . A A . 36 LEU HB2 1 1 7 3378 1 1 36 LEU HB3 H 9.277 -2.127 -2.424 1.00 . A A . 36 LEU HB3 1 1 7 3379 1 1 36 LEU HD11 H 6.851 0.758 -2.779 1.00 . A A . 36 LEU HD11 1 1 7 3380 1 1 36 LEU HD12 H 7.996 1.752 -3.702 1.00 . A A . 36 LEU HD12 1 1 7 3381 1 1 36 LEU HD13 H 7.241 0.360 -4.472 1.00 . A A . 36 LEU HD13 1 1 7 3382 1 1 36 LEU HD21 H 10.366 -0.079 -1.565 1.00 . A A . 36 LEU HD21 1 1 7 3383 1 1 36 LEU HD22 H 9.959 1.497 -2.269 1.00 . A A . 36 LEU HD22 1 1 7 3384 1 1 36 LEU HD23 H 8.869 0.741 -1.090 1.00 . A A . 36 LEU HD23 1 1 7 3385 1 1 36 LEU HG H 9.484 -0.291 -3.901 1.00 . A A . 36 LEU HG 1 1 7 3386 1 1 36 LEU N N 6.011 -1.891 -3.190 1.00 . A A . 36 LEU N 1 1 7 3387 1 1 36 LEU O O 7.181 -4.691 -4.013 1.00 . A A . 36 LEU O 1 1 7 3388 1 1 36 LEU OXT O 7.759 -4.225 -1.930 1.00 . A A . 36 LEU OXT 1 1 8 3389 1 1 1 THR C C -7.177 -3.915 -7.305 1.00 . A A . 1 THR C 1 1 8 3390 1 1 1 THR CA C -6.377 -4.975 -8.097 1.00 . A A . 1 THR CA 1 1 8 3391 1 1 1 THR CB C -5.514 -4.296 -9.190 1.00 . A A . 1 THR CB 1 1 8 3392 1 1 1 THR CG2 C -4.247 -5.099 -9.501 1.00 . A A . 1 THR CG2 1 1 8 3393 1 1 1 THR H1 H -7.964 -6.331 -8.025 1.00 . A A . 1 THR H1 1 1 8 3394 1 1 1 THR H2 H -7.667 -5.634 -9.497 1.00 . A A . 1 THR H2 1 1 8 3395 1 1 1 THR H3 H -6.703 -6.850 -8.965 1.00 . A A . 1 THR H3 1 1 8 3396 1 1 1 THR HA H -5.688 -5.451 -7.397 1.00 . A A . 1 THR HA 1 1 8 3397 1 1 1 THR HB H -5.207 -3.295 -8.868 1.00 . A A . 1 THR HB 1 1 8 3398 1 1 1 THR HG1 H -5.797 -3.601 -10.988 1.00 . A A . 1 THR HG1 1 1 8 3399 1 1 1 THR HG21 H -3.641 -5.255 -8.607 1.00 . A A . 1 THR HG21 1 1 8 3400 1 1 1 THR HG22 H -4.491 -6.067 -9.934 1.00 . A A . 1 THR HG22 1 1 8 3401 1 1 1 THR HG23 H -3.655 -4.542 -10.227 1.00 . A A . 1 THR HG23 1 1 8 3402 1 1 1 THR N N -7.239 -6.045 -8.677 1.00 . A A . 1 THR N 1 1 8 3403 1 1 1 THR O O -7.724 -2.981 -7.881 1.00 . A A . 1 THR O 1 1 8 3404 1 1 1 THR OG1 O -6.246 -4.222 -10.399 1.00 . A A . 1 THR OG1 1 1 8 3405 1 1 2 GLN C C -7.168 -2.691 -3.945 1.00 . A A . 2 GLN C 1 1 8 3406 1 1 2 GLN CA C -8.079 -3.320 -5.033 1.00 . A A . 2 GLN CA 1 1 8 3407 1 1 2 GLN CB C -9.129 -4.266 -4.403 1.00 . A A . 2 GLN CB 1 1 8 3408 1 1 2 GLN CD C -10.223 -5.241 -6.580 1.00 . A A . 2 GLN CD 1 1 8 3409 1 1 2 GLN CG C -10.397 -4.513 -5.247 1.00 . A A . 2 GLN CG 1 1 8 3410 1 1 2 GLN H H -6.820 -4.906 -5.586 1.00 . A A . 2 GLN H 1 1 8 3411 1 1 2 GLN HA H -8.587 -2.490 -5.535 1.00 . A A . 2 GLN HA 1 1 8 3412 1 1 2 GLN HB2 H -8.669 -5.221 -4.136 1.00 . A A . 2 GLN HB2 1 1 8 3413 1 1 2 GLN HB3 H -9.491 -3.823 -3.472 1.00 . A A . 2 GLN HB3 1 1 8 3414 1 1 2 GLN HE21 H -11.962 -4.498 -7.285 1.00 . A A . 2 GLN HE21 1 1 8 3415 1 1 2 GLN HE22 H -11.116 -5.635 -8.328 1.00 . A A . 2 GLN HE22 1 1 8 3416 1 1 2 GLN HG2 H -11.078 -5.134 -4.661 1.00 . A A . 2 GLN HG2 1 1 8 3417 1 1 2 GLN HG3 H -10.879 -3.554 -5.435 1.00 . A A . 2 GLN HG3 1 1 8 3418 1 1 2 GLN N N -7.305 -4.123 -5.992 1.00 . A A . 2 GLN N 1 1 8 3419 1 1 2 GLN NE2 N -11.172 -5.091 -7.483 1.00 . A A . 2 GLN NE2 1 1 8 3420 1 1 2 GLN O O -5.975 -2.981 -3.905 1.00 . A A . 2 GLN O 1 1 8 3421 1 1 2 GLN OE1 O -9.261 -5.959 -6.828 1.00 . A A . 2 GLN OE1 1 1 8 3422 1 1 3 SER C C -5.934 -2.064 -1.201 1.00 . A A . 3 SER C 1 1 8 3423 1 1 3 SER CA C -6.988 -1.196 -1.940 1.00 . A A . 3 SER CA 1 1 8 3424 1 1 3 SER CB C -7.989 -0.641 -0.910 1.00 . A A . 3 SER CB 1 1 8 3425 1 1 3 SER H H -8.695 -1.617 -3.143 1.00 . A A . 3 SER H 1 1 8 3426 1 1 3 SER HA H -6.454 -0.346 -2.368 1.00 . A A . 3 SER HA 1 1 8 3427 1 1 3 SER HB2 H -8.507 -1.475 -0.429 1.00 . A A . 3 SER HB2 1 1 8 3428 1 1 3 SER HB3 H -7.440 -0.087 -0.141 1.00 . A A . 3 SER HB3 1 1 8 3429 1 1 3 SER HG H -9.642 0.415 -0.876 1.00 . A A . 3 SER HG 1 1 8 3430 1 1 3 SER N N -7.719 -1.857 -3.047 1.00 . A A . 3 SER N 1 1 8 3431 1 1 3 SER O O -4.906 -1.556 -0.769 1.00 . A A . 3 SER O 1 1 8 3432 1 1 3 SER OG O -8.956 0.205 -1.520 1.00 . A A . 3 SER OG 1 1 8 3433 1 1 4 HIS C C -4.788 -5.421 -1.351 1.00 . A A . 4 HIS C 1 1 8 3434 1 1 4 HIS CA C -5.399 -4.373 -0.373 1.00 . A A . 4 HIS CA 1 1 8 3435 1 1 4 HIS CB C -6.278 -5.006 0.726 1.00 . A A . 4 HIS CB 1 1 8 3436 1 1 4 HIS CD2 C -6.612 -3.490 2.832 1.00 . A A . 4 HIS CD2 1 1 8 3437 1 1 4 HIS CE1 C -8.482 -2.551 2.217 1.00 . A A . 4 HIS CE1 1 1 8 3438 1 1 4 HIS CG C -6.978 -4.003 1.617 1.00 . A A . 4 HIS CG 1 1 8 3439 1 1 4 HIS H H -7.145 -3.644 -1.330 1.00 . A A . 4 HIS H 1 1 8 3440 1 1 4 HIS HA H -4.558 -3.899 0.134 1.00 . A A . 4 HIS HA 1 1 8 3441 1 1 4 HIS HB2 H -7.044 -5.625 0.253 1.00 . A A . 4 HIS HB2 1 1 8 3442 1 1 4 HIS HB3 H -5.663 -5.658 1.346 1.00 . A A . 4 HIS HB3 1 1 8 3443 1 1 4 HIS HD2 H -5.720 -3.750 3.385 1.00 . A A . 4 HIS HD2 1 1 8 3444 1 1 4 HIS HE1 H -9.358 -1.917 2.221 1.00 . A A . 4 HIS HE1 1 1 8 3445 1 1 4 HIS HE2 H -7.588 -1.968 4.023 1.00 . A A . 4 HIS HE2 1 1 8 3446 1 1 4 HIS N N -6.222 -3.360 -1.053 1.00 . A A . 4 HIS N 1 1 8 3447 1 1 4 HIS ND1 N -8.177 -3.398 1.229 1.00 . A A . 4 HIS ND1 1 1 8 3448 1 1 4 HIS NE2 N -7.566 -2.555 3.194 1.00 . A A . 4 HIS NE2 1 1 8 3449 1 1 4 HIS O O -4.718 -6.611 -1.047 1.00 . A A . 4 HIS O 1 1 8 3450 1 1 5 ALA C C -2.464 -5.015 -4.170 1.00 . A A . 5 ALA C 1 1 8 3451 1 1 5 ALA CA C -3.669 -5.782 -3.574 1.00 . A A . 5 ALA CA 1 1 8 3452 1 1 5 ALA CB C -4.654 -6.148 -4.690 1.00 . A A . 5 ALA CB 1 1 8 3453 1 1 5 ALA H H -4.486 -3.997 -2.723 1.00 . A A . 5 ALA H 1 1 8 3454 1 1 5 ALA HA H -3.309 -6.715 -3.139 1.00 . A A . 5 ALA HA 1 1 8 3455 1 1 5 ALA HB1 H -5.531 -6.649 -4.280 1.00 . A A . 5 ALA HB1 1 1 8 3456 1 1 5 ALA HB2 H -4.954 -5.232 -5.193 1.00 . A A . 5 ALA HB2 1 1 8 3457 1 1 5 ALA HB3 H -4.172 -6.807 -5.413 1.00 . A A . 5 ALA HB3 1 1 8 3458 1 1 5 ALA N N -4.370 -4.989 -2.552 1.00 . A A . 5 ALA N 1 1 8 3459 1 1 5 ALA O O -2.640 -3.935 -4.741 1.00 . A A . 5 ALA O 1 1 8 3460 1 1 6 GLY C C 0.319 -3.735 -3.391 1.00 . A A . 6 GLY C 1 1 8 3461 1 1 6 GLY CA C -0.029 -4.804 -4.432 1.00 . A A . 6 GLY CA 1 1 8 3462 1 1 6 GLY H H -1.136 -6.403 -3.523 1.00 . A A . 6 GLY H 1 1 8 3463 1 1 6 GLY HA2 H 0.810 -5.487 -4.558 1.00 . A A . 6 GLY HA2 1 1 8 3464 1 1 6 GLY HA3 H -0.185 -4.293 -5.374 1.00 . A A . 6 GLY HA3 1 1 8 3465 1 1 6 GLY N N -1.242 -5.547 -4.057 1.00 . A A . 6 GLY N 1 1 8 3466 1 1 6 GLY O O 1.285 -3.875 -2.659 1.00 . A A . 6 GLY O 1 1 8 3467 1 1 7 GLN C C -1.293 -2.944 -0.911 1.00 . A A . 7 GLN C 1 1 8 3468 1 1 7 GLN CA C -0.753 -1.995 -2.009 1.00 . A A . 7 GLN CA 1 1 8 3469 1 1 7 GLN CB C -1.740 -0.839 -2.267 1.00 . A A . 7 GLN CB 1 1 8 3470 1 1 7 GLN CD C -3.278 0.919 -1.167 1.00 . A A . 7 GLN CD 1 1 8 3471 1 1 7 GLN CG C -2.120 -0.061 -0.985 1.00 . A A . 7 GLN CG 1 1 8 3472 1 1 7 GLN H H -1.328 -2.763 -3.906 1.00 . A A . 7 GLN H 1 1 8 3473 1 1 7 GLN HA H 0.187 -1.559 -1.686 1.00 . A A . 7 GLN HA 1 1 8 3474 1 1 7 GLN HB2 H -1.297 -0.142 -2.982 1.00 . A A . 7 GLN HB2 1 1 8 3475 1 1 7 GLN HB3 H -2.654 -1.256 -2.700 1.00 . A A . 7 GLN HB3 1 1 8 3476 1 1 7 GLN HE21 H -3.346 1.363 0.815 1.00 . A A . 7 GLN HE21 1 1 8 3477 1 1 7 GLN HE22 H -4.502 2.166 -0.240 1.00 . A A . 7 GLN HE22 1 1 8 3478 1 1 7 GLN HG2 H -2.438 -0.752 -0.206 1.00 . A A . 7 GLN HG2 1 1 8 3479 1 1 7 GLN HG3 H -1.256 0.491 -0.616 1.00 . A A . 7 GLN HG3 1 1 8 3480 1 1 7 GLN N N -0.545 -2.722 -3.266 1.00 . A A . 7 GLN N 1 1 8 3481 1 1 7 GLN NE2 N -3.696 1.573 -0.101 1.00 . A A . 7 GLN NE2 1 1 8 3482 1 1 7 GLN O O -2.327 -3.577 -1.111 1.00 . A A . 7 GLN O 1 1 8 3483 1 1 7 GLN OE1 O -3.819 1.117 -2.249 1.00 . A A . 7 GLN OE1 1 1 8 3484 1 1 8 CYS C C -2.231 -2.870 2.233 1.00 . A A . 8 CYS C 1 1 8 3485 1 1 8 CYS CA C -1.204 -3.717 1.429 1.00 . A A . 8 CYS CA 1 1 8 3486 1 1 8 CYS CB C -0.064 -4.258 2.297 1.00 . A A . 8 CYS CB 1 1 8 3487 1 1 8 CYS H H 0.282 -2.611 0.301 1.00 . A A . 8 CYS H 1 1 8 3488 1 1 8 CYS HA H -1.750 -4.603 1.100 1.00 . A A . 8 CYS HA 1 1 8 3489 1 1 8 CYS HB2 H -0.468 -4.891 3.088 1.00 . A A . 8 CYS HB2 1 1 8 3490 1 1 8 CYS HB3 H 0.610 -4.864 1.692 1.00 . A A . 8 CYS HB3 1 1 8 3491 1 1 8 CYS N N -0.642 -3.029 0.251 1.00 . A A . 8 CYS N 1 1 8 3492 1 1 8 CYS O O -3.277 -3.385 2.619 1.00 . A A . 8 CYS O 1 1 8 3493 1 1 8 CYS SG S 0.945 -2.987 3.064 1.00 . A A . 8 CYS SG 1 1 8 3494 1 1 9 GLY C C -2.452 -0.355 4.685 1.00 . A A . 9 GLY C 1 1 8 3495 1 1 9 GLY CA C -2.840 -0.648 3.212 1.00 . A A . 9 GLY CA 1 1 8 3496 1 1 9 GLY H H -1.069 -1.232 2.122 1.00 . A A . 9 GLY H 1 1 8 3497 1 1 9 GLY HA2 H -2.854 0.297 2.674 1.00 . A A . 9 GLY HA2 1 1 8 3498 1 1 9 GLY HA3 H -3.865 -1.024 3.204 1.00 . A A . 9 GLY HA3 1 1 8 3499 1 1 9 GLY N N -1.946 -1.580 2.491 1.00 . A A . 9 GLY N 1 1 8 3500 1 1 9 GLY O O -3.169 -0.733 5.609 1.00 . A A . 9 GLY O 1 1 8 3501 1 1 10 GLY C C -1.202 1.779 7.069 1.00 . A A . 10 GLY C 1 1 8 3502 1 1 10 GLY CA C -0.718 0.558 6.250 1.00 . A A . 10 GLY CA 1 1 8 3503 1 1 10 GLY H H -0.794 0.599 4.093 1.00 . A A . 10 GLY H 1 1 8 3504 1 1 10 GLY HA2 H -0.877 -0.323 6.877 1.00 . A A . 10 GLY HA2 1 1 8 3505 1 1 10 GLY HA3 H 0.358 0.658 6.118 1.00 . A A . 10 GLY HA3 1 1 8 3506 1 1 10 GLY N N -1.319 0.331 4.911 1.00 . A A . 10 GLY N 1 1 8 3507 1 1 10 GLY O O -2.377 2.145 7.026 1.00 . A A . 10 GLY O 1 1 8 3508 1 1 11 ILE C C -1.569 4.521 8.325 1.00 . A A . 11 ILE C 1 1 8 3509 1 1 11 ILE CA C -0.564 3.459 8.848 1.00 . A A . 11 ILE CA 1 1 8 3510 1 1 11 ILE CB C 0.742 4.129 9.380 1.00 . A A . 11 ILE CB 1 1 8 3511 1 1 11 ILE CD1 C 3.110 3.766 10.381 1.00 . A A . 11 ILE CD1 1 1 8 3512 1 1 11 ILE CG1 C 1.758 3.134 9.996 1.00 . A A . 11 ILE CG1 1 1 8 3513 1 1 11 ILE CG2 C 0.395 5.190 10.450 1.00 . A A . 11 ILE CG2 1 1 8 3514 1 1 11 ILE H H 0.655 2.067 7.763 1.00 . A A . 11 ILE H 1 1 8 3515 1 1 11 ILE HA H -1.017 2.978 9.718 1.00 . A A . 11 ILE HA 1 1 8 3516 1 1 11 ILE HB H 1.226 4.627 8.538 1.00 . A A . 11 ILE HB 1 1 8 3517 1 1 11 ILE HD11 H 3.555 4.273 9.526 1.00 . A A . 11 ILE HD11 1 1 8 3518 1 1 11 ILE HD12 H 3.005 4.475 11.201 1.00 . A A . 11 ILE HD12 1 1 8 3519 1 1 11 ILE HD13 H 3.799 2.985 10.707 1.00 . A A . 11 ILE HD13 1 1 8 3520 1 1 11 ILE HG12 H 1.330 2.677 10.889 1.00 . A A . 11 ILE HG12 1 1 8 3521 1 1 11 ILE HG13 H 1.972 2.343 9.278 1.00 . A A . 11 ILE HG13 1 1 8 3522 1 1 11 ILE HG21 H -0.309 5.927 10.070 1.00 . A A . 11 ILE HG21 1 1 8 3523 1 1 11 ILE HG22 H -0.045 4.711 11.326 1.00 . A A . 11 ILE HG22 1 1 8 3524 1 1 11 ILE HG23 H 1.281 5.739 10.764 1.00 . A A . 11 ILE HG23 1 1 8 3525 1 1 11 ILE N N -0.296 2.390 7.855 1.00 . A A . 11 ILE N 1 1 8 3526 1 1 11 ILE O O -1.216 5.424 7.568 1.00 . A A . 11 ILE O 1 1 8 3527 1 1 12 GLY C C -4.498 5.265 6.986 1.00 . A A . 12 GLY C 1 1 8 3528 1 1 12 GLY CA C -3.920 5.332 8.414 1.00 . A A . 12 GLY CA 1 1 8 3529 1 1 12 GLY H H -3.054 3.573 9.271 1.00 . A A . 12 GLY H 1 1 8 3530 1 1 12 GLY HA2 H -4.737 5.152 9.109 1.00 . A A . 12 GLY HA2 1 1 8 3531 1 1 12 GLY HA3 H -3.563 6.350 8.577 1.00 . A A . 12 GLY HA3 1 1 8 3532 1 1 12 GLY N N -2.835 4.401 8.740 1.00 . A A . 12 GLY N 1 1 8 3533 1 1 12 GLY O O -5.155 6.214 6.568 1.00 . A A . 12 GLY O 1 1 8 3534 1 1 13 TYR C C -5.234 2.860 4.257 1.00 . A A . 13 TYR C 1 1 8 3535 1 1 13 TYR CA C -4.547 4.152 4.781 1.00 . A A . 13 TYR CA 1 1 8 3536 1 1 13 TYR CB C -3.224 4.508 4.054 1.00 . A A . 13 TYR CB 1 1 8 3537 1 1 13 TYR CD1 C -4.366 4.916 1.788 1.00 . A A . 13 TYR CD1 1 1 8 3538 1 1 13 TYR CD2 C -2.654 6.482 2.552 1.00 . A A . 13 TYR CD2 1 1 8 3539 1 1 13 TYR CE1 C -4.698 5.791 0.735 1.00 . A A . 13 TYR CE1 1 1 8 3540 1 1 13 TYR CE2 C -2.967 7.338 1.473 1.00 . A A . 13 TYR CE2 1 1 8 3541 1 1 13 TYR CG C -3.379 5.279 2.741 1.00 . A A . 13 TYR CG 1 1 8 3542 1 1 13 TYR CZ C -3.998 6.998 0.579 1.00 . A A . 13 TYR CZ 1 1 8 3543 1 1 13 TYR H H -3.728 3.427 6.634 1.00 . A A . 13 TYR H 1 1 8 3544 1 1 13 TYR HA H -5.256 4.947 4.536 1.00 . A A . 13 TYR HA 1 1 8 3545 1 1 13 TYR HB2 H -2.634 5.141 4.724 1.00 . A A . 13 TYR HB2 1 1 8 3546 1 1 13 TYR HB3 H -2.630 3.606 3.891 1.00 . A A . 13 TYR HB3 1 1 8 3547 1 1 13 TYR HD1 H -4.910 3.990 1.845 1.00 . A A . 13 TYR HD1 1 1 8 3548 1 1 13 TYR HD2 H -1.883 6.775 3.253 1.00 . A A . 13 TYR HD2 1 1 8 3549 1 1 13 TYR HE1 H -5.479 5.518 0.042 1.00 . A A . 13 TYR HE1 1 1 8 3550 1 1 13 TYR HE2 H -2.437 8.268 1.342 1.00 . A A . 13 TYR HE2 1 1 8 3551 1 1 13 TYR HH H -4.985 7.426 -1.010 1.00 . A A . 13 TYR HH 1 1 8 3552 1 1 13 TYR N N -4.292 4.170 6.235 1.00 . A A . 13 TYR N 1 1 8 3553 1 1 13 TYR O O -4.746 2.197 3.341 1.00 . A A . 13 TYR O 1 1 8 3554 1 1 13 TYR OH O -4.319 7.824 -0.447 1.00 . A A . 13 TYR OH 1 1 8 3555 1 1 14 SER C C -8.229 1.991 3.111 1.00 . A A . 14 SER C 1 1 8 3556 1 1 14 SER CA C -7.279 1.459 4.212 1.00 . A A . 14 SER CA 1 1 8 3557 1 1 14 SER CB C -8.027 0.720 5.330 1.00 . A A . 14 SER CB 1 1 8 3558 1 1 14 SER H H -6.768 3.088 5.537 1.00 . A A . 14 SER H 1 1 8 3559 1 1 14 SER HA H -6.646 0.706 3.740 1.00 . A A . 14 SER HA 1 1 8 3560 1 1 14 SER HB2 H -7.311 0.439 6.111 1.00 . A A . 14 SER HB2 1 1 8 3561 1 1 14 SER HB3 H -8.789 1.372 5.762 1.00 . A A . 14 SER HB3 1 1 8 3562 1 1 14 SER HG H -9.273 -0.800 5.410 1.00 . A A . 14 SER HG 1 1 8 3563 1 1 14 SER N N -6.423 2.524 4.776 1.00 . A A . 14 SER N 1 1 8 3564 1 1 14 SER O O -9.435 2.132 3.304 1.00 . A A . 14 SER O 1 1 8 3565 1 1 14 SER OG O -8.612 -0.462 4.796 1.00 . A A . 14 SER OG 1 1 8 3566 1 1 15 GLY C C -7.450 2.954 -0.464 1.00 . A A . 15 GLY C 1 1 8 3567 1 1 15 GLY CA C -8.339 2.940 0.800 1.00 . A A . 15 GLY CA 1 1 8 3568 1 1 15 GLY H H -6.656 2.183 1.886 1.00 . A A . 15 GLY H 1 1 8 3569 1 1 15 GLY HA2 H -9.249 2.379 0.583 1.00 . A A . 15 GLY HA2 1 1 8 3570 1 1 15 GLY HA3 H -8.609 3.968 1.047 1.00 . A A . 15 GLY HA3 1 1 8 3571 1 1 15 GLY N N -7.657 2.329 1.952 1.00 . A A . 15 GLY N 1 1 8 3572 1 1 15 GLY O O -6.251 2.687 -0.365 1.00 . A A . 15 GLY O 1 1 8 3573 1 1 16 PRO C C -6.115 4.083 -3.099 1.00 . A A . 16 PRO C 1 1 8 3574 1 1 16 PRO CA C -7.263 3.062 -2.911 1.00 . A A . 16 PRO CA 1 1 8 3575 1 1 16 PRO CB C -8.334 3.156 -4.011 1.00 . A A . 16 PRO CB 1 1 8 3576 1 1 16 PRO CD C -9.375 3.627 -1.911 1.00 . A A . 16 PRO CD 1 1 8 3577 1 1 16 PRO CG C -9.411 4.045 -3.381 1.00 . A A . 16 PRO CG 1 1 8 3578 1 1 16 PRO HA H -6.850 2.050 -2.948 1.00 . A A . 16 PRO HA 1 1 8 3579 1 1 16 PRO HB2 H -7.945 3.567 -4.948 1.00 . A A . 16 PRO HB2 1 1 8 3580 1 1 16 PRO HB3 H -8.754 2.169 -4.202 1.00 . A A . 16 PRO HB3 1 1 8 3581 1 1 16 PRO HD2 H -9.703 4.449 -1.271 1.00 . A A . 16 PRO HD2 1 1 8 3582 1 1 16 PRO HD3 H -10.031 2.766 -1.767 1.00 . A A . 16 PRO HD3 1 1 8 3583 1 1 16 PRO HG2 H -9.118 5.094 -3.475 1.00 . A A . 16 PRO HG2 1 1 8 3584 1 1 16 PRO HG3 H -10.399 3.902 -3.820 1.00 . A A . 16 PRO HG3 1 1 8 3585 1 1 16 PRO N N -7.996 3.235 -1.659 1.00 . A A . 16 PRO N 1 1 8 3586 1 1 16 PRO O O -6.346 5.278 -3.253 1.00 . A A . 16 PRO O 1 1 8 3587 1 1 17 THR C C -2.719 3.220 -4.331 1.00 . A A . 17 THR C 1 1 8 3588 1 1 17 THR CA C -3.688 4.267 -3.727 1.00 . A A . 17 THR CA 1 1 8 3589 1 1 17 THR CB C -3.050 5.237 -2.717 1.00 . A A . 17 THR CB 1 1 8 3590 1 1 17 THR CG2 C -2.559 4.576 -1.427 1.00 . A A . 17 THR CG2 1 1 8 3591 1 1 17 THR H H -4.750 2.634 -2.841 1.00 . A A . 17 THR H 1 1 8 3592 1 1 17 THR HA H -4.007 4.890 -4.568 1.00 . A A . 17 THR HA 1 1 8 3593 1 1 17 THR HB H -3.804 5.979 -2.451 1.00 . A A . 17 THR HB 1 1 8 3594 1 1 17 THR HG1 H -1.199 5.442 -3.291 1.00 . A A . 17 THR HG1 1 1 8 3595 1 1 17 THR HG21 H -1.832 3.795 -1.622 1.00 . A A . 17 THR HG21 1 1 8 3596 1 1 17 THR HG22 H -2.114 5.326 -0.773 1.00 . A A . 17 THR HG22 1 1 8 3597 1 1 17 THR HG23 H -3.408 4.125 -0.920 1.00 . A A . 17 THR HG23 1 1 8 3598 1 1 17 THR N N -4.873 3.593 -3.147 1.00 . A A . 17 THR N 1 1 8 3599 1 1 17 THR O O -1.608 2.976 -3.852 1.00 . A A . 17 THR O 1 1 8 3600 1 1 17 THR OG1 O -2.010 5.958 -3.330 1.00 . A A . 17 THR OG1 1 1 8 3601 1 1 18 VAL C C -2.052 0.675 -6.704 1.00 . A A . 18 VAL C 1 1 8 3602 1 1 18 VAL CA C -3.099 1.090 -5.630 1.00 . A A . 18 VAL CA 1 1 8 3603 1 1 18 VAL CB C -4.523 0.550 -5.925 1.00 . A A . 18 VAL CB 1 1 8 3604 1 1 18 VAL CG1 C -5.123 1.113 -7.228 1.00 . A A . 18 VAL CG1 1 1 8 3605 1 1 18 VAL CG2 C -4.621 -0.983 -5.941 1.00 . A A . 18 VAL CG2 1 1 8 3606 1 1 18 VAL H H -4.077 2.959 -5.723 1.00 . A A . 18 VAL H 1 1 8 3607 1 1 18 VAL HA H -2.772 0.618 -4.703 1.00 . A A . 18 VAL HA 1 1 8 3608 1 1 18 VAL HB H -5.167 0.877 -5.103 1.00 . A A . 18 VAL HB 1 1 8 3609 1 1 18 VAL HG11 H -4.496 0.851 -8.082 1.00 . A A . 18 VAL HG11 1 1 8 3610 1 1 18 VAL HG12 H -6.119 0.698 -7.387 1.00 . A A . 18 VAL HG12 1 1 8 3611 1 1 18 VAL HG13 H -5.211 2.198 -7.181 1.00 . A A . 18 VAL HG13 1 1 8 3612 1 1 18 VAL HG21 H -4.120 -1.404 -5.067 1.00 . A A . 18 VAL HG21 1 1 8 3613 1 1 18 VAL HG22 H -5.671 -1.273 -5.919 1.00 . A A . 18 VAL HG22 1 1 8 3614 1 1 18 VAL HG23 H -4.186 -1.400 -6.848 1.00 . A A . 18 VAL HG23 1 1 8 3615 1 1 18 VAL N N -3.239 2.537 -5.361 1.00 . A A . 18 VAL N 1 1 8 3616 1 1 18 VAL O O -1.550 1.497 -7.466 1.00 . A A . 18 VAL O 1 1 8 3617 1 1 19 CYS C C -1.079 -2.553 -8.285 1.00 . A A . 19 CYS C 1 1 8 3618 1 1 19 CYS CA C -0.647 -1.243 -7.550 1.00 . A A . 19 CYS CA 1 1 8 3619 1 1 19 CYS CB C 0.509 -1.474 -6.556 1.00 . A A . 19 CYS CB 1 1 8 3620 1 1 19 CYS H H -2.220 -1.239 -6.123 1.00 . A A . 19 CYS H 1 1 8 3621 1 1 19 CYS HA H -0.306 -0.544 -8.315 1.00 . A A . 19 CYS HA 1 1 8 3622 1 1 19 CYS HB2 H 0.713 -0.547 -6.019 1.00 . A A . 19 CYS HB2 1 1 8 3623 1 1 19 CYS HB3 H 0.187 -2.204 -5.823 1.00 . A A . 19 CYS HB3 1 1 8 3624 1 1 19 CYS N N -1.727 -0.626 -6.755 1.00 . A A . 19 CYS N 1 1 8 3625 1 1 19 CYS O O -2.195 -3.053 -8.119 1.00 . A A . 19 CYS O 1 1 8 3626 1 1 19 CYS SG S 2.121 -2.017 -7.184 1.00 . A A . 19 CYS SG 1 1 8 3627 1 1 20 ALA C C -0.263 -5.592 -8.513 1.00 . A A . 20 ALA C 1 1 8 3628 1 1 20 ALA CA C -0.272 -4.506 -9.626 1.00 . A A . 20 ALA CA 1 1 8 3629 1 1 20 ALA CB C 0.892 -4.715 -10.604 1.00 . A A . 20 ALA CB 1 1 8 3630 1 1 20 ALA H H 0.687 -2.651 -9.237 1.00 . A A . 20 ALA H 1 1 8 3631 1 1 20 ALA HA H -1.203 -4.601 -10.188 1.00 . A A . 20 ALA HA 1 1 8 3632 1 1 20 ALA HB1 H 0.848 -3.978 -11.408 1.00 . A A . 20 ALA HB1 1 1 8 3633 1 1 20 ALA HB2 H 1.844 -4.607 -10.079 1.00 . A A . 20 ALA HB2 1 1 8 3634 1 1 20 ALA HB3 H 0.847 -5.715 -11.040 1.00 . A A . 20 ALA HB3 1 1 8 3635 1 1 20 ALA N N -0.189 -3.130 -9.106 1.00 . A A . 20 ALA N 1 1 8 3636 1 1 20 ALA O O 0.221 -5.357 -7.415 1.00 . A A . 20 ALA O 1 1 8 3637 1 1 21 SER C C 0.357 -8.354 -7.113 1.00 . A A . 21 SER C 1 1 8 3638 1 1 21 SER CA C -0.968 -7.838 -7.738 1.00 . A A . 21 SER CA 1 1 8 3639 1 1 21 SER CB C -1.752 -9.026 -8.320 1.00 . A A . 21 SER CB 1 1 8 3640 1 1 21 SER H H -1.103 -6.973 -9.716 1.00 . A A . 21 SER H 1 1 8 3641 1 1 21 SER HA H -1.575 -7.405 -6.938 1.00 . A A . 21 SER HA 1 1 8 3642 1 1 21 SER HB2 H -2.575 -8.668 -8.939 1.00 . A A . 21 SER HB2 1 1 8 3643 1 1 21 SER HB3 H -1.088 -9.631 -8.950 1.00 . A A . 21 SER HB3 1 1 8 3644 1 1 21 SER HG H -2.126 -10.732 -7.400 1.00 . A A . 21 SER HG 1 1 8 3645 1 1 21 SER N N -0.813 -6.787 -8.772 1.00 . A A . 21 SER N 1 1 8 3646 1 1 21 SER O O 1.332 -8.557 -7.832 1.00 . A A . 21 SER O 1 1 8 3647 1 1 21 SER OG O -2.296 -9.794 -7.258 1.00 . A A . 21 SER OG 1 1 8 3648 1 1 22 GLY C C 1.440 -8.965 -3.546 1.00 . A A . 22 GLY C 1 1 8 3649 1 1 22 GLY CA C 1.530 -9.172 -5.070 1.00 . A A . 22 GLY CA 1 1 8 3650 1 1 22 GLY H H -0.486 -8.479 -5.291 1.00 . A A . 22 GLY H 1 1 8 3651 1 1 22 GLY HA2 H 1.593 -10.243 -5.275 1.00 . A A . 22 GLY HA2 1 1 8 3652 1 1 22 GLY HA3 H 2.455 -8.708 -5.420 1.00 . A A . 22 GLY HA3 1 1 8 3653 1 1 22 GLY N N 0.375 -8.617 -5.800 1.00 . A A . 22 GLY N 1 1 8 3654 1 1 22 GLY O O 1.175 -9.903 -2.797 1.00 . A A . 22 GLY O 1 1 8 3655 1 1 23 THR C C 2.409 -7.225 -0.737 1.00 . A A . 23 THR C 1 1 8 3656 1 1 23 THR CA C 1.255 -7.191 -1.770 1.00 . A A . 23 THR CA 1 1 8 3657 1 1 23 THR CB C -0.092 -7.771 -1.252 1.00 . A A . 23 THR CB 1 1 8 3658 1 1 23 THR CG2 C -0.742 -6.897 -0.176 1.00 . A A . 23 THR CG2 1 1 8 3659 1 1 23 THR H H 1.902 -7.042 -3.801 1.00 . A A . 23 THR H 1 1 8 3660 1 1 23 THR HA H 1.060 -6.134 -1.916 1.00 . A A . 23 THR HA 1 1 8 3661 1 1 23 THR HB H 0.060 -8.779 -0.854 1.00 . A A . 23 THR HB 1 1 8 3662 1 1 23 THR HG1 H -1.887 -8.110 -1.904 1.00 . A A . 23 THR HG1 1 1 8 3663 1 1 23 THR HG21 H -0.904 -5.897 -0.578 1.00 . A A . 23 THR HG21 1 1 8 3664 1 1 23 THR HG22 H -1.706 -7.311 0.126 1.00 . A A . 23 THR HG22 1 1 8 3665 1 1 23 THR HG23 H -0.113 -6.835 0.708 1.00 . A A . 23 THR HG23 1 1 8 3666 1 1 23 THR N N 1.615 -7.713 -3.108 1.00 . A A . 23 THR N 1 1 8 3667 1 1 23 THR O O 2.221 -7.609 0.416 1.00 . A A . 23 THR O 1 1 8 3668 1 1 23 THR OG1 O -1.062 -7.800 -2.291 1.00 . A A . 23 THR OG1 1 1 8 3669 1 1 24 THR C C 4.799 -5.319 0.522 1.00 . A A . 24 THR C 1 1 8 3670 1 1 24 THR CA C 4.813 -6.636 -0.292 1.00 . A A . 24 THR CA 1 1 8 3671 1 1 24 THR CB C 6.096 -6.767 -1.134 1.00 . A A . 24 THR CB 1 1 8 3672 1 1 24 THR CG2 C 6.391 -8.221 -1.520 1.00 . A A . 24 THR CG2 1 1 8 3673 1 1 24 THR H H 3.732 -6.463 -2.085 1.00 . A A . 24 THR H 1 1 8 3674 1 1 24 THR HA H 4.839 -7.468 0.417 1.00 . A A . 24 THR HA 1 1 8 3675 1 1 24 THR HB H 6.946 -6.395 -0.550 1.00 . A A . 24 THR HB 1 1 8 3676 1 1 24 THR HG1 H 6.896 -5.810 -2.585 1.00 . A A . 24 THR HG1 1 1 8 3677 1 1 24 THR HG21 H 6.527 -8.837 -0.631 1.00 . A A . 24 THR HG21 1 1 8 3678 1 1 24 THR HG22 H 5.582 -8.628 -2.126 1.00 . A A . 24 THR HG22 1 1 8 3679 1 1 24 THR HG23 H 7.313 -8.242 -2.102 1.00 . A A . 24 THR HG23 1 1 8 3680 1 1 24 THR N N 3.611 -6.785 -1.136 1.00 . A A . 24 THR N 1 1 8 3681 1 1 24 THR O O 4.967 -4.211 0.008 1.00 . A A . 24 THR O 1 1 8 3682 1 1 24 THR OG1 O 5.984 -6.056 -2.349 1.00 . A A . 24 THR OG1 1 1 8 3683 1 1 25 CYS C C 5.110 -3.473 3.310 1.00 . A A . 25 CYS C 1 1 8 3684 1 1 25 CYS CA C 4.019 -4.392 2.706 1.00 . A A . 25 CYS CA 1 1 8 3685 1 1 25 CYS CB C 3.126 -5.070 3.766 1.00 . A A . 25 CYS CB 1 1 8 3686 1 1 25 CYS H H 4.391 -6.404 2.136 1.00 . A A . 25 CYS H 1 1 8 3687 1 1 25 CYS HA H 3.401 -3.735 2.097 1.00 . A A . 25 CYS HA 1 1 8 3688 1 1 25 CYS HB2 H 2.507 -5.826 3.280 1.00 . A A . 25 CYS HB2 1 1 8 3689 1 1 25 CYS HB3 H 3.744 -5.561 4.516 1.00 . A A . 25 CYS HB3 1 1 8 3690 1 1 25 CYS N N 4.508 -5.455 1.822 1.00 . A A . 25 CYS N 1 1 8 3691 1 1 25 CYS O O 5.283 -3.406 4.526 1.00 . A A . 25 CYS O 1 1 8 3692 1 1 25 CYS SG S 1.957 -4.011 4.647 1.00 . A A . 25 CYS SG 1 1 8 3693 1 1 26 GLN C C 6.294 -0.274 2.577 1.00 . A A . 26 GLN C 1 1 8 3694 1 1 26 GLN CA C 6.812 -1.715 2.837 1.00 . A A . 26 GLN CA 1 1 8 3695 1 1 26 GLN CB C 8.163 -2.095 2.196 1.00 . A A . 26 GLN CB 1 1 8 3696 1 1 26 GLN CD C 9.611 -1.085 4.099 1.00 . A A . 26 GLN CD 1 1 8 3697 1 1 26 GLN CG C 9.384 -1.234 2.593 1.00 . A A . 26 GLN CG 1 1 8 3698 1 1 26 GLN H H 5.684 -2.933 1.463 1.00 . A A . 26 GLN H 1 1 8 3699 1 1 26 GLN HA H 6.956 -1.755 3.918 1.00 . A A . 26 GLN HA 1 1 8 3700 1 1 26 GLN HB2 H 8.382 -3.131 2.469 1.00 . A A . 26 GLN HB2 1 1 8 3701 1 1 26 GLN HB3 H 8.072 -2.074 1.111 1.00 . A A . 26 GLN HB3 1 1 8 3702 1 1 26 GLN HE21 H 9.024 -2.967 4.524 1.00 . A A . 26 GLN HE21 1 1 8 3703 1 1 26 GLN HE22 H 9.552 -1.949 5.876 1.00 . A A . 26 GLN HE22 1 1 8 3704 1 1 26 GLN HG2 H 10.285 -1.695 2.180 1.00 . A A . 26 GLN HG2 1 1 8 3705 1 1 26 GLN HG3 H 9.312 -0.243 2.139 1.00 . A A . 26 GLN HG3 1 1 8 3706 1 1 26 GLN N N 5.832 -2.745 2.451 1.00 . A A . 26 GLN N 1 1 8 3707 1 1 26 GLN NE2 N 9.368 -2.101 4.900 1.00 . A A . 26 GLN NE2 1 1 8 3708 1 1 26 GLN O O 5.180 -0.068 2.082 1.00 . A A . 26 GLN O 1 1 8 3709 1 1 26 GLN OE1 O 9.984 -0.030 4.581 1.00 . A A . 26 GLN OE1 1 1 8 3710 1 1 27 VAL C C 7.255 3.250 2.602 1.00 . A A . 27 VAL C 1 1 8 3711 1 1 27 VAL CA C 6.479 2.102 3.296 1.00 . A A . 27 VAL CA 1 1 8 3712 1 1 27 VAL CB C 6.380 2.283 4.827 1.00 . A A . 27 VAL CB 1 1 8 3713 1 1 27 VAL CG1 C 7.740 2.479 5.521 1.00 . A A . 27 VAL CG1 1 1 8 3714 1 1 27 VAL CG2 C 5.421 3.430 5.180 1.00 . A A . 27 VAL CG2 1 1 8 3715 1 1 27 VAL H H 7.948 0.575 3.375 1.00 . A A . 27 VAL H 1 1 8 3716 1 1 27 VAL HA H 5.461 2.158 2.909 1.00 . A A . 27 VAL HA 1 1 8 3717 1 1 27 VAL HB H 5.928 1.385 5.259 1.00 . A A . 27 VAL HB 1 1 8 3718 1 1 27 VAL HG11 H 8.267 3.355 5.148 1.00 . A A . 27 VAL HG11 1 1 8 3719 1 1 27 VAL HG12 H 7.603 2.593 6.595 1.00 . A A . 27 VAL HG12 1 1 8 3720 1 1 27 VAL HG13 H 8.352 1.600 5.355 1.00 . A A . 27 VAL HG13 1 1 8 3721 1 1 27 VAL HG21 H 5.738 4.341 4.680 1.00 . A A . 27 VAL HG21 1 1 8 3722 1 1 27 VAL HG22 H 4.410 3.186 4.849 1.00 . A A . 27 VAL HG22 1 1 8 3723 1 1 27 VAL HG23 H 5.410 3.585 6.261 1.00 . A A . 27 VAL HG23 1 1 8 3724 1 1 27 VAL N N 7.020 0.759 3.026 1.00 . A A . 27 VAL N 1 1 8 3725 1 1 27 VAL O O 8.479 3.230 2.530 1.00 . A A . 27 VAL O 1 1 8 3726 1 1 28 LEU C C 7.225 6.619 2.558 1.00 . A A . 28 LEU C 1 1 8 3727 1 1 28 LEU CA C 7.110 5.488 1.504 1.00 . A A . 28 LEU CA 1 1 8 3728 1 1 28 LEU CB C 6.285 5.955 0.284 1.00 . A A . 28 LEU CB 1 1 8 3729 1 1 28 LEU CD1 C 5.867 3.685 -0.822 1.00 . A A . 28 LEU CD1 1 1 8 3730 1 1 28 LEU CD2 C 5.753 5.772 -2.178 1.00 . A A . 28 LEU CD2 1 1 8 3731 1 1 28 LEU CG C 6.449 5.095 -0.985 1.00 . A A . 28 LEU CG 1 1 8 3732 1 1 28 LEU H H 5.532 4.166 2.133 1.00 . A A . 28 LEU H 1 1 8 3733 1 1 28 LEU HA H 8.122 5.287 1.142 1.00 . A A . 28 LEU HA 1 1 8 3734 1 1 28 LEU HB2 H 5.227 6.035 0.540 1.00 . A A . 28 LEU HB2 1 1 8 3735 1 1 28 LEU HB3 H 6.631 6.959 0.025 1.00 . A A . 28 LEU HB3 1 1 8 3736 1 1 28 LEU HD11 H 4.860 3.748 -0.412 1.00 . A A . 28 LEU HD11 1 1 8 3737 1 1 28 LEU HD12 H 5.830 3.182 -1.788 1.00 . A A . 28 LEU HD12 1 1 8 3738 1 1 28 LEU HD13 H 6.494 3.084 -0.165 1.00 . A A . 28 LEU HD13 1 1 8 3739 1 1 28 LEU HD21 H 6.191 6.755 -2.363 1.00 . A A . 28 LEU HD21 1 1 8 3740 1 1 28 LEU HD22 H 5.879 5.167 -3.079 1.00 . A A . 28 LEU HD22 1 1 8 3741 1 1 28 LEU HD23 H 4.686 5.890 -1.983 1.00 . A A . 28 LEU HD23 1 1 8 3742 1 1 28 LEU HG H 7.511 5.010 -1.222 1.00 . A A . 28 LEU HG 1 1 8 3743 1 1 28 LEU N N 6.533 4.255 2.081 1.00 . A A . 28 LEU N 1 1 8 3744 1 1 28 LEU O O 8.307 7.121 2.846 1.00 . A A . 28 LEU O 1 1 8 3745 1 1 29 ASN C C 6.277 7.242 5.627 1.00 . A A . 29 ASN C 1 1 8 3746 1 1 29 ASN CA C 5.992 7.952 4.267 1.00 . A A . 29 ASN CA 1 1 8 3747 1 1 29 ASN CB C 4.571 8.564 4.248 1.00 . A A . 29 ASN CB 1 1 8 3748 1 1 29 ASN CG C 4.174 9.219 2.929 1.00 . A A . 29 ASN CG 1 1 8 3749 1 1 29 ASN H H 5.247 6.569 2.811 1.00 . A A . 29 ASN H 1 1 8 3750 1 1 29 ASN HA H 6.721 8.762 4.149 1.00 . A A . 29 ASN HA 1 1 8 3751 1 1 29 ASN HB2 H 3.863 7.767 4.472 1.00 . A A . 29 ASN HB2 1 1 8 3752 1 1 29 ASN HB3 H 4.475 9.333 5.014 1.00 . A A . 29 ASN HB3 1 1 8 3753 1 1 29 ASN HD21 H 2.250 8.541 3.036 1.00 . A A . 29 ASN HD21 1 1 8 3754 1 1 29 ASN HD22 H 2.716 9.518 1.634 1.00 . A A . 29 ASN HD22 1 1 8 3755 1 1 29 ASN N N 6.083 7.022 3.130 1.00 . A A . 29 ASN N 1 1 8 3756 1 1 29 ASN ND2 N 2.939 9.048 2.494 1.00 . A A . 29 ASN ND2 1 1 8 3757 1 1 29 ASN O O 6.826 6.145 5.664 1.00 . A A . 29 ASN O 1 1 8 3758 1 1 29 ASN OD1 O 4.957 9.898 2.289 1.00 . A A . 29 ASN OD1 1 1 8 3759 1 1 30 PRO C C 3.677 6.598 7.332 1.00 . A A . 30 PRO C 1 1 8 3760 1 1 30 PRO CA C 5.103 6.996 7.783 1.00 . A A . 30 PRO CA 1 1 8 3761 1 1 30 PRO CB C 5.123 7.871 9.050 1.00 . A A . 30 PRO CB 1 1 8 3762 1 1 30 PRO CD C 6.208 9.068 7.286 1.00 . A A . 30 PRO CD 1 1 8 3763 1 1 30 PRO CG C 6.286 8.836 8.796 1.00 . A A . 30 PRO CG 1 1 8 3764 1 1 30 PRO HA H 5.679 6.089 7.982 1.00 . A A . 30 PRO HA 1 1 8 3765 1 1 30 PRO HB2 H 4.205 8.456 9.146 1.00 . A A . 30 PRO HB2 1 1 8 3766 1 1 30 PRO HB3 H 5.271 7.276 9.956 1.00 . A A . 30 PRO HB3 1 1 8 3767 1 1 30 PRO HD2 H 5.465 9.836 7.070 1.00 . A A . 30 PRO HD2 1 1 8 3768 1 1 30 PRO HD3 H 7.182 9.382 6.901 1.00 . A A . 30 PRO HD3 1 1 8 3769 1 1 30 PRO HG2 H 6.196 9.762 9.366 1.00 . A A . 30 PRO HG2 1 1 8 3770 1 1 30 PRO HG3 H 7.227 8.339 9.045 1.00 . A A . 30 PRO HG3 1 1 8 3771 1 1 30 PRO N N 5.777 7.788 6.750 1.00 . A A . 30 PRO N 1 1 8 3772 1 1 30 PRO O O 3.362 5.422 7.180 1.00 . A A . 30 PRO O 1 1 8 3773 1 1 31 TYR C C 1.314 6.810 5.184 1.00 . A A . 31 TYR C 1 1 8 3774 1 1 31 TYR CA C 1.426 7.401 6.612 1.00 . A A . 31 TYR CA 1 1 8 3775 1 1 31 TYR CB C 0.656 8.726 6.773 1.00 . A A . 31 TYR CB 1 1 8 3776 1 1 31 TYR CD1 C 1.322 9.795 8.989 1.00 . A A . 31 TYR CD1 1 1 8 3777 1 1 31 TYR CD2 C -0.798 8.585 8.853 1.00 . A A . 31 TYR CD2 1 1 8 3778 1 1 31 TYR CE1 C 1.115 9.993 10.371 1.00 . A A . 31 TYR CE1 1 1 8 3779 1 1 31 TYR CE2 C -1.000 8.785 10.237 1.00 . A A . 31 TYR CE2 1 1 8 3780 1 1 31 TYR CG C 0.365 9.090 8.223 1.00 . A A . 31 TYR CG 1 1 8 3781 1 1 31 TYR CZ C -0.039 9.482 10.992 1.00 . A A . 31 TYR CZ 1 1 8 3782 1 1 31 TYR H H 3.133 8.532 7.205 1.00 . A A . 31 TYR H 1 1 8 3783 1 1 31 TYR HA H 0.945 6.679 7.271 1.00 . A A . 31 TYR HA 1 1 8 3784 1 1 31 TYR HB2 H 1.217 9.531 6.291 1.00 . A A . 31 TYR HB2 1 1 8 3785 1 1 31 TYR HB3 H -0.301 8.645 6.250 1.00 . A A . 31 TYR HB3 1 1 8 3786 1 1 31 TYR HD1 H 2.225 10.168 8.525 1.00 . A A . 31 TYR HD1 1 1 8 3787 1 1 31 TYR HD2 H -1.521 8.020 8.281 1.00 . A A . 31 TYR HD2 1 1 8 3788 1 1 31 TYR HE1 H 1.843 10.527 10.964 1.00 . A A . 31 TYR HE1 1 1 8 3789 1 1 31 TYR HE2 H -1.881 8.385 10.714 1.00 . A A . 31 TYR HE2 1 1 8 3790 1 1 31 TYR HH H -1.039 9.241 12.611 1.00 . A A . 31 TYR HH 1 1 8 3791 1 1 31 TYR N N 2.813 7.588 7.070 1.00 . A A . 31 TYR N 1 1 8 3792 1 1 31 TYR O O 1.085 7.532 4.211 1.00 . A A . 31 TYR O 1 1 8 3793 1 1 31 TYR OH O -0.221 9.652 12.327 1.00 . A A . 31 TYR OH 1 1 8 3794 1 1 32 TYR C C 1.454 3.130 4.251 1.00 . A A . 32 TYR C 1 1 8 3795 1 1 32 TYR CA C 1.274 4.641 3.889 1.00 . A A . 32 TYR CA 1 1 8 3796 1 1 32 TYR CB C 2.218 5.089 2.730 1.00 . A A . 32 TYR CB 1 1 8 3797 1 1 32 TYR CD1 C 1.533 3.832 0.626 1.00 . A A . 32 TYR CD1 1 1 8 3798 1 1 32 TYR CD2 C 1.268 6.248 0.637 1.00 . A A . 32 TYR CD2 1 1 8 3799 1 1 32 TYR CE1 C 0.986 3.770 -0.668 1.00 . A A . 32 TYR CE1 1 1 8 3800 1 1 32 TYR CE2 C 0.876 6.196 -0.726 1.00 . A A . 32 TYR CE2 1 1 8 3801 1 1 32 TYR CG C 1.629 5.057 1.318 1.00 . A A . 32 TYR CG 1 1 8 3802 1 1 32 TYR CZ C 0.755 4.954 -1.381 1.00 . A A . 32 TYR CZ 1 1 8 3803 1 1 32 TYR H H 1.822 5.031 5.919 1.00 . A A . 32 TYR H 1 1 8 3804 1 1 32 TYR HA H 0.235 4.795 3.589 1.00 . A A . 32 TYR HA 1 1 8 3805 1 1 32 TYR HB2 H 2.593 6.096 2.898 1.00 . A A . 32 TYR HB2 1 1 8 3806 1 1 32 TYR HB3 H 3.115 4.466 2.749 1.00 . A A . 32 TYR HB3 1 1 8 3807 1 1 32 TYR HD1 H 1.944 2.945 1.059 1.00 . A A . 32 TYR HD1 1 1 8 3808 1 1 32 TYR HD2 H 1.311 7.200 1.147 1.00 . A A . 32 TYR HD2 1 1 8 3809 1 1 32 TYR HE1 H 0.806 2.815 -1.133 1.00 . A A . 32 TYR HE1 1 1 8 3810 1 1 32 TYR HE2 H 0.637 7.104 -1.257 1.00 . A A . 32 TYR HE2 1 1 8 3811 1 1 32 TYR HH H -0.005 4.045 -2.927 1.00 . A A . 32 TYR HH 1 1 8 3812 1 1 32 TYR N N 1.499 5.490 5.071 1.00 . A A . 32 TYR N 1 1 8 3813 1 1 32 TYR O O 1.869 2.786 5.356 1.00 . A A . 32 TYR O 1 1 8 3814 1 1 32 TYR OH O 0.423 4.877 -2.698 1.00 . A A . 32 TYR OH 1 1 8 3815 1 1 33 SER C C 1.731 0.392 1.653 1.00 . A A . 33 SER C 1 1 8 3816 1 1 33 SER CA C 2.076 1.059 3.007 1.00 . A A . 33 SER CA 1 1 8 3817 1 1 33 SER CB C 2.181 0.028 4.136 1.00 . A A . 33 SER CB 1 1 8 3818 1 1 33 SER H H 0.657 2.572 2.531 1.00 . A A . 33 SER H 1 1 8 3819 1 1 33 SER HA H 3.082 1.473 2.908 1.00 . A A . 33 SER HA 1 1 8 3820 1 1 33 SER HB2 H 2.551 0.484 5.056 1.00 . A A . 33 SER HB2 1 1 8 3821 1 1 33 SER HB3 H 1.215 -0.434 4.332 1.00 . A A . 33 SER HB3 1 1 8 3822 1 1 33 SER HG H 3.926 -0.617 3.430 1.00 . A A . 33 SER HG 1 1 8 3823 1 1 33 SER N N 1.195 2.218 3.307 1.00 . A A . 33 SER N 1 1 8 3824 1 1 33 SER O O 0.573 0.035 1.409 1.00 . A A . 33 SER O 1 1 8 3825 1 1 33 SER OG O 3.093 -0.985 3.755 1.00 . A A . 33 SER OG 1 1 8 3826 1 1 34 GLN C C 2.957 -1.240 -1.171 1.00 . A A . 34 GLN C 1 1 8 3827 1 1 34 GLN CA C 2.559 0.187 -0.701 1.00 . A A . 34 GLN CA 1 1 8 3828 1 1 34 GLN CB C 3.322 1.327 -1.418 1.00 . A A . 34 GLN CB 1 1 8 3829 1 1 34 GLN CD C 4.063 1.811 -3.818 1.00 . A A . 34 GLN CD 1 1 8 3830 1 1 34 GLN CG C 2.891 1.507 -2.895 1.00 . A A . 34 GLN CG 1 1 8 3831 1 1 34 GLN H H 3.654 0.526 1.094 1.00 . A A . 34 GLN H 1 1 8 3832 1 1 34 GLN HA H 1.507 0.310 -0.969 1.00 . A A . 34 GLN HA 1 1 8 3833 1 1 34 GLN HB2 H 3.159 2.275 -0.912 1.00 . A A . 34 GLN HB2 1 1 8 3834 1 1 34 GLN HB3 H 4.393 1.137 -1.331 1.00 . A A . 34 GLN HB3 1 1 8 3835 1 1 34 GLN HE21 H 3.233 3.517 -4.556 1.00 . A A . 34 GLN HE21 1 1 8 3836 1 1 34 GLN HE22 H 4.815 3.020 -5.175 1.00 . A A . 34 GLN HE22 1 1 8 3837 1 1 34 GLN HG2 H 2.428 0.600 -3.278 1.00 . A A . 34 GLN HG2 1 1 8 3838 1 1 34 GLN HG3 H 2.151 2.302 -2.975 1.00 . A A . 34 GLN HG3 1 1 8 3839 1 1 34 GLN N N 2.714 0.371 0.746 1.00 . A A . 34 GLN N 1 1 8 3840 1 1 34 GLN NE2 N 4.017 2.888 -4.576 1.00 . A A . 34 GLN NE2 1 1 8 3841 1 1 34 GLN O O 2.326 -2.199 -0.734 1.00 . A A . 34 GLN O 1 1 8 3842 1 1 34 GLN OE1 O 5.028 1.072 -3.861 1.00 . A A . 34 GLN OE1 1 1 8 3843 1 1 35 CYS C C 5.622 -2.628 -3.366 1.00 . A A . 35 CYS C 1 1 8 3844 1 1 35 CYS CA C 4.113 -2.432 -3.056 1.00 . A A . 35 CYS CA 1 1 8 3845 1 1 35 CYS CB C 3.289 -2.019 -4.299 1.00 . A A . 35 CYS CB 1 1 8 3846 1 1 35 CYS H H 4.449 -0.506 -2.316 1.00 . A A . 35 CYS H 1 1 8 3847 1 1 35 CYS HA H 3.741 -3.375 -2.650 1.00 . A A . 35 CYS HA 1 1 8 3848 1 1 35 CYS HB2 H 2.301 -1.689 -3.980 1.00 . A A . 35 CYS HB2 1 1 8 3849 1 1 35 CYS HB3 H 3.774 -1.173 -4.784 1.00 . A A . 35 CYS HB3 1 1 8 3850 1 1 35 CYS N N 3.924 -1.339 -2.096 1.00 . A A . 35 CYS N 1 1 8 3851 1 1 35 CYS O O 6.055 -2.406 -4.497 1.00 . A A . 35 CYS O 1 1 8 3852 1 1 35 CYS SG S 2.942 -3.231 -5.600 1.00 . A A . 35 CYS SG 1 1 8 3853 1 1 36 LEU C C 8.381 -4.325 -1.574 1.00 . A A . 36 LEU C 1 1 8 3854 1 1 36 LEU CA C 7.885 -3.121 -2.418 1.00 . A A . 36 LEU CA 1 1 8 3855 1 1 36 LEU CB C 8.656 -1.802 -2.106 1.00 . A A . 36 LEU CB 1 1 8 3856 1 1 36 LEU CD1 C 7.144 -0.277 -0.737 1.00 . A A . 36 LEU CD1 1 1 8 3857 1 1 36 LEU CD2 C 8.800 0.727 -2.291 1.00 . A A . 36 LEU CD2 1 1 8 3858 1 1 36 LEU CG C 7.862 -0.474 -2.082 1.00 . A A . 36 LEU CG 1 1 8 3859 1 1 36 LEU H H 5.970 -3.235 -1.476 1.00 . A A . 36 LEU H 1 1 8 3860 1 1 36 LEU HA H 8.136 -3.385 -3.449 1.00 . A A . 36 LEU HA 1 1 8 3861 1 1 36 LEU HB2 H 9.185 -1.887 -1.155 1.00 . A A . 36 LEU HB2 1 1 8 3862 1 1 36 LEU HB3 H 9.427 -1.713 -2.875 1.00 . A A . 36 LEU HB3 1 1 8 3863 1 1 36 LEU HD11 H 6.562 -1.159 -0.471 1.00 . A A . 36 LEU HD11 1 1 8 3864 1 1 36 LEU HD12 H 7.882 -0.090 0.041 1.00 . A A . 36 LEU HD12 1 1 8 3865 1 1 36 LEU HD13 H 6.482 0.582 -0.794 1.00 . A A . 36 LEU HD13 1 1 8 3866 1 1 36 LEU HD21 H 9.303 0.645 -3.256 1.00 . A A . 36 LEU HD21 1 1 8 3867 1 1 36 LEU HD22 H 8.224 1.653 -2.281 1.00 . A A . 36 LEU HD22 1 1 8 3868 1 1 36 LEU HD23 H 9.552 0.769 -1.500 1.00 . A A . 36 LEU HD23 1 1 8 3869 1 1 36 LEU HG H 7.136 -0.462 -2.898 1.00 . A A . 36 LEU HG 1 1 8 3870 1 1 36 LEU N N 6.418 -2.967 -2.345 1.00 . A A . 36 LEU N 1 1 8 3871 1 1 36 LEU O O 8.601 -5.394 -2.178 1.00 . A A . 36 LEU O 1 1 8 3872 1 1 36 LEU OXT O 8.453 -4.194 -0.325 1.00 . A A . 36 LEU OXT 1 1 9 3873 1 1 1 THR C C -3.723 -6.509 -11.512 1.00 . A A . 1 THR C 1 1 9 3874 1 1 1 THR CA C -2.445 -6.287 -12.358 1.00 . A A . 1 THR CA 1 1 9 3875 1 1 1 THR CB C -1.841 -4.906 -11.997 1.00 . A A . 1 THR CB 1 1 9 3876 1 1 1 THR CG2 C -2.640 -3.699 -12.513 1.00 . A A . 1 THR CG2 1 1 9 3877 1 1 1 THR H1 H -3.369 -5.797 -14.140 1.00 . A A . 1 THR H1 1 1 9 3878 1 1 1 THR H2 H -1.796 -6.257 -14.344 1.00 . A A . 1 THR H2 1 1 9 3879 1 1 1 THR H3 H -2.960 -7.382 -14.057 1.00 . A A . 1 THR H3 1 1 9 3880 1 1 1 THR HA H -1.713 -7.037 -12.046 1.00 . A A . 1 THR HA 1 1 9 3881 1 1 1 THR HB H -0.833 -4.840 -12.421 1.00 . A A . 1 THR HB 1 1 9 3882 1 1 1 THR HG1 H -2.216 -4.030 -10.273 1.00 . A A . 1 THR HG1 1 1 9 3883 1 1 1 THR HG21 H -2.708 -3.714 -13.600 1.00 . A A . 1 THR HG21 1 1 9 3884 1 1 1 THR HG22 H -3.644 -3.675 -12.086 1.00 . A A . 1 THR HG22 1 1 9 3885 1 1 1 THR HG23 H -2.129 -2.778 -12.222 1.00 . A A . 1 THR HG23 1 1 9 3886 1 1 1 THR N N -2.651 -6.445 -13.835 1.00 . A A . 1 THR N 1 1 9 3887 1 1 1 THR O O -4.753 -5.923 -11.834 1.00 . A A . 1 THR O 1 1 9 3888 1 1 1 THR OG1 O -1.716 -4.802 -10.595 1.00 . A A . 1 THR OG1 1 1 9 3889 1 1 2 GLN C C -4.773 -6.279 -8.465 1.00 . A A . 2 GLN C 1 1 9 3890 1 1 2 GLN CA C -4.787 -7.454 -9.480 1.00 . A A . 2 GLN CA 1 1 9 3891 1 1 2 GLN CB C -4.684 -8.843 -8.810 1.00 . A A . 2 GLN CB 1 1 9 3892 1 1 2 GLN CD C -7.118 -9.613 -8.936 1.00 . A A . 2 GLN CD 1 1 9 3893 1 1 2 GLN CG C -5.949 -9.249 -8.022 1.00 . A A . 2 GLN CG 1 1 9 3894 1 1 2 GLN H H -2.836 -7.832 -10.236 1.00 . A A . 2 GLN H 1 1 9 3895 1 1 2 GLN HA H -5.745 -7.420 -10.005 1.00 . A A . 2 GLN HA 1 1 9 3896 1 1 2 GLN HB2 H -4.506 -9.611 -9.567 1.00 . A A . 2 GLN HB2 1 1 9 3897 1 1 2 GLN HB3 H -3.830 -8.861 -8.129 1.00 . A A . 2 GLN HB3 1 1 9 3898 1 1 2 GLN HE21 H -8.079 -7.827 -8.662 1.00 . A A . 2 GLN HE21 1 1 9 3899 1 1 2 GLN HE22 H -8.829 -9.037 -9.715 1.00 . A A . 2 GLN HE22 1 1 9 3900 1 1 2 GLN HG2 H -5.722 -10.138 -7.434 1.00 . A A . 2 GLN HG2 1 1 9 3901 1 1 2 GLN HG3 H -6.250 -8.462 -7.328 1.00 . A A . 2 GLN HG3 1 1 9 3902 1 1 2 GLN N N -3.688 -7.336 -10.457 1.00 . A A . 2 GLN N 1 1 9 3903 1 1 2 GLN NE2 N -8.081 -8.733 -9.117 1.00 . A A . 2 GLN NE2 1 1 9 3904 1 1 2 GLN O O -4.581 -6.471 -7.263 1.00 . A A . 2 GLN O 1 1 9 3905 1 1 2 GLN OE1 O -7.163 -10.682 -9.520 1.00 . A A . 2 GLN OE1 1 1 9 3906 1 1 3 SER C C -6.147 -3.639 -7.302 1.00 . A A . 3 SER C 1 1 9 3907 1 1 3 SER CA C -4.867 -3.811 -8.153 1.00 . A A . 3 SER CA 1 1 9 3908 1 1 3 SER CB C -4.580 -2.590 -9.051 1.00 . A A . 3 SER CB 1 1 9 3909 1 1 3 SER H H -5.059 -4.962 -9.958 1.00 . A A . 3 SER H 1 1 9 3910 1 1 3 SER HA H -4.034 -3.868 -7.450 1.00 . A A . 3 SER HA 1 1 9 3911 1 1 3 SER HB2 H -5.305 -2.553 -9.870 1.00 . A A . 3 SER HB2 1 1 9 3912 1 1 3 SER HB3 H -4.697 -1.667 -8.471 1.00 . A A . 3 SER HB3 1 1 9 3913 1 1 3 SER HG H -2.730 -1.946 -9.122 1.00 . A A . 3 SER HG 1 1 9 3914 1 1 3 SER N N -4.903 -5.044 -8.963 1.00 . A A . 3 SER N 1 1 9 3915 1 1 3 SER O O -6.988 -2.789 -7.578 1.00 . A A . 3 SER O 1 1 9 3916 1 1 3 SER OG O -3.248 -2.647 -9.559 1.00 . A A . 3 SER OG 1 1 9 3917 1 1 4 HIS C C -6.920 -4.919 -3.935 1.00 . A A . 4 HIS C 1 1 9 3918 1 1 4 HIS CA C -7.419 -4.625 -5.368 1.00 . A A . 4 HIS CA 1 1 9 3919 1 1 4 HIS CB C -8.363 -5.724 -5.904 1.00 . A A . 4 HIS CB 1 1 9 3920 1 1 4 HIS CD2 C -9.944 -4.674 -7.686 1.00 . A A . 4 HIS CD2 1 1 9 3921 1 1 4 HIS CE1 C -8.929 -5.441 -9.458 1.00 . A A . 4 HIS CE1 1 1 9 3922 1 1 4 HIS CG C -8.884 -5.445 -7.292 1.00 . A A . 4 HIS CG 1 1 9 3923 1 1 4 HIS H H -5.546 -5.190 -6.223 1.00 . A A . 4 HIS H 1 1 9 3924 1 1 4 HIS HA H -7.977 -3.685 -5.331 1.00 . A A . 4 HIS HA 1 1 9 3925 1 1 4 HIS HB2 H -7.842 -6.683 -5.926 1.00 . A A . 4 HIS HB2 1 1 9 3926 1 1 4 HIS HB3 H -9.219 -5.820 -5.232 1.00 . A A . 4 HIS HB3 1 1 9 3927 1 1 4 HIS HD2 H -10.607 -4.127 -7.031 1.00 . A A . 4 HIS HD2 1 1 9 3928 1 1 4 HIS HE1 H -8.682 -5.631 -10.492 1.00 . A A . 4 HIS HE1 1 1 9 3929 1 1 4 HIS HE2 H -10.606 -4.176 -9.660 1.00 . A A . 4 HIS HE2 1 1 9 3930 1 1 4 HIS N N -6.277 -4.493 -6.283 1.00 . A A . 4 HIS N 1 1 9 3931 1 1 4 HIS ND1 N -8.247 -5.951 -8.428 1.00 . A A . 4 HIS ND1 1 1 9 3932 1 1 4 HIS NE2 N -9.957 -4.673 -9.067 1.00 . A A . 4 HIS NE2 1 1 9 3933 1 1 4 HIS O O -7.049 -4.097 -3.031 1.00 . A A . 4 HIS O 1 1 9 3934 1 1 5 ALA C C -4.136 -5.762 -2.509 1.00 . A A . 5 ALA C 1 1 9 3935 1 1 5 ALA CA C -5.541 -6.425 -2.521 1.00 . A A . 5 ALA CA 1 1 9 3936 1 1 5 ALA CB C -5.495 -7.955 -2.398 1.00 . A A . 5 ALA CB 1 1 9 3937 1 1 5 ALA H H -6.189 -6.691 -4.536 1.00 . A A . 5 ALA H 1 1 9 3938 1 1 5 ALA HA H -6.102 -6.071 -1.652 1.00 . A A . 5 ALA HA 1 1 9 3939 1 1 5 ALA HB1 H -6.506 -8.362 -2.432 1.00 . A A . 5 ALA HB1 1 1 9 3940 1 1 5 ALA HB2 H -4.910 -8.397 -3.205 1.00 . A A . 5 ALA HB2 1 1 9 3941 1 1 5 ALA HB3 H -5.053 -8.231 -1.442 1.00 . A A . 5 ALA HB3 1 1 9 3942 1 1 5 ALA N N -6.275 -6.077 -3.742 1.00 . A A . 5 ALA N 1 1 9 3943 1 1 5 ALA O O -3.239 -6.168 -3.251 1.00 . A A . 5 ALA O 1 1 9 3944 1 1 6 GLY C C -2.337 -3.307 -0.337 1.00 . A A . 6 GLY C 1 1 9 3945 1 1 6 GLY CA C -2.741 -3.869 -1.711 1.00 . A A . 6 GLY CA 1 1 9 3946 1 1 6 GLY H H -4.751 -4.412 -1.157 1.00 . A A . 6 GLY H 1 1 9 3947 1 1 6 GLY HA2 H -1.883 -4.431 -2.081 1.00 . A A . 6 GLY HA2 1 1 9 3948 1 1 6 GLY HA3 H -2.900 -3.038 -2.393 1.00 . A A . 6 GLY HA3 1 1 9 3949 1 1 6 GLY N N -3.960 -4.697 -1.716 1.00 . A A . 6 GLY N 1 1 9 3950 1 1 6 GLY O O -1.697 -3.995 0.453 1.00 . A A . 6 GLY O 1 1 9 3951 1 1 7 GLN C C -2.773 -2.034 2.454 1.00 . A A . 7 GLN C 1 1 9 3952 1 1 7 GLN CA C -2.252 -1.343 1.170 1.00 . A A . 7 GLN CA 1 1 9 3953 1 1 7 GLN CB C -2.694 0.134 1.098 1.00 . A A . 7 GLN CB 1 1 9 3954 1 1 7 GLN CD C -2.618 2.404 2.312 1.00 . A A . 7 GLN CD 1 1 9 3955 1 1 7 GLN CG C -2.056 0.992 2.208 1.00 . A A . 7 GLN CG 1 1 9 3956 1 1 7 GLN H H -3.196 -1.523 -0.741 1.00 . A A . 7 GLN H 1 1 9 3957 1 1 7 GLN HA H -1.161 -1.352 1.205 1.00 . A A . 7 GLN HA 1 1 9 3958 1 1 7 GLN HB2 H -2.437 0.562 0.125 1.00 . A A . 7 GLN HB2 1 1 9 3959 1 1 7 GLN HB3 H -3.772 0.185 1.236 1.00 . A A . 7 GLN HB3 1 1 9 3960 1 1 7 GLN HE21 H -1.189 2.980 3.636 1.00 . A A . 7 GLN HE21 1 1 9 3961 1 1 7 GLN HE22 H -2.358 4.193 3.095 1.00 . A A . 7 GLN HE22 1 1 9 3962 1 1 7 GLN HG2 H -2.199 0.522 3.178 1.00 . A A . 7 GLN HG2 1 1 9 3963 1 1 7 GLN HG3 H -0.992 1.093 2.017 1.00 . A A . 7 GLN HG3 1 1 9 3964 1 1 7 GLN N N -2.661 -2.037 -0.060 1.00 . A A . 7 GLN N 1 1 9 3965 1 1 7 GLN NE2 N -1.977 3.261 3.082 1.00 . A A . 7 GLN NE2 1 1 9 3966 1 1 7 GLN O O -3.927 -1.845 2.828 1.00 . A A . 7 GLN O 1 1 9 3967 1 1 7 GLN OE1 O -3.616 2.763 1.707 1.00 . A A . 7 GLN OE1 1 1 9 3968 1 1 8 CYS C C -2.823 -2.317 5.483 1.00 . A A . 8 CYS C 1 1 9 3969 1 1 8 CYS CA C -2.155 -3.318 4.507 1.00 . A A . 8 CYS CA 1 1 9 3970 1 1 8 CYS CB C -0.807 -3.789 5.079 1.00 . A A . 8 CYS CB 1 1 9 3971 1 1 8 CYS H H -1.023 -2.982 2.714 1.00 . A A . 8 CYS H 1 1 9 3972 1 1 8 CYS HA H -2.815 -4.185 4.430 1.00 . A A . 8 CYS HA 1 1 9 3973 1 1 8 CYS HB2 H -0.939 -4.106 6.112 1.00 . A A . 8 CYS HB2 1 1 9 3974 1 1 8 CYS HB3 H -0.454 -4.647 4.509 1.00 . A A . 8 CYS HB3 1 1 9 3975 1 1 8 CYS N N -1.915 -2.787 3.150 1.00 . A A . 8 CYS N 1 1 9 3976 1 1 8 CYS O O -3.707 -2.667 6.257 1.00 . A A . 8 CYS O 1 1 9 3977 1 1 8 CYS SG S 0.529 -2.554 5.049 1.00 . A A . 8 CYS SG 1 1 9 3978 1 1 9 GLY C C -1.428 0.754 6.826 1.00 . A A . 9 GLY C 1 1 9 3979 1 1 9 GLY CA C -2.694 0.018 6.353 1.00 . A A . 9 GLY CA 1 1 9 3980 1 1 9 GLY H H -1.599 -0.914 4.791 1.00 . A A . 9 GLY H 1 1 9 3981 1 1 9 GLY HA2 H -3.335 0.693 5.790 1.00 . A A . 9 GLY HA2 1 1 9 3982 1 1 9 GLY HA3 H -3.241 -0.331 7.228 1.00 . A A . 9 GLY HA3 1 1 9 3983 1 1 9 GLY N N -2.349 -1.069 5.443 1.00 . A A . 9 GLY N 1 1 9 3984 1 1 9 GLY O O -0.475 0.137 7.298 1.00 . A A . 9 GLY O 1 1 9 3985 1 1 10 GLY C C -0.506 3.836 8.176 1.00 . A A . 10 GLY C 1 1 9 3986 1 1 10 GLY CA C -0.235 2.923 6.966 1.00 . A A . 10 GLY CA 1 1 9 3987 1 1 10 GLY H H -2.241 2.501 6.300 1.00 . A A . 10 GLY H 1 1 9 3988 1 1 10 GLY HA2 H 0.663 2.337 7.184 1.00 . A A . 10 GLY HA2 1 1 9 3989 1 1 10 GLY HA3 H -0.025 3.523 6.085 1.00 . A A . 10 GLY HA3 1 1 9 3990 1 1 10 GLY N N -1.381 2.071 6.612 1.00 . A A . 10 GLY N 1 1 9 3991 1 1 10 GLY O O -1.150 3.431 9.142 1.00 . A A . 10 GLY O 1 1 9 3992 1 1 11 ILE C C -1.523 6.986 8.808 1.00 . A A . 11 ILE C 1 1 9 3993 1 1 11 ILE CA C -0.312 6.095 9.178 1.00 . A A . 11 ILE CA 1 1 9 3994 1 1 11 ILE CB C 0.978 6.880 9.517 1.00 . A A . 11 ILE CB 1 1 9 3995 1 1 11 ILE CD1 C 3.412 6.540 10.336 1.00 . A A . 11 ILE CD1 1 1 9 3996 1 1 11 ILE CG1 C 2.081 5.886 9.957 1.00 . A A . 11 ILE CG1 1 1 9 3997 1 1 11 ILE CG2 C 0.699 7.912 10.628 1.00 . A A . 11 ILE CG2 1 1 9 3998 1 1 11 ILE H H 0.427 5.380 7.275 1.00 . A A . 11 ILE H 1 1 9 3999 1 1 11 ILE HA H -0.567 5.583 10.110 1.00 . A A . 11 ILE HA 1 1 9 4000 1 1 11 ILE HB H 1.308 7.416 8.627 1.00 . A A . 11 ILE HB 1 1 9 4001 1 1 11 ILE HD11 H 3.751 7.187 9.530 1.00 . A A . 11 ILE HD11 1 1 9 4002 1 1 11 ILE HD12 H 3.311 7.115 11.254 1.00 . A A . 11 ILE HD12 1 1 9 4003 1 1 11 ILE HD13 H 4.157 5.761 10.498 1.00 . A A . 11 ILE HD13 1 1 9 4004 1 1 11 ILE HG12 H 1.727 5.303 10.808 1.00 . A A . 11 ILE HG12 1 1 9 4005 1 1 11 ILE HG13 H 2.288 5.197 9.137 1.00 . A A . 11 ILE HG13 1 1 9 4006 1 1 11 ILE HG21 H -0.089 8.602 10.328 1.00 . A A . 11 ILE HG21 1 1 9 4007 1 1 11 ILE HG22 H 0.393 7.404 11.543 1.00 . A A . 11 ILE HG22 1 1 9 4008 1 1 11 ILE HG23 H 1.586 8.509 10.834 1.00 . A A . 11 ILE HG23 1 1 9 4009 1 1 11 ILE N N -0.057 5.094 8.121 1.00 . A A . 11 ILE N 1 1 9 4010 1 1 11 ILE O O -1.419 7.873 7.964 1.00 . A A . 11 ILE O 1 1 9 4011 1 1 12 GLY C C -4.599 6.845 7.773 1.00 . A A . 12 GLY C 1 1 9 4012 1 1 12 GLY CA C -3.979 7.336 9.100 1.00 . A A . 12 GLY CA 1 1 9 4013 1 1 12 GLY H H -2.664 5.976 10.111 1.00 . A A . 12 GLY H 1 1 9 4014 1 1 12 GLY HA2 H -4.678 7.104 9.901 1.00 . A A . 12 GLY HA2 1 1 9 4015 1 1 12 GLY HA3 H -3.863 8.422 9.061 1.00 . A A . 12 GLY HA3 1 1 9 4016 1 1 12 GLY N N -2.683 6.717 9.425 1.00 . A A . 12 GLY N 1 1 9 4017 1 1 12 GLY O O -5.001 7.649 6.937 1.00 . A A . 12 GLY O 1 1 9 4018 1 1 13 TYR C C -5.302 3.399 6.355 1.00 . A A . 13 TYR C 1 1 9 4019 1 1 13 TYR CA C -4.994 4.917 6.269 1.00 . A A . 13 TYR CA 1 1 9 4020 1 1 13 TYR CB C -3.816 5.180 5.298 1.00 . A A . 13 TYR CB 1 1 9 4021 1 1 13 TYR CD1 C -5.182 5.326 3.154 1.00 . A A . 13 TYR CD1 1 1 9 4022 1 1 13 TYR CD2 C -3.458 7.010 3.570 1.00 . A A . 13 TYR CD2 1 1 9 4023 1 1 13 TYR CE1 C -5.461 5.930 1.908 1.00 . A A . 13 TYR CE1 1 1 9 4024 1 1 13 TYR CE2 C -3.704 7.573 2.299 1.00 . A A . 13 TYR CE2 1 1 9 4025 1 1 13 TYR CG C -4.177 5.867 3.991 1.00 . A A . 13 TYR CG 1 1 9 4026 1 1 13 TYR CZ C -4.687 7.015 1.461 1.00 . A A . 13 TYR CZ 1 1 9 4027 1 1 13 TYR H H -4.343 4.918 8.312 1.00 . A A . 13 TYR H 1 1 9 4028 1 1 13 TYR HA H -5.892 5.420 5.899 1.00 . A A . 13 TYR HA 1 1 9 4029 1 1 13 TYR HB2 H -3.037 5.763 5.797 1.00 . A A . 13 TYR HB2 1 1 9 4030 1 1 13 TYR HB3 H -3.337 4.238 5.040 1.00 . A A . 13 TYR HB3 1 1 9 4031 1 1 13 TYR HD1 H -5.735 4.447 3.454 1.00 . A A . 13 TYR HD1 1 1 9 4032 1 1 13 TYR HD2 H -2.712 7.451 4.219 1.00 . A A . 13 TYR HD2 1 1 9 4033 1 1 13 TYR HE1 H -6.255 5.549 1.286 1.00 . A A . 13 TYR HE1 1 1 9 4034 1 1 13 TYR HE2 H -3.134 8.430 1.976 1.00 . A A . 13 TYR HE2 1 1 9 4035 1 1 13 TYR HH H -4.325 8.281 0.066 1.00 . A A . 13 TYR HH 1 1 9 4036 1 1 13 TYR N N -4.673 5.521 7.574 1.00 . A A . 13 TYR N 1 1 9 4037 1 1 13 TYR O O -4.442 2.633 6.788 1.00 . A A . 13 TYR O 1 1 9 4038 1 1 13 TYR OH O -4.872 7.505 0.206 1.00 . A A . 13 TYR OH 1 1 9 4039 1 1 14 SER C C -7.440 0.924 4.676 1.00 . A A . 14 SER C 1 1 9 4040 1 1 14 SER CA C -7.002 1.580 6.013 1.00 . A A . 14 SER CA 1 1 9 4041 1 1 14 SER CB C -8.191 1.534 6.998 1.00 . A A . 14 SER CB 1 1 9 4042 1 1 14 SER H H -7.135 3.683 5.602 1.00 . A A . 14 SER H 1 1 9 4043 1 1 14 SER HA H -6.224 0.933 6.427 1.00 . A A . 14 SER HA 1 1 9 4044 1 1 14 SER HB2 H -9.067 2.020 6.555 1.00 . A A . 14 SER HB2 1 1 9 4045 1 1 14 SER HB3 H -8.438 0.485 7.200 1.00 . A A . 14 SER HB3 1 1 9 4046 1 1 14 SER HG H -8.540 1.988 8.886 1.00 . A A . 14 SER HG 1 1 9 4047 1 1 14 SER N N -6.491 2.970 5.899 1.00 . A A . 14 SER N 1 1 9 4048 1 1 14 SER O O -7.494 -0.297 4.575 1.00 . A A . 14 SER O 1 1 9 4049 1 1 14 SER OG O -7.873 2.185 8.221 1.00 . A A . 14 SER OG 1 1 9 4050 1 1 15 GLY C C -7.179 1.099 1.309 1.00 . A A . 15 GLY C 1 1 9 4051 1 1 15 GLY CA C -8.301 1.244 2.360 1.00 . A A . 15 GLY CA 1 1 9 4052 1 1 15 GLY H H -7.742 2.712 3.812 1.00 . A A . 15 GLY H 1 1 9 4053 1 1 15 GLY HA2 H -8.873 0.325 2.483 1.00 . A A . 15 GLY HA2 1 1 9 4054 1 1 15 GLY HA3 H -8.990 1.993 1.970 1.00 . A A . 15 GLY HA3 1 1 9 4055 1 1 15 GLY N N -7.829 1.719 3.672 1.00 . A A . 15 GLY N 1 1 9 4056 1 1 15 GLY O O -6.378 2.024 1.182 1.00 . A A . 15 GLY O 1 1 9 4057 1 1 16 PRO C C -6.004 0.936 -1.561 1.00 . A A . 16 PRO C 1 1 9 4058 1 1 16 PRO CA C -6.185 -0.234 -0.567 1.00 . A A . 16 PRO CA 1 1 9 4059 1 1 16 PRO CB C -6.639 -1.539 -1.239 1.00 . A A . 16 PRO CB 1 1 9 4060 1 1 16 PRO CD C -7.845 -1.249 0.802 1.00 . A A . 16 PRO CD 1 1 9 4061 1 1 16 PRO CG C -7.152 -2.329 -0.037 1.00 . A A . 16 PRO CG 1 1 9 4062 1 1 16 PRO HA H -5.220 -0.465 -0.128 1.00 . A A . 16 PRO HA 1 1 9 4063 1 1 16 PRO HB2 H -7.464 -1.359 -1.937 1.00 . A A . 16 PRO HB2 1 1 9 4064 1 1 16 PRO HB3 H -5.825 -2.056 -1.757 1.00 . A A . 16 PRO HB3 1 1 9 4065 1 1 16 PRO HD2 H -8.891 -1.146 0.508 1.00 . A A . 16 PRO HD2 1 1 9 4066 1 1 16 PRO HD3 H -7.771 -1.522 1.857 1.00 . A A . 16 PRO HD3 1 1 9 4067 1 1 16 PRO HG2 H -7.828 -3.139 -0.323 1.00 . A A . 16 PRO HG2 1 1 9 4068 1 1 16 PRO HG3 H -6.303 -2.730 0.522 1.00 . A A . 16 PRO HG3 1 1 9 4069 1 1 16 PRO N N -7.124 -0.010 0.536 1.00 . A A . 16 PRO N 1 1 9 4070 1 1 16 PRO O O -6.534 0.905 -2.668 1.00 . A A . 16 PRO O 1 1 9 4071 1 1 17 THR C C -3.742 2.676 -3.110 1.00 . A A . 17 THR C 1 1 9 4072 1 1 17 THR CA C -4.847 3.078 -2.106 1.00 . A A . 17 THR CA 1 1 9 4073 1 1 17 THR CB C -4.539 4.348 -1.272 1.00 . A A . 17 THR CB 1 1 9 4074 1 1 17 THR CG2 C -3.114 4.475 -0.715 1.00 . A A . 17 THR CG2 1 1 9 4075 1 1 17 THR H H -4.864 1.964 -0.253 1.00 . A A . 17 THR H 1 1 9 4076 1 1 17 THR HA H -5.736 3.312 -2.696 1.00 . A A . 17 THR HA 1 1 9 4077 1 1 17 THR HB H -5.230 4.354 -0.426 1.00 . A A . 17 THR HB 1 1 9 4078 1 1 17 THR HG1 H -4.873 6.258 -1.404 1.00 . A A . 17 THR HG1 1 1 9 4079 1 1 17 THR HG21 H -2.727 3.507 -0.416 1.00 . A A . 17 THR HG21 1 1 9 4080 1 1 17 THR HG22 H -2.445 4.895 -1.463 1.00 . A A . 17 THR HG22 1 1 9 4081 1 1 17 THR HG23 H -3.107 5.139 0.146 1.00 . A A . 17 THR HG23 1 1 9 4082 1 1 17 THR N N -5.196 1.944 -1.212 1.00 . A A . 17 THR N 1 1 9 4083 1 1 17 THR O O -2.675 3.274 -3.228 1.00 . A A . 17 THR O 1 1 9 4084 1 1 17 THR OG1 O -4.809 5.515 -2.018 1.00 . A A . 17 THR OG1 1 1 9 4085 1 1 18 VAL C C -2.290 1.066 -5.638 1.00 . A A . 18 VAL C 1 1 9 4086 1 1 18 VAL CA C -2.938 0.625 -4.302 1.00 . A A . 18 VAL CA 1 1 9 4087 1 1 18 VAL CB C -3.544 -0.797 -4.377 1.00 . A A . 18 VAL CB 1 1 9 4088 1 1 18 VAL CG1 C -4.760 -0.858 -5.318 1.00 . A A . 18 VAL CG1 1 1 9 4089 1 1 18 VAL CG2 C -2.517 -1.873 -4.769 1.00 . A A . 18 VAL CG2 1 1 9 4090 1 1 18 VAL H H -4.913 1.192 -3.679 1.00 . A A . 18 VAL H 1 1 9 4091 1 1 18 VAL HA H -2.132 0.586 -3.564 1.00 . A A . 18 VAL HA 1 1 9 4092 1 1 18 VAL HB H -3.901 -1.046 -3.376 1.00 . A A . 18 VAL HB 1 1 9 4093 1 1 18 VAL HG11 H -5.510 -0.117 -5.036 1.00 . A A . 18 VAL HG11 1 1 9 4094 1 1 18 VAL HG12 H -4.449 -0.662 -6.343 1.00 . A A . 18 VAL HG12 1 1 9 4095 1 1 18 VAL HG13 H -5.220 -1.845 -5.264 1.00 . A A . 18 VAL HG13 1 1 9 4096 1 1 18 VAL HG21 H -1.654 -1.841 -4.100 1.00 . A A . 18 VAL HG21 1 1 9 4097 1 1 18 VAL HG22 H -2.971 -2.864 -4.714 1.00 . A A . 18 VAL HG22 1 1 9 4098 1 1 18 VAL HG23 H -2.179 -1.714 -5.791 1.00 . A A . 18 VAL HG23 1 1 9 4099 1 1 18 VAL N N -3.965 1.536 -3.771 1.00 . A A . 18 VAL N 1 1 9 4100 1 1 18 VAL O O -2.946 1.618 -6.515 1.00 . A A . 18 VAL O 1 1 9 4101 1 1 19 CYS C C -0.565 -0.208 -8.055 1.00 . A A . 19 CYS C 1 1 9 4102 1 1 19 CYS CA C -0.228 0.929 -7.040 1.00 . A A . 19 CYS CA 1 1 9 4103 1 1 19 CYS CB C 1.269 1.031 -6.651 1.00 . A A . 19 CYS CB 1 1 9 4104 1 1 19 CYS H H -0.521 0.367 -5.003 1.00 . A A . 19 CYS H 1 1 9 4105 1 1 19 CYS HA H -0.501 1.870 -7.522 1.00 . A A . 19 CYS HA 1 1 9 4106 1 1 19 CYS HB2 H 1.844 1.323 -7.527 1.00 . A A . 19 CYS HB2 1 1 9 4107 1 1 19 CYS HB3 H 1.404 1.815 -5.907 1.00 . A A . 19 CYS HB3 1 1 9 4108 1 1 19 CYS N N -0.989 0.787 -5.789 1.00 . A A . 19 CYS N 1 1 9 4109 1 1 19 CYS O O -1.725 -0.589 -8.246 1.00 . A A . 19 CYS O 1 1 9 4110 1 1 19 CYS SG S 2.039 -0.481 -5.991 1.00 . A A . 19 CYS SG 1 1 9 4111 1 1 20 ALA C C -0.069 -3.175 -7.856 1.00 . A A . 20 ALA C 1 1 9 4112 1 1 20 ALA CA C 0.338 -2.255 -9.046 1.00 . A A . 20 ALA CA 1 1 9 4113 1 1 20 ALA CB C 1.674 -2.687 -9.666 1.00 . A A . 20 ALA CB 1 1 9 4114 1 1 20 ALA H H 1.372 -0.476 -8.532 1.00 . A A . 20 ALA H 1 1 9 4115 1 1 20 ALA HA H -0.431 -2.344 -9.816 1.00 . A A . 20 ALA HA 1 1 9 4116 1 1 20 ALA HB1 H 1.918 -2.046 -10.516 1.00 . A A . 20 ALA HB1 1 1 9 4117 1 1 20 ALA HB2 H 2.476 -2.611 -8.928 1.00 . A A . 20 ALA HB2 1 1 9 4118 1 1 20 ALA HB3 H 1.617 -3.720 -10.013 1.00 . A A . 20 ALA HB3 1 1 9 4119 1 1 20 ALA N N 0.443 -0.842 -8.663 1.00 . A A . 20 ALA N 1 1 9 4120 1 1 20 ALA O O -0.061 -2.772 -6.695 1.00 . A A . 20 ALA O 1 1 9 4121 1 1 21 SER C C 0.445 -5.805 -6.227 1.00 . A A . 21 SER C 1 1 9 4122 1 1 21 SER CA C -0.770 -5.424 -7.107 1.00 . A A . 21 SER CA 1 1 9 4123 1 1 21 SER CB C -1.337 -6.675 -7.784 1.00 . A A . 21 SER CB 1 1 9 4124 1 1 21 SER H H -0.491 -4.683 -9.116 1.00 . A A . 21 SER H 1 1 9 4125 1 1 21 SER HA H -1.544 -5.006 -6.460 1.00 . A A . 21 SER HA 1 1 9 4126 1 1 21 SER HB2 H -2.064 -6.372 -8.534 1.00 . A A . 21 SER HB2 1 1 9 4127 1 1 21 SER HB3 H -0.529 -7.217 -8.283 1.00 . A A . 21 SER HB3 1 1 9 4128 1 1 21 SER HG H -2.842 -7.162 -6.603 1.00 . A A . 21 SER HG 1 1 9 4129 1 1 21 SER N N -0.463 -4.418 -8.143 1.00 . A A . 21 SER N 1 1 9 4130 1 1 21 SER O O 1.585 -5.644 -6.652 1.00 . A A . 21 SER O 1 1 9 4131 1 1 21 SER OG O -1.973 -7.519 -6.840 1.00 . A A . 21 SER OG 1 1 9 4132 1 1 22 GLY C C 0.769 -7.291 -2.737 1.00 . A A . 22 GLY C 1 1 9 4133 1 1 22 GLY CA C 1.256 -6.677 -4.061 1.00 . A A . 22 GLY CA 1 1 9 4134 1 1 22 GLY H H -0.772 -6.528 -4.817 1.00 . A A . 22 GLY H 1 1 9 4135 1 1 22 GLY HA2 H 1.964 -7.367 -4.527 1.00 . A A . 22 GLY HA2 1 1 9 4136 1 1 22 GLY HA3 H 1.794 -5.765 -3.801 1.00 . A A . 22 GLY HA3 1 1 9 4137 1 1 22 GLY N N 0.197 -6.340 -5.030 1.00 . A A . 22 GLY N 1 1 9 4138 1 1 22 GLY O O 1.452 -8.115 -2.133 1.00 . A A . 22 GLY O 1 1 9 4139 1 1 23 THR C C -0.332 -7.571 0.238 1.00 . A A . 23 THR C 1 1 9 4140 1 1 23 THR CA C -1.141 -7.384 -1.074 1.00 . A A . 23 THR CA 1 1 9 4141 1 1 23 THR CB C -1.954 -8.648 -1.443 1.00 . A A . 23 THR CB 1 1 9 4142 1 1 23 THR CG2 C -1.100 -9.888 -1.727 1.00 . A A . 23 THR CG2 1 1 9 4143 1 1 23 THR H H -0.879 -6.160 -2.802 1.00 . A A . 23 THR H 1 1 9 4144 1 1 23 THR HA H -1.870 -6.611 -0.825 1.00 . A A . 23 THR HA 1 1 9 4145 1 1 23 THR HB H -2.553 -8.441 -2.333 1.00 . A A . 23 THR HB 1 1 9 4146 1 1 23 THR HG1 H -2.293 -9.167 0.383 1.00 . A A . 23 THR HG1 1 1 9 4147 1 1 23 THR HG21 H -0.467 -10.115 -0.870 1.00 . A A . 23 THR HG21 1 1 9 4148 1 1 23 THR HG22 H -1.741 -10.749 -1.925 1.00 . A A . 23 THR HG22 1 1 9 4149 1 1 23 THR HG23 H -0.473 -9.722 -2.603 1.00 . A A . 23 THR HG23 1 1 9 4150 1 1 23 THR N N -0.410 -6.867 -2.257 1.00 . A A . 23 THR N 1 1 9 4151 1 1 23 THR O O -0.719 -8.342 1.114 1.00 . A A . 23 THR O 1 1 9 4152 1 1 23 THR OG1 O -2.836 -8.985 -0.398 1.00 . A A . 23 THR OG1 1 1 9 4153 1 1 24 THR C C 2.302 -5.592 1.955 1.00 . A A . 24 THR C 1 1 9 4154 1 1 24 THR CA C 1.754 -6.969 1.504 1.00 . A A . 24 THR CA 1 1 9 4155 1 1 24 THR CB C 2.898 -7.941 1.148 1.00 . A A . 24 THR CB 1 1 9 4156 1 1 24 THR CG2 C 2.376 -9.365 0.945 1.00 . A A . 24 THR CG2 1 1 9 4157 1 1 24 THR H H 1.050 -6.274 -0.390 1.00 . A A . 24 THR H 1 1 9 4158 1 1 24 THR HA H 1.241 -7.378 2.380 1.00 . A A . 24 THR HA 1 1 9 4159 1 1 24 THR HB H 3.652 -7.969 1.943 1.00 . A A . 24 THR HB 1 1 9 4160 1 1 24 THR HG1 H 2.892 -7.714 -0.780 1.00 . A A . 24 THR HG1 1 1 9 4161 1 1 24 THR HG21 H 1.831 -9.699 1.829 1.00 . A A . 24 THR HG21 1 1 9 4162 1 1 24 THR HG22 H 1.706 -9.410 0.090 1.00 . A A . 24 THR HG22 1 1 9 4163 1 1 24 THR HG23 H 3.207 -10.047 0.763 1.00 . A A . 24 THR HG23 1 1 9 4164 1 1 24 THR N N 0.791 -6.865 0.383 1.00 . A A . 24 THR N 1 1 9 4165 1 1 24 THR O O 1.909 -4.556 1.415 1.00 . A A . 24 THR O 1 1 9 4166 1 1 24 THR OG1 O 3.508 -7.540 -0.054 1.00 . A A . 24 THR OG1 1 1 9 4167 1 1 25 CYS C C 4.769 -3.834 3.927 1.00 . A A . 25 CYS C 1 1 9 4168 1 1 25 CYS CA C 3.307 -4.356 3.862 1.00 . A A . 25 CYS CA 1 1 9 4169 1 1 25 CYS CB C 2.737 -4.727 5.253 1.00 . A A . 25 CYS CB 1 1 9 4170 1 1 25 CYS H H 3.469 -6.423 3.380 1.00 . A A . 25 CYS H 1 1 9 4171 1 1 25 CYS HA H 2.705 -3.532 3.476 1.00 . A A . 25 CYS HA 1 1 9 4172 1 1 25 CYS HB2 H 1.889 -5.403 5.145 1.00 . A A . 25 CYS HB2 1 1 9 4173 1 1 25 CYS HB3 H 3.487 -5.241 5.854 1.00 . A A . 25 CYS HB3 1 1 9 4174 1 1 25 CYS N N 3.131 -5.548 3.009 1.00 . A A . 25 CYS N 1 1 9 4175 1 1 25 CYS O O 5.519 -4.247 4.810 1.00 . A A . 25 CYS O 1 1 9 4176 1 1 25 CYS SG S 2.077 -3.381 6.280 1.00 . A A . 25 CYS SG 1 1 9 4177 1 1 26 GLN C C 6.380 -0.690 3.115 1.00 . A A . 26 GLN C 1 1 9 4178 1 1 26 GLN CA C 6.494 -2.237 3.108 1.00 . A A . 26 GLN CA 1 1 9 4179 1 1 26 GLN CB C 7.487 -2.848 2.100 1.00 . A A . 26 GLN CB 1 1 9 4180 1 1 26 GLN CD C 10.001 -3.211 1.623 1.00 . A A . 26 GLN CD 1 1 9 4181 1 1 26 GLN CG C 8.944 -2.631 2.561 1.00 . A A . 26 GLN CG 1 1 9 4182 1 1 26 GLN H H 4.555 -2.682 2.272 1.00 . A A . 26 GLN H 1 1 9 4183 1 1 26 GLN HA H 6.925 -2.443 4.093 1.00 . A A . 26 GLN HA 1 1 9 4184 1 1 26 GLN HB2 H 7.327 -3.926 2.060 1.00 . A A . 26 GLN HB2 1 1 9 4185 1 1 26 GLN HB3 H 7.338 -2.446 1.096 1.00 . A A . 26 GLN HB3 1 1 9 4186 1 1 26 GLN HE21 H 9.286 -5.106 1.776 1.00 . A A . 26 GLN HE21 1 1 9 4187 1 1 26 GLN HE22 H 10.674 -4.816 0.709 1.00 . A A . 26 GLN HE22 1 1 9 4188 1 1 26 GLN HG2 H 9.134 -1.568 2.667 1.00 . A A . 26 GLN HG2 1 1 9 4189 1 1 26 GLN HG3 H 9.100 -3.100 3.532 1.00 . A A . 26 GLN HG3 1 1 9 4190 1 1 26 GLN N N 5.188 -2.934 3.019 1.00 . A A . 26 GLN N 1 1 9 4191 1 1 26 GLN NE2 N 9.989 -4.508 1.380 1.00 . A A . 26 GLN NE2 1 1 9 4192 1 1 26 GLN O O 5.797 -0.154 4.056 1.00 . A A . 26 GLN O 1 1 9 4193 1 1 26 GLN OE1 O 10.874 -2.512 1.134 1.00 . A A . 26 GLN OE1 1 1 9 4194 1 1 27 VAL C C 7.211 2.215 0.788 1.00 . A A . 27 VAL C 1 1 9 4195 1 1 27 VAL CA C 6.935 1.538 2.159 1.00 . A A . 27 VAL CA 1 1 9 4196 1 1 27 VAL CB C 7.904 2.050 3.261 1.00 . A A . 27 VAL CB 1 1 9 4197 1 1 27 VAL CG1 C 9.375 1.650 3.044 1.00 . A A . 27 VAL CG1 1 1 9 4198 1 1 27 VAL CG2 C 7.816 3.574 3.435 1.00 . A A . 27 VAL CG2 1 1 9 4199 1 1 27 VAL H H 7.371 -0.417 1.365 1.00 . A A . 27 VAL H 1 1 9 4200 1 1 27 VAL HA H 5.936 1.860 2.455 1.00 . A A . 27 VAL HA 1 1 9 4201 1 1 27 VAL HB H 7.595 1.624 4.219 1.00 . A A . 27 VAL HB 1 1 9 4202 1 1 27 VAL HG11 H 9.444 0.592 2.810 1.00 . A A . 27 VAL HG11 1 1 9 4203 1 1 27 VAL HG12 H 9.814 2.219 2.228 1.00 . A A . 27 VAL HG12 1 1 9 4204 1 1 27 VAL HG13 H 9.947 1.841 3.953 1.00 . A A . 27 VAL HG13 1 1 9 4205 1 1 27 VAL HG21 H 6.793 3.852 3.695 1.00 . A A . 27 VAL HG21 1 1 9 4206 1 1 27 VAL HG22 H 8.484 3.896 4.236 1.00 . A A . 27 VAL HG22 1 1 9 4207 1 1 27 VAL HG23 H 8.109 4.090 2.519 1.00 . A A . 27 VAL HG23 1 1 9 4208 1 1 27 VAL N N 6.916 0.056 2.135 1.00 . A A . 27 VAL N 1 1 9 4209 1 1 27 VAL O O 8.258 2.001 0.189 1.00 . A A . 27 VAL O 1 1 9 4210 1 1 28 LEU C C 7.230 5.374 -0.137 1.00 . A A . 28 LEU C 1 1 9 4211 1 1 28 LEU CA C 6.597 4.091 -0.735 1.00 . A A . 28 LEU CA 1 1 9 4212 1 1 28 LEU CB C 5.308 4.440 -1.517 1.00 . A A . 28 LEU CB 1 1 9 4213 1 1 28 LEU CD1 C 3.701 2.477 -1.318 1.00 . A A . 28 LEU CD1 1 1 9 4214 1 1 28 LEU CD2 C 3.831 3.808 -3.442 1.00 . A A . 28 LEU CD2 1 1 9 4215 1 1 28 LEU CG C 4.636 3.263 -2.250 1.00 . A A . 28 LEU CG 1 1 9 4216 1 1 28 LEU H H 5.444 3.190 0.847 1.00 . A A . 28 LEU H 1 1 9 4217 1 1 28 LEU HA H 7.308 3.674 -1.452 1.00 . A A . 28 LEU HA 1 1 9 4218 1 1 28 LEU HB2 H 4.571 4.905 -0.863 1.00 . A A . 28 LEU HB2 1 1 9 4219 1 1 28 LEU HB3 H 5.587 5.189 -2.261 1.00 . A A . 28 LEU HB3 1 1 9 4220 1 1 28 LEU HD11 H 3.027 3.153 -0.803 1.00 . A A . 28 LEU HD11 1 1 9 4221 1 1 28 LEU HD12 H 3.108 1.774 -1.897 1.00 . A A . 28 LEU HD12 1 1 9 4222 1 1 28 LEU HD13 H 4.266 1.915 -0.580 1.00 . A A . 28 LEU HD13 1 1 9 4223 1 1 28 LEU HD21 H 3.161 4.595 -3.109 1.00 . A A . 28 LEU HD21 1 1 9 4224 1 1 28 LEU HD22 H 4.504 4.228 -4.188 1.00 . A A . 28 LEU HD22 1 1 9 4225 1 1 28 LEU HD23 H 3.241 3.020 -3.911 1.00 . A A . 28 LEU HD23 1 1 9 4226 1 1 28 LEU HG H 5.399 2.590 -2.636 1.00 . A A . 28 LEU HG 1 1 9 4227 1 1 28 LEU N N 6.316 3.109 0.335 1.00 . A A . 28 LEU N 1 1 9 4228 1 1 28 LEU O O 8.405 5.682 -0.325 1.00 . A A . 28 LEU O 1 1 9 4229 1 1 29 ASN C C 6.377 6.632 3.055 1.00 . A A . 29 ASN C 1 1 9 4230 1 1 29 ASN CA C 6.859 7.087 1.651 1.00 . A A . 29 ASN CA 1 1 9 4231 1 1 29 ASN CB C 6.260 8.462 1.301 1.00 . A A . 29 ASN CB 1 1 9 4232 1 1 29 ASN CG C 6.594 8.950 -0.106 1.00 . A A . 29 ASN CG 1 1 9 4233 1 1 29 ASN H H 5.488 5.758 0.732 1.00 . A A . 29 ASN H 1 1 9 4234 1 1 29 ASN HA H 7.949 7.153 1.662 1.00 . A A . 29 ASN HA 1 1 9 4235 1 1 29 ASN HB2 H 5.173 8.417 1.399 1.00 . A A . 29 ASN HB2 1 1 9 4236 1 1 29 ASN HB3 H 6.628 9.216 1.997 1.00 . A A . 29 ASN HB3 1 1 9 4237 1 1 29 ASN HD21 H 8.573 8.500 0.041 1.00 . A A . 29 ASN HD21 1 1 9 4238 1 1 29 ASN HD22 H 8.003 9.253 -1.444 1.00 . A A . 29 ASN HD22 1 1 9 4239 1 1 29 ASN N N 6.431 6.106 0.647 1.00 . A A . 29 ASN N 1 1 9 4240 1 1 29 ASN ND2 N 7.851 8.942 -0.500 1.00 . A A . 29 ASN ND2 1 1 9 4241 1 1 29 ASN O O 5.362 5.942 3.120 1.00 . A A . 29 ASN O 1 1 9 4242 1 1 29 ASN OD1 O 5.727 9.364 -0.855 1.00 . A A . 29 ASN OD1 1 1 9 4243 1 1 30 PRO C C 5.252 6.276 5.860 1.00 . A A . 30 PRO C 1 1 9 4244 1 1 30 PRO CA C 6.731 6.567 5.531 1.00 . A A . 30 PRO CA 1 1 9 4245 1 1 30 PRO CB C 7.346 7.636 6.438 1.00 . A A . 30 PRO CB 1 1 9 4246 1 1 30 PRO CD C 8.147 7.972 4.203 1.00 . A A . 30 PRO CD 1 1 9 4247 1 1 30 PRO CG C 8.608 8.010 5.661 1.00 . A A . 30 PRO CG 1 1 9 4248 1 1 30 PRO HA H 7.283 5.639 5.689 1.00 . A A . 30 PRO HA 1 1 9 4249 1 1 30 PRO HB2 H 6.693 8.508 6.512 1.00 . A A . 30 PRO HB2 1 1 9 4250 1 1 30 PRO HB3 H 7.570 7.258 7.436 1.00 . A A . 30 PRO HB3 1 1 9 4251 1 1 30 PRO HD2 H 7.795 8.963 3.920 1.00 . A A . 30 PRO HD2 1 1 9 4252 1 1 30 PRO HD3 H 8.980 7.676 3.564 1.00 . A A . 30 PRO HD3 1 1 9 4253 1 1 30 PRO HG2 H 9.006 8.986 5.949 1.00 . A A . 30 PRO HG2 1 1 9 4254 1 1 30 PRO HG3 H 9.369 7.244 5.826 1.00 . A A . 30 PRO HG3 1 1 9 4255 1 1 30 PRO N N 7.038 7.025 4.165 1.00 . A A . 30 PRO N 1 1 9 4256 1 1 30 PRO O O 4.911 5.178 6.285 1.00 . A A . 30 PRO O 1 1 9 4257 1 1 31 TYR C C 2.200 6.026 5.045 1.00 . A A . 31 TYR C 1 1 9 4258 1 1 31 TYR CA C 2.916 7.077 5.936 1.00 . A A . 31 TYR CA 1 1 9 4259 1 1 31 TYR CB C 2.185 8.441 5.890 1.00 . A A . 31 TYR CB 1 1 9 4260 1 1 31 TYR CD1 C 3.623 9.458 7.778 1.00 . A A . 31 TYR CD1 1 1 9 4261 1 1 31 TYR CD2 C 1.422 10.402 7.309 1.00 . A A . 31 TYR CD2 1 1 9 4262 1 1 31 TYR CE1 C 3.857 10.480 8.725 1.00 . A A . 31 TYR CE1 1 1 9 4263 1 1 31 TYR CE2 C 1.647 11.401 8.283 1.00 . A A . 31 TYR CE2 1 1 9 4264 1 1 31 TYR CG C 2.420 9.436 7.029 1.00 . A A . 31 TYR CG 1 1 9 4265 1 1 31 TYR CZ C 2.877 11.459 8.960 1.00 . A A . 31 TYR CZ 1 1 9 4266 1 1 31 TYR H H 4.680 8.138 5.317 1.00 . A A . 31 TYR H 1 1 9 4267 1 1 31 TYR HA H 2.822 6.695 6.956 1.00 . A A . 31 TYR HA 1 1 9 4268 1 1 31 TYR HB2 H 2.401 8.939 4.941 1.00 . A A . 31 TYR HB2 1 1 9 4269 1 1 31 TYR HB3 H 1.112 8.222 5.895 1.00 . A A . 31 TYR HB3 1 1 9 4270 1 1 31 TYR HD1 H 4.375 8.698 7.657 1.00 . A A . 31 TYR HD1 1 1 9 4271 1 1 31 TYR HD2 H 0.481 10.385 6.774 1.00 . A A . 31 TYR HD2 1 1 9 4272 1 1 31 TYR HE1 H 4.788 10.508 9.272 1.00 . A A . 31 TYR HE1 1 1 9 4273 1 1 31 TYR HE2 H 0.883 12.131 8.508 1.00 . A A . 31 TYR HE2 1 1 9 4274 1 1 31 TYR HH H 4.009 12.399 10.197 1.00 . A A . 31 TYR HH 1 1 9 4275 1 1 31 TYR N N 4.353 7.247 5.653 1.00 . A A . 31 TYR N 1 1 9 4276 1 1 31 TYR O O 1.183 5.473 5.462 1.00 . A A . 31 TYR O 1 1 9 4277 1 1 31 TYR OH O 3.126 12.466 9.836 1.00 . A A . 31 TYR OH 1 1 9 4278 1 1 32 TYR C C 2.841 3.529 2.629 1.00 . A A . 32 TYR C 1 1 9 4279 1 1 32 TYR CA C 2.088 4.880 2.814 1.00 . A A . 32 TYR CA 1 1 9 4280 1 1 32 TYR CB C 1.943 5.670 1.498 1.00 . A A . 32 TYR CB 1 1 9 4281 1 1 32 TYR CD1 C 0.644 3.686 0.467 1.00 . A A . 32 TYR CD1 1 1 9 4282 1 1 32 TYR CD2 C 1.336 5.535 -0.964 1.00 . A A . 32 TYR CD2 1 1 9 4283 1 1 32 TYR CE1 C 0.123 3.017 -0.661 1.00 . A A . 32 TYR CE1 1 1 9 4284 1 1 32 TYR CE2 C 0.784 4.871 -2.084 1.00 . A A . 32 TYR CE2 1 1 9 4285 1 1 32 TYR CG C 1.282 4.945 0.323 1.00 . A A . 32 TYR CG 1 1 9 4286 1 1 32 TYR CZ C 0.280 3.568 -1.943 1.00 . A A . 32 TYR CZ 1 1 9 4287 1 1 32 TYR H H 3.594 6.157 3.607 1.00 . A A . 32 TYR H 1 1 9 4288 1 1 32 TYR HA H 1.067 4.657 3.129 1.00 . A A . 32 TYR HA 1 1 9 4289 1 1 32 TYR HB2 H 1.394 6.593 1.707 1.00 . A A . 32 TYR HB2 1 1 9 4290 1 1 32 TYR HB3 H 2.942 5.970 1.178 1.00 . A A . 32 TYR HB3 1 1 9 4291 1 1 32 TYR HD1 H 0.538 3.216 1.433 1.00 . A A . 32 TYR HD1 1 1 9 4292 1 1 32 TYR HD2 H 1.839 6.480 -1.092 1.00 . A A . 32 TYR HD2 1 1 9 4293 1 1 32 TYR HE1 H -0.401 2.081 -0.556 1.00 . A A . 32 TYR HE1 1 1 9 4294 1 1 32 TYR HE2 H 0.827 5.327 -3.061 1.00 . A A . 32 TYR HE2 1 1 9 4295 1 1 32 TYR HH H -0.816 3.250 -3.443 1.00 . A A . 32 TYR HH 1 1 9 4296 1 1 32 TYR N N 2.693 5.757 3.828 1.00 . A A . 32 TYR N 1 1 9 4297 1 1 32 TYR O O 3.768 3.406 1.827 1.00 . A A . 32 TYR O 1 1 9 4298 1 1 32 TYR OH O -0.047 2.836 -3.038 1.00 . A A . 32 TYR OH 1 1 9 4299 1 1 33 SER C C 2.114 0.236 2.175 1.00 . A A . 33 SER C 1 1 9 4300 1 1 33 SER CA C 2.812 1.095 3.259 1.00 . A A . 33 SER CA 1 1 9 4301 1 1 33 SER CB C 2.651 0.432 4.635 1.00 . A A . 33 SER CB 1 1 9 4302 1 1 33 SER H H 1.643 2.729 4.009 1.00 . A A . 33 SER H 1 1 9 4303 1 1 33 SER HA H 3.879 1.103 3.039 1.00 . A A . 33 SER HA 1 1 9 4304 1 1 33 SER HB2 H 3.165 1.024 5.398 1.00 . A A . 33 SER HB2 1 1 9 4305 1 1 33 SER HB3 H 1.591 0.366 4.897 1.00 . A A . 33 SER HB3 1 1 9 4306 1 1 33 SER HG H 4.166 -0.807 4.663 1.00 . A A . 33 SER HG 1 1 9 4307 1 1 33 SER N N 2.355 2.496 3.331 1.00 . A A . 33 SER N 1 1 9 4308 1 1 33 SER O O 0.994 -0.243 2.376 1.00 . A A . 33 SER O 1 1 9 4309 1 1 33 SER OG O 3.204 -0.872 4.589 1.00 . A A . 33 SER OG 1 1 9 4310 1 1 34 GLN C C 3.656 -1.100 -0.976 1.00 . A A . 34 GLN C 1 1 9 4311 1 1 34 GLN CA C 2.415 -0.885 -0.063 1.00 . A A . 34 GLN CA 1 1 9 4312 1 1 34 GLN CB C 1.134 -0.366 -0.774 1.00 . A A . 34 GLN CB 1 1 9 4313 1 1 34 GLN CD C 0.876 -2.680 -1.996 1.00 . A A . 34 GLN CD 1 1 9 4314 1 1 34 GLN CG C 0.439 -1.223 -1.866 1.00 . A A . 34 GLN CG 1 1 9 4315 1 1 34 GLN H H 3.703 0.444 0.981 1.00 . A A . 34 GLN H 1 1 9 4316 1 1 34 GLN HA H 2.205 -1.856 0.390 1.00 . A A . 34 GLN HA 1 1 9 4317 1 1 34 GLN HB2 H 0.379 -0.181 -0.013 1.00 . A A . 34 GLN HB2 1 1 9 4318 1 1 34 GLN HB3 H 1.368 0.605 -1.209 1.00 . A A . 34 GLN HB3 1 1 9 4319 1 1 34 GLN HE21 H 0.435 -3.190 -0.059 1.00 . A A . 34 GLN HE21 1 1 9 4320 1 1 34 GLN HE22 H 1.198 -4.379 -1.078 1.00 . A A . 34 GLN HE22 1 1 9 4321 1 1 34 GLN HG2 H -0.635 -1.210 -1.699 1.00 . A A . 34 GLN HG2 1 1 9 4322 1 1 34 GLN HG3 H 0.599 -0.744 -2.833 1.00 . A A . 34 GLN HG3 1 1 9 4323 1 1 34 GLN N N 2.777 0.041 1.028 1.00 . A A . 34 GLN N 1 1 9 4324 1 1 34 GLN NE2 N 0.755 -3.487 -0.969 1.00 . A A . 34 GLN NE2 1 1 9 4325 1 1 34 GLN O O 4.756 -1.182 -0.443 1.00 . A A . 34 GLN O 1 1 9 4326 1 1 34 GLN OE1 O 1.333 -3.108 -3.038 1.00 . A A . 34 GLN OE1 1 1 9 4327 1 1 35 CYS C C 5.869 -1.880 -3.060 1.00 . A A . 35 CYS C 1 1 9 4328 1 1 35 CYS CA C 4.472 -1.275 -3.389 1.00 . A A . 35 CYS CA 1 1 9 4329 1 1 35 CYS CB C 4.550 0.054 -4.169 1.00 . A A . 35 CYS CB 1 1 9 4330 1 1 35 CYS H H 2.537 -1.069 -2.635 1.00 . A A . 35 CYS H 1 1 9 4331 1 1 35 CYS HA H 3.994 -1.998 -4.057 1.00 . A A . 35 CYS HA 1 1 9 4332 1 1 35 CYS HB2 H 3.848 0.784 -3.780 1.00 . A A . 35 CYS HB2 1 1 9 4333 1 1 35 CYS HB3 H 5.547 0.486 -4.091 1.00 . A A . 35 CYS HB3 1 1 9 4334 1 1 35 CYS N N 3.480 -1.146 -2.306 1.00 . A A . 35 CYS N 1 1 9 4335 1 1 35 CYS O O 6.674 -1.270 -2.359 1.00 . A A . 35 CYS O 1 1 9 4336 1 1 35 CYS SG S 4.157 -0.100 -5.927 1.00 . A A . 35 CYS SG 1 1 9 4337 1 1 36 LEU C C 7.916 -4.350 -4.817 1.00 . A A . 36 LEU C 1 1 9 4338 1 1 36 LEU CA C 7.363 -3.862 -3.450 1.00 . A A . 36 LEU CA 1 1 9 4339 1 1 36 LEU CB C 7.076 -5.070 -2.530 1.00 . A A . 36 LEU CB 1 1 9 4340 1 1 36 LEU CD1 C 4.773 -4.849 -1.411 1.00 . A A . 36 LEU CD1 1 1 9 4341 1 1 36 LEU CD2 C 6.691 -5.786 -0.141 1.00 . A A . 36 LEU CD2 1 1 9 4342 1 1 36 LEU CG C 6.301 -4.767 -1.224 1.00 . A A . 36 LEU CG 1 1 9 4343 1 1 36 LEU H H 5.515 -3.427 -4.314 1.00 . A A . 36 LEU H 1 1 9 4344 1 1 36 LEU HA H 8.143 -3.254 -2.991 1.00 . A A . 36 LEU HA 1 1 9 4345 1 1 36 LEU HB2 H 6.533 -5.834 -3.091 1.00 . A A . 36 LEU HB2 1 1 9 4346 1 1 36 LEU HB3 H 8.050 -5.489 -2.274 1.00 . A A . 36 LEU HB3 1 1 9 4347 1 1 36 LEU HD11 H 4.501 -5.828 -1.809 1.00 . A A . 36 LEU HD11 1 1 9 4348 1 1 36 LEU HD12 H 4.274 -4.710 -0.452 1.00 . A A . 36 LEU HD12 1 1 9 4349 1 1 36 LEU HD13 H 4.408 -4.087 -2.097 1.00 . A A . 36 LEU HD13 1 1 9 4350 1 1 36 LEU HD21 H 6.472 -6.798 -0.483 1.00 . A A . 36 LEU HD21 1 1 9 4351 1 1 36 LEU HD22 H 7.758 -5.711 0.076 1.00 . A A . 36 LEU HD22 1 1 9 4352 1 1 36 LEU HD23 H 6.130 -5.595 0.777 1.00 . A A . 36 LEU HD23 1 1 9 4353 1 1 36 LEU HG H 6.570 -3.772 -0.866 1.00 . A A . 36 LEU HG 1 1 9 4354 1 1 36 LEU N N 6.143 -3.064 -3.614 1.00 . A A . 36 LEU N 1 1 9 4355 1 1 36 LEU O O 9.114 -4.701 -4.861 1.00 . A A . 36 LEU O 1 1 9 4356 1 1 36 LEU OXT O 7.122 -4.390 -5.789 1.00 . A A . 36 LEU OXT 1 1 10 4357 1 1 1 THR C C -6.627 -4.810 -7.699 1.00 . A A . 1 THR C 1 1 10 4358 1 1 1 THR CA C -5.850 -4.575 -9.015 1.00 . A A . 1 THR CA 1 1 10 4359 1 1 1 THR CB C -5.584 -5.940 -9.697 1.00 . A A . 1 THR CB 1 1 10 4360 1 1 1 THR CG2 C -4.658 -6.859 -8.889 1.00 . A A . 1 THR CG2 1 1 10 4361 1 1 1 THR H1 H -3.990 -4.146 -8.120 1.00 . A A . 1 THR H1 1 1 10 4362 1 1 1 THR H2 H -4.065 -3.689 -9.698 1.00 . A A . 1 THR H2 1 1 10 4363 1 1 1 THR H3 H -4.789 -2.822 -8.527 1.00 . A A . 1 THR H3 1 1 10 4364 1 1 1 THR HA H -6.505 -4.006 -9.678 1.00 . A A . 1 THR HA 1 1 10 4365 1 1 1 THR HB H -5.131 -5.771 -10.680 1.00 . A A . 1 THR HB 1 1 10 4366 1 1 1 THR HG1 H -6.653 -7.493 -10.244 1.00 . A A . 1 THR HG1 1 1 10 4367 1 1 1 THR HG21 H -3.705 -6.366 -8.700 1.00 . A A . 1 THR HG21 1 1 10 4368 1 1 1 THR HG22 H -5.109 -7.129 -7.933 1.00 . A A . 1 THR HG22 1 1 10 4369 1 1 1 THR HG23 H -4.463 -7.779 -9.446 1.00 . A A . 1 THR HG23 1 1 10 4370 1 1 1 THR N N -4.602 -3.766 -8.848 1.00 . A A . 1 THR N 1 1 10 4371 1 1 1 THR O O -5.993 -4.959 -6.657 1.00 . A A . 1 THR O 1 1 10 4372 1 1 1 THR OG1 O -6.811 -6.612 -9.884 1.00 . A A . 1 THR OG1 1 1 10 4373 1 1 2 GLN C C -8.818 -6.566 -6.093 1.00 . A A . 2 GLN C 1 1 10 4374 1 1 2 GLN CA C -8.772 -5.063 -6.488 1.00 . A A . 2 GLN CA 1 1 10 4375 1 1 2 GLN CB C -10.152 -4.388 -6.667 1.00 . A A . 2 GLN CB 1 1 10 4376 1 1 2 GLN CD C -11.134 -5.004 -4.351 1.00 . A A . 2 GLN CD 1 1 10 4377 1 1 2 GLN CG C -10.790 -3.898 -5.347 1.00 . A A . 2 GLN CG 1 1 10 4378 1 1 2 GLN H H -8.459 -4.793 -8.585 1.00 . A A . 2 GLN H 1 1 10 4379 1 1 2 GLN HA H -8.293 -4.546 -5.654 1.00 . A A . 2 GLN HA 1 1 10 4380 1 1 2 GLN HB2 H -10.039 -3.492 -7.284 1.00 . A A . 2 GLN HB2 1 1 10 4381 1 1 2 GLN HB3 H -10.844 -5.052 -7.190 1.00 . A A . 2 GLN HB3 1 1 10 4382 1 1 2 GLN HE21 H -9.329 -4.915 -3.393 1.00 . A A . 2 GLN HE21 1 1 10 4383 1 1 2 GLN HE22 H -10.515 -6.103 -2.853 1.00 . A A . 2 GLN HE22 1 1 10 4384 1 1 2 GLN HG2 H -10.126 -3.176 -4.865 1.00 . A A . 2 GLN HG2 1 1 10 4385 1 1 2 GLN HG3 H -11.719 -3.380 -5.587 1.00 . A A . 2 GLN HG3 1 1 10 4386 1 1 2 GLN N N -7.967 -4.838 -7.704 1.00 . A A . 2 GLN N 1 1 10 4387 1 1 2 GLN NE2 N -10.221 -5.363 -3.468 1.00 . A A . 2 GLN NE2 1 1 10 4388 1 1 2 GLN O O -9.857 -7.213 -6.120 1.00 . A A . 2 GLN O 1 1 10 4389 1 1 2 GLN OE1 O -12.233 -5.529 -4.337 1.00 . A A . 2 GLN OE1 1 1 10 4390 1 1 3 SER C C -5.929 -8.522 -4.724 1.00 . A A . 3 SER C 1 1 10 4391 1 1 3 SER CA C -7.356 -8.484 -5.323 1.00 . A A . 3 SER CA 1 1 10 4392 1 1 3 SER CB C -7.548 -9.482 -6.490 1.00 . A A . 3 SER CB 1 1 10 4393 1 1 3 SER H H -6.869 -6.453 -5.774 1.00 . A A . 3 SER H 1 1 10 4394 1 1 3 SER HA H -8.043 -8.763 -4.519 1.00 . A A . 3 SER HA 1 1 10 4395 1 1 3 SER HB2 H -7.106 -9.091 -7.410 1.00 . A A . 3 SER HB2 1 1 10 4396 1 1 3 SER HB3 H -7.067 -10.438 -6.260 1.00 . A A . 3 SER HB3 1 1 10 4397 1 1 3 SER HG H -9.456 -8.976 -6.522 1.00 . A A . 3 SER HG 1 1 10 4398 1 1 3 SER N N -7.642 -7.105 -5.761 1.00 . A A . 3 SER N 1 1 10 4399 1 1 3 SER O O -5.750 -8.288 -3.532 1.00 . A A . 3 SER O 1 1 10 4400 1 1 3 SER OG O -8.918 -9.756 -6.719 1.00 . A A . 3 SER OG 1 1 10 4401 1 1 4 HIS C C -3.368 -6.764 -5.020 1.00 . A A . 4 HIS C 1 1 10 4402 1 1 4 HIS CA C -3.505 -8.294 -5.243 1.00 . A A . 4 HIS CA 1 1 10 4403 1 1 4 HIS CB C -2.580 -8.822 -6.352 1.00 . A A . 4 HIS CB 1 1 10 4404 1 1 4 HIS CD2 C -2.029 -11.365 -6.258 1.00 . A A . 4 HIS CD2 1 1 10 4405 1 1 4 HIS CE1 C -3.746 -12.061 -7.413 1.00 . A A . 4 HIS CE1 1 1 10 4406 1 1 4 HIS CG C -2.770 -10.285 -6.651 1.00 . A A . 4 HIS CG 1 1 10 4407 1 1 4 HIS H H -5.073 -9.005 -6.499 1.00 . A A . 4 HIS H 1 1 10 4408 1 1 4 HIS HA H -3.210 -8.802 -4.321 1.00 . A A . 4 HIS HA 1 1 10 4409 1 1 4 HIS HB2 H -2.765 -8.274 -7.273 1.00 . A A . 4 HIS HB2 1 1 10 4410 1 1 4 HIS HB3 H -1.546 -8.658 -6.052 1.00 . A A . 4 HIS HB3 1 1 10 4411 1 1 4 HIS HD2 H -1.135 -11.334 -5.651 1.00 . A A . 4 HIS HD2 1 1 10 4412 1 1 4 HIS HE1 H -4.449 -12.719 -7.905 1.00 . A A . 4 HIS HE1 1 1 10 4413 1 1 4 HIS HE2 H -2.376 -13.451 -6.614 1.00 . A A . 4 HIS HE2 1 1 10 4414 1 1 4 HIS N N -4.897 -8.658 -5.567 1.00 . A A . 4 HIS N 1 1 10 4415 1 1 4 HIS ND1 N -3.869 -10.730 -7.388 1.00 . A A . 4 HIS ND1 1 1 10 4416 1 1 4 HIS NE2 N -2.664 -12.492 -6.745 1.00 . A A . 4 HIS NE2 1 1 10 4417 1 1 4 HIS O O -3.046 -6.004 -5.939 1.00 . A A . 4 HIS O 1 1 10 4418 1 1 5 ALA C C -2.810 -4.046 -3.116 1.00 . A A . 5 ALA C 1 1 10 4419 1 1 5 ALA CA C -4.039 -4.916 -3.483 1.00 . A A . 5 ALA CA 1 1 10 4420 1 1 5 ALA CB C -5.117 -4.923 -2.385 1.00 . A A . 5 ALA CB 1 1 10 4421 1 1 5 ALA H H -4.043 -7.020 -3.164 1.00 . A A . 5 ALA H 1 1 10 4422 1 1 5 ALA HA H -4.494 -4.439 -4.352 1.00 . A A . 5 ALA HA 1 1 10 4423 1 1 5 ALA HB1 H -6.002 -5.459 -2.733 1.00 . A A . 5 ALA HB1 1 1 10 4424 1 1 5 ALA HB2 H -4.738 -5.416 -1.486 1.00 . A A . 5 ALA HB2 1 1 10 4425 1 1 5 ALA HB3 H -5.406 -3.902 -2.129 1.00 . A A . 5 ALA HB3 1 1 10 4426 1 1 5 ALA N N -3.733 -6.311 -3.818 1.00 . A A . 5 ALA N 1 1 10 4427 1 1 5 ALA O O -2.685 -3.592 -1.982 1.00 . A A . 5 ALA O 1 1 10 4428 1 1 6 GLY C C -0.414 -2.197 -2.707 1.00 . A A . 6 GLY C 1 1 10 4429 1 1 6 GLY CA C -0.716 -2.948 -4.028 1.00 . A A . 6 GLY CA 1 1 10 4430 1 1 6 GLY H H -2.123 -4.231 -4.988 1.00 . A A . 6 GLY H 1 1 10 4431 1 1 6 GLY HA2 H 0.126 -3.614 -4.228 1.00 . A A . 6 GLY HA2 1 1 10 4432 1 1 6 GLY HA3 H -0.751 -2.221 -4.837 1.00 . A A . 6 GLY HA3 1 1 10 4433 1 1 6 GLY N N -1.948 -3.765 -4.106 1.00 . A A . 6 GLY N 1 1 10 4434 1 1 6 GLY O O 0.257 -2.730 -1.829 1.00 . A A . 6 GLY O 1 1 10 4435 1 1 7 GLN C C -1.839 -0.610 -0.269 1.00 . A A . 7 GLN C 1 1 10 4436 1 1 7 GLN CA C -0.756 -0.193 -1.298 1.00 . A A . 7 GLN CA 1 1 10 4437 1 1 7 GLN CB C -0.729 1.320 -1.609 1.00 . A A . 7 GLN CB 1 1 10 4438 1 1 7 GLN CD C -0.513 3.724 -0.680 1.00 . A A . 7 GLN CD 1 1 10 4439 1 1 7 GLN CG C -0.542 2.228 -0.368 1.00 . A A . 7 GLN CG 1 1 10 4440 1 1 7 GLN H H -1.479 -0.567 -3.272 1.00 . A A . 7 GLN H 1 1 10 4441 1 1 7 GLN HA H 0.213 -0.424 -0.859 1.00 . A A . 7 GLN HA 1 1 10 4442 1 1 7 GLN HB2 H 0.074 1.523 -2.320 1.00 . A A . 7 GLN HB2 1 1 10 4443 1 1 7 GLN HB3 H -1.668 1.594 -2.075 1.00 . A A . 7 GLN HB3 1 1 10 4444 1 1 7 GLN HE21 H -1.218 4.248 1.152 1.00 . A A . 7 GLN HE21 1 1 10 4445 1 1 7 GLN HE22 H -0.817 5.547 0.030 1.00 . A A . 7 GLN HE22 1 1 10 4446 1 1 7 GLN HG2 H -1.338 2.043 0.350 1.00 . A A . 7 GLN HG2 1 1 10 4447 1 1 7 GLN HG3 H 0.404 2.014 0.112 1.00 . A A . 7 GLN HG3 1 1 10 4448 1 1 7 GLN N N -0.888 -0.951 -2.555 1.00 . A A . 7 GLN N 1 1 10 4449 1 1 7 GLN NE2 N -0.842 4.574 0.279 1.00 . A A . 7 GLN NE2 1 1 10 4450 1 1 7 GLN O O -2.876 0.040 -0.148 1.00 . A A . 7 GLN O 1 1 10 4451 1 1 7 GLN OE1 O -0.148 4.159 -1.762 1.00 . A A . 7 GLN OE1 1 1 10 4452 1 1 8 CYS C C -3.362 -1.313 2.324 1.00 . A A . 8 CYS C 1 1 10 4453 1 1 8 CYS CA C -2.492 -2.299 1.493 1.00 . A A . 8 CYS CA 1 1 10 4454 1 1 8 CYS CB C -1.654 -3.195 2.430 1.00 . A A . 8 CYS CB 1 1 10 4455 1 1 8 CYS H H -0.768 -2.220 0.214 1.00 . A A . 8 CYS H 1 1 10 4456 1 1 8 CYS HA H -3.187 -2.954 0.965 1.00 . A A . 8 CYS HA 1 1 10 4457 1 1 8 CYS HB2 H -2.293 -3.616 3.204 1.00 . A A . 8 CYS HB2 1 1 10 4458 1 1 8 CYS HB3 H -1.212 -4.018 1.865 1.00 . A A . 8 CYS HB3 1 1 10 4459 1 1 8 CYS N N -1.597 -1.698 0.477 1.00 . A A . 8 CYS N 1 1 10 4460 1 1 8 CYS O O -4.539 -1.572 2.555 1.00 . A A . 8 CYS O 1 1 10 4461 1 1 8 CYS SG S -0.309 -2.302 3.238 1.00 . A A . 8 CYS SG 1 1 10 4462 1 1 9 GLY C C -2.919 0.721 5.152 1.00 . A A . 9 GLY C 1 1 10 4463 1 1 9 GLY CA C -3.415 0.782 3.692 1.00 . A A . 9 GLY CA 1 1 10 4464 1 1 9 GLY H H -1.812 -0.078 2.543 1.00 . A A . 9 GLY H 1 1 10 4465 1 1 9 GLY HA2 H -3.210 1.776 3.295 1.00 . A A . 9 GLY HA2 1 1 10 4466 1 1 9 GLY HA3 H -4.499 0.658 3.694 1.00 . A A . 9 GLY HA3 1 1 10 4467 1 1 9 GLY N N -2.774 -0.209 2.809 1.00 . A A . 9 GLY N 1 1 10 4468 1 1 9 GLY O O -3.615 0.219 6.030 1.00 . A A . 9 GLY O 1 1 10 4469 1 1 10 GLY C C -1.098 2.569 7.471 1.00 . A A . 10 GLY C 1 1 10 4470 1 1 10 GLY CA C -1.045 1.223 6.716 1.00 . A A . 10 GLY CA 1 1 10 4471 1 1 10 GLY H H -1.188 1.595 4.612 1.00 . A A . 10 GLY H 1 1 10 4472 1 1 10 GLY HA2 H -1.496 0.470 7.367 1.00 . A A . 10 GLY HA2 1 1 10 4473 1 1 10 GLY HA3 H -0.006 0.926 6.568 1.00 . A A . 10 GLY HA3 1 1 10 4474 1 1 10 GLY N N -1.699 1.225 5.396 1.00 . A A . 10 GLY N 1 1 10 4475 1 1 10 GLY O O -2.162 3.109 7.764 1.00 . A A . 10 GLY O 1 1 10 4476 1 1 11 ILE C C -0.501 5.548 8.249 1.00 . A A . 11 ILE C 1 1 10 4477 1 1 11 ILE CA C 0.123 4.239 8.808 1.00 . A A . 11 ILE CA 1 1 10 4478 1 1 11 ILE CB C 1.561 4.418 9.344 1.00 . A A . 11 ILE CB 1 1 10 4479 1 1 11 ILE CD1 C 3.601 3.128 10.272 1.00 . A A . 11 ILE CD1 1 1 10 4480 1 1 11 ILE CG1 C 2.112 3.086 9.914 1.00 . A A . 11 ILE CG1 1 1 10 4481 1 1 11 ILE CG2 C 1.577 5.511 10.432 1.00 . A A . 11 ILE CG2 1 1 10 4482 1 1 11 ILE H H 0.918 2.734 7.485 1.00 . A A . 11 ILE H 1 1 10 4483 1 1 11 ILE HA H -0.469 3.931 9.675 1.00 . A A . 11 ILE HA 1 1 10 4484 1 1 11 ILE HB H 2.182 4.733 8.509 1.00 . A A . 11 ILE HB 1 1 10 4485 1 1 11 ILE HD11 H 4.183 3.380 9.389 1.00 . A A . 11 ILE HD11 1 1 10 4486 1 1 11 ILE HD12 H 3.801 3.853 11.057 1.00 . A A . 11 ILE HD12 1 1 10 4487 1 1 11 ILE HD13 H 3.917 2.144 10.618 1.00 . A A . 11 ILE HD13 1 1 10 4488 1 1 11 ILE HG12 H 1.540 2.807 10.799 1.00 . A A . 11 ILE HG12 1 1 10 4489 1 1 11 ILE HG13 H 2.005 2.290 9.178 1.00 . A A . 11 ILE HG13 1 1 10 4490 1 1 11 ILE HG21 H 1.197 6.456 10.044 1.00 . A A . 11 ILE HG21 1 1 10 4491 1 1 11 ILE HG22 H 0.953 5.203 11.274 1.00 . A A . 11 ILE HG22 1 1 10 4492 1 1 11 ILE HG23 H 2.589 5.694 10.795 1.00 . A A . 11 ILE HG23 1 1 10 4493 1 1 11 ILE N N 0.057 3.130 7.838 1.00 . A A . 11 ILE N 1 1 10 4494 1 1 11 ILE O O -0.006 6.127 7.285 1.00 . A A . 11 ILE O 1 1 10 4495 1 1 12 GLY C C -3.033 6.859 6.904 1.00 . A A . 12 GLY C 1 1 10 4496 1 1 12 GLY CA C -2.475 7.071 8.329 1.00 . A A . 12 GLY CA 1 1 10 4497 1 1 12 GLY H H -1.972 5.429 9.602 1.00 . A A . 12 GLY H 1 1 10 4498 1 1 12 GLY HA2 H -3.336 7.146 8.990 1.00 . A A . 12 GLY HA2 1 1 10 4499 1 1 12 GLY HA3 H -1.954 8.024 8.378 1.00 . A A . 12 GLY HA3 1 1 10 4500 1 1 12 GLY N N -1.619 5.988 8.840 1.00 . A A . 12 GLY N 1 1 10 4501 1 1 12 GLY O O -3.200 7.813 6.148 1.00 . A A . 12 GLY O 1 1 10 4502 1 1 13 TYR C C -5.030 3.984 5.635 1.00 . A A . 13 TYR C 1 1 10 4503 1 1 13 TYR CA C -4.125 5.212 5.374 1.00 . A A . 13 TYR CA 1 1 10 4504 1 1 13 TYR CB C -3.143 4.952 4.213 1.00 . A A . 13 TYR CB 1 1 10 4505 1 1 13 TYR CD1 C -3.861 6.708 2.532 1.00 . A A . 13 TYR CD1 1 1 10 4506 1 1 13 TYR CD2 C -1.522 6.671 3.244 1.00 . A A . 13 TYR CD2 1 1 10 4507 1 1 13 TYR CE1 C -3.567 7.743 1.620 1.00 . A A . 13 TYR CE1 1 1 10 4508 1 1 13 TYR CE2 C -1.228 7.687 2.307 1.00 . A A . 13 TYR CE2 1 1 10 4509 1 1 13 TYR CG C -2.836 6.157 3.337 1.00 . A A . 13 TYR CG 1 1 10 4510 1 1 13 TYR CZ C -2.250 8.221 1.503 1.00 . A A . 13 TYR CZ 1 1 10 4511 1 1 13 TYR H H -3.175 4.873 7.244 1.00 . A A . 13 TYR H 1 1 10 4512 1 1 13 TYR HA H -4.800 6.027 5.102 1.00 . A A . 13 TYR HA 1 1 10 4513 1 1 13 TYR HB2 H -2.223 4.520 4.608 1.00 . A A . 13 TYR HB2 1 1 10 4514 1 1 13 TYR HB3 H -3.566 4.204 3.541 1.00 . A A . 13 TYR HB3 1 1 10 4515 1 1 13 TYR HD1 H -4.873 6.333 2.609 1.00 . A A . 13 TYR HD1 1 1 10 4516 1 1 13 TYR HD2 H -0.740 6.290 3.887 1.00 . A A . 13 TYR HD2 1 1 10 4517 1 1 13 TYR HE1 H -4.356 8.168 1.018 1.00 . A A . 13 TYR HE1 1 1 10 4518 1 1 13 TYR HE2 H -0.229 8.088 2.229 1.00 . A A . 13 TYR HE2 1 1 10 4519 1 1 13 TYR HH H -2.773 9.561 0.232 1.00 . A A . 13 TYR HH 1 1 10 4520 1 1 13 TYR N N -3.384 5.610 6.575 1.00 . A A . 13 TYR N 1 1 10 4521 1 1 13 TYR O O -4.790 3.191 6.539 1.00 . A A . 13 TYR O 1 1 10 4522 1 1 13 TYR OH O -1.967 9.198 0.602 1.00 . A A . 13 TYR OH 1 1 10 4523 1 1 14 SER C C -7.911 2.480 3.704 1.00 . A A . 14 SER C 1 1 10 4524 1 1 14 SER CA C -7.063 2.713 4.976 1.00 . A A . 14 SER CA 1 1 10 4525 1 1 14 SER CB C -8.015 2.942 6.177 1.00 . A A . 14 SER CB 1 1 10 4526 1 1 14 SER H H -6.204 4.488 4.092 1.00 . A A . 14 SER H 1 1 10 4527 1 1 14 SER HA H -6.501 1.791 5.165 1.00 . A A . 14 SER HA 1 1 10 4528 1 1 14 SER HB2 H -8.784 3.680 5.931 1.00 . A A . 14 SER HB2 1 1 10 4529 1 1 14 SER HB3 H -8.513 1.996 6.407 1.00 . A A . 14 SER HB3 1 1 10 4530 1 1 14 SER HG H -6.501 2.951 7.431 1.00 . A A . 14 SER HG 1 1 10 4531 1 1 14 SER N N -6.089 3.821 4.835 1.00 . A A . 14 SER N 1 1 10 4532 1 1 14 SER O O -8.258 1.352 3.368 1.00 . A A . 14 SER O 1 1 10 4533 1 1 14 SER OG O -7.364 3.387 7.353 1.00 . A A . 14 SER OG 1 1 10 4534 1 1 15 GLY C C -8.349 2.914 0.536 1.00 . A A . 15 GLY C 1 1 10 4535 1 1 15 GLY CA C -9.087 3.495 1.772 1.00 . A A . 15 GLY CA 1 1 10 4536 1 1 15 GLY H H -8.038 4.464 3.373 1.00 . A A . 15 GLY H 1 1 10 4537 1 1 15 GLY HA2 H -9.960 2.891 2.007 1.00 . A A . 15 GLY HA2 1 1 10 4538 1 1 15 GLY HA3 H -9.423 4.502 1.522 1.00 . A A . 15 GLY HA3 1 1 10 4539 1 1 15 GLY N N -8.297 3.562 3.009 1.00 . A A . 15 GLY N 1 1 10 4540 1 1 15 GLY O O -7.120 2.804 0.548 1.00 . A A . 15 GLY O 1 1 10 4541 1 1 16 PRO C C -7.444 2.510 -2.563 1.00 . A A . 16 PRO C 1 1 10 4542 1 1 16 PRO CA C -8.533 1.819 -1.705 1.00 . A A . 16 PRO CA 1 1 10 4543 1 1 16 PRO CB C -9.763 1.427 -2.547 1.00 . A A . 16 PRO CB 1 1 10 4544 1 1 16 PRO CD C -10.527 2.642 -0.665 1.00 . A A . 16 PRO CD 1 1 10 4545 1 1 16 PRO CG C -10.910 1.452 -1.542 1.00 . A A . 16 PRO CG 1 1 10 4546 1 1 16 PRO HA H -8.098 0.891 -1.326 1.00 . A A . 16 PRO HA 1 1 10 4547 1 1 16 PRO HB2 H -9.980 2.181 -3.311 1.00 . A A . 16 PRO HB2 1 1 10 4548 1 1 16 PRO HB3 H -9.646 0.454 -3.028 1.00 . A A . 16 PRO HB3 1 1 10 4549 1 1 16 PRO HD2 H -10.802 3.581 -1.151 1.00 . A A . 16 PRO HD2 1 1 10 4550 1 1 16 PRO HD3 H -11.073 2.562 0.272 1.00 . A A . 16 PRO HD3 1 1 10 4551 1 1 16 PRO HG2 H -11.885 1.568 -2.018 1.00 . A A . 16 PRO HG2 1 1 10 4552 1 1 16 PRO HG3 H -10.891 0.537 -0.946 1.00 . A A . 16 PRO HG3 1 1 10 4553 1 1 16 PRO N N -9.072 2.567 -0.552 1.00 . A A . 16 PRO N 1 1 10 4554 1 1 16 PRO O O -7.656 2.795 -3.741 1.00 . A A . 16 PRO O 1 1 10 4555 1 1 17 THR C C -4.477 2.076 -3.786 1.00 . A A . 17 THR C 1 1 10 4556 1 1 17 THR CA C -5.052 3.157 -2.820 1.00 . A A . 17 THR CA 1 1 10 4557 1 1 17 THR CB C -3.981 3.774 -1.888 1.00 . A A . 17 THR CB 1 1 10 4558 1 1 17 THR CG2 C -4.513 4.981 -1.110 1.00 . A A . 17 THR CG2 1 1 10 4559 1 1 17 THR H H -6.130 2.530 -1.042 1.00 . A A . 17 THR H 1 1 10 4560 1 1 17 THR HA H -5.375 3.979 -3.463 1.00 . A A . 17 THR HA 1 1 10 4561 1 1 17 THR HB H -3.135 4.115 -2.492 1.00 . A A . 17 THR HB 1 1 10 4562 1 1 17 THR HG1 H -4.194 2.263 -0.641 1.00 . A A . 17 THR HG1 1 1 10 4563 1 1 17 THR HG21 H -4.930 5.717 -1.798 1.00 . A A . 17 THR HG21 1 1 10 4564 1 1 17 THR HG22 H -5.281 4.678 -0.400 1.00 . A A . 17 THR HG22 1 1 10 4565 1 1 17 THR HG23 H -3.688 5.440 -0.562 1.00 . A A . 17 THR HG23 1 1 10 4566 1 1 17 THR N N -6.230 2.699 -2.038 1.00 . A A . 17 THR N 1 1 10 4567 1 1 17 THR O O -3.297 1.737 -3.787 1.00 . A A . 17 THR O 1 1 10 4568 1 1 17 THR OG1 O -3.498 2.863 -0.927 1.00 . A A . 17 THR OG1 1 1 10 4569 1 1 18 VAL C C -4.256 0.095 -6.562 1.00 . A A . 18 VAL C 1 1 10 4570 1 1 18 VAL CA C -5.110 0.163 -5.255 1.00 . A A . 18 VAL CA 1 1 10 4571 1 1 18 VAL CB C -6.466 -0.570 -5.359 1.00 . A A . 18 VAL CB 1 1 10 4572 1 1 18 VAL CG1 C -7.500 0.132 -6.258 1.00 . A A . 18 VAL CG1 1 1 10 4573 1 1 18 VAL CG2 C -6.276 -2.027 -5.804 1.00 . A A . 18 VAL CG2 1 1 10 4574 1 1 18 VAL H H -6.263 1.872 -4.633 1.00 . A A . 18 VAL H 1 1 10 4575 1 1 18 VAL HA H -4.551 -0.425 -4.522 1.00 . A A . 18 VAL HA 1 1 10 4576 1 1 18 VAL HB H -6.892 -0.601 -4.352 1.00 . A A . 18 VAL HB 1 1 10 4577 1 1 18 VAL HG11 H -7.612 1.178 -5.972 1.00 . A A . 18 VAL HG11 1 1 10 4578 1 1 18 VAL HG12 H -7.209 0.087 -7.306 1.00 . A A . 18 VAL HG12 1 1 10 4579 1 1 18 VAL HG13 H -8.470 -0.355 -6.149 1.00 . A A . 18 VAL HG13 1 1 10 4580 1 1 18 VAL HG21 H -5.603 -2.542 -5.118 1.00 . A A . 18 VAL HG21 1 1 10 4581 1 1 18 VAL HG22 H -7.238 -2.535 -5.802 1.00 . A A . 18 VAL HG22 1 1 10 4582 1 1 18 VAL HG23 H -5.860 -2.079 -6.807 1.00 . A A . 18 VAL HG23 1 1 10 4583 1 1 18 VAL N N -5.323 1.493 -4.645 1.00 . A A . 18 VAL N 1 1 10 4584 1 1 18 VAL O O -4.771 0.025 -7.679 1.00 . A A . 18 VAL O 1 1 10 4585 1 1 19 CYS C C -1.887 -1.757 -7.970 1.00 . A A . 19 CYS C 1 1 10 4586 1 1 19 CYS CA C -1.949 -0.269 -7.490 1.00 . A A . 19 CYS CA 1 1 10 4587 1 1 19 CYS CB C -0.625 0.352 -6.989 1.00 . A A . 19 CYS CB 1 1 10 4588 1 1 19 CYS H H -2.591 0.060 -5.464 1.00 . A A . 19 CYS H 1 1 10 4589 1 1 19 CYS HA H -2.244 0.303 -8.373 1.00 . A A . 19 CYS HA 1 1 10 4590 1 1 19 CYS HB2 H -0.706 1.439 -7.072 1.00 . A A . 19 CYS HB2 1 1 10 4591 1 1 19 CYS HB3 H -0.503 0.124 -5.930 1.00 . A A . 19 CYS HB3 1 1 10 4592 1 1 19 CYS N N -2.933 -0.014 -6.413 1.00 . A A . 19 CYS N 1 1 10 4593 1 1 19 CYS O O -2.685 -2.596 -7.545 1.00 . A A . 19 CYS O 1 1 10 4594 1 1 19 CYS SG S 0.963 -0.058 -7.754 1.00 . A A . 19 CYS SG 1 1 10 4595 1 1 20 ALA C C -0.336 -4.522 -8.463 1.00 . A A . 20 ALA C 1 1 10 4596 1 1 20 ALA CA C -0.710 -3.414 -9.492 1.00 . A A . 20 ALA CA 1 1 10 4597 1 1 20 ALA CB C 0.396 -3.218 -10.546 1.00 . A A . 20 ALA CB 1 1 10 4598 1 1 20 ALA H H -0.498 -1.320 -9.346 1.00 . A A . 20 ALA H 1 1 10 4599 1 1 20 ALA HA H -1.593 -3.779 -10.019 1.00 . A A . 20 ALA HA 1 1 10 4600 1 1 20 ALA HB1 H 0.085 -2.475 -11.282 1.00 . A A . 20 ALA HB1 1 1 10 4601 1 1 20 ALA HB2 H 1.315 -2.872 -10.068 1.00 . A A . 20 ALA HB2 1 1 10 4602 1 1 20 ALA HB3 H 0.612 -4.144 -11.080 1.00 . A A . 20 ALA HB3 1 1 10 4603 1 1 20 ALA N N -1.028 -2.080 -8.951 1.00 . A A . 20 ALA N 1 1 10 4604 1 1 20 ALA O O -0.428 -4.338 -7.254 1.00 . A A . 20 ALA O 1 1 10 4605 1 1 21 SER C C 1.621 -7.156 -7.626 1.00 . A A . 21 SER C 1 1 10 4606 1 1 21 SER CA C 0.192 -6.948 -8.181 1.00 . A A . 21 SER CA 1 1 10 4607 1 1 21 SER CB C -0.212 -8.153 -9.053 1.00 . A A . 21 SER CB 1 1 10 4608 1 1 21 SER H H 0.070 -5.814 -9.966 1.00 . A A . 21 SER H 1 1 10 4609 1 1 21 SER HA H -0.515 -6.925 -7.347 1.00 . A A . 21 SER HA 1 1 10 4610 1 1 21 SER HB2 H 0.543 -8.336 -9.827 1.00 . A A . 21 SER HB2 1 1 10 4611 1 1 21 SER HB3 H -0.273 -9.057 -8.435 1.00 . A A . 21 SER HB3 1 1 10 4612 1 1 21 SER HG H -2.058 -7.587 -8.930 1.00 . A A . 21 SER HG 1 1 10 4613 1 1 21 SER N N 0.012 -5.710 -8.965 1.00 . A A . 21 SER N 1 1 10 4614 1 1 21 SER O O 2.559 -7.265 -8.409 1.00 . A A . 21 SER O 1 1 10 4615 1 1 21 SER OG O -1.479 -7.885 -9.638 1.00 . A A . 21 SER OG 1 1 10 4616 1 1 22 GLY C C 2.575 -8.275 -4.172 1.00 . A A . 22 GLY C 1 1 10 4617 1 1 22 GLY CA C 2.948 -7.749 -5.579 1.00 . A A . 22 GLY CA 1 1 10 4618 1 1 22 GLY H H 0.909 -7.125 -5.757 1.00 . A A . 22 GLY H 1 1 10 4619 1 1 22 GLY HA2 H 3.410 -8.563 -6.141 1.00 . A A . 22 GLY HA2 1 1 10 4620 1 1 22 GLY HA3 H 3.665 -6.930 -5.517 1.00 . A A . 22 GLY HA3 1 1 10 4621 1 1 22 GLY N N 1.741 -7.294 -6.301 1.00 . A A . 22 GLY N 1 1 10 4622 1 1 22 GLY O O 2.329 -9.469 -3.998 1.00 . A A . 22 GLY O 1 1 10 4623 1 1 23 THR C C 1.953 -7.437 -0.727 1.00 . A A . 23 THR C 1 1 10 4624 1 1 23 THR CA C 1.300 -7.392 -2.121 1.00 . A A . 23 THR CA 1 1 10 4625 1 1 23 THR CB C 0.129 -8.409 -2.233 1.00 . A A . 23 THR CB 1 1 10 4626 1 1 23 THR CG2 C -1.144 -7.945 -1.499 1.00 . A A . 23 THR CG2 1 1 10 4627 1 1 23 THR H H 2.836 -6.508 -3.344 1.00 . A A . 23 THR H 1 1 10 4628 1 1 23 THR HA H 0.816 -6.418 -2.161 1.00 . A A . 23 THR HA 1 1 10 4629 1 1 23 THR HB H 0.449 -9.380 -1.829 1.00 . A A . 23 THR HB 1 1 10 4630 1 1 23 THR HG1 H 0.428 -8.855 -4.067 1.00 . A A . 23 THR HG1 1 1 10 4631 1 1 23 THR HG21 H -1.432 -6.964 -1.877 1.00 . A A . 23 THR HG21 1 1 10 4632 1 1 23 THR HG22 H -1.961 -8.642 -1.699 1.00 . A A . 23 THR HG22 1 1 10 4633 1 1 23 THR HG23 H -1.002 -7.887 -0.419 1.00 . A A . 23 THR HG23 1 1 10 4634 1 1 23 THR N N 2.269 -7.353 -3.257 1.00 . A A . 23 THR N 1 1 10 4635 1 1 23 THR O O 1.389 -7.963 0.229 1.00 . A A . 23 THR O 1 1 10 4636 1 1 23 THR OG1 O -0.324 -8.519 -3.567 1.00 . A A . 23 THR OG1 1 1 10 4637 1 1 24 THR C C 3.523 -5.364 1.378 1.00 . A A . 24 THR C 1 1 10 4638 1 1 24 THR CA C 3.884 -6.683 0.661 1.00 . A A . 24 THR CA 1 1 10 4639 1 1 24 THR CB C 5.407 -6.756 0.419 1.00 . A A . 24 THR CB 1 1 10 4640 1 1 24 THR CG2 C 5.844 -8.056 -0.264 1.00 . A A . 24 THR CG2 1 1 10 4641 1 1 24 THR H H 3.542 -6.442 -1.433 1.00 . A A . 24 THR H 1 1 10 4642 1 1 24 THR HA H 3.639 -7.522 1.320 1.00 . A A . 24 THR HA 1 1 10 4643 1 1 24 THR HB H 5.905 -6.694 1.390 1.00 . A A . 24 THR HB 1 1 10 4644 1 1 24 THR HG1 H 5.397 -5.702 -1.220 1.00 . A A . 24 THR HG1 1 1 10 4645 1 1 24 THR HG21 H 5.556 -8.917 0.339 1.00 . A A . 24 THR HG21 1 1 10 4646 1 1 24 THR HG22 H 5.388 -8.136 -1.252 1.00 . A A . 24 THR HG22 1 1 10 4647 1 1 24 THR HG23 H 6.927 -8.050 -0.386 1.00 . A A . 24 THR HG23 1 1 10 4648 1 1 24 THR N N 3.138 -6.851 -0.594 1.00 . A A . 24 THR N 1 1 10 4649 1 1 24 THR O O 3.696 -4.268 0.848 1.00 . A A . 24 THR O 1 1 10 4650 1 1 24 THR OG1 O 5.874 -5.690 -0.375 1.00 . A A . 24 THR OG1 1 1 10 4651 1 1 25 CYS C C 3.845 -3.514 4.006 1.00 . A A . 25 CYS C 1 1 10 4652 1 1 25 CYS CA C 2.613 -4.261 3.401 1.00 . A A . 25 CYS CA 1 1 10 4653 1 1 25 CYS CB C 1.508 -4.686 4.392 1.00 . A A . 25 CYS CB 1 1 10 4654 1 1 25 CYS H H 2.835 -6.365 2.982 1.00 . A A . 25 CYS H 1 1 10 4655 1 1 25 CYS HA H 2.148 -3.560 2.711 1.00 . A A . 25 CYS HA 1 1 10 4656 1 1 25 CYS HB2 H 0.868 -5.432 3.916 1.00 . A A . 25 CYS HB2 1 1 10 4657 1 1 25 CYS HB3 H 1.954 -5.139 5.279 1.00 . A A . 25 CYS HB3 1 1 10 4658 1 1 25 CYS N N 3.002 -5.443 2.608 1.00 . A A . 25 CYS N 1 1 10 4659 1 1 25 CYS O O 4.095 -3.540 5.209 1.00 . A A . 25 CYS O 1 1 10 4660 1 1 25 CYS SG S 0.332 -3.426 4.983 1.00 . A A . 25 CYS SG 1 1 10 4661 1 1 26 GLN C C 5.778 -0.862 4.151 1.00 . A A . 26 GLN C 1 1 10 4662 1 1 26 GLN CA C 5.907 -2.161 3.302 1.00 . A A . 26 GLN CA 1 1 10 4663 1 1 26 GLN CB C 6.399 -1.886 1.852 1.00 . A A . 26 GLN CB 1 1 10 4664 1 1 26 GLN CD C 8.975 -1.401 2.139 1.00 . A A . 26 GLN CD 1 1 10 4665 1 1 26 GLN CG C 7.617 -0.969 1.586 1.00 . A A . 26 GLN CG 1 1 10 4666 1 1 26 GLN H H 4.347 -3.053 2.154 1.00 . A A . 26 GLN H 1 1 10 4667 1 1 26 GLN HA H 6.624 -2.800 3.817 1.00 . A A . 26 GLN HA 1 1 10 4668 1 1 26 GLN HB2 H 6.595 -2.840 1.359 1.00 . A A . 26 GLN HB2 1 1 10 4669 1 1 26 GLN HB3 H 5.575 -1.417 1.305 1.00 . A A . 26 GLN HB3 1 1 10 4670 1 1 26 GLN HE21 H 8.334 -3.211 2.789 1.00 . A A . 26 GLN HE21 1 1 10 4671 1 1 26 GLN HE22 H 10.024 -2.764 3.081 1.00 . A A . 26 GLN HE22 1 1 10 4672 1 1 26 GLN HG2 H 7.744 -0.905 0.509 1.00 . A A . 26 GLN HG2 1 1 10 4673 1 1 26 GLN HG3 H 7.419 0.052 1.915 1.00 . A A . 26 GLN HG3 1 1 10 4674 1 1 26 GLN N N 4.651 -2.921 3.113 1.00 . A A . 26 GLN N 1 1 10 4675 1 1 26 GLN NE2 N 9.096 -2.557 2.755 1.00 . A A . 26 GLN NE2 1 1 10 4676 1 1 26 GLN O O 4.708 -0.485 4.613 1.00 . A A . 26 GLN O 1 1 10 4677 1 1 26 GLN OE1 O 9.951 -0.682 2.026 1.00 . A A . 26 GLN OE1 1 1 10 4678 1 1 27 VAL C C 7.998 2.138 4.198 1.00 . A A . 27 VAL C 1 1 10 4679 1 1 27 VAL CA C 6.818 1.302 4.774 1.00 . A A . 27 VAL CA 1 1 10 4680 1 1 27 VAL CB C 6.659 1.355 6.314 1.00 . A A . 27 VAL CB 1 1 10 4681 1 1 27 VAL CG1 C 7.988 1.495 7.078 1.00 . A A . 27 VAL CG1 1 1 10 4682 1 1 27 VAL CG2 C 5.661 2.451 6.720 1.00 . A A . 27 VAL CG2 1 1 10 4683 1 1 27 VAL H H 7.767 -0.471 4.057 1.00 . A A . 27 VAL H 1 1 10 4684 1 1 27 VAL HA H 5.917 1.737 4.334 1.00 . A A . 27 VAL HA 1 1 10 4685 1 1 27 VAL HB H 6.208 0.422 6.666 1.00 . A A . 27 VAL HB 1 1 10 4686 1 1 27 VAL HG11 H 8.663 0.693 6.783 1.00 . A A . 27 VAL HG11 1 1 10 4687 1 1 27 VAL HG12 H 8.452 2.459 6.868 1.00 . A A . 27 VAL HG12 1 1 10 4688 1 1 27 VAL HG13 H 7.810 1.420 8.150 1.00 . A A . 27 VAL HG13 1 1 10 4689 1 1 27 VAL HG21 H 5.873 3.376 6.188 1.00 . A A . 27 VAL HG21 1 1 10 4690 1 1 27 VAL HG22 H 4.643 2.141 6.463 1.00 . A A . 27 VAL HG22 1 1 10 4691 1 1 27 VAL HG23 H 5.708 2.634 7.795 1.00 . A A . 27 VAL HG23 1 1 10 4692 1 1 27 VAL N N 6.867 -0.103 4.326 1.00 . A A . 27 VAL N 1 1 10 4693 1 1 27 VAL O O 9.119 1.643 4.140 1.00 . A A . 27 VAL O 1 1 10 4694 1 1 28 LEU C C 8.993 5.505 4.013 1.00 . A A . 28 LEU C 1 1 10 4695 1 1 28 LEU CA C 8.753 4.271 3.106 1.00 . A A . 28 LEU CA 1 1 10 4696 1 1 28 LEU CB C 8.344 4.738 1.682 1.00 . A A . 28 LEU CB 1 1 10 4697 1 1 28 LEU CD1 C 7.160 4.558 -0.484 1.00 . A A . 28 LEU CD1 1 1 10 4698 1 1 28 LEU CD2 C 8.432 2.562 0.354 1.00 . A A . 28 LEU CD2 1 1 10 4699 1 1 28 LEU CG C 7.582 3.767 0.767 1.00 . A A . 28 LEU CG 1 1 10 4700 1 1 28 LEU H H 6.814 3.715 3.868 1.00 . A A . 28 LEU H 1 1 10 4701 1 1 28 LEU HA H 9.711 3.748 3.009 1.00 . A A . 28 LEU HA 1 1 10 4702 1 1 28 LEU HB2 H 7.685 5.604 1.740 1.00 . A A . 28 LEU HB2 1 1 10 4703 1 1 28 LEU HB3 H 9.249 5.072 1.169 1.00 . A A . 28 LEU HB3 1 1 10 4704 1 1 28 LEU HD11 H 8.038 4.961 -0.989 1.00 . A A . 28 LEU HD11 1 1 10 4705 1 1 28 LEU HD12 H 6.636 3.919 -1.186 1.00 . A A . 28 LEU HD12 1 1 10 4706 1 1 28 LEU HD13 H 6.502 5.386 -0.213 1.00 . A A . 28 LEU HD13 1 1 10 4707 1 1 28 LEU HD21 H 8.860 2.077 1.230 1.00 . A A . 28 LEU HD21 1 1 10 4708 1 1 28 LEU HD22 H 7.811 1.842 -0.178 1.00 . A A . 28 LEU HD22 1 1 10 4709 1 1 28 LEU HD23 H 9.242 2.877 -0.303 1.00 . A A . 28 LEU HD23 1 1 10 4710 1 1 28 LEU HG H 6.685 3.416 1.278 1.00 . A A . 28 LEU HG 1 1 10 4711 1 1 28 LEU N N 7.741 3.362 3.706 1.00 . A A . 28 LEU N 1 1 10 4712 1 1 28 LEU O O 9.994 5.618 4.714 1.00 . A A . 28 LEU O 1 1 10 4713 1 1 29 ASN C C 7.459 6.525 6.448 1.00 . A A . 29 ASN C 1 1 10 4714 1 1 29 ASN CA C 7.745 7.328 5.146 1.00 . A A . 29 ASN CA 1 1 10 4715 1 1 29 ASN CB C 6.481 8.153 4.788 1.00 . A A . 29 ASN CB 1 1 10 4716 1 1 29 ASN CG C 6.439 8.753 3.384 1.00 . A A . 29 ASN CG 1 1 10 4717 1 1 29 ASN H H 7.240 6.237 3.413 1.00 . A A . 29 ASN H 1 1 10 4718 1 1 29 ASN HA H 8.605 7.987 5.285 1.00 . A A . 29 ASN HA 1 1 10 4719 1 1 29 ASN HB2 H 5.623 7.486 4.881 1.00 . A A . 29 ASN HB2 1 1 10 4720 1 1 29 ASN HB3 H 6.345 8.974 5.489 1.00 . A A . 29 ASN HB3 1 1 10 4721 1 1 29 ASN HD21 H 4.426 8.474 3.216 1.00 . A A . 29 ASN HD21 1 1 10 4722 1 1 29 ASN HD22 H 5.282 9.195 1.842 1.00 . A A . 29 ASN HD22 1 1 10 4723 1 1 29 ASN N N 8.004 6.408 4.039 1.00 . A A . 29 ASN N 1 1 10 4724 1 1 29 ASN ND2 N 5.275 8.790 2.761 1.00 . A A . 29 ASN ND2 1 1 10 4725 1 1 29 ASN O O 7.266 5.311 6.377 1.00 . A A . 29 ASN O 1 1 10 4726 1 1 29 ASN OD1 O 7.439 9.184 2.837 1.00 . A A . 29 ASN OD1 1 1 10 4727 1 1 30 PRO C C 4.922 6.423 7.948 1.00 . A A . 30 PRO C 1 1 10 4728 1 1 30 PRO CA C 6.312 6.632 8.598 1.00 . A A . 30 PRO CA 1 1 10 4729 1 1 30 PRO CB C 6.316 7.646 9.759 1.00 . A A . 30 PRO CB 1 1 10 4730 1 1 30 PRO CD C 7.698 8.502 7.980 1.00 . A A . 30 PRO CD 1 1 10 4731 1 1 30 PRO CG C 7.554 8.519 9.501 1.00 . A A . 30 PRO CG 1 1 10 4732 1 1 30 PRO HA H 6.694 5.673 8.958 1.00 . A A . 30 PRO HA 1 1 10 4733 1 1 30 PRO HB2 H 5.428 8.281 9.742 1.00 . A A . 30 PRO HB2 1 1 10 4734 1 1 30 PRO HB3 H 6.374 7.146 10.729 1.00 . A A . 30 PRO HB3 1 1 10 4735 1 1 30 PRO HD2 H 7.054 9.268 7.550 1.00 . A A . 30 PRO HD2 1 1 10 4736 1 1 30 PRO HD3 H 8.735 8.677 7.685 1.00 . A A . 30 PRO HD3 1 1 10 4737 1 1 30 PRO HG2 H 7.438 9.531 9.897 1.00 . A A . 30 PRO HG2 1 1 10 4738 1 1 30 PRO HG3 H 8.432 8.047 9.948 1.00 . A A . 30 PRO HG3 1 1 10 4739 1 1 30 PRO N N 7.237 7.177 7.602 1.00 . A A . 30 PRO N 1 1 10 4740 1 1 30 PRO O O 4.435 5.309 7.817 1.00 . A A . 30 PRO O 1 1 10 4741 1 1 31 TYR C C 2.998 6.978 5.337 1.00 . A A . 31 TYR C 1 1 10 4742 1 1 31 TYR CA C 3.007 7.534 6.788 1.00 . A A . 31 TYR CA 1 1 10 4743 1 1 31 TYR CB C 2.481 8.983 6.850 1.00 . A A . 31 TYR CB 1 1 10 4744 1 1 31 TYR CD1 C 3.025 9.901 9.171 1.00 . A A . 31 TYR CD1 1 1 10 4745 1 1 31 TYR CD2 C 0.751 9.163 8.675 1.00 . A A . 31 TYR CD2 1 1 10 4746 1 1 31 TYR CE1 C 2.668 10.078 10.525 1.00 . A A . 31 TYR CE1 1 1 10 4747 1 1 31 TYR CE2 C 0.397 9.335 10.030 1.00 . A A . 31 TYR CE2 1 1 10 4748 1 1 31 TYR CG C 2.069 9.423 8.245 1.00 . A A . 31 TYR CG 1 1 10 4749 1 1 31 TYR CZ C 1.359 9.783 10.952 1.00 . A A . 31 TYR CZ 1 1 10 4750 1 1 31 TYR H H 4.781 8.390 7.589 1.00 . A A . 31 TYR H 1 1 10 4751 1 1 31 TYR HA H 2.320 6.915 7.361 1.00 . A A . 31 TYR HA 1 1 10 4752 1 1 31 TYR HB2 H 3.232 9.666 6.449 1.00 . A A . 31 TYR HB2 1 1 10 4753 1 1 31 TYR HB3 H 1.604 9.061 6.202 1.00 . A A . 31 TYR HB3 1 1 10 4754 1 1 31 TYR HD1 H 4.037 10.107 8.853 1.00 . A A . 31 TYR HD1 1 1 10 4755 1 1 31 TYR HD2 H 0.030 8.800 7.960 1.00 . A A . 31 TYR HD2 1 1 10 4756 1 1 31 TYR HE1 H 3.400 10.429 11.236 1.00 . A A . 31 TYR HE1 1 1 10 4757 1 1 31 TYR HE2 H -0.600 9.104 10.370 1.00 . A A . 31 TYR HE2 1 1 10 4758 1 1 31 TYR HH H 1.787 10.203 12.775 1.00 . A A . 31 TYR HH 1 1 10 4759 1 1 31 TYR N N 4.319 7.508 7.454 1.00 . A A . 31 TYR N 1 1 10 4760 1 1 31 TYR O O 3.055 7.755 4.381 1.00 . A A . 31 TYR O 1 1 10 4761 1 1 31 TYR OH O 1.028 9.923 12.262 1.00 . A A . 31 TYR OH 1 1 10 4762 1 1 32 TYR C C 2.437 3.428 3.989 1.00 . A A . 32 TYR C 1 1 10 4763 1 1 32 TYR CA C 2.681 4.966 3.866 1.00 . A A . 32 TYR CA 1 1 10 4764 1 1 32 TYR CB C 3.825 5.291 2.864 1.00 . A A . 32 TYR CB 1 1 10 4765 1 1 32 TYR CD1 C 2.651 6.666 1.064 1.00 . A A . 32 TYR CD1 1 1 10 4766 1 1 32 TYR CD2 C 3.675 4.537 0.437 1.00 . A A . 32 TYR CD2 1 1 10 4767 1 1 32 TYR CE1 C 2.293 6.886 -0.285 1.00 . A A . 32 TYR CE1 1 1 10 4768 1 1 32 TYR CE2 C 3.250 4.732 -0.894 1.00 . A A . 32 TYR CE2 1 1 10 4769 1 1 32 TYR CG C 3.376 5.504 1.424 1.00 . A A . 32 TYR CG 1 1 10 4770 1 1 32 TYR CZ C 2.618 5.929 -1.266 1.00 . A A . 32 TYR CZ 1 1 10 4771 1 1 32 TYR H H 2.942 5.079 6.001 1.00 . A A . 32 TYR H 1 1 10 4772 1 1 32 TYR HA H 1.752 5.388 3.480 1.00 . A A . 32 TYR HA 1 1 10 4773 1 1 32 TYR HB2 H 4.368 6.188 3.141 1.00 . A A . 32 TYR HB2 1 1 10 4774 1 1 32 TYR HB3 H 4.578 4.503 2.910 1.00 . A A . 32 TYR HB3 1 1 10 4775 1 1 32 TYR HD1 H 2.371 7.389 1.822 1.00 . A A . 32 TYR HD1 1 1 10 4776 1 1 32 TYR HD2 H 4.225 3.647 0.699 1.00 . A A . 32 TYR HD2 1 1 10 4777 1 1 32 TYR HE1 H 1.777 7.792 -0.561 1.00 . A A . 32 TYR HE1 1 1 10 4778 1 1 32 TYR HE2 H 3.417 3.979 -1.639 1.00 . A A . 32 TYR HE2 1 1 10 4779 1 1 32 TYR HH H 1.876 6.988 -2.677 1.00 . A A . 32 TYR HH 1 1 10 4780 1 1 32 TYR N N 2.926 5.646 5.159 1.00 . A A . 32 TYR N 1 1 10 4781 1 1 32 TYR O O 2.133 2.925 5.068 1.00 . A A . 32 TYR O 1 1 10 4782 1 1 32 TYR OH O 2.348 6.161 -2.576 1.00 . A A . 32 TYR OH 1 1 10 4783 1 1 33 SER C C 2.811 0.726 1.294 1.00 . A A . 33 SER C 1 1 10 4784 1 1 33 SER CA C 2.914 1.248 2.752 1.00 . A A . 33 SER CA 1 1 10 4785 1 1 33 SER CB C 2.074 0.363 3.692 1.00 . A A . 33 SER CB 1 1 10 4786 1 1 33 SER H H 2.679 3.239 2.033 1.00 . A A . 33 SER H 1 1 10 4787 1 1 33 SER HA H 3.957 1.140 3.033 1.00 . A A . 33 SER HA 1 1 10 4788 1 1 33 SER HB2 H 2.381 0.501 4.733 1.00 . A A . 33 SER HB2 1 1 10 4789 1 1 33 SER HB3 H 1.015 0.609 3.603 1.00 . A A . 33 SER HB3 1 1 10 4790 1 1 33 SER HG H 2.021 -1.162 2.431 1.00 . A A . 33 SER HG 1 1 10 4791 1 1 33 SER N N 2.591 2.693 2.872 1.00 . A A . 33 SER N 1 1 10 4792 1 1 33 SER O O 1.753 0.247 0.894 1.00 . A A . 33 SER O 1 1 10 4793 1 1 33 SER OG O 2.267 -1.000 3.352 1.00 . A A . 33 SER OG 1 1 10 4794 1 1 34 GLN C C 3.612 -0.596 -1.665 1.00 . A A . 34 GLN C 1 1 10 4795 1 1 34 GLN CA C 3.767 0.796 -0.994 1.00 . A A . 34 GLN CA 1 1 10 4796 1 1 34 GLN CB C 4.958 1.557 -1.607 1.00 . A A . 34 GLN CB 1 1 10 4797 1 1 34 GLN CD C 5.722 2.969 -3.617 1.00 . A A . 34 GLN CD 1 1 10 4798 1 1 34 GLN CG C 4.764 1.897 -3.105 1.00 . A A . 34 GLN CG 1 1 10 4799 1 1 34 GLN H H 4.748 1.119 0.882 1.00 . A A . 34 GLN H 1 1 10 4800 1 1 34 GLN HA H 2.870 1.371 -1.245 1.00 . A A . 34 GLN HA 1 1 10 4801 1 1 34 GLN HB2 H 5.076 2.483 -1.051 1.00 . A A . 34 GLN HB2 1 1 10 4802 1 1 34 GLN HB3 H 5.873 0.973 -1.485 1.00 . A A . 34 GLN HB3 1 1 10 4803 1 1 34 GLN HE21 H 4.329 4.466 -3.542 1.00 . A A . 34 GLN HE21 1 1 10 4804 1 1 34 GLN HE22 H 5.956 4.859 -4.099 1.00 . A A . 34 GLN HE22 1 1 10 4805 1 1 34 GLN HG2 H 4.941 1.006 -3.706 1.00 . A A . 34 GLN HG2 1 1 10 4806 1 1 34 GLN HG3 H 3.745 2.237 -3.289 1.00 . A A . 34 GLN HG3 1 1 10 4807 1 1 34 GLN N N 3.864 0.858 0.479 1.00 . A A . 34 GLN N 1 1 10 4808 1 1 34 GLN NE2 N 5.278 4.206 -3.749 1.00 . A A . 34 GLN NE2 1 1 10 4809 1 1 34 GLN O O 4.087 -1.616 -1.184 1.00 . A A . 34 GLN O 1 1 10 4810 1 1 34 GLN OE1 O 6.876 2.711 -3.911 1.00 . A A . 34 GLN OE1 1 1 10 4811 1 1 35 CYS C C 4.152 -2.282 -4.371 1.00 . A A . 35 CYS C 1 1 10 4812 1 1 35 CYS CA C 2.853 -1.566 -3.908 1.00 . A A . 35 CYS CA 1 1 10 4813 1 1 35 CYS CB C 2.174 -0.807 -5.060 1.00 . A A . 35 CYS CB 1 1 10 4814 1 1 35 CYS H H 2.620 0.350 -3.073 1.00 . A A . 35 CYS H 1 1 10 4815 1 1 35 CYS HA H 2.184 -2.351 -3.556 1.00 . A A . 35 CYS HA 1 1 10 4816 1 1 35 CYS HB2 H 1.279 -0.325 -4.670 1.00 . A A . 35 CYS HB2 1 1 10 4817 1 1 35 CYS HB3 H 2.844 -0.024 -5.410 1.00 . A A . 35 CYS HB3 1 1 10 4818 1 1 35 CYS N N 2.998 -0.554 -2.853 1.00 . A A . 35 CYS N 1 1 10 4819 1 1 35 CYS O O 4.559 -2.135 -5.522 1.00 . A A . 35 CYS O 1 1 10 4820 1 1 35 CYS SG S 1.635 -1.698 -6.537 1.00 . A A . 35 CYS SG 1 1 10 4821 1 1 36 LEU C C 5.250 -5.506 -3.572 1.00 . A A . 36 LEU C 1 1 10 4822 1 1 36 LEU CA C 5.803 -4.065 -3.748 1.00 . A A . 36 LEU CA 1 1 10 4823 1 1 36 LEU CB C 6.978 -3.778 -2.789 1.00 . A A . 36 LEU CB 1 1 10 4824 1 1 36 LEU CD1 C 7.446 -1.570 -4.094 1.00 . A A . 36 LEU CD1 1 1 10 4825 1 1 36 LEU CD2 C 8.805 -2.177 -2.106 1.00 . A A . 36 LEU CD2 1 1 10 4826 1 1 36 LEU CG C 8.020 -2.751 -3.295 1.00 . A A . 36 LEU CG 1 1 10 4827 1 1 36 LEU H H 4.369 -3.077 -2.544 1.00 . A A . 36 LEU H 1 1 10 4828 1 1 36 LEU HA H 6.157 -4.002 -4.776 1.00 . A A . 36 LEU HA 1 1 10 4829 1 1 36 LEU HB2 H 6.571 -3.449 -1.828 1.00 . A A . 36 LEU HB2 1 1 10 4830 1 1 36 LEU HB3 H 7.516 -4.709 -2.606 1.00 . A A . 36 LEU HB3 1 1 10 4831 1 1 36 LEU HD11 H 6.657 -1.074 -3.530 1.00 . A A . 36 LEU HD11 1 1 10 4832 1 1 36 LEU HD12 H 8.236 -0.849 -4.306 1.00 . A A . 36 LEU HD12 1 1 10 4833 1 1 36 LEU HD13 H 7.054 -1.919 -5.049 1.00 . A A . 36 LEU HD13 1 1 10 4834 1 1 36 LEU HD21 H 9.207 -2.981 -1.488 1.00 . A A . 36 LEU HD21 1 1 10 4835 1 1 36 LEU HD22 H 9.627 -1.554 -2.460 1.00 . A A . 36 LEU HD22 1 1 10 4836 1 1 36 LEU HD23 H 8.133 -1.565 -1.509 1.00 . A A . 36 LEU HD23 1 1 10 4837 1 1 36 LEU HG H 8.721 -3.281 -3.944 1.00 . A A . 36 LEU HG 1 1 10 4838 1 1 36 LEU N N 4.750 -3.068 -3.483 1.00 . A A . 36 LEU N 1 1 10 4839 1 1 36 LEU O O 4.339 -5.699 -2.744 1.00 . A A . 36 LEU O 1 1 10 4840 1 1 36 LEU OXT O 5.731 -6.423 -4.278 1.00 . A A . 36 LEU OXT 1 1 11 4841 1 1 1 THR C C -6.414 -6.706 -7.185 1.00 . A A . 1 THR C 1 1 11 4842 1 1 1 THR CA C -5.293 -5.951 -7.955 1.00 . A A . 1 THR CA 1 1 11 4843 1 1 1 THR CB C -5.763 -5.667 -9.402 1.00 . A A . 1 THR CB 1 1 11 4844 1 1 1 THR CG2 C -4.831 -4.710 -10.162 1.00 . A A . 1 THR CG2 1 1 11 4845 1 1 1 THR H1 H -3.683 -6.902 -7.027 1.00 . A A . 1 THR H1 1 1 11 4846 1 1 1 THR H2 H -3.991 -7.424 -8.561 1.00 . A A . 1 THR H2 1 1 11 4847 1 1 1 THR H3 H -3.245 -5.974 -8.314 1.00 . A A . 1 THR H3 1 1 11 4848 1 1 1 THR HA H -5.180 -4.985 -7.457 1.00 . A A . 1 THR HA 1 1 11 4849 1 1 1 THR HB H -6.775 -5.242 -9.399 1.00 . A A . 1 THR HB 1 1 11 4850 1 1 1 THR HG1 H -6.022 -6.700 -11.037 1.00 . A A . 1 THR HG1 1 1 11 4851 1 1 1 THR HG21 H -4.765 -3.744 -9.658 1.00 . A A . 1 THR HG21 1 1 11 4852 1 1 1 THR HG22 H -3.828 -5.124 -10.266 1.00 . A A . 1 THR HG22 1 1 11 4853 1 1 1 THR HG23 H -5.229 -4.540 -11.164 1.00 . A A . 1 THR HG23 1 1 11 4854 1 1 1 THR N N -3.950 -6.611 -7.964 1.00 . A A . 1 THR N 1 1 11 4855 1 1 1 THR O O -6.947 -6.165 -6.225 1.00 . A A . 1 THR O 1 1 11 4856 1 1 1 THR OG1 O -5.755 -6.882 -10.127 1.00 . A A . 1 THR OG1 1 1 11 4857 1 1 2 GLN C C -7.775 -9.330 -5.696 1.00 . A A . 2 GLN C 1 1 11 4858 1 1 2 GLN CA C -7.978 -8.655 -7.080 1.00 . A A . 2 GLN CA 1 1 11 4859 1 1 2 GLN CB C -8.459 -9.668 -8.142 1.00 . A A . 2 GLN CB 1 1 11 4860 1 1 2 GLN CD C -10.156 -8.271 -9.530 1.00 . A A . 2 GLN CD 1 1 11 4861 1 1 2 GLN CG C -8.840 -9.051 -9.509 1.00 . A A . 2 GLN CG 1 1 11 4862 1 1 2 GLN H H -6.391 -8.265 -8.462 1.00 . A A . 2 GLN H 1 1 11 4863 1 1 2 GLN HA H -8.797 -7.951 -6.926 1.00 . A A . 2 GLN HA 1 1 11 4864 1 1 2 GLN HB2 H -7.659 -10.394 -8.313 1.00 . A A . 2 GLN HB2 1 1 11 4865 1 1 2 GLN HB3 H -9.326 -10.215 -7.759 1.00 . A A . 2 GLN HB3 1 1 11 4866 1 1 2 GLN HE21 H -9.446 -6.708 -8.420 1.00 . A A . 2 GLN HE21 1 1 11 4867 1 1 2 GLN HE22 H -11.112 -6.650 -9.000 1.00 . A A . 2 GLN HE22 1 1 11 4868 1 1 2 GLN HG2 H -8.046 -8.402 -9.881 1.00 . A A . 2 GLN HG2 1 1 11 4869 1 1 2 GLN HG3 H -8.949 -9.869 -10.223 1.00 . A A . 2 GLN HG3 1 1 11 4870 1 1 2 GLN N N -6.810 -7.914 -7.617 1.00 . A A . 2 GLN N 1 1 11 4871 1 1 2 GLN NE2 N -10.206 -7.087 -8.951 1.00 . A A . 2 GLN NE2 1 1 11 4872 1 1 2 GLN O O -8.489 -9.025 -4.750 1.00 . A A . 2 GLN O 1 1 11 4873 1 1 2 GLN OE1 O -11.145 -8.705 -10.094 1.00 . A A . 2 GLN OE1 1 1 11 4874 1 1 3 SER C C -5.824 -9.999 -3.273 1.00 . A A . 3 SER C 1 1 11 4875 1 1 3 SER CA C -6.473 -10.950 -4.310 1.00 . A A . 3 SER CA 1 1 11 4876 1 1 3 SER CB C -5.522 -12.118 -4.640 1.00 . A A . 3 SER CB 1 1 11 4877 1 1 3 SER H H -6.270 -10.491 -6.381 1.00 . A A . 3 SER H 1 1 11 4878 1 1 3 SER HA H -7.376 -11.366 -3.855 1.00 . A A . 3 SER HA 1 1 11 4879 1 1 3 SER HB2 H -5.184 -12.594 -3.711 1.00 . A A . 3 SER HB2 1 1 11 4880 1 1 3 SER HB3 H -6.064 -12.866 -5.229 1.00 . A A . 3 SER HB3 1 1 11 4881 1 1 3 SER HG H -3.737 -12.325 -5.468 1.00 . A A . 3 SER HG 1 1 11 4882 1 1 3 SER N N -6.827 -10.268 -5.573 1.00 . A A . 3 SER N 1 1 11 4883 1 1 3 SER O O -6.375 -9.729 -2.211 1.00 . A A . 3 SER O 1 1 11 4884 1 1 3 SER OG O -4.406 -11.635 -5.390 1.00 . A A . 3 SER OG 1 1 11 4885 1 1 4 HIS C C -3.699 -7.280 -4.219 1.00 . A A . 4 HIS C 1 1 11 4886 1 1 4 HIS CA C -4.014 -8.272 -3.061 1.00 . A A . 4 HIS CA 1 1 11 4887 1 1 4 HIS CB C -2.788 -8.708 -2.222 1.00 . A A . 4 HIS CB 1 1 11 4888 1 1 4 HIS CD2 C -1.533 -7.941 -0.060 1.00 . A A . 4 HIS CD2 1 1 11 4889 1 1 4 HIS CE1 C -1.269 -5.839 -0.584 1.00 . A A . 4 HIS CE1 1 1 11 4890 1 1 4 HIS CG C -2.170 -7.712 -1.254 1.00 . A A . 4 HIS CG 1 1 11 4891 1 1 4 HIS H H -4.249 -9.882 -4.459 1.00 . A A . 4 HIS H 1 1 11 4892 1 1 4 HIS HA H -4.717 -7.776 -2.386 1.00 . A A . 4 HIS HA 1 1 11 4893 1 1 4 HIS HB2 H -3.080 -9.567 -1.615 1.00 . A A . 4 HIS HB2 1 1 11 4894 1 1 4 HIS HB3 H -2.018 -9.042 -2.915 1.00 . A A . 4 HIS HB3 1 1 11 4895 1 1 4 HIS HD2 H -1.416 -8.900 0.424 1.00 . A A . 4 HIS HD2 1 1 11 4896 1 1 4 HIS HE1 H -0.940 -4.809 -0.556 1.00 . A A . 4 HIS HE1 1 1 11 4897 1 1 4 HIS HE2 H -0.428 -6.585 1.194 1.00 . A A . 4 HIS HE2 1 1 11 4898 1 1 4 HIS N N -4.647 -9.480 -3.619 1.00 . A A . 4 HIS N 1 1 11 4899 1 1 4 HIS ND1 N -2.000 -6.367 -1.569 1.00 . A A . 4 HIS ND1 1 1 11 4900 1 1 4 HIS NE2 N -0.974 -6.744 0.359 1.00 . A A . 4 HIS NE2 1 1 11 4901 1 1 4 HIS O O -3.827 -7.602 -5.411 1.00 . A A . 4 HIS O 1 1 11 4902 1 1 5 ALA C C -1.577 -4.363 -4.524 1.00 . A A . 5 ALA C 1 1 11 4903 1 1 5 ALA CA C -2.973 -4.965 -4.835 1.00 . A A . 5 ALA CA 1 1 11 4904 1 1 5 ALA CB C -4.138 -3.955 -4.805 1.00 . A A . 5 ALA CB 1 1 11 4905 1 1 5 ALA H H -3.150 -5.879 -2.920 1.00 . A A . 5 ALA H 1 1 11 4906 1 1 5 ALA HA H -2.887 -5.341 -5.851 1.00 . A A . 5 ALA HA 1 1 11 4907 1 1 5 ALA HB1 H -5.090 -4.465 -4.961 1.00 . A A . 5 ALA HB1 1 1 11 4908 1 1 5 ALA HB2 H -4.176 -3.452 -3.836 1.00 . A A . 5 ALA HB2 1 1 11 4909 1 1 5 ALA HB3 H -4.028 -3.207 -5.589 1.00 . A A . 5 ALA HB3 1 1 11 4910 1 1 5 ALA N N -3.322 -6.042 -3.908 1.00 . A A . 5 ALA N 1 1 11 4911 1 1 5 ALA O O -0.605 -5.106 -4.351 1.00 . A A . 5 ALA O 1 1 11 4912 1 1 6 GLY C C -0.664 -1.682 -2.611 1.00 . A A . 6 GLY C 1 1 11 4913 1 1 6 GLY CA C -0.354 -2.264 -3.998 1.00 . A A . 6 GLY CA 1 1 11 4914 1 1 6 GLY H H -2.264 -2.508 -4.886 1.00 . A A . 6 GLY H 1 1 11 4915 1 1 6 GLY HA2 H 0.552 -2.871 -3.936 1.00 . A A . 6 GLY HA2 1 1 11 4916 1 1 6 GLY HA3 H -0.176 -1.454 -4.700 1.00 . A A . 6 GLY HA3 1 1 11 4917 1 1 6 GLY N N -1.486 -3.031 -4.509 1.00 . A A . 6 GLY N 1 1 11 4918 1 1 6 GLY O O -0.669 -2.420 -1.628 1.00 . A A . 6 GLY O 1 1 11 4919 1 1 7 GLN C C -2.254 -0.065 -0.347 1.00 . A A . 7 GLN C 1 1 11 4920 1 1 7 GLN CA C -1.117 0.407 -1.300 1.00 . A A . 7 GLN CA 1 1 11 4921 1 1 7 GLN CB C -1.160 1.914 -1.651 1.00 . A A . 7 GLN CB 1 1 11 4922 1 1 7 GLN CD C -0.696 4.325 -0.794 1.00 . A A . 7 GLN CD 1 1 11 4923 1 1 7 GLN CG C -0.885 2.845 -0.446 1.00 . A A . 7 GLN CG 1 1 11 4924 1 1 7 GLN H H -1.012 0.131 -3.406 1.00 . A A . 7 GLN H 1 1 11 4925 1 1 7 GLN HA H -0.191 0.252 -0.752 1.00 . A A . 7 GLN HA 1 1 11 4926 1 1 7 GLN HB2 H -0.410 2.124 -2.417 1.00 . A A . 7 GLN HB2 1 1 11 4927 1 1 7 GLN HB3 H -2.145 2.145 -2.051 1.00 . A A . 7 GLN HB3 1 1 11 4928 1 1 7 GLN HE21 H -1.870 4.966 0.721 1.00 . A A . 7 GLN HE21 1 1 11 4929 1 1 7 GLN HE22 H -1.071 6.197 -0.255 1.00 . A A . 7 GLN HE22 1 1 11 4930 1 1 7 GLN HG2 H -1.680 2.730 0.290 1.00 . A A . 7 GLN HG2 1 1 11 4931 1 1 7 GLN HG3 H 0.048 2.561 0.026 1.00 . A A . 7 GLN HG3 1 1 11 4932 1 1 7 GLN N N -0.982 -0.377 -2.541 1.00 . A A . 7 GLN N 1 1 11 4933 1 1 7 GLN NE2 N -1.219 5.238 0.003 1.00 . A A . 7 GLN NE2 1 1 11 4934 1 1 7 GLN O O -3.282 0.587 -0.193 1.00 . A A . 7 GLN O 1 1 11 4935 1 1 7 GLN OE1 O -0.004 4.693 -1.737 1.00 . A A . 7 GLN OE1 1 1 11 4936 1 1 8 CYS C C -3.541 -0.933 2.368 1.00 . A A . 8 CYS C 1 1 11 4937 1 1 8 CYS CA C -2.861 -1.867 1.336 1.00 . A A . 8 CYS CA 1 1 11 4938 1 1 8 CYS CB C -1.971 -2.907 2.048 1.00 . A A . 8 CYS CB 1 1 11 4939 1 1 8 CYS H H -1.195 -1.693 0.011 1.00 . A A . 8 CYS H 1 1 11 4940 1 1 8 CYS HA H -3.662 -2.406 0.824 1.00 . A A . 8 CYS HA 1 1 11 4941 1 1 8 CYS HB2 H -2.481 -3.290 2.932 1.00 . A A . 8 CYS HB2 1 1 11 4942 1 1 8 CYS HB3 H -1.791 -3.745 1.380 1.00 . A A . 8 CYS HB3 1 1 11 4943 1 1 8 CYS N N -2.033 -1.206 0.311 1.00 . A A . 8 CYS N 1 1 11 4944 1 1 8 CYS O O -4.662 -1.202 2.795 1.00 . A A . 8 CYS O 1 1 11 4945 1 1 8 CYS SG S -0.342 -2.273 2.560 1.00 . A A . 8 CYS SG 1 1 11 4946 1 1 9 GLY C C -2.458 0.970 5.132 1.00 . A A . 9 GLY C 1 1 11 4947 1 1 9 GLY CA C -3.295 1.065 3.839 1.00 . A A . 9 GLY CA 1 1 11 4948 1 1 9 GLY H H -1.941 0.253 2.377 1.00 . A A . 9 GLY H 1 1 11 4949 1 1 9 GLY HA2 H -3.239 2.076 3.434 1.00 . A A . 9 GLY HA2 1 1 11 4950 1 1 9 GLY HA3 H -4.336 0.886 4.110 1.00 . A A . 9 GLY HA3 1 1 11 4951 1 1 9 GLY N N -2.845 0.124 2.803 1.00 . A A . 9 GLY N 1 1 11 4952 1 1 9 GLY O O -2.655 0.069 5.945 1.00 . A A . 9 GLY O 1 1 11 4953 1 1 10 GLY C C -1.024 2.971 7.587 1.00 . A A . 10 GLY C 1 1 11 4954 1 1 10 GLY CA C -0.625 1.940 6.509 1.00 . A A . 10 GLY CA 1 1 11 4955 1 1 10 GLY H H -1.434 2.620 4.631 1.00 . A A . 10 GLY H 1 1 11 4956 1 1 10 GLY HA2 H -0.584 0.963 6.995 1.00 . A A . 10 GLY HA2 1 1 11 4957 1 1 10 GLY HA3 H 0.386 2.162 6.187 1.00 . A A . 10 GLY HA3 1 1 11 4958 1 1 10 GLY N N -1.500 1.888 5.319 1.00 . A A . 10 GLY N 1 1 11 4959 1 1 10 GLY O O -2.074 3.604 7.494 1.00 . A A . 10 GLY O 1 1 11 4960 1 1 11 ILE C C -1.182 5.207 9.694 1.00 . A A . 11 ILE C 1 1 11 4961 1 1 11 ILE CA C -0.437 3.853 9.884 1.00 . A A . 11 ILE CA 1 1 11 4962 1 1 11 ILE CB C 0.865 4.010 10.724 1.00 . A A . 11 ILE CB 1 1 11 4963 1 1 11 ILE CD1 C 2.952 2.829 11.658 1.00 . A A . 11 ILE CD1 1 1 11 4964 1 1 11 ILE CG1 C 1.559 2.659 11.032 1.00 . A A . 11 ILE CG1 1 1 11 4965 1 1 11 ILE CG2 C 0.560 4.721 12.062 1.00 . A A . 11 ILE CG2 1 1 11 4966 1 1 11 ILE H H 0.681 2.597 8.561 1.00 . A A . 11 ILE H 1 1 11 4967 1 1 11 ILE HA H -1.087 3.218 10.487 1.00 . A A . 11 ILE HA 1 1 11 4968 1 1 11 ILE HB H 1.566 4.625 10.156 1.00 . A A . 11 ILE HB 1 1 11 4969 1 1 11 ILE HD11 H 3.565 3.477 11.031 1.00 . A A . 11 ILE HD11 1 1 11 4970 1 1 11 ILE HD12 H 2.886 3.254 12.658 1.00 . A A . 11 ILE HD12 1 1 11 4971 1 1 11 ILE HD13 H 3.441 1.857 11.736 1.00 . A A . 11 ILE HD13 1 1 11 4972 1 1 11 ILE HG12 H 0.936 2.068 11.705 1.00 . A A . 11 ILE HG12 1 1 11 4973 1 1 11 ILE HG13 H 1.701 2.089 10.115 1.00 . A A . 11 ILE HG13 1 1 11 4974 1 1 11 ILE HG21 H 0.089 5.690 11.909 1.00 . A A . 11 ILE HG21 1 1 11 4975 1 1 11 ILE HG22 H -0.108 4.104 12.664 1.00 . A A . 11 ILE HG22 1 1 11 4976 1 1 11 ILE HG23 H 1.471 4.908 12.626 1.00 . A A . 11 ILE HG23 1 1 11 4977 1 1 11 ILE N N -0.182 3.115 8.623 1.00 . A A . 11 ILE N 1 1 11 4978 1 1 11 ILE O O -0.568 6.260 9.551 1.00 . A A . 11 ILE O 1 1 11 4979 1 1 12 GLY C C -3.633 6.859 8.160 1.00 . A A . 12 GLY C 1 1 11 4980 1 1 12 GLY CA C -3.414 6.322 9.593 1.00 . A A . 12 GLY CA 1 1 11 4981 1 1 12 GLY H H -2.930 4.245 9.743 1.00 . A A . 12 GLY H 1 1 11 4982 1 1 12 GLY HA2 H -4.393 6.019 9.960 1.00 . A A . 12 GLY HA2 1 1 11 4983 1 1 12 GLY HA3 H -3.059 7.135 10.229 1.00 . A A . 12 GLY HA3 1 1 11 4984 1 1 12 GLY N N -2.519 5.166 9.727 1.00 . A A . 12 GLY N 1 1 11 4985 1 1 12 GLY O O -3.792 8.063 7.977 1.00 . A A . 12 GLY O 1 1 11 4986 1 1 13 TYR C C -4.890 5.292 5.023 1.00 . A A . 13 TYR C 1 1 11 4987 1 1 13 TYR CA C -3.999 6.345 5.744 1.00 . A A . 13 TYR CA 1 1 11 4988 1 1 13 TYR CB C -2.636 6.615 5.063 1.00 . A A . 13 TYR CB 1 1 11 4989 1 1 13 TYR CD1 C -3.729 7.687 2.974 1.00 . A A . 13 TYR CD1 1 1 11 4990 1 1 13 TYR CD2 C -1.323 7.903 3.332 1.00 . A A . 13 TYR CD2 1 1 11 4991 1 1 13 TYR CE1 C -3.594 8.368 1.741 1.00 . A A . 13 TYR CE1 1 1 11 4992 1 1 13 TYR CE2 C -1.187 8.534 2.079 1.00 . A A . 13 TYR CE2 1 1 11 4993 1 1 13 TYR CG C -2.582 7.421 3.764 1.00 . A A . 13 TYR CG 1 1 11 4994 1 1 13 TYR CZ C -2.324 8.770 1.289 1.00 . A A . 13 TYR CZ 1 1 11 4995 1 1 13 TYR H H -3.473 5.019 7.360 1.00 . A A . 13 TYR H 1 1 11 4996 1 1 13 TYR HA H -4.566 7.281 5.727 1.00 . A A . 13 TYR HA 1 1 11 4997 1 1 13 TYR HB2 H -2.021 7.171 5.775 1.00 . A A . 13 TYR HB2 1 1 11 4998 1 1 13 TYR HB3 H -2.134 5.660 4.892 1.00 . A A . 13 TYR HB3 1 1 11 4999 1 1 13 TYR HD1 H -4.716 7.390 3.299 1.00 . A A . 13 TYR HD1 1 1 11 5000 1 1 13 TYR HD2 H -0.462 7.804 3.979 1.00 . A A . 13 TYR HD2 1 1 11 5001 1 1 13 TYR HE1 H -4.461 8.579 1.135 1.00 . A A . 13 TYR HE1 1 1 11 5002 1 1 13 TYR HE2 H -0.210 8.841 1.738 1.00 . A A . 13 TYR HE2 1 1 11 5003 1 1 13 TYR HH H -1.298 9.699 -0.048 1.00 . A A . 13 TYR HH 1 1 11 5004 1 1 13 TYR N N -3.726 5.979 7.151 1.00 . A A . 13 TYR N 1 1 11 5005 1 1 13 TYR O O -4.525 4.720 3.995 1.00 . A A . 13 TYR O 1 1 11 5006 1 1 13 TYR OH O -2.195 9.384 0.084 1.00 . A A . 13 TYR OH 1 1 11 5007 1 1 14 SER C C -7.932 4.258 4.014 1.00 . A A . 14 SER C 1 1 11 5008 1 1 14 SER CA C -6.973 3.916 5.180 1.00 . A A . 14 SER CA 1 1 11 5009 1 1 14 SER CB C -7.790 3.449 6.406 1.00 . A A . 14 SER CB 1 1 11 5010 1 1 14 SER H H -6.293 5.502 6.434 1.00 . A A . 14 SER H 1 1 11 5011 1 1 14 SER HA H -6.360 3.065 4.875 1.00 . A A . 14 SER HA 1 1 11 5012 1 1 14 SER HB2 H -8.512 4.215 6.698 1.00 . A A . 14 SER HB2 1 1 11 5013 1 1 14 SER HB3 H -8.344 2.547 6.133 1.00 . A A . 14 SER HB3 1 1 11 5014 1 1 14 SER HG H -7.469 2.783 8.231 1.00 . A A . 14 SER HG 1 1 11 5015 1 1 14 SER N N -6.083 5.026 5.571 1.00 . A A . 14 SER N 1 1 11 5016 1 1 14 SER O O -9.079 4.635 4.254 1.00 . A A . 14 SER O 1 1 11 5017 1 1 14 SER OG O -6.950 3.161 7.513 1.00 . A A . 14 SER OG 1 1 11 5018 1 1 15 GLY C C -7.912 3.915 0.198 1.00 . A A . 15 GLY C 1 1 11 5019 1 1 15 GLY CA C -8.419 4.323 1.603 1.00 . A A . 15 GLY CA 1 1 11 5020 1 1 15 GLY H H -6.566 3.782 2.593 1.00 . A A . 15 GLY H 1 1 11 5021 1 1 15 GLY HA2 H -9.315 3.734 1.799 1.00 . A A . 15 GLY HA2 1 1 11 5022 1 1 15 GLY HA3 H -8.684 5.382 1.571 1.00 . A A . 15 GLY HA3 1 1 11 5023 1 1 15 GLY N N -7.516 4.097 2.750 1.00 . A A . 15 GLY N 1 1 11 5024 1 1 15 GLY O O -6.780 3.440 0.078 1.00 . A A . 15 GLY O 1 1 11 5025 1 1 16 PRO C C -7.316 4.182 -3.031 1.00 . A A . 16 PRO C 1 1 11 5026 1 1 16 PRO CA C -8.528 3.618 -2.244 1.00 . A A . 16 PRO CA 1 1 11 5027 1 1 16 PRO CB C -9.849 3.905 -2.980 1.00 . A A . 16 PRO CB 1 1 11 5028 1 1 16 PRO CD C -10.135 4.546 -0.726 1.00 . A A . 16 PRO CD 1 1 11 5029 1 1 16 PRO CG C -10.893 3.884 -1.872 1.00 . A A . 16 PRO CG 1 1 11 5030 1 1 16 PRO HA H -8.396 2.534 -2.203 1.00 . A A . 16 PRO HA 1 1 11 5031 1 1 16 PRO HB2 H -9.839 4.911 -3.412 1.00 . A A . 16 PRO HB2 1 1 11 5032 1 1 16 PRO HB3 H -10.050 3.178 -3.768 1.00 . A A . 16 PRO HB3 1 1 11 5033 1 1 16 PRO HD2 H -10.175 5.633 -0.823 1.00 . A A . 16 PRO HD2 1 1 11 5034 1 1 16 PRO HD3 H -10.623 4.258 0.206 1.00 . A A . 16 PRO HD3 1 1 11 5035 1 1 16 PRO HG2 H -11.799 4.431 -2.136 1.00 . A A . 16 PRO HG2 1 1 11 5036 1 1 16 PRO HG3 H -11.140 2.853 -1.616 1.00 . A A . 16 PRO HG3 1 1 11 5037 1 1 16 PRO N N -8.748 4.092 -0.859 1.00 . A A . 16 PRO N 1 1 11 5038 1 1 16 PRO O O -7.433 4.586 -4.185 1.00 . A A . 16 PRO O 1 1 11 5039 1 1 17 THR C C -4.177 3.595 -3.980 1.00 . A A . 17 THR C 1 1 11 5040 1 1 17 THR CA C -4.846 4.623 -3.031 1.00 . A A . 17 THR CA 1 1 11 5041 1 1 17 THR CB C -3.924 5.016 -1.856 1.00 . A A . 17 THR CB 1 1 11 5042 1 1 17 THR CG2 C -4.493 6.178 -1.036 1.00 . A A . 17 THR CG2 1 1 11 5043 1 1 17 THR H H -6.068 3.725 -1.542 1.00 . A A . 17 THR H 1 1 11 5044 1 1 17 THR HA H -5.028 5.520 -3.624 1.00 . A A . 17 THR HA 1 1 11 5045 1 1 17 THR HB H -2.958 5.325 -2.260 1.00 . A A . 17 THR HB 1 1 11 5046 1 1 17 THR HG1 H -4.565 3.765 -0.474 1.00 . A A . 17 THR HG1 1 1 11 5047 1 1 17 THR HG21 H -4.618 7.061 -1.661 1.00 . A A . 17 THR HG21 1 1 11 5048 1 1 17 THR HG22 H -5.452 5.911 -0.595 1.00 . A A . 17 THR HG22 1 1 11 5049 1 1 17 THR HG23 H -3.799 6.420 -0.232 1.00 . A A . 17 THR HG23 1 1 11 5050 1 1 17 THR N N -6.120 4.141 -2.458 1.00 . A A . 17 THR N 1 1 11 5051 1 1 17 THR O O -2.965 3.386 -3.986 1.00 . A A . 17 THR O 1 1 11 5052 1 1 17 THR OG1 O -3.744 3.940 -0.951 1.00 . A A . 17 THR OG1 1 1 11 5053 1 1 18 VAL C C -3.810 1.239 -6.389 1.00 . A A . 18 VAL C 1 1 11 5054 1 1 18 VAL CA C -4.723 1.491 -5.156 1.00 . A A . 18 VAL CA 1 1 11 5055 1 1 18 VAL CB C -6.069 0.731 -5.174 1.00 . A A . 18 VAL CB 1 1 11 5056 1 1 18 VAL CG1 C -7.078 1.248 -6.216 1.00 . A A . 18 VAL CG1 1 1 11 5057 1 1 18 VAL CG2 C -5.858 -0.783 -5.321 1.00 . A A . 18 VAL CG2 1 1 11 5058 1 1 18 VAL H H -5.933 3.236 -4.840 1.00 . A A . 18 VAL H 1 1 11 5059 1 1 18 VAL HA H -4.185 1.040 -4.317 1.00 . A A . 18 VAL HA 1 1 11 5060 1 1 18 VAL HB H -6.527 0.886 -4.193 1.00 . A A . 18 VAL HB 1 1 11 5061 1 1 18 VAL HG11 H -7.249 2.319 -6.096 1.00 . A A . 18 VAL HG11 1 1 11 5062 1 1 18 VAL HG12 H -6.731 1.059 -7.230 1.00 . A A . 18 VAL HG12 1 1 11 5063 1 1 18 VAL HG13 H -8.031 0.735 -6.076 1.00 . A A . 18 VAL HG13 1 1 11 5064 1 1 18 VAL HG21 H -5.183 -1.136 -4.540 1.00 . A A . 18 VAL HG21 1 1 11 5065 1 1 18 VAL HG22 H -6.812 -1.299 -5.222 1.00 . A A . 18 VAL HG22 1 1 11 5066 1 1 18 VAL HG23 H -5.431 -1.023 -6.294 1.00 . A A . 18 VAL HG23 1 1 11 5067 1 1 18 VAL N N -4.979 2.897 -4.790 1.00 . A A . 18 VAL N 1 1 11 5068 1 1 18 VAL O O -4.266 0.930 -7.487 1.00 . A A . 18 VAL O 1 1 11 5069 1 1 19 CYS C C -1.646 -0.777 -7.474 1.00 . A A . 19 CYS C 1 1 11 5070 1 1 19 CYS CA C -1.472 0.736 -7.100 1.00 . A A . 19 CYS CA 1 1 11 5071 1 1 19 CYS CB C -0.105 1.090 -6.487 1.00 . A A . 19 CYS CB 1 1 11 5072 1 1 19 CYS H H -2.203 1.700 -5.307 1.00 . A A . 19 CYS H 1 1 11 5073 1 1 19 CYS HA H -1.558 1.293 -8.036 1.00 . A A . 19 CYS HA 1 1 11 5074 1 1 19 CYS HB2 H -0.041 2.179 -6.423 1.00 . A A . 19 CYS HB2 1 1 11 5075 1 1 19 CYS HB3 H -0.042 0.709 -5.471 1.00 . A A . 19 CYS HB3 1 1 11 5076 1 1 19 CYS N N -2.491 1.275 -6.178 1.00 . A A . 19 CYS N 1 1 11 5077 1 1 19 CYS O O -2.428 -1.507 -6.861 1.00 . A A . 19 CYS O 1 1 11 5078 1 1 19 CYS SG S 1.403 0.588 -7.360 1.00 . A A . 19 CYS SG 1 1 11 5079 1 1 20 ALA C C -0.813 -3.827 -8.431 1.00 . A A . 20 ALA C 1 1 11 5080 1 1 20 ALA CA C -1.059 -2.515 -9.245 1.00 . A A . 20 ALA CA 1 1 11 5081 1 1 20 ALA CB C -0.177 -2.385 -10.505 1.00 . A A . 20 ALA CB 1 1 11 5082 1 1 20 ALA H H -0.322 -0.551 -8.940 1.00 . A A . 20 ALA H 1 1 11 5083 1 1 20 ALA HA H -2.089 -2.588 -9.600 1.00 . A A . 20 ALA HA 1 1 11 5084 1 1 20 ALA HB1 H -0.405 -1.449 -11.024 1.00 . A A . 20 ALA HB1 1 1 11 5085 1 1 20 ALA HB2 H 0.879 -2.377 -10.230 1.00 . A A . 20 ALA HB2 1 1 11 5086 1 1 20 ALA HB3 H -0.354 -3.198 -11.209 1.00 . A A . 20 ALA HB3 1 1 11 5087 1 1 20 ALA N N -0.939 -1.229 -8.523 1.00 . A A . 20 ALA N 1 1 11 5088 1 1 20 ALA O O -0.989 -3.876 -7.223 1.00 . A A . 20 ALA O 1 1 11 5089 1 1 21 SER C C 1.065 -6.484 -7.773 1.00 . A A . 21 SER C 1 1 11 5090 1 1 21 SER CA C -0.325 -6.277 -8.420 1.00 . A A . 21 SER CA 1 1 11 5091 1 1 21 SER CB C -0.625 -7.407 -9.425 1.00 . A A . 21 SER CB 1 1 11 5092 1 1 21 SER H H -0.305 -4.929 -10.067 1.00 . A A . 21 SER H 1 1 11 5093 1 1 21 SER HA H -1.045 -6.394 -7.609 1.00 . A A . 21 SER HA 1 1 11 5094 1 1 21 SER HB2 H -0.395 -8.385 -8.990 1.00 . A A . 21 SER HB2 1 1 11 5095 1 1 21 SER HB3 H -1.674 -7.402 -9.717 1.00 . A A . 21 SER HB3 1 1 11 5096 1 1 21 SER HG H 1.090 -7.275 -10.324 1.00 . A A . 21 SER HG 1 1 11 5097 1 1 21 SER N N -0.511 -4.963 -9.079 1.00 . A A . 21 SER N 1 1 11 5098 1 1 21 SER O O 1.896 -7.180 -8.348 1.00 . A A . 21 SER O 1 1 11 5099 1 1 21 SER OG O 0.156 -7.224 -10.583 1.00 . A A . 21 SER OG 1 1 11 5100 1 1 22 GLY C C 2.134 -7.564 -4.840 1.00 . A A . 22 GLY C 1 1 11 5101 1 1 22 GLY CA C 2.389 -6.301 -5.681 1.00 . A A . 22 GLY CA 1 1 11 5102 1 1 22 GLY H H 0.534 -5.369 -6.165 1.00 . A A . 22 GLY H 1 1 11 5103 1 1 22 GLY HA2 H 3.315 -6.432 -6.247 1.00 . A A . 22 GLY HA2 1 1 11 5104 1 1 22 GLY HA3 H 2.543 -5.473 -4.989 1.00 . A A . 22 GLY HA3 1 1 11 5105 1 1 22 GLY N N 1.255 -5.964 -6.557 1.00 . A A . 22 GLY N 1 1 11 5106 1 1 22 GLY O O 2.665 -8.638 -5.112 1.00 . A A . 22 GLY O 1 1 11 5107 1 1 23 THR C C 1.944 -8.074 -1.492 1.00 . A A . 23 THR C 1 1 11 5108 1 1 23 THR CA C 1.043 -8.393 -2.701 1.00 . A A . 23 THR CA 1 1 11 5109 1 1 23 THR CB C 1.095 -9.894 -3.084 1.00 . A A . 23 THR CB 1 1 11 5110 1 1 23 THR CG2 C 0.395 -10.826 -2.084 1.00 . A A . 23 THR CG2 1 1 11 5111 1 1 23 THR H H 0.745 -6.573 -3.820 1.00 . A A . 23 THR H 1 1 11 5112 1 1 23 THR HA H 0.037 -8.211 -2.359 1.00 . A A . 23 THR HA 1 1 11 5113 1 1 23 THR HB H 2.136 -10.219 -3.206 1.00 . A A . 23 THR HB 1 1 11 5114 1 1 23 THR HG1 H 0.882 -9.555 -4.948 1.00 . A A . 23 THR HG1 1 1 11 5115 1 1 23 THR HG21 H -0.597 -10.448 -1.854 1.00 . A A . 23 THR HG21 1 1 11 5116 1 1 23 THR HG22 H 0.290 -11.817 -2.528 1.00 . A A . 23 THR HG22 1 1 11 5117 1 1 23 THR HG23 H 0.960 -10.928 -1.160 1.00 . A A . 23 THR HG23 1 1 11 5118 1 1 23 THR N N 1.244 -7.456 -3.845 1.00 . A A . 23 THR N 1 1 11 5119 1 1 23 THR O O 2.224 -8.913 -0.641 1.00 . A A . 23 THR O 1 1 11 5120 1 1 23 THR OG1 O 0.388 -10.063 -4.292 1.00 . A A . 23 THR OG1 1 1 11 5121 1 1 24 THR C C 3.426 -5.184 0.112 1.00 . A A . 24 THR C 1 1 11 5122 1 1 24 THR CA C 3.646 -6.424 -0.763 1.00 . A A . 24 THR CA 1 1 11 5123 1 1 24 THR CB C 4.724 -6.196 -1.848 1.00 . A A . 24 THR CB 1 1 11 5124 1 1 24 THR CG2 C 5.261 -7.534 -2.378 1.00 . A A . 24 THR CG2 1 1 11 5125 1 1 24 THR H H 2.149 -6.233 -2.197 1.00 . A A . 24 THR H 1 1 11 5126 1 1 24 THR HA H 4.003 -7.210 -0.095 1.00 . A A . 24 THR HA 1 1 11 5127 1 1 24 THR HB H 5.570 -5.634 -1.438 1.00 . A A . 24 THR HB 1 1 11 5128 1 1 24 THR HG1 H 4.833 -5.473 -3.647 1.00 . A A . 24 THR HG1 1 1 11 5129 1 1 24 THR HG21 H 5.690 -8.124 -1.568 1.00 . A A . 24 THR HG21 1 1 11 5130 1 1 24 THR HG22 H 4.477 -8.110 -2.866 1.00 . A A . 24 THR HG22 1 1 11 5131 1 1 24 THR HG23 H 6.049 -7.343 -3.107 1.00 . A A . 24 THR HG23 1 1 11 5132 1 1 24 THR N N 2.404 -6.829 -1.424 1.00 . A A . 24 THR N 1 1 11 5133 1 1 24 THR O O 3.813 -4.069 -0.226 1.00 . A A . 24 THR O 1 1 11 5134 1 1 24 THR OG1 O 4.160 -5.485 -2.940 1.00 . A A . 24 THR OG1 1 1 11 5135 1 1 25 CYS C C 3.777 -3.815 3.020 1.00 . A A . 25 CYS C 1 1 11 5136 1 1 25 CYS CA C 2.511 -4.331 2.271 1.00 . A A . 25 CYS CA 1 1 11 5137 1 1 25 CYS CB C 1.394 -4.846 3.204 1.00 . A A . 25 CYS CB 1 1 11 5138 1 1 25 CYS H H 2.518 -6.333 1.481 1.00 . A A . 25 CYS H 1 1 11 5139 1 1 25 CYS HA H 2.116 -3.473 1.724 1.00 . A A . 25 CYS HA 1 1 11 5140 1 1 25 CYS HB2 H 0.671 -5.429 2.636 1.00 . A A . 25 CYS HB2 1 1 11 5141 1 1 25 CYS HB3 H 1.828 -5.498 3.961 1.00 . A A . 25 CYS HB3 1 1 11 5142 1 1 25 CYS N N 2.804 -5.386 1.284 1.00 . A A . 25 CYS N 1 1 11 5143 1 1 25 CYS O O 3.843 -3.827 4.252 1.00 . A A . 25 CYS O 1 1 11 5144 1 1 25 CYS SG S 0.416 -3.591 4.079 1.00 . A A . 25 CYS SG 1 1 11 5145 1 1 26 GLN C C 6.058 -1.200 2.351 1.00 . A A . 26 GLN C 1 1 11 5146 1 1 26 GLN CA C 6.032 -2.713 2.697 1.00 . A A . 26 GLN CA 1 1 11 5147 1 1 26 GLN CB C 7.188 -3.538 2.084 1.00 . A A . 26 GLN CB 1 1 11 5148 1 1 26 GLN CD C 9.123 -2.820 3.709 1.00 . A A . 26 GLN CD 1 1 11 5149 1 1 26 GLN CG C 8.628 -2.993 2.267 1.00 . A A . 26 GLN CG 1 1 11 5150 1 1 26 GLN H H 4.576 -3.306 1.269 1.00 . A A . 26 GLN H 1 1 11 5151 1 1 26 GLN HA H 6.093 -2.771 3.784 1.00 . A A . 26 GLN HA 1 1 11 5152 1 1 26 GLN HB2 H 7.142 -4.550 2.496 1.00 . A A . 26 GLN HB2 1 1 11 5153 1 1 26 GLN HB3 H 7.020 -3.628 1.007 1.00 . A A . 26 GLN HB3 1 1 11 5154 1 1 26 GLN HE21 H 7.664 -3.955 4.536 1.00 . A A . 26 GLN HE21 1 1 11 5155 1 1 26 GLN HE22 H 8.898 -3.264 5.607 1.00 . A A . 26 GLN HE22 1 1 11 5156 1 1 26 GLN HG2 H 9.317 -3.683 1.772 1.00 . A A . 26 GLN HG2 1 1 11 5157 1 1 26 GLN HG3 H 8.733 -2.035 1.754 1.00 . A A . 26 GLN HG3 1 1 11 5158 1 1 26 GLN N N 4.771 -3.341 2.264 1.00 . A A . 26 GLN N 1 1 11 5159 1 1 26 GLN NE2 N 8.472 -3.384 4.704 1.00 . A A . 26 GLN NE2 1 1 11 5160 1 1 26 GLN O O 5.233 -0.707 1.586 1.00 . A A . 26 GLN O 1 1 11 5161 1 1 26 GLN OE1 O 10.104 -2.149 3.972 1.00 . A A . 26 GLN OE1 1 1 11 5162 1 1 27 VAL C C 7.972 1.930 2.818 1.00 . A A . 27 VAL C 1 1 11 5163 1 1 27 VAL CA C 6.748 1.041 3.154 1.00 . A A . 27 VAL CA 1 1 11 5164 1 1 27 VAL CB C 6.241 1.275 4.594 1.00 . A A . 27 VAL CB 1 1 11 5165 1 1 27 VAL CG1 C 7.231 0.809 5.679 1.00 . A A . 27 VAL CG1 1 1 11 5166 1 1 27 VAL CG2 C 5.917 2.757 4.824 1.00 . A A . 27 VAL CG2 1 1 11 5167 1 1 27 VAL H H 7.649 -0.849 3.544 1.00 . A A . 27 VAL H 1 1 11 5168 1 1 27 VAL HA H 5.954 1.382 2.486 1.00 . A A . 27 VAL HA 1 1 11 5169 1 1 27 VAL HB H 5.311 0.716 4.727 1.00 . A A . 27 VAL HB 1 1 11 5170 1 1 27 VAL HG11 H 7.444 -0.253 5.577 1.00 . A A . 27 VAL HG11 1 1 11 5171 1 1 27 VAL HG12 H 8.163 1.368 5.611 1.00 . A A . 27 VAL HG12 1 1 11 5172 1 1 27 VAL HG13 H 6.798 0.974 6.665 1.00 . A A . 27 VAL HG13 1 1 11 5173 1 1 27 VAL HG21 H 5.227 3.128 4.064 1.00 . A A . 27 VAL HG21 1 1 11 5174 1 1 27 VAL HG22 H 5.467 2.880 5.810 1.00 . A A . 27 VAL HG22 1 1 11 5175 1 1 27 VAL HG23 H 6.837 3.337 4.792 1.00 . A A . 27 VAL HG23 1 1 11 5176 1 1 27 VAL N N 6.940 -0.411 2.976 1.00 . A A . 27 VAL N 1 1 11 5177 1 1 27 VAL O O 9.109 1.581 3.117 1.00 . A A . 27 VAL O 1 1 11 5178 1 1 28 LEU C C 8.984 4.898 3.480 1.00 . A A . 28 LEU C 1 1 11 5179 1 1 28 LEU CA C 8.691 4.219 2.112 1.00 . A A . 28 LEU CA 1 1 11 5180 1 1 28 LEU CB C 8.164 5.252 1.087 1.00 . A A . 28 LEU CB 1 1 11 5181 1 1 28 LEU CD1 C 6.989 3.755 -0.641 1.00 . A A . 28 LEU CD1 1 1 11 5182 1 1 28 LEU CD2 C 7.836 6.009 -1.282 1.00 . A A . 28 LEU CD2 1 1 11 5183 1 1 28 LEU CG C 8.097 4.787 -0.384 1.00 . A A . 28 LEU CG 1 1 11 5184 1 1 28 LEU H H 6.762 3.308 2.003 1.00 . A A . 28 LEU H 1 1 11 5185 1 1 28 LEU HA H 9.634 3.816 1.727 1.00 . A A . 28 LEU HA 1 1 11 5186 1 1 28 LEU HB2 H 7.176 5.608 1.384 1.00 . A A . 28 LEU HB2 1 1 11 5187 1 1 28 LEU HB3 H 8.843 6.107 1.119 1.00 . A A . 28 LEU HB3 1 1 11 5188 1 1 28 LEU HD11 H 6.045 4.101 -0.219 1.00 . A A . 28 LEU HD11 1 1 11 5189 1 1 28 LEU HD12 H 6.860 3.614 -1.713 1.00 . A A . 28 LEU HD12 1 1 11 5190 1 1 28 LEU HD13 H 7.249 2.788 -0.215 1.00 . A A . 28 LEU HD13 1 1 11 5191 1 1 28 LEU HD21 H 6.897 6.489 -1.004 1.00 . A A . 28 LEU HD21 1 1 11 5192 1 1 28 LEU HD22 H 8.645 6.733 -1.179 1.00 . A A . 28 LEU HD22 1 1 11 5193 1 1 28 LEU HD23 H 7.779 5.709 -2.329 1.00 . A A . 28 LEU HD23 1 1 11 5194 1 1 28 LEU HG H 9.057 4.355 -0.669 1.00 . A A . 28 LEU HG 1 1 11 5195 1 1 28 LEU N N 7.717 3.124 2.260 1.00 . A A . 28 LEU N 1 1 11 5196 1 1 28 LEU O O 10.071 4.776 4.036 1.00 . A A . 28 LEU O 1 1 11 5197 1 1 29 ASN C C 6.777 5.606 6.218 1.00 . A A . 29 ASN C 1 1 11 5198 1 1 29 ASN CA C 7.957 6.194 5.379 1.00 . A A . 29 ASN CA 1 1 11 5199 1 1 29 ASN CB C 7.864 7.729 5.250 1.00 . A A . 29 ASN CB 1 1 11 5200 1 1 29 ASN CG C 6.609 8.201 4.515 1.00 . A A . 29 ASN CG 1 1 11 5201 1 1 29 ASN H H 7.161 5.737 3.468 1.00 . A A . 29 ASN H 1 1 11 5202 1 1 29 ASN HA H 8.904 5.986 5.878 1.00 . A A . 29 ASN HA 1 1 11 5203 1 1 29 ASN HB2 H 7.904 8.169 6.249 1.00 . A A . 29 ASN HB2 1 1 11 5204 1 1 29 ASN HB3 H 8.729 8.092 4.694 1.00 . A A . 29 ASN HB3 1 1 11 5205 1 1 29 ASN HD21 H 6.035 9.453 6.017 1.00 . A A . 29 ASN HD21 1 1 11 5206 1 1 29 ASN HD22 H 5.004 9.334 4.592 1.00 . A A . 29 ASN HD22 1 1 11 5207 1 1 29 ASN N N 7.992 5.613 4.028 1.00 . A A . 29 ASN N 1 1 11 5208 1 1 29 ASN ND2 N 5.824 9.076 5.113 1.00 . A A . 29 ASN ND2 1 1 11 5209 1 1 29 ASN O O 5.656 5.590 5.710 1.00 . A A . 29 ASN O 1 1 11 5210 1 1 29 ASN OD1 O 6.319 7.786 3.404 1.00 . A A . 29 ASN OD1 1 1 11 5211 1 1 30 PRO C C 4.502 4.838 8.204 1.00 . A A . 30 PRO C 1 1 11 5212 1 1 30 PRO CA C 5.994 4.438 8.310 1.00 . A A . 30 PRO CA 1 1 11 5213 1 1 30 PRO CB C 6.535 4.558 9.736 1.00 . A A . 30 PRO CB 1 1 11 5214 1 1 30 PRO CD C 8.262 5.189 8.186 1.00 . A A . 30 PRO CD 1 1 11 5215 1 1 30 PRO CG C 8.043 4.444 9.505 1.00 . A A . 30 PRO CG 1 1 11 5216 1 1 30 PRO HA H 6.048 3.382 8.038 1.00 . A A . 30 PRO HA 1 1 11 5217 1 1 30 PRO HB2 H 6.297 5.537 10.159 1.00 . A A . 30 PRO HB2 1 1 11 5218 1 1 30 PRO HB3 H 6.160 3.768 10.390 1.00 . A A . 30 PRO HB3 1 1 11 5219 1 1 30 PRO HD2 H 8.527 6.228 8.391 1.00 . A A . 30 PRO HD2 1 1 11 5220 1 1 30 PRO HD3 H 9.068 4.698 7.635 1.00 . A A . 30 PRO HD3 1 1 11 5221 1 1 30 PRO HG2 H 8.623 4.871 10.327 1.00 . A A . 30 PRO HG2 1 1 11 5222 1 1 30 PRO HG3 H 8.307 3.390 9.382 1.00 . A A . 30 PRO HG3 1 1 11 5223 1 1 30 PRO N N 6.988 5.139 7.473 1.00 . A A . 30 PRO N 1 1 11 5224 1 1 30 PRO O O 3.631 3.972 8.222 1.00 . A A . 30 PRO O 1 1 11 5225 1 1 31 TYR C C 2.136 6.331 6.500 1.00 . A A . 31 TYR C 1 1 11 5226 1 1 31 TYR CA C 2.806 6.640 7.874 1.00 . A A . 31 TYR CA 1 1 11 5227 1 1 31 TYR CB C 2.788 8.131 8.274 1.00 . A A . 31 TYR CB 1 1 11 5228 1 1 31 TYR CD1 C 1.930 8.201 10.658 1.00 . A A . 31 TYR CD1 1 1 11 5229 1 1 31 TYR CD2 C 4.324 8.502 10.280 1.00 . A A . 31 TYR CD2 1 1 11 5230 1 1 31 TYR CE1 C 2.155 8.151 12.050 1.00 . A A . 31 TYR CE1 1 1 11 5231 1 1 31 TYR CE2 C 4.543 8.470 11.675 1.00 . A A . 31 TYR CE2 1 1 11 5232 1 1 31 TYR CG C 3.016 8.350 9.764 1.00 . A A . 31 TYR CG 1 1 11 5233 1 1 31 TYR CZ C 3.461 8.280 12.553 1.00 . A A . 31 TYR CZ 1 1 11 5234 1 1 31 TYR H H 4.933 6.792 8.032 1.00 . A A . 31 TYR H 1 1 11 5235 1 1 31 TYR HA H 2.152 6.130 8.582 1.00 . A A . 31 TYR HA 1 1 11 5236 1 1 31 TYR HB2 H 3.535 8.675 7.692 1.00 . A A . 31 TYR HB2 1 1 11 5237 1 1 31 TYR HB3 H 1.815 8.561 8.023 1.00 . A A . 31 TYR HB3 1 1 11 5238 1 1 31 TYR HD1 H 0.925 8.110 10.276 1.00 . A A . 31 TYR HD1 1 1 11 5239 1 1 31 TYR HD2 H 5.162 8.627 9.608 1.00 . A A . 31 TYR HD2 1 1 11 5240 1 1 31 TYR HE1 H 1.323 8.004 12.722 1.00 . A A . 31 TYR HE1 1 1 11 5241 1 1 31 TYR HE2 H 5.538 8.582 12.079 1.00 . A A . 31 TYR HE2 1 1 11 5242 1 1 31 TYR HH H 2.848 8.087 14.358 1.00 . A A . 31 TYR HH 1 1 11 5243 1 1 31 TYR N N 4.181 6.129 8.060 1.00 . A A . 31 TYR N 1 1 11 5244 1 1 31 TYR O O 1.277 7.079 6.042 1.00 . A A . 31 TYR O 1 1 11 5245 1 1 31 TYR OH O 3.675 8.216 13.892 1.00 . A A . 31 TYR OH 1 1 11 5246 1 1 32 TYR C C 2.244 2.995 4.677 1.00 . A A . 32 TYR C 1 1 11 5247 1 1 32 TYR CA C 1.688 4.430 4.893 1.00 . A A . 32 TYR CA 1 1 11 5248 1 1 32 TYR CB C 1.435 5.226 3.594 1.00 . A A . 32 TYR CB 1 1 11 5249 1 1 32 TYR CD1 C 2.568 4.519 1.490 1.00 . A A . 32 TYR CD1 1 1 11 5250 1 1 32 TYR CD2 C 2.934 6.764 2.300 1.00 . A A . 32 TYR CD2 1 1 11 5251 1 1 32 TYR CE1 C 2.403 5.006 0.181 1.00 . A A . 32 TYR CE1 1 1 11 5252 1 1 32 TYR CE2 C 2.841 7.252 0.973 1.00 . A A . 32 TYR CE2 1 1 11 5253 1 1 32 TYR CG C 2.557 5.425 2.577 1.00 . A A . 32 TYR CG 1 1 11 5254 1 1 32 TYR CZ C 2.422 6.388 -0.055 1.00 . A A . 32 TYR CZ 1 1 11 5255 1 1 32 TYR H H 3.187 4.647 6.360 1.00 . A A . 32 TYR H 1 1 11 5256 1 1 32 TYR HA H 0.700 4.293 5.335 1.00 . A A . 32 TYR HA 1 1 11 5257 1 1 32 TYR HB2 H 0.608 4.734 3.076 1.00 . A A . 32 TYR HB2 1 1 11 5258 1 1 32 TYR HB3 H 1.041 6.203 3.853 1.00 . A A . 32 TYR HB3 1 1 11 5259 1 1 32 TYR HD1 H 2.507 3.458 1.645 1.00 . A A . 32 TYR HD1 1 1 11 5260 1 1 32 TYR HD2 H 3.149 7.443 3.116 1.00 . A A . 32 TYR HD2 1 1 11 5261 1 1 32 TYR HE1 H 2.188 4.318 -0.615 1.00 . A A . 32 TYR HE1 1 1 11 5262 1 1 32 TYR HE2 H 3.017 8.294 0.758 1.00 . A A . 32 TYR HE2 1 1 11 5263 1 1 32 TYR HH H 1.459 6.186 -1.691 1.00 . A A . 32 TYR HH 1 1 11 5264 1 1 32 TYR N N 2.467 5.182 5.890 1.00 . A A . 32 TYR N 1 1 11 5265 1 1 32 TYR O O 3.052 2.509 5.459 1.00 . A A . 32 TYR O 1 1 11 5266 1 1 32 TYR OH O 1.994 6.860 -1.255 1.00 . A A . 32 TYR OH 1 1 11 5267 1 1 33 SER C C 1.992 0.735 1.705 1.00 . A A . 33 SER C 1 1 11 5268 1 1 33 SER CA C 2.388 1.016 3.172 1.00 . A A . 33 SER CA 1 1 11 5269 1 1 33 SER CB C 2.018 -0.135 4.113 1.00 . A A . 33 SER CB 1 1 11 5270 1 1 33 SER H H 1.062 2.692 3.085 1.00 . A A . 33 SER H 1 1 11 5271 1 1 33 SER HA H 3.472 1.127 3.199 1.00 . A A . 33 SER HA 1 1 11 5272 1 1 33 SER HB2 H 2.393 0.075 5.117 1.00 . A A . 33 SER HB2 1 1 11 5273 1 1 33 SER HB3 H 0.934 -0.250 4.165 1.00 . A A . 33 SER HB3 1 1 11 5274 1 1 33 SER HG H 2.694 -1.979 4.309 1.00 . A A . 33 SER HG 1 1 11 5275 1 1 33 SER N N 1.781 2.275 3.654 1.00 . A A . 33 SER N 1 1 11 5276 1 1 33 SER O O 0.799 0.745 1.404 1.00 . A A . 33 SER O 1 1 11 5277 1 1 33 SER OG O 2.632 -1.305 3.619 1.00 . A A . 33 SER OG 1 1 11 5278 1 1 34 GLN C C 2.793 -0.320 -1.577 1.00 . A A . 34 GLN C 1 1 11 5279 1 1 34 GLN CA C 2.837 0.938 -0.656 1.00 . A A . 34 GLN CA 1 1 11 5280 1 1 34 GLN CB C 3.904 1.981 -1.060 1.00 . A A . 34 GLN CB 1 1 11 5281 1 1 34 GLN CD C 4.808 2.590 -3.401 1.00 . A A . 34 GLN CD 1 1 11 5282 1 1 34 GLN CG C 3.625 2.634 -2.444 1.00 . A A . 34 GLN CG 1 1 11 5283 1 1 34 GLN H H 3.900 0.471 1.140 1.00 . A A . 34 GLN H 1 1 11 5284 1 1 34 GLN HA H 1.880 1.433 -0.826 1.00 . A A . 34 GLN HA 1 1 11 5285 1 1 34 GLN HB2 H 3.933 2.774 -0.314 1.00 . A A . 34 GLN HB2 1 1 11 5286 1 1 34 GLN HB3 H 4.888 1.512 -1.022 1.00 . A A . 34 GLN HB3 1 1 11 5287 1 1 34 GLN HE21 H 4.441 4.441 -4.165 1.00 . A A . 34 GLN HE21 1 1 11 5288 1 1 34 GLN HE22 H 5.796 3.515 -4.825 1.00 . A A . 34 GLN HE22 1 1 11 5289 1 1 34 GLN HG2 H 2.796 2.143 -2.948 1.00 . A A . 34 GLN HG2 1 1 11 5290 1 1 34 GLN HG3 H 3.348 3.677 -2.313 1.00 . A A . 34 GLN HG3 1 1 11 5291 1 1 34 GLN N N 2.970 0.661 0.787 1.00 . A A . 34 GLN N 1 1 11 5292 1 1 34 GLN NE2 N 5.018 3.619 -4.196 1.00 . A A . 34 GLN NE2 1 1 11 5293 1 1 34 GLN O O 1.850 -1.093 -1.491 1.00 . A A . 34 GLN O 1 1 11 5294 1 1 34 GLN OE1 O 5.539 1.619 -3.451 1.00 . A A . 34 GLN OE1 1 1 11 5295 1 1 35 CYS C C 4.868 -1.770 -4.332 1.00 . A A . 35 CYS C 1 1 11 5296 1 1 35 CYS CA C 3.518 -1.274 -3.757 1.00 . A A . 35 CYS CA 1 1 11 5297 1 1 35 CYS CB C 2.731 -0.389 -4.742 1.00 . A A . 35 CYS CB 1 1 11 5298 1 1 35 CYS H H 4.499 0.176 -2.560 1.00 . A A . 35 CYS H 1 1 11 5299 1 1 35 CYS HA H 2.922 -2.163 -3.533 1.00 . A A . 35 CYS HA 1 1 11 5300 1 1 35 CYS HB2 H 1.850 0.000 -4.232 1.00 . A A . 35 CYS HB2 1 1 11 5301 1 1 35 CYS HB3 H 3.349 0.458 -5.031 1.00 . A A . 35 CYS HB3 1 1 11 5302 1 1 35 CYS N N 3.708 -0.458 -2.546 1.00 . A A . 35 CYS N 1 1 11 5303 1 1 35 CYS O O 5.348 -1.225 -5.326 1.00 . A A . 35 CYS O 1 1 11 5304 1 1 35 CYS SG S 2.110 -1.131 -6.273 1.00 . A A . 35 CYS SG 1 1 11 5305 1 1 36 LEU C C 6.968 -4.748 -3.961 1.00 . A A . 36 LEU C 1 1 11 5306 1 1 36 LEU CA C 6.870 -3.198 -3.913 1.00 . A A . 36 LEU CA 1 1 11 5307 1 1 36 LEU CB C 7.851 -2.541 -2.897 1.00 . A A . 36 LEU CB 1 1 11 5308 1 1 36 LEU CD1 C 6.567 -1.269 -1.114 1.00 . A A . 36 LEU CD1 1 1 11 5309 1 1 36 LEU CD2 C 8.691 -0.317 -1.971 1.00 . A A . 36 LEU CD2 1 1 11 5310 1 1 36 LEU CG C 7.457 -1.143 -2.364 1.00 . A A . 36 LEU CG 1 1 11 5311 1 1 36 LEU H H 4.982 -3.212 -2.923 1.00 . A A . 36 LEU H 1 1 11 5312 1 1 36 LEU HA H 7.177 -2.876 -4.911 1.00 . A A . 36 LEU HA 1 1 11 5313 1 1 36 LEU HB2 H 7.988 -3.188 -2.029 1.00 . A A . 36 LEU HB2 1 1 11 5314 1 1 36 LEU HB3 H 8.820 -2.477 -3.395 1.00 . A A . 36 LEU HB3 1 1 11 5315 1 1 36 LEU HD11 H 5.703 -1.909 -1.290 1.00 . A A . 36 LEU HD11 1 1 11 5316 1 1 36 LEU HD12 H 7.148 -1.698 -0.300 1.00 . A A . 36 LEU HD12 1 1 11 5317 1 1 36 LEU HD13 H 6.218 -0.285 -0.810 1.00 . A A . 36 LEU HD13 1 1 11 5318 1 1 36 LEU HD21 H 9.276 -0.841 -1.214 1.00 . A A . 36 LEU HD21 1 1 11 5319 1 1 36 LEU HD22 H 9.316 -0.143 -2.848 1.00 . A A . 36 LEU HD22 1 1 11 5320 1 1 36 LEU HD23 H 8.376 0.649 -1.573 1.00 . A A . 36 LEU HD23 1 1 11 5321 1 1 36 LEU HG H 6.937 -0.584 -3.144 1.00 . A A . 36 LEU HG 1 1 11 5322 1 1 36 LEU N N 5.487 -2.749 -3.666 1.00 . A A . 36 LEU N 1 1 11 5323 1 1 36 LEU O O 7.746 -5.328 -3.172 1.00 . A A . 36 LEU O 1 1 11 5324 1 1 36 LEU OXT O 6.184 -5.348 -4.731 1.00 . A A . 36 LEU OXT 1 1 12 5325 1 1 1 THR C C -5.688 -7.118 -7.142 1.00 . A A . 1 THR C 1 1 12 5326 1 1 1 THR CA C -4.397 -6.628 -7.839 1.00 . A A . 1 THR CA 1 1 12 5327 1 1 1 THR CB C -4.762 -5.675 -9.005 1.00 . A A . 1 THR CB 1 1 12 5328 1 1 1 THR CG2 C -5.306 -4.331 -8.482 1.00 . A A . 1 THR CG2 1 1 12 5329 1 1 1 THR H1 H -3.783 -8.490 -8.657 1.00 . A A . 1 THR H1 1 1 12 5330 1 1 1 THR H2 H -2.659 -7.301 -8.771 1.00 . A A . 1 THR H2 1 1 12 5331 1 1 1 THR H3 H -2.945 -7.992 -7.313 1.00 . A A . 1 THR H3 1 1 12 5332 1 1 1 THR HA H -3.878 -5.994 -7.130 1.00 . A A . 1 THR HA 1 1 12 5333 1 1 1 THR HB H -5.508 -6.133 -9.659 1.00 . A A . 1 THR HB 1 1 12 5334 1 1 1 THR HG1 H -3.787 -4.650 -10.344 1.00 . A A . 1 THR HG1 1 1 12 5335 1 1 1 THR HG21 H -4.594 -3.845 -7.811 1.00 . A A . 1 THR HG21 1 1 12 5336 1 1 1 THR HG22 H -5.505 -3.646 -9.308 1.00 . A A . 1 THR HG22 1 1 12 5337 1 1 1 THR HG23 H -6.235 -4.468 -7.928 1.00 . A A . 1 THR HG23 1 1 12 5338 1 1 1 THR N N -3.395 -7.688 -8.182 1.00 . A A . 1 THR N 1 1 12 5339 1 1 1 THR O O -5.945 -6.794 -5.990 1.00 . A A . 1 THR O 1 1 12 5340 1 1 1 THR OG1 O -3.617 -5.424 -9.793 1.00 . A A . 1 THR OG1 1 1 12 5341 1 1 2 GLN C C -7.542 -9.770 -6.507 1.00 . A A . 2 GLN C 1 1 12 5342 1 1 2 GLN CA C -7.787 -8.428 -7.239 1.00 . A A . 2 GLN CA 1 1 12 5343 1 1 2 GLN CB C -8.869 -8.461 -8.332 1.00 . A A . 2 GLN CB 1 1 12 5344 1 1 2 GLN CD C -9.813 -6.079 -7.904 1.00 . A A . 2 GLN CD 1 1 12 5345 1 1 2 GLN CG C -9.182 -7.055 -8.901 1.00 . A A . 2 GLN CG 1 1 12 5346 1 1 2 GLN H H -6.344 -8.148 -8.777 1.00 . A A . 2 GLN H 1 1 12 5347 1 1 2 GLN HA H -8.171 -7.762 -6.462 1.00 . A A . 2 GLN HA 1 1 12 5348 1 1 2 GLN HB2 H -8.541 -9.112 -9.148 1.00 . A A . 2 GLN HB2 1 1 12 5349 1 1 2 GLN HB3 H -9.788 -8.882 -7.918 1.00 . A A . 2 GLN HB3 1 1 12 5350 1 1 2 GLN HE21 H -8.067 -5.647 -6.916 1.00 . A A . 2 GLN HE21 1 1 12 5351 1 1 2 GLN HE22 H -9.549 -4.843 -6.411 1.00 . A A . 2 GLN HE22 1 1 12 5352 1 1 2 GLN HG2 H -8.284 -6.598 -9.317 1.00 . A A . 2 GLN HG2 1 1 12 5353 1 1 2 GLN HG3 H -9.892 -7.180 -9.721 1.00 . A A . 2 GLN HG3 1 1 12 5354 1 1 2 GLN N N -6.540 -7.892 -7.825 1.00 . A A . 2 GLN N 1 1 12 5355 1 1 2 GLN NE2 N -9.044 -5.458 -7.028 1.00 . A A . 2 GLN NE2 1 1 12 5356 1 1 2 GLN O O -7.822 -10.850 -7.014 1.00 . A A . 2 GLN O 1 1 12 5357 1 1 2 GLN OE1 O -11.006 -5.841 -7.918 1.00 . A A . 2 GLN OE1 1 1 12 5358 1 1 3 SER C C -5.595 -10.016 -3.302 1.00 . A A . 3 SER C 1 1 12 5359 1 1 3 SER CA C -6.503 -10.683 -4.367 1.00 . A A . 3 SER CA 1 1 12 5360 1 1 3 SER CB C -5.843 -11.880 -5.081 1.00 . A A . 3 SER CB 1 1 12 5361 1 1 3 SER H H -6.764 -8.689 -5.046 1.00 . A A . 3 SER H 1 1 12 5362 1 1 3 SER HA H -7.385 -11.056 -3.842 1.00 . A A . 3 SER HA 1 1 12 5363 1 1 3 SER HB2 H -6.612 -12.498 -5.555 1.00 . A A . 3 SER HB2 1 1 12 5364 1 1 3 SER HB3 H -5.169 -11.531 -5.866 1.00 . A A . 3 SER HB3 1 1 12 5365 1 1 3 SER HG H -5.685 -13.114 -3.554 1.00 . A A . 3 SER HG 1 1 12 5366 1 1 3 SER N N -6.931 -9.648 -5.325 1.00 . A A . 3 SER N 1 1 12 5367 1 1 3 SER O O -6.099 -9.555 -2.282 1.00 . A A . 3 SER O 1 1 12 5368 1 1 3 SER OG O -5.094 -12.667 -4.171 1.00 . A A . 3 SER OG 1 1 12 5369 1 1 4 HIS C C -3.170 -7.639 -4.180 1.00 . A A . 4 HIS C 1 1 12 5370 1 1 4 HIS CA C -3.482 -8.708 -3.090 1.00 . A A . 4 HIS CA 1 1 12 5371 1 1 4 HIS CB C -2.225 -9.268 -2.390 1.00 . A A . 4 HIS CB 1 1 12 5372 1 1 4 HIS CD2 C -0.625 -8.655 -0.417 1.00 . A A . 4 HIS CD2 1 1 12 5373 1 1 4 HIS CE1 C -0.914 -6.491 -0.441 1.00 . A A . 4 HIS CE1 1 1 12 5374 1 1 4 HIS CG C -1.551 -8.354 -1.381 1.00 . A A . 4 HIS CG 1 1 12 5375 1 1 4 HIS H H -3.938 -10.366 -4.374 1.00 . A A . 4 HIS H 1 1 12 5376 1 1 4 HIS HA H -4.056 -8.199 -2.311 1.00 . A A . 4 HIS HA 1 1 12 5377 1 1 4 HIS HB2 H -2.500 -10.170 -1.843 1.00 . A A . 4 HIS HB2 1 1 12 5378 1 1 4 HIS HB3 H -1.496 -9.544 -3.153 1.00 . A A . 4 HIS HB3 1 1 12 5379 1 1 4 HIS HD2 H -0.235 -9.640 -0.204 1.00 . A A . 4 HIS HD2 1 1 12 5380 1 1 4 HIS HE1 H -0.802 -5.439 -0.221 1.00 . A A . 4 HIS HE1 1 1 12 5381 1 1 4 HIS HE2 H 0.478 -7.350 0.885 1.00 . A A . 4 HIS HE2 1 1 12 5382 1 1 4 HIS N N -4.309 -9.812 -3.618 1.00 . A A . 4 HIS N 1 1 12 5383 1 1 4 HIS ND1 N -1.757 -6.977 -1.356 1.00 . A A . 4 HIS ND1 1 1 12 5384 1 1 4 HIS NE2 N -0.218 -7.465 0.163 1.00 . A A . 4 HIS NE2 1 1 12 5385 1 1 4 HIS O O -3.169 -7.911 -5.395 1.00 . A A . 4 HIS O 1 1 12 5386 1 1 5 ALA C C -1.622 -4.299 -4.096 1.00 . A A . 5 ALA C 1 1 12 5387 1 1 5 ALA CA C -2.851 -5.156 -4.488 1.00 . A A . 5 ALA CA 1 1 12 5388 1 1 5 ALA CB C -4.177 -4.394 -4.287 1.00 . A A . 5 ALA CB 1 1 12 5389 1 1 5 ALA H H -2.840 -6.328 -2.725 1.00 . A A . 5 ALA H 1 1 12 5390 1 1 5 ALA HA H -2.705 -5.386 -5.534 1.00 . A A . 5 ALA HA 1 1 12 5391 1 1 5 ALA HB1 H -5.029 -5.037 -4.498 1.00 . A A . 5 ALA HB1 1 1 12 5392 1 1 5 ALA HB2 H -4.259 -4.059 -3.249 1.00 . A A . 5 ALA HB2 1 1 12 5393 1 1 5 ALA HB3 H -4.234 -3.527 -4.944 1.00 . A A . 5 ALA HB3 1 1 12 5394 1 1 5 ALA N N -2.963 -6.401 -3.731 1.00 . A A . 5 ALA N 1 1 12 5395 1 1 5 ALA O O -0.676 -4.785 -3.478 1.00 . A A . 5 ALA O 1 1 12 5396 1 1 6 GLY C C -1.018 -1.429 -2.587 1.00 . A A . 6 GLY C 1 1 12 5397 1 1 6 GLY CA C -0.704 -2.003 -3.986 1.00 . A A . 6 GLY CA 1 1 12 5398 1 1 6 GLY H H -2.351 -2.731 -5.137 1.00 . A A . 6 GLY H 1 1 12 5399 1 1 6 GLY HA2 H 0.306 -2.413 -3.971 1.00 . A A . 6 GLY HA2 1 1 12 5400 1 1 6 GLY HA3 H -0.737 -1.194 -4.712 1.00 . A A . 6 GLY HA3 1 1 12 5401 1 1 6 GLY N N -1.642 -3.017 -4.471 1.00 . A A . 6 GLY N 1 1 12 5402 1 1 6 GLY O O -1.241 -2.169 -1.632 1.00 . A A . 6 GLY O 1 1 12 5403 1 1 7 GLN C C -2.168 0.314 -0.207 1.00 . A A . 7 GLN C 1 1 12 5404 1 1 7 GLN CA C -1.043 0.682 -1.213 1.00 . A A . 7 GLN CA 1 1 12 5405 1 1 7 GLN CB C -0.963 2.183 -1.579 1.00 . A A . 7 GLN CB 1 1 12 5406 1 1 7 GLN CD C -0.366 4.522 -0.670 1.00 . A A . 7 GLN CD 1 1 12 5407 1 1 7 GLN CG C -1.018 3.165 -0.385 1.00 . A A . 7 GLN CG 1 1 12 5408 1 1 7 GLN H H -0.838 0.430 -3.305 1.00 . A A . 7 GLN H 1 1 12 5409 1 1 7 GLN HA H -0.111 0.464 -0.688 1.00 . A A . 7 GLN HA 1 1 12 5410 1 1 7 GLN HB2 H -0.022 2.331 -2.115 1.00 . A A . 7 GLN HB2 1 1 12 5411 1 1 7 GLN HB3 H -1.776 2.447 -2.255 1.00 . A A . 7 GLN HB3 1 1 12 5412 1 1 7 GLN HE21 H -0.350 5.077 1.293 1.00 . A A . 7 GLN HE21 1 1 12 5413 1 1 7 GLN HE22 H 0.288 6.217 0.117 1.00 . A A . 7 GLN HE22 1 1 12 5414 1 1 7 GLN HG2 H -2.058 3.348 -0.115 1.00 . A A . 7 GLN HG2 1 1 12 5415 1 1 7 GLN HG3 H -0.538 2.730 0.484 1.00 . A A . 7 GLN HG3 1 1 12 5416 1 1 7 GLN N N -1.036 -0.091 -2.470 1.00 . A A . 7 GLN N 1 1 12 5417 1 1 7 GLN NE2 N -0.107 5.322 0.349 1.00 . A A . 7 GLN NE2 1 1 12 5418 1 1 7 GLN O O -3.167 1.013 -0.091 1.00 . A A . 7 GLN O 1 1 12 5419 1 1 7 GLN OE1 O -0.049 4.883 -1.797 1.00 . A A . 7 GLN OE1 1 1 12 5420 1 1 8 CYS C C -3.774 -0.411 2.369 1.00 . A A . 8 CYS C 1 1 12 5421 1 1 8 CYS CA C -2.817 -1.362 1.605 1.00 . A A . 8 CYS CA 1 1 12 5422 1 1 8 CYS CB C -1.909 -2.049 2.649 1.00 . A A . 8 CYS CB 1 1 12 5423 1 1 8 CYS H H -1.217 -1.356 0.193 1.00 . A A . 8 CYS H 1 1 12 5424 1 1 8 CYS HA H -3.431 -2.132 1.133 1.00 . A A . 8 CYS HA 1 1 12 5425 1 1 8 CYS HB2 H -1.352 -1.290 3.199 1.00 . A A . 8 CYS HB2 1 1 12 5426 1 1 8 CYS HB3 H -2.534 -2.587 3.362 1.00 . A A . 8 CYS HB3 1 1 12 5427 1 1 8 CYS N N -1.959 -0.769 0.553 1.00 . A A . 8 CYS N 1 1 12 5428 1 1 8 CYS O O -4.876 -0.799 2.750 1.00 . A A . 8 CYS O 1 1 12 5429 1 1 8 CYS SG S -0.675 -3.235 2.062 1.00 . A A . 8 CYS SG 1 1 12 5430 1 1 9 GLY C C -2.851 1.311 5.074 1.00 . A A . 9 GLY C 1 1 12 5431 1 1 9 GLY CA C -3.729 1.592 3.838 1.00 . A A . 9 GLY CA 1 1 12 5432 1 1 9 GLY H H -2.429 1.045 2.235 1.00 . A A . 9 GLY H 1 1 12 5433 1 1 9 GLY HA2 H -3.645 2.635 3.537 1.00 . A A . 9 GLY HA2 1 1 12 5434 1 1 9 GLY HA3 H -4.772 1.391 4.089 1.00 . A A . 9 GLY HA3 1 1 12 5435 1 1 9 GLY N N -3.278 0.783 2.706 1.00 . A A . 9 GLY N 1 1 12 5436 1 1 9 GLY O O -2.980 0.267 5.709 1.00 . A A . 9 GLY O 1 1 12 5437 1 1 10 GLY C C -1.317 2.641 7.759 1.00 . A A . 10 GLY C 1 1 12 5438 1 1 10 GLY CA C -0.890 2.017 6.417 1.00 . A A . 10 GLY CA 1 1 12 5439 1 1 10 GLY H H -1.887 3.052 4.820 1.00 . A A . 10 GLY H 1 1 12 5440 1 1 10 GLY HA2 H -0.681 0.959 6.590 1.00 . A A . 10 GLY HA2 1 1 12 5441 1 1 10 GLY HA3 H 0.038 2.483 6.080 1.00 . A A . 10 GLY HA3 1 1 12 5442 1 1 10 GLY N N -1.879 2.190 5.342 1.00 . A A . 10 GLY N 1 1 12 5443 1 1 10 GLY O O -2.459 2.518 8.195 1.00 . A A . 10 GLY O 1 1 12 5444 1 1 11 ILE C C -1.234 5.496 9.310 1.00 . A A . 11 ILE C 1 1 12 5445 1 1 11 ILE CA C -0.674 4.093 9.654 1.00 . A A . 11 ILE CA 1 1 12 5446 1 1 11 ILE CB C 0.602 4.131 10.531 1.00 . A A . 11 ILE CB 1 1 12 5447 1 1 11 ILE CD1 C 2.424 2.629 11.586 1.00 . A A . 11 ILE CD1 1 1 12 5448 1 1 11 ILE CG1 C 1.158 2.698 10.727 1.00 . A A . 11 ILE CG1 1 1 12 5449 1 1 11 ILE CG2 C 0.294 4.787 11.890 1.00 . A A . 11 ILE CG2 1 1 12 5450 1 1 11 ILE H H 0.519 3.454 8.005 1.00 . A A . 11 ILE H 1 1 12 5451 1 1 11 ILE HA H -1.426 3.555 10.236 1.00 . A A . 11 ILE HA 1 1 12 5452 1 1 11 ILE HB H 1.363 4.730 10.026 1.00 . A A . 11 ILE HB 1 1 12 5453 1 1 11 ILE HD11 H 3.167 3.329 11.205 1.00 . A A . 11 ILE HD11 1 1 12 5454 1 1 11 ILE HD12 H 2.195 2.861 12.625 1.00 . A A . 11 ILE HD12 1 1 12 5455 1 1 11 ILE HD13 H 2.834 1.619 11.539 1.00 . A A . 11 ILE HD13 1 1 12 5456 1 1 11 ILE HG12 H 0.391 2.061 11.172 1.00 . A A . 11 ILE HG12 1 1 12 5457 1 1 11 ILE HG13 H 1.426 2.278 9.756 1.00 . A A . 11 ILE HG13 1 1 12 5458 1 1 11 ILE HG21 H -0.137 5.779 11.751 1.00 . A A . 11 ILE HG21 1 1 12 5459 1 1 11 ILE HG22 H -0.409 4.170 12.452 1.00 . A A . 11 ILE HG22 1 1 12 5460 1 1 11 ILE HG23 H 1.207 4.905 12.475 1.00 . A A . 11 ILE HG23 1 1 12 5461 1 1 11 ILE N N -0.399 3.353 8.415 1.00 . A A . 11 ILE N 1 1 12 5462 1 1 11 ILE O O -0.557 6.286 8.662 1.00 . A A . 11 ILE O 1 1 12 5463 1 1 12 GLY C C -3.319 7.428 7.880 1.00 . A A . 12 GLY C 1 1 12 5464 1 1 12 GLY CA C -3.153 7.077 9.379 1.00 . A A . 12 GLY CA 1 1 12 5465 1 1 12 GLY H H -3.005 5.084 10.177 1.00 . A A . 12 GLY H 1 1 12 5466 1 1 12 GLY HA2 H -4.154 7.048 9.808 1.00 . A A . 12 GLY HA2 1 1 12 5467 1 1 12 GLY HA3 H -2.602 7.883 9.867 1.00 . A A . 12 GLY HA3 1 1 12 5468 1 1 12 GLY N N -2.486 5.796 9.682 1.00 . A A . 12 GLY N 1 1 12 5469 1 1 12 GLY O O -3.179 8.583 7.487 1.00 . A A . 12 GLY O 1 1 12 5470 1 1 13 TYR C C -4.705 5.347 5.082 1.00 . A A . 13 TYR C 1 1 12 5471 1 1 13 TYR CA C -3.900 6.559 5.606 1.00 . A A . 13 TYR CA 1 1 12 5472 1 1 13 TYR CB C -2.539 6.671 4.896 1.00 . A A . 13 TYR CB 1 1 12 5473 1 1 13 TYR CD1 C -2.700 8.430 3.081 1.00 . A A . 13 TYR CD1 1 1 12 5474 1 1 13 TYR CD2 C -2.681 6.074 2.424 1.00 . A A . 13 TYR CD2 1 1 12 5475 1 1 13 TYR CE1 C -2.716 8.807 1.720 1.00 . A A . 13 TYR CE1 1 1 12 5476 1 1 13 TYR CE2 C -2.729 6.461 1.069 1.00 . A A . 13 TYR CE2 1 1 12 5477 1 1 13 TYR CG C -2.635 7.061 3.434 1.00 . A A . 13 TYR CG 1 1 12 5478 1 1 13 TYR CZ C -2.682 7.822 0.720 1.00 . A A . 13 TYR CZ 1 1 12 5479 1 1 13 TYR H H -3.759 5.518 7.466 1.00 . A A . 13 TYR H 1 1 12 5480 1 1 13 TYR HA H -4.467 7.475 5.418 1.00 . A A . 13 TYR HA 1 1 12 5481 1 1 13 TYR HB2 H -1.926 7.422 5.396 1.00 . A A . 13 TYR HB2 1 1 12 5482 1 1 13 TYR HB3 H -2.004 5.725 4.992 1.00 . A A . 13 TYR HB3 1 1 12 5483 1 1 13 TYR HD1 H -2.716 9.187 3.850 1.00 . A A . 13 TYR HD1 1 1 12 5484 1 1 13 TYR HD2 H -2.660 5.022 2.684 1.00 . A A . 13 TYR HD2 1 1 12 5485 1 1 13 TYR HE1 H -2.743 9.848 1.443 1.00 . A A . 13 TYR HE1 1 1 12 5486 1 1 13 TYR HE2 H -2.772 5.715 0.290 1.00 . A A . 13 TYR HE2 1 1 12 5487 1 1 13 TYR HH H -2.675 7.420 -1.163 1.00 . A A . 13 TYR HH 1 1 12 5488 1 1 13 TYR N N -3.674 6.437 7.056 1.00 . A A . 13 TYR N 1 1 12 5489 1 1 13 TYR O O -4.293 4.206 5.301 1.00 . A A . 13 TYR O 1 1 12 5490 1 1 13 TYR OH O -2.611 8.191 -0.585 1.00 . A A . 13 TYR OH 1 1 12 5491 1 1 14 SER C C -7.892 4.744 3.110 1.00 . A A . 14 SER C 1 1 12 5492 1 1 14 SER CA C -6.857 4.463 4.231 1.00 . A A . 14 SER CA 1 1 12 5493 1 1 14 SER CB C -7.598 4.174 5.557 1.00 . A A . 14 SER CB 1 1 12 5494 1 1 14 SER H H -6.153 6.495 4.248 1.00 . A A . 14 SER H 1 1 12 5495 1 1 14 SER HA H -6.322 3.559 3.931 1.00 . A A . 14 SER HA 1 1 12 5496 1 1 14 SER HB2 H -8.221 5.029 5.822 1.00 . A A . 14 SER HB2 1 1 12 5497 1 1 14 SER HB3 H -8.254 3.308 5.436 1.00 . A A . 14 SER HB3 1 1 12 5498 1 1 14 SER HG H -5.868 3.608 6.326 1.00 . A A . 14 SER HG 1 1 12 5499 1 1 14 SER N N -5.873 5.547 4.453 1.00 . A A . 14 SER N 1 1 12 5500 1 1 14 SER O O -8.029 5.874 2.648 1.00 . A A . 14 SER O 1 1 12 5501 1 1 14 SER OG O -6.727 3.916 6.648 1.00 . A A . 14 SER OG 1 1 12 5502 1 1 15 GLY C C -9.251 3.542 0.227 1.00 . A A . 15 GLY C 1 1 12 5503 1 1 15 GLY CA C -9.720 3.804 1.679 1.00 . A A . 15 GLY CA 1 1 12 5504 1 1 15 GLY H H -8.445 2.812 3.086 1.00 . A A . 15 GLY H 1 1 12 5505 1 1 15 GLY HA2 H -10.464 3.043 1.921 1.00 . A A . 15 GLY HA2 1 1 12 5506 1 1 15 GLY HA3 H -10.202 4.781 1.737 1.00 . A A . 15 GLY HA3 1 1 12 5507 1 1 15 GLY N N -8.654 3.720 2.700 1.00 . A A . 15 GLY N 1 1 12 5508 1 1 15 GLY O O -8.180 2.963 0.028 1.00 . A A . 15 GLY O 1 1 12 5509 1 1 16 PRO C C -8.504 4.581 -2.744 1.00 . A A . 16 PRO C 1 1 12 5510 1 1 16 PRO CA C -9.708 3.751 -2.226 1.00 . A A . 16 PRO CA 1 1 12 5511 1 1 16 PRO CB C -11.012 4.066 -2.986 1.00 . A A . 16 PRO CB 1 1 12 5512 1 1 16 PRO CD C -11.435 4.334 -0.666 1.00 . A A . 16 PRO CD 1 1 12 5513 1 1 16 PRO CG C -12.102 3.823 -1.945 1.00 . A A . 16 PRO CG 1 1 12 5514 1 1 16 PRO HA H -9.470 2.698 -2.393 1.00 . A A . 16 PRO HA 1 1 12 5515 1 1 16 PRO HB2 H -11.050 5.122 -3.275 1.00 . A A . 16 PRO HB2 1 1 12 5516 1 1 16 PRO HB3 H -11.130 3.446 -3.877 1.00 . A A . 16 PRO HB3 1 1 12 5517 1 1 16 PRO HD2 H -11.499 5.423 -0.617 1.00 . A A . 16 PRO HD2 1 1 12 5518 1 1 16 PRO HD3 H -11.939 3.899 0.201 1.00 . A A . 16 PRO HD3 1 1 12 5519 1 1 16 PRO HG2 H -13.029 4.350 -2.178 1.00 . A A . 16 PRO HG2 1 1 12 5520 1 1 16 PRO HG3 H -12.292 2.752 -1.864 1.00 . A A . 16 PRO HG3 1 1 12 5521 1 1 16 PRO N N -10.038 3.935 -0.801 1.00 . A A . 16 PRO N 1 1 12 5522 1 1 16 PRO O O -8.618 5.327 -3.711 1.00 . A A . 16 PRO O 1 1 12 5523 1 1 17 THR C C -4.946 4.101 -2.724 1.00 . A A . 17 THR C 1 1 12 5524 1 1 17 THR CA C -6.070 5.122 -2.455 1.00 . A A . 17 THR CA 1 1 12 5525 1 1 17 THR CB C -5.749 6.172 -1.375 1.00 . A A . 17 THR CB 1 1 12 5526 1 1 17 THR CG2 C -5.673 5.621 0.055 1.00 . A A . 17 THR CG2 1 1 12 5527 1 1 17 THR H H -7.305 3.781 -1.348 1.00 . A A . 17 THR H 1 1 12 5528 1 1 17 THR HA H -6.181 5.681 -3.387 1.00 . A A . 17 THR HA 1 1 12 5529 1 1 17 THR HB H -6.559 6.907 -1.397 1.00 . A A . 17 THR HB 1 1 12 5530 1 1 17 THR HG1 H -4.491 7.652 -1.196 1.00 . A A . 17 THR HG1 1 1 12 5531 1 1 17 THR HG21 H -4.909 4.850 0.141 1.00 . A A . 17 THR HG21 1 1 12 5532 1 1 17 THR HG22 H -5.451 6.429 0.751 1.00 . A A . 17 THR HG22 1 1 12 5533 1 1 17 THR HG23 H -6.629 5.189 0.342 1.00 . A A . 17 THR HG23 1 1 12 5534 1 1 17 THR N N -7.334 4.435 -2.120 1.00 . A A . 17 THR N 1 1 12 5535 1 1 17 THR O O -3.999 3.935 -1.958 1.00 . A A . 17 THR O 1 1 12 5536 1 1 17 THR OG1 O -4.549 6.837 -1.708 1.00 . A A . 17 THR OG1 1 1 12 5537 1 1 18 VAL C C -3.848 1.879 -5.461 1.00 . A A . 18 VAL C 1 1 12 5538 1 1 18 VAL CA C -4.488 2.025 -4.055 1.00 . A A . 18 VAL CA 1 1 12 5539 1 1 18 VAL CB C -5.522 0.913 -3.747 1.00 . A A . 18 VAL CB 1 1 12 5540 1 1 18 VAL CG1 C -6.698 0.896 -4.740 1.00 . A A . 18 VAL CG1 1 1 12 5541 1 1 18 VAL CG2 C -4.891 -0.489 -3.672 1.00 . A A . 18 VAL CG2 1 1 12 5542 1 1 18 VAL H H -5.864 3.616 -4.435 1.00 . A A . 18 VAL H 1 1 12 5543 1 1 18 VAL HA H -3.677 1.897 -3.337 1.00 . A A . 18 VAL HA 1 1 12 5544 1 1 18 VAL HB H -5.935 1.115 -2.755 1.00 . A A . 18 VAL HB 1 1 12 5545 1 1 18 VAL HG11 H -7.206 1.861 -4.747 1.00 . A A . 18 VAL HG11 1 1 12 5546 1 1 18 VAL HG12 H -6.345 0.677 -5.749 1.00 . A A . 18 VAL HG12 1 1 12 5547 1 1 18 VAL HG13 H -7.417 0.129 -4.449 1.00 . A A . 18 VAL HG13 1 1 12 5548 1 1 18 VAL HG21 H -4.021 -0.478 -3.015 1.00 . A A . 18 VAL HG21 1 1 12 5549 1 1 18 VAL HG22 H -5.617 -1.197 -3.271 1.00 . A A . 18 VAL HG22 1 1 12 5550 1 1 18 VAL HG23 H -4.594 -0.835 -4.661 1.00 . A A . 18 VAL HG23 1 1 12 5551 1 1 18 VAL N N -5.118 3.337 -3.814 1.00 . A A . 18 VAL N 1 1 12 5552 1 1 18 VAL O O -4.212 2.570 -6.408 1.00 . A A . 18 VAL O 1 1 12 5553 1 1 19 CYS C C -2.202 -0.788 -7.272 1.00 . A A . 19 CYS C 1 1 12 5554 1 1 19 CYS CA C -2.069 0.685 -6.781 1.00 . A A . 19 CYS CA 1 1 12 5555 1 1 19 CYS CB C -0.639 1.173 -6.455 1.00 . A A . 19 CYS CB 1 1 12 5556 1 1 19 CYS H H -2.740 0.376 -4.779 1.00 . A A . 19 CYS H 1 1 12 5557 1 1 19 CYS HA H -2.426 1.292 -7.617 1.00 . A A . 19 CYS HA 1 1 12 5558 1 1 19 CYS HB2 H -0.646 2.263 -6.522 1.00 . A A . 19 CYS HB2 1 1 12 5559 1 1 19 CYS HB3 H -0.378 0.934 -5.427 1.00 . A A . 19 CYS HB3 1 1 12 5560 1 1 19 CYS N N -2.886 0.959 -5.586 1.00 . A A . 19 CYS N 1 1 12 5561 1 1 19 CYS O O -2.849 -1.606 -6.620 1.00 . A A . 19 CYS O 1 1 12 5562 1 1 19 CYS SG S 0.766 0.643 -7.470 1.00 . A A . 19 CYS SG 1 1 12 5563 1 1 20 ALA C C -1.472 -3.693 -8.504 1.00 . A A . 20 ALA C 1 1 12 5564 1 1 20 ALA CA C -1.754 -2.344 -9.236 1.00 . A A . 20 ALA CA 1 1 12 5565 1 1 20 ALA CB C -0.887 -2.145 -10.498 1.00 . A A . 20 ALA CB 1 1 12 5566 1 1 20 ALA H H -1.152 -0.342 -8.898 1.00 . A A . 20 ALA H 1 1 12 5567 1 1 20 ALA HA H -2.790 -2.410 -9.575 1.00 . A A . 20 ALA HA 1 1 12 5568 1 1 20 ALA HB1 H -1.165 -1.224 -11.013 1.00 . A A . 20 ALA HB1 1 1 12 5569 1 1 20 ALA HB2 H 0.169 -2.078 -10.226 1.00 . A A . 20 ALA HB2 1 1 12 5570 1 1 20 ALA HB3 H -1.022 -2.971 -11.195 1.00 . A A . 20 ALA HB3 1 1 12 5571 1 1 20 ALA N N -1.638 -1.101 -8.448 1.00 . A A . 20 ALA N 1 1 12 5572 1 1 20 ALA O O -2.162 -4.052 -7.552 1.00 . A A . 20 ALA O 1 1 12 5573 1 1 21 SER C C 1.298 -5.734 -7.793 1.00 . A A . 21 SER C 1 1 12 5574 1 1 21 SER CA C -0.125 -5.793 -8.385 1.00 . A A . 21 SER CA 1 1 12 5575 1 1 21 SER CB C -0.246 -6.938 -9.415 1.00 . A A . 21 SER CB 1 1 12 5576 1 1 21 SER H H 0.043 -4.159 -9.751 1.00 . A A . 21 SER H 1 1 12 5577 1 1 21 SER HA H -0.796 -6.020 -7.554 1.00 . A A . 21 SER HA 1 1 12 5578 1 1 21 SER HB2 H -0.974 -6.675 -10.185 1.00 . A A . 21 SER HB2 1 1 12 5579 1 1 21 SER HB3 H 0.710 -7.110 -9.925 1.00 . A A . 21 SER HB3 1 1 12 5580 1 1 21 SER HG H 0.054 -8.594 -8.406 1.00 . A A . 21 SER HG 1 1 12 5581 1 1 21 SER N N -0.529 -4.510 -8.996 1.00 . A A . 21 SER N 1 1 12 5582 1 1 21 SER O O 2.081 -4.875 -8.176 1.00 . A A . 21 SER O 1 1 12 5583 1 1 21 SER OG O -0.709 -8.113 -8.761 1.00 . A A . 21 SER OG 1 1 12 5584 1 1 22 GLY C C 2.931 -7.839 -5.127 1.00 . A A . 22 GLY C 1 1 12 5585 1 1 22 GLY CA C 2.920 -6.756 -6.220 1.00 . A A . 22 GLY CA 1 1 12 5586 1 1 22 GLY H H 0.896 -7.313 -6.608 1.00 . A A . 22 GLY H 1 1 12 5587 1 1 22 GLY HA2 H 3.702 -6.973 -6.951 1.00 . A A . 22 GLY HA2 1 1 12 5588 1 1 22 GLY HA3 H 3.147 -5.798 -5.750 1.00 . A A . 22 GLY HA3 1 1 12 5589 1 1 22 GLY N N 1.609 -6.659 -6.882 1.00 . A A . 22 GLY N 1 1 12 5590 1 1 22 GLY O O 3.655 -8.829 -5.204 1.00 . A A . 22 GLY O 1 1 12 5591 1 1 23 THR C C 2.529 -8.251 -1.754 1.00 . A A . 23 THR C 1 1 12 5592 1 1 23 THR CA C 1.730 -8.616 -3.028 1.00 . A A . 23 THR CA 1 1 12 5593 1 1 23 THR CB C 1.859 -10.114 -3.422 1.00 . A A . 23 THR CB 1 1 12 5594 1 1 23 THR CG2 C 1.234 -11.105 -2.434 1.00 . A A . 23 THR CG2 1 1 12 5595 1 1 23 THR H H 1.459 -6.854 -4.225 1.00 . A A . 23 THR H 1 1 12 5596 1 1 23 THR HA H 0.686 -8.449 -2.787 1.00 . A A . 23 THR HA 1 1 12 5597 1 1 23 THR HB H 2.917 -10.375 -3.527 1.00 . A A . 23 THR HB 1 1 12 5598 1 1 23 THR HG1 H 1.837 -10.664 -5.276 1.00 . A A . 23 THR HG1 1 1 12 5599 1 1 23 THR HG21 H 0.179 -10.886 -2.294 1.00 . A A . 23 THR HG21 1 1 12 5600 1 1 23 THR HG22 H 1.329 -12.113 -2.838 1.00 . A A . 23 THR HG22 1 1 12 5601 1 1 23 THR HG23 H 1.736 -11.093 -1.470 1.00 . A A . 23 THR HG23 1 1 12 5602 1 1 23 THR N N 2.012 -7.695 -4.160 1.00 . A A . 23 THR N 1 1 12 5603 1 1 23 THR O O 2.924 -9.101 -0.962 1.00 . A A . 23 THR O 1 1 12 5604 1 1 23 THR OG1 O 1.177 -10.359 -4.643 1.00 . A A . 23 THR OG1 1 1 12 5605 1 1 24 THR C C 3.576 -5.275 0.149 1.00 . A A . 24 THR C 1 1 12 5606 1 1 24 THR CA C 3.938 -6.433 -0.804 1.00 . A A . 24 THR CA 1 1 12 5607 1 1 24 THR CB C 5.021 -6.004 -1.823 1.00 . A A . 24 THR CB 1 1 12 5608 1 1 24 THR CG2 C 5.745 -7.218 -2.422 1.00 . A A . 24 THR CG2 1 1 12 5609 1 1 24 THR H H 2.431 -6.331 -2.262 1.00 . A A . 24 THR H 1 1 12 5610 1 1 24 THR HA H 4.377 -7.208 -0.171 1.00 . A A . 24 THR HA 1 1 12 5611 1 1 24 THR HB H 5.776 -5.384 -1.330 1.00 . A A . 24 THR HB 1 1 12 5612 1 1 24 THR HG1 H 4.859 -5.515 -3.706 1.00 . A A . 24 THR HG1 1 1 12 5613 1 1 24 THR HG21 H 6.136 -7.862 -1.635 1.00 . A A . 24 THR HG21 1 1 12 5614 1 1 24 THR HG22 H 5.073 -7.795 -3.053 1.00 . A A . 24 THR HG22 1 1 12 5615 1 1 24 THR HG23 H 6.579 -6.882 -3.037 1.00 . A A . 24 THR HG23 1 1 12 5616 1 1 24 THR N N 2.777 -6.956 -1.548 1.00 . A A . 24 THR N 1 1 12 5617 1 1 24 THR O O 3.931 -4.117 -0.064 1.00 . A A . 24 THR O 1 1 12 5618 1 1 24 THR OG1 O 4.419 -5.262 -2.871 1.00 . A A . 24 THR OG1 1 1 12 5619 1 1 25 CYS C C 3.944 -4.236 3.090 1.00 . A A . 25 CYS C 1 1 12 5620 1 1 25 CYS CA C 2.633 -4.615 2.333 1.00 . A A . 25 CYS CA 1 1 12 5621 1 1 25 CYS CB C 1.502 -5.142 3.239 1.00 . A A . 25 CYS CB 1 1 12 5622 1 1 25 CYS H H 2.706 -6.566 1.423 1.00 . A A . 25 CYS H 1 1 12 5623 1 1 25 CYS HA H 2.256 -3.716 1.838 1.00 . A A . 25 CYS HA 1 1 12 5624 1 1 25 CYS HB2 H 0.862 -5.831 2.688 1.00 . A A . 25 CYS HB2 1 1 12 5625 1 1 25 CYS HB3 H 1.911 -5.680 4.094 1.00 . A A . 25 CYS HB3 1 1 12 5626 1 1 25 CYS N N 2.900 -5.590 1.262 1.00 . A A . 25 CYS N 1 1 12 5627 1 1 25 CYS O O 4.680 -5.119 3.530 1.00 . A A . 25 CYS O 1 1 12 5628 1 1 25 CYS SG S 0.374 -3.863 3.844 1.00 . A A . 25 CYS SG 1 1 12 5629 1 1 26 GLN C C 5.853 -1.147 4.082 1.00 . A A . 26 GLN C 1 1 12 5630 1 1 26 GLN CA C 5.693 -2.465 3.266 1.00 . A A . 26 GLN CA 1 1 12 5631 1 1 26 GLN CB C 6.220 -2.376 1.808 1.00 . A A . 26 GLN CB 1 1 12 5632 1 1 26 GLN CD C 8.726 -2.750 2.383 1.00 . A A . 26 GLN CD 1 1 12 5633 1 1 26 GLN CG C 7.693 -1.969 1.574 1.00 . A A . 26 GLN CG 1 1 12 5634 1 1 26 GLN H H 3.592 -2.274 2.861 1.00 . A A . 26 GLN H 1 1 12 5635 1 1 26 GLN HA H 6.285 -3.209 3.802 1.00 . A A . 26 GLN HA 1 1 12 5636 1 1 26 GLN HB2 H 6.090 -3.359 1.349 1.00 . A A . 26 GLN HB2 1 1 12 5637 1 1 26 GLN HB3 H 5.596 -1.673 1.247 1.00 . A A . 26 GLN HB3 1 1 12 5638 1 1 26 GLN HE21 H 7.783 -4.531 2.137 1.00 . A A . 26 GLN HE21 1 1 12 5639 1 1 26 GLN HE22 H 9.281 -4.507 3.078 1.00 . A A . 26 GLN HE22 1 1 12 5640 1 1 26 GLN HG2 H 7.946 -2.121 0.524 1.00 . A A . 26 GLN HG2 1 1 12 5641 1 1 26 GLN HG3 H 7.821 -0.905 1.779 1.00 . A A . 26 GLN HG3 1 1 12 5642 1 1 26 GLN N N 4.296 -2.945 3.146 1.00 . A A . 26 GLN N 1 1 12 5643 1 1 26 GLN NE2 N 8.574 -4.049 2.528 1.00 . A A . 26 GLN NE2 1 1 12 5644 1 1 26 GLN O O 4.882 -0.585 4.582 1.00 . A A . 26 GLN O 1 1 12 5645 1 1 26 GLN OE1 O 9.654 -2.185 2.937 1.00 . A A . 26 GLN OE1 1 1 12 5646 1 1 27 VAL C C 8.444 1.485 4.055 1.00 . A A . 27 VAL C 1 1 12 5647 1 1 27 VAL CA C 7.444 0.629 4.890 1.00 . A A . 27 VAL CA 1 1 12 5648 1 1 27 VAL CB C 7.934 0.350 6.334 1.00 . A A . 27 VAL CB 1 1 12 5649 1 1 27 VAL CG1 C 9.044 -0.715 6.457 1.00 . A A . 27 VAL CG1 1 1 12 5650 1 1 27 VAL CG2 C 8.397 1.638 7.040 1.00 . A A . 27 VAL CG2 1 1 12 5651 1 1 27 VAL H H 7.864 -1.199 3.906 1.00 . A A . 27 VAL H 1 1 12 5652 1 1 27 VAL HA H 6.547 1.247 4.996 1.00 . A A . 27 VAL HA 1 1 12 5653 1 1 27 VAL HB H 7.082 -0.027 6.904 1.00 . A A . 27 VAL HB 1 1 12 5654 1 1 27 VAL HG11 H 8.698 -1.672 6.071 1.00 . A A . 27 VAL HG11 1 1 12 5655 1 1 27 VAL HG12 H 9.936 -0.417 5.912 1.00 . A A . 27 VAL HG12 1 1 12 5656 1 1 27 VAL HG13 H 9.313 -0.847 7.504 1.00 . A A . 27 VAL HG13 1 1 12 5657 1 1 27 VAL HG21 H 7.599 2.371 6.973 1.00 . A A . 27 VAL HG21 1 1 12 5658 1 1 27 VAL HG22 H 8.610 1.441 8.094 1.00 . A A . 27 VAL HG22 1 1 12 5659 1 1 27 VAL HG23 H 9.298 2.043 6.575 1.00 . A A . 27 VAL HG23 1 1 12 5660 1 1 27 VAL N N 7.087 -0.646 4.232 1.00 . A A . 27 VAL N 1 1 12 5661 1 1 27 VAL O O 9.654 1.316 4.162 1.00 . A A . 27 VAL O 1 1 12 5662 1 1 28 LEU C C 9.156 4.579 3.802 1.00 . A A . 28 LEU C 1 1 12 5663 1 1 28 LEU CA C 8.815 3.537 2.706 1.00 . A A . 28 LEU CA 1 1 12 5664 1 1 28 LEU CB C 8.114 4.197 1.497 1.00 . A A . 28 LEU CB 1 1 12 5665 1 1 28 LEU CD1 C 7.634 2.079 0.145 1.00 . A A . 28 LEU CD1 1 1 12 5666 1 1 28 LEU CD2 C 7.842 4.307 -1.003 1.00 . A A . 28 LEU CD2 1 1 12 5667 1 1 28 LEU CG C 8.335 3.445 0.169 1.00 . A A . 28 LEU CG 1 1 12 5668 1 1 28 LEU H H 6.956 2.530 3.182 1.00 . A A . 28 LEU H 1 1 12 5669 1 1 28 LEU HA H 9.765 3.121 2.358 1.00 . A A . 28 LEU HA 1 1 12 5670 1 1 28 LEU HB2 H 7.045 4.320 1.681 1.00 . A A . 28 LEU HB2 1 1 12 5671 1 1 28 LEU HB3 H 8.535 5.196 1.366 1.00 . A A . 28 LEU HB3 1 1 12 5672 1 1 28 LEU HD11 H 6.580 2.191 0.398 1.00 . A A . 28 LEU HD11 1 1 12 5673 1 1 28 LEU HD12 H 7.716 1.642 -0.851 1.00 . A A . 28 LEU HD12 1 1 12 5674 1 1 28 LEU HD13 H 8.105 1.399 0.854 1.00 . A A . 28 LEU HD13 1 1 12 5675 1 1 28 LEU HD21 H 8.335 5.279 -0.996 1.00 . A A . 28 LEU HD21 1 1 12 5676 1 1 28 LEU HD22 H 8.085 3.812 -1.944 1.00 . A A . 28 LEU HD22 1 1 12 5677 1 1 28 LEU HD23 H 6.764 4.453 -0.943 1.00 . A A . 28 LEU HD23 1 1 12 5678 1 1 28 LEU HG H 9.405 3.289 0.029 1.00 . A A . 28 LEU HG 1 1 12 5679 1 1 28 LEU N N 7.965 2.454 3.259 1.00 . A A . 28 LEU N 1 1 12 5680 1 1 28 LEU O O 10.306 4.927 4.045 1.00 . A A . 28 LEU O 1 1 12 5681 1 1 29 ASN C C 6.990 4.888 6.678 1.00 . A A . 29 ASN C 1 1 12 5682 1 1 29 ASN CA C 8.133 5.575 5.866 1.00 . A A . 29 ASN CA 1 1 12 5683 1 1 29 ASN CB C 8.027 7.113 5.789 1.00 . A A . 29 ASN CB 1 1 12 5684 1 1 29 ASN CG C 6.697 7.578 5.213 1.00 . A A . 29 ASN CG 1 1 12 5685 1 1 29 ASN H H 7.222 4.689 4.173 1.00 . A A . 29 ASN H 1 1 12 5686 1 1 29 ASN HA H 9.079 5.316 6.349 1.00 . A A . 29 ASN HA 1 1 12 5687 1 1 29 ASN HB2 H 8.123 7.560 6.777 1.00 . A A . 29 ASN HB2 1 1 12 5688 1 1 29 ASN HB3 H 8.851 7.498 5.187 1.00 . A A . 29 ASN HB3 1 1 12 5689 1 1 29 ASN HD21 H 7.466 7.831 3.357 1.00 . A A . 29 ASN HD21 1 1 12 5690 1 1 29 ASN HD22 H 5.764 8.231 3.593 1.00 . A A . 29 ASN HD22 1 1 12 5691 1 1 29 ASN N N 8.114 5.041 4.495 1.00 . A A . 29 ASN N 1 1 12 5692 1 1 29 ASN ND2 N 6.649 7.906 3.937 1.00 . A A . 29 ASN ND2 1 1 12 5693 1 1 29 ASN O O 6.120 4.285 6.047 1.00 . A A . 29 ASN O 1 1 12 5694 1 1 29 ASN OD1 O 5.697 7.633 5.911 1.00 . A A . 29 ASN OD1 1 1 12 5695 1 1 30 PRO C C 4.436 4.505 8.334 1.00 . A A . 30 PRO C 1 1 12 5696 1 1 30 PRO CA C 5.886 4.217 8.789 1.00 . A A . 30 PRO CA 1 1 12 5697 1 1 30 PRO CB C 6.136 4.545 10.270 1.00 . A A . 30 PRO CB 1 1 12 5698 1 1 30 PRO CD C 7.879 5.548 8.944 1.00 . A A . 30 PRO CD 1 1 12 5699 1 1 30 PRO CG C 7.099 5.736 10.245 1.00 . A A . 30 PRO CG 1 1 12 5700 1 1 30 PRO HA H 6.033 3.142 8.659 1.00 . A A . 30 PRO HA 1 1 12 5701 1 1 30 PRO HB2 H 5.220 4.784 10.820 1.00 . A A . 30 PRO HB2 1 1 12 5702 1 1 30 PRO HB3 H 6.627 3.696 10.751 1.00 . A A . 30 PRO HB3 1 1 12 5703 1 1 30 PRO HD2 H 8.254 6.511 8.611 1.00 . A A . 30 PRO HD2 1 1 12 5704 1 1 30 PRO HD3 H 8.718 4.871 9.116 1.00 . A A . 30 PRO HD3 1 1 12 5705 1 1 30 PRO HG2 H 6.524 6.665 10.196 1.00 . A A . 30 PRO HG2 1 1 12 5706 1 1 30 PRO HG3 H 7.748 5.754 11.124 1.00 . A A . 30 PRO HG3 1 1 12 5707 1 1 30 PRO N N 6.936 4.924 8.028 1.00 . A A . 30 PRO N 1 1 12 5708 1 1 30 PRO O O 3.593 3.611 8.339 1.00 . A A . 30 PRO O 1 1 12 5709 1 1 31 TYR C C 2.594 5.667 5.875 1.00 . A A . 31 TYR C 1 1 12 5710 1 1 31 TYR CA C 2.836 6.117 7.347 1.00 . A A . 31 TYR CA 1 1 12 5711 1 1 31 TYR CB C 2.613 7.629 7.578 1.00 . A A . 31 TYR CB 1 1 12 5712 1 1 31 TYR CD1 C 4.114 8.310 9.523 1.00 . A A . 31 TYR CD1 1 1 12 5713 1 1 31 TYR CD2 C 1.707 8.183 9.908 1.00 . A A . 31 TYR CD2 1 1 12 5714 1 1 31 TYR CE1 C 4.321 8.533 10.902 1.00 . A A . 31 TYR CE1 1 1 12 5715 1 1 31 TYR CE2 C 1.918 8.398 11.288 1.00 . A A . 31 TYR CE2 1 1 12 5716 1 1 31 TYR CG C 2.809 8.083 9.024 1.00 . A A . 31 TYR CG 1 1 12 5717 1 1 31 TYR CZ C 3.224 8.557 11.782 1.00 . A A . 31 TYR CZ 1 1 12 5718 1 1 31 TYR H H 4.873 6.427 7.891 1.00 . A A . 31 TYR H 1 1 12 5719 1 1 31 TYR HA H 2.058 5.612 7.919 1.00 . A A . 31 TYR HA 1 1 12 5720 1 1 31 TYR HB2 H 3.289 8.199 6.936 1.00 . A A . 31 TYR HB2 1 1 12 5721 1 1 31 TYR HB3 H 1.593 7.873 7.268 1.00 . A A . 31 TYR HB3 1 1 12 5722 1 1 31 TYR HD1 H 4.958 8.299 8.848 1.00 . A A . 31 TYR HD1 1 1 12 5723 1 1 31 TYR HD2 H 0.699 8.118 9.533 1.00 . A A . 31 TYR HD2 1 1 12 5724 1 1 31 TYR HE1 H 5.320 8.695 11.278 1.00 . A A . 31 TYR HE1 1 1 12 5725 1 1 31 TYR HE2 H 1.080 8.452 11.967 1.00 . A A . 31 TYR HE2 1 1 12 5726 1 1 31 TYR HH H 4.364 8.781 13.312 1.00 . A A . 31 TYR HH 1 1 12 5727 1 1 31 TYR N N 4.146 5.731 7.892 1.00 . A A . 31 TYR N 1 1 12 5728 1 1 31 TYR O O 1.483 5.808 5.367 1.00 . A A . 31 TYR O 1 1 12 5729 1 1 31 TYR OH O 3.428 8.736 13.113 1.00 . A A . 31 TYR OH 1 1 12 5730 1 1 32 TYR C C 3.958 3.222 3.483 1.00 . A A . 32 TYR C 1 1 12 5731 1 1 32 TYR CA C 3.513 4.690 3.765 1.00 . A A . 32 TYR CA 1 1 12 5732 1 1 32 TYR CB C 4.246 5.750 2.905 1.00 . A A . 32 TYR CB 1 1 12 5733 1 1 32 TYR CD1 C 3.225 4.810 0.744 1.00 . A A . 32 TYR CD1 1 1 12 5734 1 1 32 TYR CD2 C 3.907 7.150 0.791 1.00 . A A . 32 TYR CD2 1 1 12 5735 1 1 32 TYR CE1 C 2.842 4.943 -0.603 1.00 . A A . 32 TYR CE1 1 1 12 5736 1 1 32 TYR CE2 C 3.496 7.283 -0.557 1.00 . A A . 32 TYR CE2 1 1 12 5737 1 1 32 TYR CG C 3.781 5.902 1.452 1.00 . A A . 32 TYR CG 1 1 12 5738 1 1 32 TYR CZ C 2.987 6.174 -1.256 1.00 . A A . 32 TYR CZ 1 1 12 5739 1 1 32 TYR H H 4.483 4.996 5.643 1.00 . A A . 32 TYR H 1 1 12 5740 1 1 32 TYR HA H 2.468 4.747 3.453 1.00 . A A . 32 TYR HA 1 1 12 5741 1 1 32 TYR HB2 H 4.094 6.722 3.385 1.00 . A A . 32 TYR HB2 1 1 12 5742 1 1 32 TYR HB3 H 5.320 5.549 2.919 1.00 . A A . 32 TYR HB3 1 1 12 5743 1 1 32 TYR HD1 H 3.069 3.863 1.219 1.00 . A A . 32 TYR HD1 1 1 12 5744 1 1 32 TYR HD2 H 4.318 8.005 1.313 1.00 . A A . 32 TYR HD2 1 1 12 5745 1 1 32 TYR HE1 H 2.426 4.096 -1.125 1.00 . A A . 32 TYR HE1 1 1 12 5746 1 1 32 TYR HE2 H 3.570 8.237 -1.056 1.00 . A A . 32 TYR HE2 1 1 12 5747 1 1 32 TYR HH H 1.910 5.661 -2.746 1.00 . A A . 32 TYR HH 1 1 12 5748 1 1 32 TYR N N 3.591 5.094 5.178 1.00 . A A . 32 TYR N 1 1 12 5749 1 1 32 TYR O O 5.126 2.951 3.199 1.00 . A A . 32 TYR O 1 1 12 5750 1 1 32 TYR OH O 2.643 6.259 -2.566 1.00 . A A . 32 TYR OH 1 1 12 5751 1 1 33 SER C C 2.603 1.204 1.207 1.00 . A A . 33 SER C 1 1 12 5752 1 1 33 SER CA C 3.024 1.028 2.678 1.00 . A A . 33 SER CA 1 1 12 5753 1 1 33 SER CB C 2.081 -0.007 3.314 1.00 . A A . 33 SER CB 1 1 12 5754 1 1 33 SER H H 2.066 2.644 3.706 1.00 . A A . 33 SER H 1 1 12 5755 1 1 33 SER HA H 4.041 0.634 2.682 1.00 . A A . 33 SER HA 1 1 12 5756 1 1 33 SER HB2 H 2.391 -0.224 4.341 1.00 . A A . 33 SER HB2 1 1 12 5757 1 1 33 SER HB3 H 1.060 0.384 3.345 1.00 . A A . 33 SER HB3 1 1 12 5758 1 1 33 SER HG H 1.639 -1.097 1.711 1.00 . A A . 33 SER HG 1 1 12 5759 1 1 33 SER N N 2.975 2.305 3.428 1.00 . A A . 33 SER N 1 1 12 5760 1 1 33 SER O O 1.612 1.881 0.945 1.00 . A A . 33 SER O 1 1 12 5761 1 1 33 SER OG O 2.103 -1.208 2.550 1.00 . A A . 33 SER OG 1 1 12 5762 1 1 34 GLN C C 2.767 -0.362 -2.043 1.00 . A A . 34 GLN C 1 1 12 5763 1 1 34 GLN CA C 3.137 0.880 -1.187 1.00 . A A . 34 GLN CA 1 1 12 5764 1 1 34 GLN CB C 4.369 1.683 -1.659 1.00 . A A . 34 GLN CB 1 1 12 5765 1 1 34 GLN CD C 5.360 3.268 -3.391 1.00 . A A . 34 GLN CD 1 1 12 5766 1 1 34 GLN CG C 4.200 2.344 -3.045 1.00 . A A . 34 GLN CG 1 1 12 5767 1 1 34 GLN H H 4.052 -0.020 0.532 1.00 . A A . 34 GLN H 1 1 12 5768 1 1 34 GLN HA H 2.279 1.544 -1.337 1.00 . A A . 34 GLN HA 1 1 12 5769 1 1 34 GLN HB2 H 4.535 2.487 -0.939 1.00 . A A . 34 GLN HB2 1 1 12 5770 1 1 34 GLN HB3 H 5.256 1.045 -1.642 1.00 . A A . 34 GLN HB3 1 1 12 5771 1 1 34 GLN HE21 H 4.261 4.993 -3.233 1.00 . A A . 34 GLN HE21 1 1 12 5772 1 1 34 GLN HE22 H 5.959 5.112 -3.692 1.00 . A A . 34 GLN HE22 1 1 12 5773 1 1 34 GLN HG2 H 4.179 1.594 -3.832 1.00 . A A . 34 GLN HG2 1 1 12 5774 1 1 34 GLN HG3 H 3.268 2.904 -3.087 1.00 . A A . 34 GLN HG3 1 1 12 5775 1 1 34 GLN N N 3.309 0.595 0.248 1.00 . A A . 34 GLN N 1 1 12 5776 1 1 34 GLN NE2 N 5.156 4.571 -3.425 1.00 . A A . 34 GLN NE2 1 1 12 5777 1 1 34 GLN O O 1.688 -0.915 -1.871 1.00 . A A . 34 GLN O 1 1 12 5778 1 1 34 GLN OE1 O 6.464 2.822 -3.646 1.00 . A A . 34 GLN OE1 1 1 12 5779 1 1 35 CYS C C 4.358 -1.946 -5.054 1.00 . A A . 35 CYS C 1 1 12 5780 1 1 35 CYS CA C 3.146 -1.469 -4.224 1.00 . A A . 35 CYS CA 1 1 12 5781 1 1 35 CYS CB C 2.243 -0.516 -5.030 1.00 . A A . 35 CYS CB 1 1 12 5782 1 1 35 CYS H H 4.496 -0.304 -3.066 1.00 . A A . 35 CYS H 1 1 12 5783 1 1 35 CYS HA H 2.575 -2.352 -3.928 1.00 . A A . 35 CYS HA 1 1 12 5784 1 1 35 CYS HB2 H 1.440 -0.148 -4.396 1.00 . A A . 35 CYS HB2 1 1 12 5785 1 1 35 CYS HB3 H 2.828 0.345 -5.346 1.00 . A A . 35 CYS HB3 1 1 12 5786 1 1 35 CYS N N 3.581 -0.730 -3.032 1.00 . A A . 35 CYS N 1 1 12 5787 1 1 35 CYS O O 4.738 -1.276 -6.014 1.00 . A A . 35 CYS O 1 1 12 5788 1 1 35 CYS SG S 1.445 -1.163 -6.518 1.00 . A A . 35 CYS SG 1 1 12 5789 1 1 36 LEU C C 6.085 -4.888 -5.866 1.00 . A A . 36 LEU C 1 1 12 5790 1 1 36 LEU CA C 6.269 -3.532 -5.137 1.00 . A A . 36 LEU CA 1 1 12 5791 1 1 36 LEU CB C 7.288 -3.650 -3.981 1.00 . A A . 36 LEU CB 1 1 12 5792 1 1 36 LEU CD1 C 7.619 -1.087 -3.893 1.00 . A A . 36 LEU CD1 1 1 12 5793 1 1 36 LEU CD2 C 6.530 -2.268 -1.932 1.00 . A A . 36 LEU CD2 1 1 12 5794 1 1 36 LEU CG C 7.527 -2.399 -3.098 1.00 . A A . 36 LEU CG 1 1 12 5795 1 1 36 LEU H H 4.603 -3.549 -3.836 1.00 . A A . 36 LEU H 1 1 12 5796 1 1 36 LEU HA H 6.684 -2.831 -5.868 1.00 . A A . 36 LEU HA 1 1 12 5797 1 1 36 LEU HB2 H 6.997 -4.475 -3.329 1.00 . A A . 36 LEU HB2 1 1 12 5798 1 1 36 LEU HB3 H 8.240 -3.927 -4.438 1.00 . A A . 36 LEU HB3 1 1 12 5799 1 1 36 LEU HD11 H 8.296 -1.212 -4.740 1.00 . A A . 36 LEU HD11 1 1 12 5800 1 1 36 LEU HD12 H 6.643 -0.781 -4.260 1.00 . A A . 36 LEU HD12 1 1 12 5801 1 1 36 LEU HD13 H 8.004 -0.294 -3.252 1.00 . A A . 36 LEU HD13 1 1 12 5802 1 1 36 LEU HD21 H 5.498 -2.281 -2.265 1.00 . A A . 36 LEU HD21 1 1 12 5803 1 1 36 LEU HD22 H 6.667 -3.102 -1.243 1.00 . A A . 36 LEU HD22 1 1 12 5804 1 1 36 LEU HD23 H 6.707 -1.338 -1.395 1.00 . A A . 36 LEU HD23 1 1 12 5805 1 1 36 LEU HG H 8.504 -2.543 -2.631 1.00 . A A . 36 LEU HG 1 1 12 5806 1 1 36 LEU N N 4.997 -3.028 -4.610 1.00 . A A . 36 LEU N 1 1 12 5807 1 1 36 LEU O O 6.423 -4.964 -7.068 1.00 . A A . 36 LEU O 1 1 12 5808 1 1 36 LEU OXT O 5.598 -5.835 -5.204 1.00 . A A . 36 LEU OXT 1 1 13 5809 1 1 1 THR C C -5.993 -5.274 -8.033 1.00 . A A . 1 THR C 1 1 13 5810 1 1 1 THR CA C -6.271 -6.572 -8.829 1.00 . A A . 1 THR CA 1 1 13 5811 1 1 1 THR CB C -6.269 -6.397 -10.368 1.00 . A A . 1 THR CB 1 1 13 5812 1 1 1 THR CG2 C -4.882 -6.074 -10.925 1.00 . A A . 1 THR CG2 1 1 13 5813 1 1 1 THR H1 H -8.286 -6.718 -8.123 1.00 . A A . 1 THR H1 1 1 13 5814 1 1 1 THR H2 H -7.760 -7.889 -9.183 1.00 . A A . 1 THR H2 1 1 13 5815 1 1 1 THR H3 H -7.293 -7.914 -7.606 1.00 . A A . 1 THR H3 1 1 13 5816 1 1 1 THR HA H -5.437 -7.247 -8.613 1.00 . A A . 1 THR HA 1 1 13 5817 1 1 1 THR HB H -6.995 -5.645 -10.680 1.00 . A A . 1 THR HB 1 1 13 5818 1 1 1 THR HG1 H -6.392 -7.645 -11.873 1.00 . A A . 1 THR HG1 1 1 13 5819 1 1 1 THR HG21 H -4.188 -6.874 -10.655 1.00 . A A . 1 THR HG21 1 1 13 5820 1 1 1 THR HG22 H -4.921 -5.993 -12.016 1.00 . A A . 1 THR HG22 1 1 13 5821 1 1 1 THR HG23 H -4.521 -5.129 -10.512 1.00 . A A . 1 THR HG23 1 1 13 5822 1 1 1 THR N N -7.500 -7.302 -8.401 1.00 . A A . 1 THR N 1 1 13 5823 1 1 1 THR O O -5.422 -5.347 -6.954 1.00 . A A . 1 THR O 1 1 13 5824 1 1 1 THR OG1 O -6.665 -7.630 -10.947 1.00 . A A . 1 THR OG1 1 1 13 5825 1 1 2 GLN C C -7.652 -3.253 -6.396 1.00 . A A . 2 GLN C 1 1 13 5826 1 1 2 GLN CA C -6.710 -2.934 -7.595 1.00 . A A . 2 GLN CA 1 1 13 5827 1 1 2 GLN CB C -7.229 -1.760 -8.454 1.00 . A A . 2 GLN CB 1 1 13 5828 1 1 2 GLN CD C -5.668 -2.095 -10.528 1.00 . A A . 2 GLN CD 1 1 13 5829 1 1 2 GLN CG C -6.185 -1.160 -9.428 1.00 . A A . 2 GLN CG 1 1 13 5830 1 1 2 GLN H H -6.838 -4.035 -9.416 1.00 . A A . 2 GLN H 1 1 13 5831 1 1 2 GLN HA H -5.750 -2.628 -7.171 1.00 . A A . 2 GLN HA 1 1 13 5832 1 1 2 GLN HB2 H -8.123 -2.054 -9.009 1.00 . A A . 2 GLN HB2 1 1 13 5833 1 1 2 GLN HB3 H -7.507 -0.944 -7.779 1.00 . A A . 2 GLN HB3 1 1 13 5834 1 1 2 GLN HE21 H -3.918 -1.095 -10.673 1.00 . A A . 2 GLN HE21 1 1 13 5835 1 1 2 GLN HE22 H -4.152 -2.465 -11.768 1.00 . A A . 2 GLN HE22 1 1 13 5836 1 1 2 GLN HG2 H -6.629 -0.301 -9.938 1.00 . A A . 2 GLN HG2 1 1 13 5837 1 1 2 GLN HG3 H -5.333 -0.794 -8.852 1.00 . A A . 2 GLN HG3 1 1 13 5838 1 1 2 GLN N N -6.505 -4.113 -8.463 1.00 . A A . 2 GLN N 1 1 13 5839 1 1 2 GLN NE2 N -4.470 -1.864 -11.026 1.00 . A A . 2 GLN NE2 1 1 13 5840 1 1 2 GLN O O -7.470 -2.770 -5.290 1.00 . A A . 2 GLN O 1 1 13 5841 1 1 2 GLN OE1 O -6.320 -3.050 -10.933 1.00 . A A . 2 GLN OE1 1 1 13 5842 1 1 3 SER C C -8.588 -5.945 -4.743 1.00 . A A . 3 SER C 1 1 13 5843 1 1 3 SER CA C -9.379 -4.925 -5.612 1.00 . A A . 3 SER CA 1 1 13 5844 1 1 3 SER CB C -10.497 -5.661 -6.370 1.00 . A A . 3 SER CB 1 1 13 5845 1 1 3 SER H H -8.767 -4.417 -7.578 1.00 . A A . 3 SER H 1 1 13 5846 1 1 3 SER HA H -9.844 -4.226 -4.912 1.00 . A A . 3 SER HA 1 1 13 5847 1 1 3 SER HB2 H -11.081 -6.267 -5.667 1.00 . A A . 3 SER HB2 1 1 13 5848 1 1 3 SER HB3 H -11.172 -4.919 -6.805 1.00 . A A . 3 SER HB3 1 1 13 5849 1 1 3 SER HG H -10.668 -7.007 -7.777 1.00 . A A . 3 SER HG 1 1 13 5850 1 1 3 SER N N -8.609 -4.168 -6.618 1.00 . A A . 3 SER N 1 1 13 5851 1 1 3 SER O O -9.193 -6.736 -4.028 1.00 . A A . 3 SER O 1 1 13 5852 1 1 3 SER OG O -9.946 -6.478 -7.411 1.00 . A A . 3 SER OG 1 1 13 5853 1 1 4 HIS C C -5.284 -5.731 -3.307 1.00 . A A . 4 HIS C 1 1 13 5854 1 1 4 HIS CA C -6.342 -6.688 -3.912 1.00 . A A . 4 HIS CA 1 1 13 5855 1 1 4 HIS CB C -5.641 -7.818 -4.694 1.00 . A A . 4 HIS CB 1 1 13 5856 1 1 4 HIS CD2 C -6.687 -10.182 -4.442 1.00 . A A . 4 HIS CD2 1 1 13 5857 1 1 4 HIS CE1 C -7.744 -10.248 -6.347 1.00 . A A . 4 HIS CE1 1 1 13 5858 1 1 4 HIS CG C -6.505 -8.989 -5.087 1.00 . A A . 4 HIS CG 1 1 13 5859 1 1 4 HIS H H -6.797 -5.247 -5.367 1.00 . A A . 4 HIS H 1 1 13 5860 1 1 4 HIS HA H -6.887 -7.128 -3.076 1.00 . A A . 4 HIS HA 1 1 13 5861 1 1 4 HIS HB2 H -5.193 -7.397 -5.592 1.00 . A A . 4 HIS HB2 1 1 13 5862 1 1 4 HIS HB3 H -4.830 -8.225 -4.087 1.00 . A A . 4 HIS HB3 1 1 13 5863 1 1 4 HIS HD2 H -6.251 -10.465 -3.495 1.00 . A A . 4 HIS HD2 1 1 13 5864 1 1 4 HIS HE1 H -8.340 -10.609 -7.174 1.00 . A A . 4 HIS HE1 1 1 13 5865 1 1 4 HIS HE2 H -7.733 -11.937 -5.087 1.00 . A A . 4 HIS HE2 1 1 13 5866 1 1 4 HIS N N -7.251 -5.951 -4.804 1.00 . A A . 4 HIS N 1 1 13 5867 1 1 4 HIS ND1 N -7.177 -9.036 -6.311 1.00 . A A . 4 HIS ND1 1 1 13 5868 1 1 4 HIS NE2 N -7.457 -10.982 -5.263 1.00 . A A . 4 HIS NE2 1 1 13 5869 1 1 4 HIS O O -5.155 -4.578 -3.719 1.00 . A A . 4 HIS O 1 1 13 5870 1 1 5 ALA C C -2.251 -5.173 -2.906 1.00 . A A . 5 ALA C 1 1 13 5871 1 1 5 ALA CA C -3.325 -5.484 -1.831 1.00 . A A . 5 ALA CA 1 1 13 5872 1 1 5 ALA CB C -2.754 -6.274 -0.644 1.00 . A A . 5 ALA CB 1 1 13 5873 1 1 5 ALA H H -4.605 -7.169 -2.054 1.00 . A A . 5 ALA H 1 1 13 5874 1 1 5 ALA HA H -3.666 -4.528 -1.423 1.00 . A A . 5 ALA HA 1 1 13 5875 1 1 5 ALA HB1 H -3.525 -6.409 0.117 1.00 . A A . 5 ALA HB1 1 1 13 5876 1 1 5 ALA HB2 H -2.406 -7.254 -0.977 1.00 . A A . 5 ALA HB2 1 1 13 5877 1 1 5 ALA HB3 H -1.917 -5.730 -0.199 1.00 . A A . 5 ALA HB3 1 1 13 5878 1 1 5 ALA N N -4.476 -6.218 -2.362 1.00 . A A . 5 ALA N 1 1 13 5879 1 1 5 ALA O O -1.311 -5.936 -3.113 1.00 . A A . 5 ALA O 1 1 13 5880 1 1 6 GLY C C -0.576 -2.547 -2.829 1.00 . A A . 6 GLY C 1 1 13 5881 1 1 6 GLY CA C -1.191 -3.278 -4.029 1.00 . A A . 6 GLY CA 1 1 13 5882 1 1 6 GLY H H -3.263 -3.555 -3.508 1.00 . A A . 6 GLY H 1 1 13 5883 1 1 6 GLY HA2 H -0.422 -3.945 -4.421 1.00 . A A . 6 GLY HA2 1 1 13 5884 1 1 6 GLY HA3 H -1.484 -2.566 -4.801 1.00 . A A . 6 GLY HA3 1 1 13 5885 1 1 6 GLY N N -2.372 -4.032 -3.586 1.00 . A A . 6 GLY N 1 1 13 5886 1 1 6 GLY O O -0.045 -3.197 -1.933 1.00 . A A . 6 GLY O 1 1 13 5887 1 1 7 GLN C C -1.650 -1.269 -0.361 1.00 . A A . 7 GLN C 1 1 13 5888 1 1 7 GLN CA C -0.806 -0.527 -1.435 1.00 . A A . 7 GLN CA 1 1 13 5889 1 1 7 GLN CB C -1.287 0.912 -1.704 1.00 . A A . 7 GLN CB 1 1 13 5890 1 1 7 GLN CD C -1.125 3.217 -0.543 1.00 . A A . 7 GLN CD 1 1 13 5891 1 1 7 GLN CG C -1.516 1.742 -0.420 1.00 . A A . 7 GLN CG 1 1 13 5892 1 1 7 GLN H H -1.166 -0.749 -3.537 1.00 . A A . 7 GLN H 1 1 13 5893 1 1 7 GLN HA H 0.209 -0.455 -1.059 1.00 . A A . 7 GLN HA 1 1 13 5894 1 1 7 GLN HB2 H -0.524 1.380 -2.332 1.00 . A A . 7 GLN HB2 1 1 13 5895 1 1 7 GLN HB3 H -2.222 0.896 -2.268 1.00 . A A . 7 GLN HB3 1 1 13 5896 1 1 7 GLN HE21 H -2.356 3.786 0.975 1.00 . A A . 7 GLN HE21 1 1 13 5897 1 1 7 GLN HE22 H -1.389 5.034 0.176 1.00 . A A . 7 GLN HE22 1 1 13 5898 1 1 7 GLN HG2 H -2.564 1.660 -0.129 1.00 . A A . 7 GLN HG2 1 1 13 5899 1 1 7 GLN HG3 H -0.945 1.339 0.406 1.00 . A A . 7 GLN HG3 1 1 13 5900 1 1 7 GLN N N -0.792 -1.232 -2.727 1.00 . A A . 7 GLN N 1 1 13 5901 1 1 7 GLN NE2 N -1.666 4.075 0.301 1.00 . A A . 7 GLN NE2 1 1 13 5902 1 1 7 GLN O O -2.872 -1.298 -0.451 1.00 . A A . 7 GLN O 1 1 13 5903 1 1 7 GLN OE1 O -0.339 3.628 -1.389 1.00 . A A . 7 GLN OE1 1 1 13 5904 1 1 8 CYS C C -2.681 -1.624 2.558 1.00 . A A . 8 CYS C 1 1 13 5905 1 1 8 CYS CA C -1.793 -2.584 1.719 1.00 . A A . 8 CYS CA 1 1 13 5906 1 1 8 CYS CB C -0.830 -3.390 2.608 1.00 . A A . 8 CYS CB 1 1 13 5907 1 1 8 CYS H H -0.026 -1.950 0.619 1.00 . A A . 8 CYS H 1 1 13 5908 1 1 8 CYS HA H -2.463 -3.310 1.254 1.00 . A A . 8 CYS HA 1 1 13 5909 1 1 8 CYS HB2 H -1.400 -3.886 3.394 1.00 . A A . 8 CYS HB2 1 1 13 5910 1 1 8 CYS HB3 H -0.330 -4.157 2.016 1.00 . A A . 8 CYS HB3 1 1 13 5911 1 1 8 CYS N N -1.038 -1.899 0.648 1.00 . A A . 8 CYS N 1 1 13 5912 1 1 8 CYS O O -3.863 -1.878 2.776 1.00 . A A . 8 CYS O 1 1 13 5913 1 1 8 CYS SG S 0.461 -2.409 3.405 1.00 . A A . 8 CYS SG 1 1 13 5914 1 1 9 GLY C C -1.739 0.533 5.279 1.00 . A A . 9 GLY C 1 1 13 5915 1 1 9 GLY CA C -2.638 0.398 4.031 1.00 . A A . 9 GLY CA 1 1 13 5916 1 1 9 GLY H H -1.124 -0.399 2.762 1.00 . A A . 9 GLY H 1 1 13 5917 1 1 9 GLY HA2 H -2.730 1.360 3.531 1.00 . A A . 9 GLY HA2 1 1 13 5918 1 1 9 GLY HA3 H -3.623 0.080 4.371 1.00 . A A . 9 GLY HA3 1 1 13 5919 1 1 9 GLY N N -2.084 -0.527 3.039 1.00 . A A . 9 GLY N 1 1 13 5920 1 1 9 GLY O O -1.486 -0.449 5.971 1.00 . A A . 9 GLY O 1 1 13 5921 1 1 10 GLY C C -0.865 2.671 7.870 1.00 . A A . 10 GLY C 1 1 13 5922 1 1 10 GLY CA C -0.244 2.008 6.626 1.00 . A A . 10 GLY CA 1 1 13 5923 1 1 10 GLY H H -1.543 2.505 4.976 1.00 . A A . 10 GLY H 1 1 13 5924 1 1 10 GLY HA2 H 0.247 1.085 6.944 1.00 . A A . 10 GLY HA2 1 1 13 5925 1 1 10 GLY HA3 H 0.541 2.657 6.233 1.00 . A A . 10 GLY HA3 1 1 13 5926 1 1 10 GLY N N -1.213 1.739 5.542 1.00 . A A . 10 GLY N 1 1 13 5927 1 1 10 GLY O O -1.251 2.001 8.821 1.00 . A A . 10 GLY O 1 1 13 5928 1 1 11 ILE C C -2.714 5.717 8.245 1.00 . A A . 11 ILE C 1 1 13 5929 1 1 11 ILE CA C -1.634 4.818 8.894 1.00 . A A . 11 ILE CA 1 1 13 5930 1 1 11 ILE CB C -0.577 5.636 9.680 1.00 . A A . 11 ILE CB 1 1 13 5931 1 1 11 ILE CD1 C 1.582 5.400 11.102 1.00 . A A . 11 ILE CD1 1 1 13 5932 1 1 11 ILE CG1 C 0.437 4.689 10.369 1.00 . A A . 11 ILE CG1 1 1 13 5933 1 1 11 ILE CG2 C -1.258 6.550 10.717 1.00 . A A . 11 ILE CG2 1 1 13 5934 1 1 11 ILE H H -0.618 4.496 7.052 1.00 . A A . 11 ILE H 1 1 13 5935 1 1 11 ILE HA H -2.140 4.169 9.613 1.00 . A A . 11 ILE HA 1 1 13 5936 1 1 11 ILE HB H -0.037 6.270 8.974 1.00 . A A . 11 ILE HB 1 1 13 5937 1 1 11 ILE HD11 H 2.104 6.067 10.417 1.00 . A A . 11 ILE HD11 1 1 13 5938 1 1 11 ILE HD12 H 1.213 5.965 11.957 1.00 . A A . 11 ILE HD12 1 1 13 5939 1 1 11 ILE HD13 H 2.291 4.655 11.467 1.00 . A A . 11 ILE HD13 1 1 13 5940 1 1 11 ILE HG12 H -0.086 4.045 11.079 1.00 . A A . 11 ILE HG12 1 1 13 5941 1 1 11 ILE HG13 H 0.908 4.053 9.617 1.00 . A A . 11 ILE HG13 1 1 13 5942 1 1 11 ILE HG21 H -1.944 7.242 10.233 1.00 . A A . 11 ILE HG21 1 1 13 5943 1 1 11 ILE HG22 H -1.810 5.947 11.438 1.00 . A A . 11 ILE HG22 1 1 13 5944 1 1 11 ILE HG23 H -0.522 7.152 11.247 1.00 . A A . 11 ILE HG23 1 1 13 5945 1 1 11 ILE N N -0.975 4.004 7.857 1.00 . A A . 11 ILE N 1 1 13 5946 1 1 11 ILE O O -2.464 6.352 7.221 1.00 . A A . 11 ILE O 1 1 13 5947 1 1 12 GLY C C -5.689 5.866 6.962 1.00 . A A . 12 GLY C 1 1 13 5948 1 1 12 GLY CA C -5.066 6.505 8.224 1.00 . A A . 12 GLY CA 1 1 13 5949 1 1 12 GLY H H -4.105 5.172 9.601 1.00 . A A . 12 GLY H 1 1 13 5950 1 1 12 GLY HA2 H -5.838 6.588 8.989 1.00 . A A . 12 GLY HA2 1 1 13 5951 1 1 12 GLY HA3 H -4.744 7.517 7.973 1.00 . A A . 12 GLY HA3 1 1 13 5952 1 1 12 GLY N N -3.937 5.746 8.789 1.00 . A A . 12 GLY N 1 1 13 5953 1 1 12 GLY O O -6.882 5.575 6.920 1.00 . A A . 12 GLY O 1 1 13 5954 1 1 13 TYR C C -5.358 3.374 4.914 1.00 . A A . 13 TYR C 1 1 13 5955 1 1 13 TYR CA C -5.275 4.910 4.705 1.00 . A A . 13 TYR CA 1 1 13 5956 1 1 13 TYR CB C -4.319 5.306 3.550 1.00 . A A . 13 TYR CB 1 1 13 5957 1 1 13 TYR CD1 C -5.820 4.506 1.636 1.00 . A A . 13 TYR CD1 1 1 13 5958 1 1 13 TYR CD2 C -4.779 6.715 1.486 1.00 . A A . 13 TYR CD2 1 1 13 5959 1 1 13 TYR CE1 C -6.484 4.743 0.413 1.00 . A A . 13 TYR CE1 1 1 13 5960 1 1 13 TYR CE2 C -5.419 6.931 0.249 1.00 . A A . 13 TYR CE2 1 1 13 5961 1 1 13 TYR CG C -4.980 5.503 2.190 1.00 . A A . 13 TYR CG 1 1 13 5962 1 1 13 TYR CZ C -6.280 5.954 -0.276 1.00 . A A . 13 TYR CZ 1 1 13 5963 1 1 13 TYR H H -3.912 5.912 6.038 1.00 . A A . 13 TYR H 1 1 13 5964 1 1 13 TYR HA H -6.272 5.263 4.428 1.00 . A A . 13 TYR HA 1 1 13 5965 1 1 13 TYR HB2 H -3.811 6.236 3.813 1.00 . A A . 13 TYR HB2 1 1 13 5966 1 1 13 TYR HB3 H -3.526 4.568 3.429 1.00 . A A . 13 TYR HB3 1 1 13 5967 1 1 13 TYR HD1 H -5.964 3.562 2.147 1.00 . A A . 13 TYR HD1 1 1 13 5968 1 1 13 TYR HD2 H -4.139 7.484 1.895 1.00 . A A . 13 TYR HD2 1 1 13 5969 1 1 13 TYR HE1 H -7.127 3.982 -0.003 1.00 . A A . 13 TYR HE1 1 1 13 5970 1 1 13 TYR HE2 H -5.256 7.847 -0.295 1.00 . A A . 13 TYR HE2 1 1 13 5971 1 1 13 TYR HH H -7.546 5.498 -1.646 1.00 . A A . 13 TYR HH 1 1 13 5972 1 1 13 TYR N N -4.876 5.617 5.932 1.00 . A A . 13 TYR N 1 1 13 5973 1 1 13 TYR O O -4.372 2.660 4.736 1.00 . A A . 13 TYR O 1 1 13 5974 1 1 13 TYR OH O -6.890 6.175 -1.469 1.00 . A A . 13 TYR OH 1 1 13 5975 1 1 14 SER C C -7.289 0.703 4.220 1.00 . A A . 14 SER C 1 1 13 5976 1 1 14 SER CA C -6.781 1.413 5.501 1.00 . A A . 14 SER CA 1 1 13 5977 1 1 14 SER CB C -7.768 1.234 6.671 1.00 . A A . 14 SER CB 1 1 13 5978 1 1 14 SER H H -7.261 3.508 5.533 1.00 . A A . 14 SER H 1 1 13 5979 1 1 14 SER HA H -5.856 0.909 5.795 1.00 . A A . 14 SER HA 1 1 13 5980 1 1 14 SER HB2 H -8.692 1.780 6.464 1.00 . A A . 14 SER HB2 1 1 13 5981 1 1 14 SER HB3 H -8.026 0.177 6.781 1.00 . A A . 14 SER HB3 1 1 13 5982 1 1 14 SER HG H -6.376 1.240 8.060 1.00 . A A . 14 SER HG 1 1 13 5983 1 1 14 SER N N -6.528 2.853 5.293 1.00 . A A . 14 SER N 1 1 13 5984 1 1 14 SER O O -8.482 0.438 4.089 1.00 . A A . 14 SER O 1 1 13 5985 1 1 14 SER OG O -7.200 1.704 7.883 1.00 . A A . 14 SER OG 1 1 13 5986 1 1 15 GLY C C -5.917 0.100 0.785 1.00 . A A . 15 GLY C 1 1 13 5987 1 1 15 GLY CA C -6.687 -0.362 2.045 1.00 . A A . 15 GLY CA 1 1 13 5988 1 1 15 GLY H H -5.430 0.651 3.449 1.00 . A A . 15 GLY H 1 1 13 5989 1 1 15 GLY HA2 H -6.456 -1.416 2.224 1.00 . A A . 15 GLY HA2 1 1 13 5990 1 1 15 GLY HA3 H -7.753 -0.285 1.820 1.00 . A A . 15 GLY HA3 1 1 13 5991 1 1 15 GLY N N -6.389 0.385 3.282 1.00 . A A . 15 GLY N 1 1 13 5992 1 1 15 GLY O O -5.092 1.020 0.851 1.00 . A A . 15 GLY O 1 1 13 5993 1 1 16 PRO C C -6.021 1.085 -2.316 1.00 . A A . 16 PRO C 1 1 13 5994 1 1 16 PRO CA C -5.562 -0.225 -1.654 1.00 . A A . 16 PRO CA 1 1 13 5995 1 1 16 PRO CB C -5.810 -1.463 -2.527 1.00 . A A . 16 PRO CB 1 1 13 5996 1 1 16 PRO CD C -7.094 -1.676 -0.520 1.00 . A A . 16 PRO CD 1 1 13 5997 1 1 16 PRO CG C -7.172 -1.947 -2.025 1.00 . A A . 16 PRO CG 1 1 13 5998 1 1 16 PRO HA H -4.494 -0.098 -1.513 1.00 . A A . 16 PRO HA 1 1 13 5999 1 1 16 PRO HB2 H -5.810 -1.259 -3.602 1.00 . A A . 16 PRO HB2 1 1 13 6000 1 1 16 PRO HB3 H -5.052 -2.215 -2.300 1.00 . A A . 16 PRO HB3 1 1 13 6001 1 1 16 PRO HD2 H -8.093 -1.491 -0.121 1.00 . A A . 16 PRO HD2 1 1 13 6002 1 1 16 PRO HD3 H -6.644 -2.539 -0.023 1.00 . A A . 16 PRO HD3 1 1 13 6003 1 1 16 PRO HG2 H -7.955 -1.332 -2.478 1.00 . A A . 16 PRO HG2 1 1 13 6004 1 1 16 PRO HG3 H -7.349 -3.000 -2.253 1.00 . A A . 16 PRO HG3 1 1 13 6005 1 1 16 PRO N N -6.204 -0.527 -0.376 1.00 . A A . 16 PRO N 1 1 13 6006 1 1 16 PRO O O -6.999 1.717 -1.922 1.00 . A A . 16 PRO O 1 1 13 6007 1 1 17 THR C C -4.254 2.920 -5.125 1.00 . A A . 17 THR C 1 1 13 6008 1 1 17 THR CA C -5.314 2.807 -4.008 1.00 . A A . 17 THR CA 1 1 13 6009 1 1 17 THR CB C -5.224 3.975 -2.999 1.00 . A A . 17 THR CB 1 1 13 6010 1 1 17 THR CG2 C -4.022 3.937 -2.043 1.00 . A A . 17 THR CG2 1 1 13 6011 1 1 17 THR H H -4.492 0.878 -3.575 1.00 . A A . 17 THR H 1 1 13 6012 1 1 17 THR HA H -6.290 2.879 -4.494 1.00 . A A . 17 THR HA 1 1 13 6013 1 1 17 THR HB H -6.132 3.937 -2.398 1.00 . A A . 17 THR HB 1 1 13 6014 1 1 17 THR HG1 H -5.451 5.904 -3.044 1.00 . A A . 17 THR HG1 1 1 13 6015 1 1 17 THR HG21 H -3.933 2.955 -1.584 1.00 . A A . 17 THR HG21 1 1 13 6016 1 1 17 THR HG22 H -3.098 4.191 -2.554 1.00 . A A . 17 THR HG22 1 1 13 6017 1 1 17 THR HG23 H -4.156 4.666 -1.249 1.00 . A A . 17 THR HG23 1 1 13 6018 1 1 17 THR N N -5.240 1.504 -3.319 1.00 . A A . 17 THR N 1 1 13 6019 1 1 17 THR O O -4.579 3.005 -6.308 1.00 . A A . 17 THR O 1 1 13 6020 1 1 17 THR OG1 O -5.203 5.215 -3.671 1.00 . A A . 17 THR OG1 1 1 13 6021 1 1 18 VAL C C -1.379 1.311 -5.985 1.00 . A A . 18 VAL C 1 1 13 6022 1 1 18 VAL CA C -1.816 2.768 -5.668 1.00 . A A . 18 VAL CA 1 1 13 6023 1 1 18 VAL CB C -0.661 3.600 -5.062 1.00 . A A . 18 VAL CB 1 1 13 6024 1 1 18 VAL CG1 C 0.612 3.554 -5.924 1.00 . A A . 18 VAL CG1 1 1 13 6025 1 1 18 VAL CG2 C -1.063 5.075 -4.886 1.00 . A A . 18 VAL CG2 1 1 13 6026 1 1 18 VAL H H -2.789 2.714 -3.775 1.00 . A A . 18 VAL H 1 1 13 6027 1 1 18 VAL HA H -2.089 3.247 -6.612 1.00 . A A . 18 VAL HA 1 1 13 6028 1 1 18 VAL HB H -0.413 3.195 -4.079 1.00 . A A . 18 VAL HB 1 1 13 6029 1 1 18 VAL HG11 H 0.392 3.883 -6.940 1.00 . A A . 18 VAL HG11 1 1 13 6030 1 1 18 VAL HG12 H 1.371 4.215 -5.501 1.00 . A A . 18 VAL HG12 1 1 13 6031 1 1 18 VAL HG13 H 1.025 2.546 -5.953 1.00 . A A . 18 VAL HG13 1 1 13 6032 1 1 18 VAL HG21 H -1.920 5.171 -4.223 1.00 . A A . 18 VAL HG21 1 1 13 6033 1 1 18 VAL HG22 H -0.237 5.641 -4.453 1.00 . A A . 18 VAL HG22 1 1 13 6034 1 1 18 VAL HG23 H -1.321 5.514 -5.850 1.00 . A A . 18 VAL HG23 1 1 13 6035 1 1 18 VAL N N -2.971 2.814 -4.758 1.00 . A A . 18 VAL N 1 1 13 6036 1 1 18 VAL O O -1.426 0.435 -5.115 1.00 . A A . 18 VAL O 1 1 13 6037 1 1 19 CYS C C -1.366 -1.213 -8.261 1.00 . A A . 19 CYS C 1 1 13 6038 1 1 19 CYS CA C -0.329 -0.171 -7.745 1.00 . A A . 19 CYS CA 1 1 13 6039 1 1 19 CYS CB C 0.646 -0.762 -6.703 1.00 . A A . 19 CYS CB 1 1 13 6040 1 1 19 CYS H H -0.953 1.869 -7.853 1.00 . A A . 19 CYS H 1 1 13 6041 1 1 19 CYS HA H 0.268 0.129 -8.606 1.00 . A A . 19 CYS HA 1 1 13 6042 1 1 19 CYS HB2 H 1.129 0.040 -6.146 1.00 . A A . 19 CYS HB2 1 1 13 6043 1 1 19 CYS HB3 H 0.090 -1.369 -5.993 1.00 . A A . 19 CYS HB3 1 1 13 6044 1 1 19 CYS N N -0.917 1.082 -7.224 1.00 . A A . 19 CYS N 1 1 13 6045 1 1 19 CYS O O -2.577 -1.051 -8.125 1.00 . A A . 19 CYS O 1 1 13 6046 1 1 19 CYS SG S 2.028 -1.778 -7.282 1.00 . A A . 19 CYS SG 1 1 13 6047 1 1 20 ALA C C -1.381 -4.498 -7.797 1.00 . A A . 20 ALA C 1 1 13 6048 1 1 20 ALA CA C -1.611 -3.569 -9.023 1.00 . A A . 20 ALA CA 1 1 13 6049 1 1 20 ALA CB C -1.202 -4.196 -10.367 1.00 . A A . 20 ALA CB 1 1 13 6050 1 1 20 ALA H H 0.121 -2.348 -8.975 1.00 . A A . 20 ALA H 1 1 13 6051 1 1 20 ALA HA H -2.684 -3.377 -9.068 1.00 . A A . 20 ALA HA 1 1 13 6052 1 1 20 ALA HB1 H -1.406 -3.491 -11.176 1.00 . A A . 20 ALA HB1 1 1 13 6053 1 1 20 ALA HB2 H -0.136 -4.431 -10.368 1.00 . A A . 20 ALA HB2 1 1 13 6054 1 1 20 ALA HB3 H -1.765 -5.110 -10.558 1.00 . A A . 20 ALA HB3 1 1 13 6055 1 1 20 ALA N N -0.878 -2.302 -8.871 1.00 . A A . 20 ALA N 1 1 13 6056 1 1 20 ALA O O -0.826 -4.071 -6.794 1.00 . A A . 20 ALA O 1 1 13 6057 1 1 21 SER C C -0.162 -7.117 -6.446 1.00 . A A . 21 SER C 1 1 13 6058 1 1 21 SER CA C -1.634 -6.731 -6.739 1.00 . A A . 21 SER CA 1 1 13 6059 1 1 21 SER CB C -2.440 -8.001 -7.057 1.00 . A A . 21 SER CB 1 1 13 6060 1 1 21 SER H H -2.149 -6.135 -8.717 1.00 . A A . 21 SER H 1 1 13 6061 1 1 21 SER HA H -2.067 -6.297 -5.835 1.00 . A A . 21 SER HA 1 1 13 6062 1 1 21 SER HB2 H -2.257 -8.764 -6.294 1.00 . A A . 21 SER HB2 1 1 13 6063 1 1 21 SER HB3 H -3.502 -7.764 -7.051 1.00 . A A . 21 SER HB3 1 1 13 6064 1 1 21 SER HG H -1.123 -8.620 -8.358 1.00 . A A . 21 SER HG 1 1 13 6065 1 1 21 SER N N -1.803 -5.767 -7.848 1.00 . A A . 21 SER N 1 1 13 6066 1 1 21 SER O O 0.460 -7.771 -7.280 1.00 . A A . 21 SER O 1 1 13 6067 1 1 21 SER OG O -2.086 -8.498 -8.338 1.00 . A A . 21 SER OG 1 1 13 6068 1 1 22 GLY C C 1.738 -7.767 -3.372 1.00 . A A . 22 GLY C 1 1 13 6069 1 1 22 GLY CA C 1.702 -7.097 -4.765 1.00 . A A . 22 GLY CA 1 1 13 6070 1 1 22 GLY H H -0.254 -6.240 -4.639 1.00 . A A . 22 GLY H 1 1 13 6071 1 1 22 GLY HA2 H 2.226 -7.748 -5.466 1.00 . A A . 22 GLY HA2 1 1 13 6072 1 1 22 GLY HA3 H 2.268 -6.168 -4.698 1.00 . A A . 22 GLY HA3 1 1 13 6073 1 1 22 GLY N N 0.349 -6.771 -5.257 1.00 . A A . 22 GLY N 1 1 13 6074 1 1 22 GLY O O 2.372 -8.801 -3.180 1.00 . A A . 22 GLY O 1 1 13 6075 1 1 23 THR C C 2.156 -7.676 -0.142 1.00 . A A . 23 THR C 1 1 13 6076 1 1 23 THR CA C 0.876 -7.731 -1.014 1.00 . A A . 23 THR CA 1 1 13 6077 1 1 23 THR CB C 0.228 -9.142 -1.034 1.00 . A A . 23 THR CB 1 1 13 6078 1 1 23 THR CG2 C -0.475 -9.521 0.278 1.00 . A A . 23 THR CG2 1 1 13 6079 1 1 23 THR H H 0.471 -6.396 -2.639 1.00 . A A . 23 THR H 1 1 13 6080 1 1 23 THR HA H 0.171 -7.065 -0.516 1.00 . A A . 23 THR HA 1 1 13 6081 1 1 23 THR HB H 0.998 -9.884 -1.260 1.00 . A A . 23 THR HB 1 1 13 6082 1 1 23 THR HG1 H -0.731 -10.077 -2.441 1.00 . A A . 23 THR HG1 1 1 13 6083 1 1 23 THR HG21 H -1.233 -8.777 0.529 1.00 . A A . 23 THR HG21 1 1 13 6084 1 1 23 THR HG22 H -0.961 -10.491 0.165 1.00 . A A . 23 THR HG22 1 1 13 6085 1 1 23 THR HG23 H 0.227 -9.597 1.106 1.00 . A A . 23 THR HG23 1 1 13 6086 1 1 23 THR N N 1.047 -7.187 -2.383 1.00 . A A . 23 THR N 1 1 13 6087 1 1 23 THR O O 2.297 -8.412 0.832 1.00 . A A . 23 THR O 1 1 13 6088 1 1 23 THR OG1 O -0.797 -9.221 -2.012 1.00 . A A . 23 THR OG1 1 1 13 6089 1 1 24 THR C C 4.238 -5.237 1.131 1.00 . A A . 24 THR C 1 1 13 6090 1 1 24 THR CA C 4.339 -6.506 0.266 1.00 . A A . 24 THR CA 1 1 13 6091 1 1 24 THR CB C 5.516 -6.443 -0.731 1.00 . A A . 24 THR CB 1 1 13 6092 1 1 24 THR CG2 C 5.807 -7.833 -1.315 1.00 . A A . 24 THR CG2 1 1 13 6093 1 1 24 THR H H 2.926 -6.203 -1.280 1.00 . A A . 24 THR H 1 1 13 6094 1 1 24 THR HA H 4.562 -7.330 0.947 1.00 . A A . 24 THR HA 1 1 13 6095 1 1 24 THR HB H 6.417 -6.087 -0.219 1.00 . A A . 24 THR HB 1 1 13 6096 1 1 24 THR HG1 H 5.994 -5.671 -2.420 1.00 . A A . 24 THR HG1 1 1 13 6097 1 1 24 THR HG21 H 6.015 -8.552 -0.524 1.00 . A A . 24 THR HG21 1 1 13 6098 1 1 24 THR HG22 H 4.958 -8.181 -1.898 1.00 . A A . 24 THR HG22 1 1 13 6099 1 1 24 THR HG23 H 6.676 -7.784 -1.971 1.00 . A A . 24 THR HG23 1 1 13 6100 1 1 24 THR N N 3.076 -6.760 -0.452 1.00 . A A . 24 THR N 1 1 13 6101 1 1 24 THR O O 4.621 -4.141 0.729 1.00 . A A . 24 THR O 1 1 13 6102 1 1 24 THR OG1 O 5.232 -5.583 -1.818 1.00 . A A . 24 THR OG1 1 1 13 6103 1 1 25 CYS C C 4.568 -3.536 3.884 1.00 . A A . 25 CYS C 1 1 13 6104 1 1 25 CYS CA C 3.342 -4.270 3.257 1.00 . A A . 25 CYS CA 1 1 13 6105 1 1 25 CYS CB C 2.322 -4.796 4.292 1.00 . A A . 25 CYS CB 1 1 13 6106 1 1 25 CYS H H 3.369 -6.307 2.585 1.00 . A A . 25 CYS H 1 1 13 6107 1 1 25 CYS HA H 2.835 -3.529 2.640 1.00 . A A . 25 CYS HA 1 1 13 6108 1 1 25 CYS HB2 H 1.657 -5.521 3.821 1.00 . A A . 25 CYS HB2 1 1 13 6109 1 1 25 CYS HB3 H 2.851 -5.298 5.104 1.00 . A A . 25 CYS HB3 1 1 13 6110 1 1 25 CYS N N 3.684 -5.378 2.345 1.00 . A A . 25 CYS N 1 1 13 6111 1 1 25 CYS O O 4.794 -3.576 5.091 1.00 . A A . 25 CYS O 1 1 13 6112 1 1 25 CYS SG S 1.219 -3.573 5.045 1.00 . A A . 25 CYS SG 1 1 13 6113 1 1 26 GLN C C 6.361 -0.586 2.850 1.00 . A A . 26 GLN C 1 1 13 6114 1 1 26 GLN CA C 6.539 -2.051 3.328 1.00 . A A . 26 GLN CA 1 1 13 6115 1 1 26 GLN CB C 7.780 -2.763 2.732 1.00 . A A . 26 GLN CB 1 1 13 6116 1 1 26 GLN CD C 9.632 -1.388 3.907 1.00 . A A . 26 GLN CD 1 1 13 6117 1 1 26 GLN CG C 9.072 -1.916 2.586 1.00 . A A . 26 GLN CG 1 1 13 6118 1 1 26 GLN H H 5.071 -2.914 2.057 1.00 . A A . 26 GLN H 1 1 13 6119 1 1 26 GLN HA H 6.688 -2.019 4.409 1.00 . A A . 26 GLN HA 1 1 13 6120 1 1 26 GLN HB2 H 8.014 -3.633 3.353 1.00 . A A . 26 GLN HB2 1 1 13 6121 1 1 26 GLN HB3 H 7.534 -3.165 1.755 1.00 . A A . 26 GLN HB3 1 1 13 6122 1 1 26 GLN HE21 H 10.166 0.429 3.123 1.00 . A A . 26 GLN HE21 1 1 13 6123 1 1 26 GLN HE22 H 10.519 0.120 4.831 1.00 . A A . 26 GLN HE22 1 1 13 6124 1 1 26 GLN HG2 H 9.853 -2.536 2.146 1.00 . A A . 26 GLN HG2 1 1 13 6125 1 1 26 GLN HG3 H 8.902 -1.084 1.899 1.00 . A A . 26 GLN HG3 1 1 13 6126 1 1 26 GLN N N 5.352 -2.866 3.029 1.00 . A A . 26 GLN N 1 1 13 6127 1 1 26 GLN NE2 N 10.171 -0.182 3.934 1.00 . A A . 26 GLN NE2 1 1 13 6128 1 1 26 GLN O O 5.537 -0.266 1.993 1.00 . A A . 26 GLN O 1 1 13 6129 1 1 26 GLN OE1 O 9.532 -2.014 4.948 1.00 . A A . 26 GLN OE1 1 1 13 6130 1 1 27 VAL C C 8.028 2.587 2.608 1.00 . A A . 27 VAL C 1 1 13 6131 1 1 27 VAL CA C 6.950 1.798 3.399 1.00 . A A . 27 VAL CA 1 1 13 6132 1 1 27 VAL CB C 6.833 2.279 4.862 1.00 . A A . 27 VAL CB 1 1 13 6133 1 1 27 VAL CG1 C 7.992 1.804 5.761 1.00 . A A . 27 VAL CG1 1 1 13 6134 1 1 27 VAL CG2 C 6.736 3.809 4.984 1.00 . A A . 27 VAL CG2 1 1 13 6135 1 1 27 VAL H H 7.789 -0.007 4.111 1.00 . A A . 27 VAL H 1 1 13 6136 1 1 27 VAL HA H 6.003 2.029 2.914 1.00 . A A . 27 VAL HA 1 1 13 6137 1 1 27 VAL HB H 5.901 1.872 5.267 1.00 . A A . 27 VAL HB 1 1 13 6138 1 1 27 VAL HG11 H 8.947 2.069 5.309 1.00 . A A . 27 VAL HG11 1 1 13 6139 1 1 27 VAL HG12 H 7.920 2.273 6.741 1.00 . A A . 27 VAL HG12 1 1 13 6140 1 1 27 VAL HG13 H 7.948 0.725 5.906 1.00 . A A . 27 VAL HG13 1 1 13 6141 1 1 27 VAL HG21 H 6.049 4.212 4.237 1.00 . A A . 27 VAL HG21 1 1 13 6142 1 1 27 VAL HG22 H 6.362 4.060 5.978 1.00 . A A . 27 VAL HG22 1 1 13 6143 1 1 27 VAL HG23 H 7.719 4.261 4.850 1.00 . A A . 27 VAL HG23 1 1 13 6144 1 1 27 VAL N N 7.123 0.338 3.441 1.00 . A A . 27 VAL N 1 1 13 6145 1 1 27 VAL O O 9.182 2.172 2.513 1.00 . A A . 27 VAL O 1 1 13 6146 1 1 28 LEU C C 8.737 5.839 2.832 1.00 . A A . 28 LEU C 1 1 13 6147 1 1 28 LEU CA C 8.500 4.868 1.643 1.00 . A A . 28 LEU CA 1 1 13 6148 1 1 28 LEU CB C 7.846 5.587 0.437 1.00 . A A . 28 LEU CB 1 1 13 6149 1 1 28 LEU CD1 C 7.528 3.431 -0.923 1.00 . A A . 28 LEU CD1 1 1 13 6150 1 1 28 LEU CD2 C 7.273 5.665 -2.015 1.00 . A A . 28 LEU CD2 1 1 13 6151 1 1 28 LEU CG C 8.022 4.883 -0.924 1.00 . A A . 28 LEU CG 1 1 13 6152 1 1 28 LEU H H 6.646 3.962 2.168 1.00 . A A . 28 LEU H 1 1 13 6153 1 1 28 LEU HA H 9.480 4.498 1.319 1.00 . A A . 28 LEU HA 1 1 13 6154 1 1 28 LEU HB2 H 6.779 5.737 0.624 1.00 . A A . 28 LEU HB2 1 1 13 6155 1 1 28 LEU HB3 H 8.294 6.578 0.330 1.00 . A A . 28 LEU HB3 1 1 13 6156 1 1 28 LEU HD11 H 6.509 3.374 -0.545 1.00 . A A . 28 LEU HD11 1 1 13 6157 1 1 28 LEU HD12 H 7.546 3.027 -1.936 1.00 . A A . 28 LEU HD12 1 1 13 6158 1 1 28 LEU HD13 H 8.178 2.810 -0.310 1.00 . A A . 28 LEU HD13 1 1 13 6159 1 1 28 LEU HD21 H 6.210 5.721 -1.783 1.00 . A A . 28 LEU HD21 1 1 13 6160 1 1 28 LEU HD22 H 7.669 6.677 -2.094 1.00 . A A . 28 LEU HD22 1 1 13 6161 1 1 28 LEU HD23 H 7.390 5.173 -2.982 1.00 . A A . 28 LEU HD23 1 1 13 6162 1 1 28 LEU HG H 9.081 4.875 -1.182 1.00 . A A . 28 LEU HG 1 1 13 6163 1 1 28 LEU N N 7.630 3.759 2.082 1.00 . A A . 28 LEU N 1 1 13 6164 1 1 28 LEU O O 9.779 5.804 3.480 1.00 . A A . 28 LEU O 1 1 13 6165 1 1 29 ASN C C 6.560 6.996 5.358 1.00 . A A . 29 ASN C 1 1 13 6166 1 1 29 ASN CA C 7.659 7.509 4.371 1.00 . A A . 29 ASN CA 1 1 13 6167 1 1 29 ASN CB C 7.416 8.974 3.951 1.00 . A A . 29 ASN CB 1 1 13 6168 1 1 29 ASN CG C 6.123 9.174 3.158 1.00 . A A . 29 ASN CG 1 1 13 6169 1 1 29 ASN H H 6.937 6.703 2.544 1.00 . A A . 29 ASN H 1 1 13 6170 1 1 29 ASN HA H 8.627 7.490 4.874 1.00 . A A . 29 ASN HA 1 1 13 6171 1 1 29 ASN HB2 H 7.406 9.602 4.844 1.00 . A A . 29 ASN HB2 1 1 13 6172 1 1 29 ASN HB3 H 8.242 9.307 3.322 1.00 . A A . 29 ASN HB3 1 1 13 6173 1 1 29 ASN HD21 H 5.540 10.793 4.251 1.00 . A A . 29 ASN HD21 1 1 13 6174 1 1 29 ASN HD22 H 4.482 10.233 2.954 1.00 . A A . 29 ASN HD22 1 1 13 6175 1 1 29 ASN N N 7.743 6.679 3.155 1.00 . A A . 29 ASN N 1 1 13 6176 1 1 29 ASN ND2 N 5.319 10.159 3.507 1.00 . A A . 29 ASN ND2 1 1 13 6177 1 1 29 ASN O O 5.466 6.659 4.904 1.00 . A A . 29 ASN O 1 1 13 6178 1 1 29 ASN OD1 O 5.822 8.451 2.221 1.00 . A A . 29 ASN OD1 1 1 13 6179 1 1 30 PRO C C 4.390 6.410 7.483 1.00 . A A . 30 PRO C 1 1 13 6180 1 1 30 PRO CA C 5.915 6.433 7.733 1.00 . A A . 30 PRO CA 1 1 13 6181 1 1 30 PRO CB C 6.302 7.211 8.993 1.00 . A A . 30 PRO CB 1 1 13 6182 1 1 30 PRO CD C 8.028 7.454 7.328 1.00 . A A . 30 PRO CD 1 1 13 6183 1 1 30 PRO CG C 7.823 7.288 8.839 1.00 . A A . 30 PRO CG 1 1 13 6184 1 1 30 PRO HA H 6.211 5.394 7.898 1.00 . A A . 30 PRO HA 1 1 13 6185 1 1 30 PRO HB2 H 5.879 8.219 8.973 1.00 . A A . 30 PRO HB2 1 1 13 6186 1 1 30 PRO HB3 H 6.007 6.700 9.911 1.00 . A A . 30 PRO HB3 1 1 13 6187 1 1 30 PRO HD2 H 8.177 8.510 7.095 1.00 . A A . 30 PRO HD2 1 1 13 6188 1 1 30 PRO HD3 H 8.904 6.879 7.018 1.00 . A A . 30 PRO HD3 1 1 13 6189 1 1 30 PRO HG2 H 8.255 8.110 9.415 1.00 . A A . 30 PRO HG2 1 1 13 6190 1 1 30 PRO HG3 H 8.263 6.343 9.171 1.00 . A A . 30 PRO HG3 1 1 13 6191 1 1 30 PRO N N 6.809 6.966 6.689 1.00 . A A . 30 PRO N 1 1 13 6192 1 1 30 PRO O O 3.757 5.372 7.648 1.00 . A A . 30 PRO O 1 1 13 6193 1 1 31 TYR C C 1.692 6.945 5.692 1.00 . A A . 31 TYR C 1 1 13 6194 1 1 31 TYR CA C 2.304 7.631 6.951 1.00 . A A . 31 TYR CA 1 1 13 6195 1 1 31 TYR CB C 1.863 9.102 7.167 1.00 . A A . 31 TYR CB 1 1 13 6196 1 1 31 TYR CD1 C 2.460 8.915 9.671 1.00 . A A . 31 TYR CD1 1 1 13 6197 1 1 31 TYR CD2 C 1.068 10.771 8.911 1.00 . A A . 31 TYR CD2 1 1 13 6198 1 1 31 TYR CE1 C 2.298 9.344 11.006 1.00 . A A . 31 TYR CE1 1 1 13 6199 1 1 31 TYR CE2 C 0.910 11.198 10.248 1.00 . A A . 31 TYR CE2 1 1 13 6200 1 1 31 TYR CG C 1.832 9.616 8.610 1.00 . A A . 31 TYR CG 1 1 13 6201 1 1 31 TYR CZ C 1.523 10.480 11.292 1.00 . A A . 31 TYR CZ 1 1 13 6202 1 1 31 TYR H H 4.327 8.358 6.957 1.00 . A A . 31 TYR H 1 1 13 6203 1 1 31 TYR HA H 1.838 7.057 7.754 1.00 . A A . 31 TYR HA 1 1 13 6204 1 1 31 TYR HB2 H 2.490 9.762 6.563 1.00 . A A . 31 TYR HB2 1 1 13 6205 1 1 31 TYR HB3 H 0.840 9.208 6.795 1.00 . A A . 31 TYR HB3 1 1 13 6206 1 1 31 TYR HD1 H 3.050 8.032 9.492 1.00 . A A . 31 TYR HD1 1 1 13 6207 1 1 31 TYR HD2 H 0.580 11.317 8.115 1.00 . A A . 31 TYR HD2 1 1 13 6208 1 1 31 TYR HE1 H 2.749 8.793 11.818 1.00 . A A . 31 TYR HE1 1 1 13 6209 1 1 31 TYR HE2 H 0.308 12.065 10.472 1.00 . A A . 31 TYR HE2 1 1 13 6210 1 1 31 TYR HH H 0.803 11.652 12.642 1.00 . A A . 31 TYR HH 1 1 13 6211 1 1 31 TYR N N 3.771 7.534 7.101 1.00 . A A . 31 TYR N 1 1 13 6212 1 1 31 TYR O O 0.571 7.265 5.304 1.00 . A A . 31 TYR O 1 1 13 6213 1 1 31 TYR OH O 1.368 10.882 12.581 1.00 . A A . 31 TYR OH 1 1 13 6214 1 1 32 TYR C C 2.584 3.626 4.074 1.00 . A A . 32 TYR C 1 1 13 6215 1 1 32 TYR CA C 1.763 4.935 4.206 1.00 . A A . 32 TYR CA 1 1 13 6216 1 1 32 TYR CB C 1.358 5.558 2.848 1.00 . A A . 32 TYR CB 1 1 13 6217 1 1 32 TYR CD1 C 2.771 4.663 0.983 1.00 . A A . 32 TYR CD1 1 1 13 6218 1 1 32 TYR CD2 C 2.366 7.041 1.100 1.00 . A A . 32 TYR CD2 1 1 13 6219 1 1 32 TYR CE1 C 2.503 4.670 -0.400 1.00 . A A . 32 TYR CE1 1 1 13 6220 1 1 32 TYR CE2 C 2.177 7.071 -0.303 1.00 . A A . 32 TYR CE2 1 1 13 6221 1 1 32 TYR CG C 2.415 5.789 1.765 1.00 . A A . 32 TYR CG 1 1 13 6222 1 1 32 TYR CZ C 2.084 5.860 -1.014 1.00 . A A . 32 TYR CZ 1 1 13 6223 1 1 32 TYR H H 3.268 5.711 5.502 1.00 . A A . 32 TYR H 1 1 13 6224 1 1 32 TYR HA H 0.830 4.624 4.680 1.00 . A A . 32 TYR HA 1 1 13 6225 1 1 32 TYR HB2 H 0.614 4.892 2.404 1.00 . A A . 32 TYR HB2 1 1 13 6226 1 1 32 TYR HB3 H 0.821 6.490 3.024 1.00 . A A . 32 TYR HB3 1 1 13 6227 1 1 32 TYR HD1 H 3.125 3.755 1.437 1.00 . A A . 32 TYR HD1 1 1 13 6228 1 1 32 TYR HD2 H 2.326 7.959 1.672 1.00 . A A . 32 TYR HD2 1 1 13 6229 1 1 32 TYR HE1 H 2.549 3.762 -0.977 1.00 . A A . 32 TYR HE1 1 1 13 6230 1 1 32 TYR HE2 H 2.017 8.005 -0.819 1.00 . A A . 32 TYR HE2 1 1 13 6231 1 1 32 TYR HH H 1.081 4.965 -2.337 1.00 . A A . 32 TYR HH 1 1 13 6232 1 1 32 TYR N N 2.358 5.932 5.114 1.00 . A A . 32 TYR N 1 1 13 6233 1 1 32 TYR O O 3.696 3.516 4.576 1.00 . A A . 32 TYR O 1 1 13 6234 1 1 32 TYR OH O 1.531 5.811 -2.251 1.00 . A A . 32 TYR OH 1 1 13 6235 1 1 33 SER C C 2.352 0.931 1.562 1.00 . A A . 33 SER C 1 1 13 6236 1 1 33 SER CA C 2.751 1.387 2.982 1.00 . A A . 33 SER CA 1 1 13 6237 1 1 33 SER CB C 2.480 0.292 4.017 1.00 . A A . 33 SER CB 1 1 13 6238 1 1 33 SER H H 1.125 2.781 2.981 1.00 . A A . 33 SER H 1 1 13 6239 1 1 33 SER HA H 3.824 1.574 2.972 1.00 . A A . 33 SER HA 1 1 13 6240 1 1 33 SER HB2 H 2.831 0.624 4.998 1.00 . A A . 33 SER HB2 1 1 13 6241 1 1 33 SER HB3 H 1.408 0.108 4.092 1.00 . A A . 33 SER HB3 1 1 13 6242 1 1 33 SER HG H 3.237 -1.028 2.730 1.00 . A A . 33 SER HG 1 1 13 6243 1 1 33 SER N N 2.038 2.620 3.379 1.00 . A A . 33 SER N 1 1 13 6244 1 1 33 SER O O 1.161 0.835 1.273 1.00 . A A . 33 SER O 1 1 13 6245 1 1 33 SER OG O 3.174 -0.898 3.684 1.00 . A A . 33 SER OG 1 1 13 6246 1 1 34 GLN C C 3.071 -0.922 -1.285 1.00 . A A . 34 GLN C 1 1 13 6247 1 1 34 GLN CA C 3.116 0.555 -0.783 1.00 . A A . 34 GLN CA 1 1 13 6248 1 1 34 GLN CB C 4.157 1.447 -1.511 1.00 . A A . 34 GLN CB 1 1 13 6249 1 1 34 GLN CD C 4.859 2.369 -3.807 1.00 . A A . 34 GLN CD 1 1 13 6250 1 1 34 GLN CG C 3.739 1.759 -2.969 1.00 . A A . 34 GLN CG 1 1 13 6251 1 1 34 GLN H H 4.270 0.674 1.017 1.00 . A A . 34 GLN H 1 1 13 6252 1 1 34 GLN HA H 2.140 0.971 -1.045 1.00 . A A . 34 GLN HA 1 1 13 6253 1 1 34 GLN HB2 H 4.268 2.396 -0.985 1.00 . A A . 34 GLN HB2 1 1 13 6254 1 1 34 GLN HB3 H 5.146 0.982 -1.482 1.00 . A A . 34 GLN HB3 1 1 13 6255 1 1 34 GLN HE21 H 5.751 0.558 -4.252 1.00 . A A . 34 GLN HE21 1 1 13 6256 1 1 34 GLN HE22 H 6.476 2.029 -4.878 1.00 . A A . 34 GLN HE22 1 1 13 6257 1 1 34 GLN HG2 H 3.396 0.875 -3.497 1.00 . A A . 34 GLN HG2 1 1 13 6258 1 1 34 GLN HG3 H 2.899 2.453 -2.953 1.00 . A A . 34 GLN HG3 1 1 13 6259 1 1 34 GLN N N 3.320 0.703 0.667 1.00 . A A . 34 GLN N 1 1 13 6260 1 1 34 GLN NE2 N 5.773 1.569 -4.325 1.00 . A A . 34 GLN NE2 1 1 13 6261 1 1 34 GLN O O 2.241 -1.711 -0.848 1.00 . A A . 34 GLN O 1 1 13 6262 1 1 34 GLN OE1 O 4.905 3.568 -4.025 1.00 . A A . 34 GLN OE1 1 1 13 6263 1 1 35 CYS C C 5.272 -2.376 -3.892 1.00 . A A . 35 CYS C 1 1 13 6264 1 1 35 CYS CA C 3.869 -2.317 -3.248 1.00 . A A . 35 CYS CA 1 1 13 6265 1 1 35 CYS CB C 2.788 -1.938 -4.274 1.00 . A A . 35 CYS CB 1 1 13 6266 1 1 35 CYS H H 4.633 -0.550 -2.450 1.00 . A A . 35 CYS H 1 1 13 6267 1 1 35 CYS HA H 3.621 -3.270 -2.770 1.00 . A A . 35 CYS HA 1 1 13 6268 1 1 35 CYS HB2 H 1.850 -1.774 -3.753 1.00 . A A . 35 CYS HB2 1 1 13 6269 1 1 35 CYS HB3 H 3.067 -1.002 -4.750 1.00 . A A . 35 CYS HB3 1 1 13 6270 1 1 35 CYS N N 3.921 -1.236 -2.265 1.00 . A A . 35 CYS N 1 1 13 6271 1 1 35 CYS O O 5.624 -1.448 -4.632 1.00 . A A . 35 CYS O 1 1 13 6272 1 1 35 CYS SG S 2.413 -3.094 -5.615 1.00 . A A . 35 CYS SG 1 1 13 6273 1 1 36 LEU C C 8.068 -4.819 -3.889 1.00 . A A . 36 LEU C 1 1 13 6274 1 1 36 LEU CA C 7.553 -3.374 -3.671 1.00 . A A . 36 LEU CA 1 1 13 6275 1 1 36 LEU CB C 8.286 -2.719 -2.469 1.00 . A A . 36 LEU CB 1 1 13 6276 1 1 36 LEU CD1 C 6.684 -1.702 -0.787 1.00 . A A . 36 LEU CD1 1 1 13 6277 1 1 36 LEU CD2 C 8.732 -0.440 -1.399 1.00 . A A . 36 LEU CD2 1 1 13 6278 1 1 36 LEU CG C 7.665 -1.407 -1.932 1.00 . A A . 36 LEU CG 1 1 13 6279 1 1 36 LEU H H 5.719 -4.042 -2.851 1.00 . A A . 36 LEU H 1 1 13 6280 1 1 36 LEU HA H 7.809 -2.814 -4.573 1.00 . A A . 36 LEU HA 1 1 13 6281 1 1 36 LEU HB2 H 8.351 -3.436 -1.645 1.00 . A A . 36 LEU HB2 1 1 13 6282 1 1 36 LEU HB3 H 9.308 -2.523 -2.801 1.00 . A A . 36 LEU HB3 1 1 13 6283 1 1 36 LEU HD11 H 5.968 -2.480 -1.046 1.00 . A A . 36 LEU HD11 1 1 13 6284 1 1 36 LEU HD12 H 7.259 -2.044 0.061 1.00 . A A . 36 LEU HD12 1 1 13 6285 1 1 36 LEU HD13 H 6.149 -0.806 -0.488 1.00 . A A . 36 LEU HD13 1 1 13 6286 1 1 36 LEU HD21 H 9.339 -0.917 -0.629 1.00 . A A . 36 LEU HD21 1 1 13 6287 1 1 36 LEU HD22 H 9.379 -0.119 -2.217 1.00 . A A . 36 LEU HD22 1 1 13 6288 1 1 36 LEU HD23 H 8.247 0.438 -0.975 1.00 . A A . 36 LEU HD23 1 1 13 6289 1 1 36 LEU HG H 7.148 -0.885 -2.736 1.00 . A A . 36 LEU HG 1 1 13 6290 1 1 36 LEU N N 6.095 -3.333 -3.470 1.00 . A A . 36 LEU N 1 1 13 6291 1 1 36 LEU O O 8.996 -4.987 -4.716 1.00 . A A . 36 LEU O 1 1 13 6292 1 1 36 LEU OXT O 7.533 -5.722 -3.210 1.00 . A A . 36 LEU OXT 1 1 14 6293 1 1 1 THR C C -6.338 -4.886 -5.793 1.00 . A A . 1 THR C 1 1 14 6294 1 1 1 THR CA C -5.228 -5.932 -6.048 1.00 . A A . 1 THR CA 1 1 14 6295 1 1 1 THR CB C -4.691 -5.870 -7.507 1.00 . A A . 1 THR CB 1 1 14 6296 1 1 1 THR CG2 C -3.750 -4.691 -7.770 1.00 . A A . 1 THR CG2 1 1 14 6297 1 1 1 THR H1 H -6.494 -7.593 -6.131 1.00 . A A . 1 THR H1 1 1 14 6298 1 1 1 THR H2 H -4.887 -7.919 -6.115 1.00 . A A . 1 THR H2 1 1 14 6299 1 1 1 THR H3 H -5.651 -7.496 -4.707 1.00 . A A . 1 THR H3 1 1 14 6300 1 1 1 THR HA H -4.397 -5.671 -5.408 1.00 . A A . 1 THR HA 1 1 14 6301 1 1 1 THR HB H -5.526 -5.827 -8.217 1.00 . A A . 1 THR HB 1 1 14 6302 1 1 1 THR HG1 H -3.598 -6.991 -8.666 1.00 . A A . 1 THR HG1 1 1 14 6303 1 1 1 THR HG21 H -4.222 -3.743 -7.510 1.00 . A A . 1 THR HG21 1 1 14 6304 1 1 1 THR HG22 H -2.829 -4.788 -7.191 1.00 . A A . 1 THR HG22 1 1 14 6305 1 1 1 THR HG23 H -3.484 -4.648 -8.829 1.00 . A A . 1 THR HG23 1 1 14 6306 1 1 1 THR N N -5.614 -7.337 -5.705 1.00 . A A . 1 THR N 1 1 14 6307 1 1 1 THR O O -6.892 -4.347 -6.740 1.00 . A A . 1 THR O 1 1 14 6308 1 1 1 THR OG1 O -3.947 -7.051 -7.767 1.00 . A A . 1 THR OG1 1 1 14 6309 1 1 2 GLN C C -7.826 -3.580 -2.571 1.00 . A A . 2 GLN C 1 1 14 6310 1 1 2 GLN CA C -7.930 -3.943 -4.078 1.00 . A A . 2 GLN CA 1 1 14 6311 1 1 2 GLN CB C -9.202 -4.798 -4.337 1.00 . A A . 2 GLN CB 1 1 14 6312 1 1 2 GLN CD C -10.099 -3.449 -6.347 1.00 . A A . 2 GLN CD 1 1 14 6313 1 1 2 GLN CG C -9.771 -4.828 -5.774 1.00 . A A . 2 GLN CG 1 1 14 6314 1 1 2 GLN H H -6.184 -5.108 -3.790 1.00 . A A . 2 GLN H 1 1 14 6315 1 1 2 GLN HA H -8.022 -3.003 -4.621 1.00 . A A . 2 GLN HA 1 1 14 6316 1 1 2 GLN HB2 H -9.014 -5.828 -4.024 1.00 . A A . 2 GLN HB2 1 1 14 6317 1 1 2 GLN HB3 H -10.012 -4.428 -3.704 1.00 . A A . 2 GLN HB3 1 1 14 6318 1 1 2 GLN HE21 H -8.312 -3.305 -7.291 1.00 . A A . 2 GLN HE21 1 1 14 6319 1 1 2 GLN HE22 H -9.457 -1.972 -7.503 1.00 . A A . 2 GLN HE22 1 1 14 6320 1 1 2 GLN HG2 H -9.108 -5.365 -6.450 1.00 . A A . 2 GLN HG2 1 1 14 6321 1 1 2 GLN HG3 H -10.710 -5.385 -5.745 1.00 . A A . 2 GLN HG3 1 1 14 6322 1 1 2 GLN N N -6.734 -4.691 -4.525 1.00 . A A . 2 GLN N 1 1 14 6323 1 1 2 GLN NE2 N -9.204 -2.866 -7.117 1.00 . A A . 2 GLN NE2 1 1 14 6324 1 1 2 GLN O O -8.355 -4.300 -1.733 1.00 . A A . 2 GLN O 1 1 14 6325 1 1 2 GLN OE1 O -11.155 -2.889 -6.106 1.00 . A A . 2 GLN OE1 1 1 14 6326 1 1 3 SER C C -5.999 -3.582 -0.165 1.00 . A A . 3 SER C 1 1 14 6327 1 1 3 SER CA C -6.619 -2.309 -0.803 1.00 . A A . 3 SER CA 1 1 14 6328 1 1 3 SER CB C -7.772 -1.739 0.054 1.00 . A A . 3 SER CB 1 1 14 6329 1 1 3 SER H H -6.664 -1.949 -2.916 1.00 . A A . 3 SER H 1 1 14 6330 1 1 3 SER HA H -5.830 -1.552 -0.832 1.00 . A A . 3 SER HA 1 1 14 6331 1 1 3 SER HB2 H -8.394 -1.090 -0.561 1.00 . A A . 3 SER HB2 1 1 14 6332 1 1 3 SER HB3 H -8.411 -2.552 0.418 1.00 . A A . 3 SER HB3 1 1 14 6333 1 1 3 SER HG H -6.468 -1.376 1.499 1.00 . A A . 3 SER HG 1 1 14 6334 1 1 3 SER N N -7.066 -2.537 -2.202 1.00 . A A . 3 SER N 1 1 14 6335 1 1 3 SER O O -6.390 -4.035 0.906 1.00 . A A . 3 SER O 1 1 14 6336 1 1 3 SER OG O -7.281 -0.972 1.153 1.00 . A A . 3 SER OG 1 1 14 6337 1 1 4 HIS C C -3.035 -5.579 -1.261 1.00 . A A . 4 HIS C 1 1 14 6338 1 1 4 HIS CA C -4.387 -5.456 -0.510 1.00 . A A . 4 HIS CA 1 1 14 6339 1 1 4 HIS CB C -5.349 -6.645 -0.697 1.00 . A A . 4 HIS CB 1 1 14 6340 1 1 4 HIS CD2 C -4.615 -8.244 1.214 1.00 . A A . 4 HIS CD2 1 1 14 6341 1 1 4 HIS CE1 C -3.807 -9.829 -0.049 1.00 . A A . 4 HIS CE1 1 1 14 6342 1 1 4 HIS CG C -4.801 -7.910 -0.099 1.00 . A A . 4 HIS CG 1 1 14 6343 1 1 4 HIS H H -4.746 -3.718 -1.714 1.00 . A A . 4 HIS H 1 1 14 6344 1 1 4 HIS HA H -4.137 -5.385 0.552 1.00 . A A . 4 HIS HA 1 1 14 6345 1 1 4 HIS HB2 H -6.295 -6.438 -0.197 1.00 . A A . 4 HIS HB2 1 1 14 6346 1 1 4 HIS HB3 H -5.567 -6.794 -1.756 1.00 . A A . 4 HIS HB3 1 1 14 6347 1 1 4 HIS HD2 H -4.875 -7.632 2.068 1.00 . A A . 4 HIS HD2 1 1 14 6348 1 1 4 HIS HE1 H -3.330 -10.749 -0.351 1.00 . A A . 4 HIS HE1 1 1 14 6349 1 1 4 HIS HE2 H -3.700 -9.988 2.052 1.00 . A A . 4 HIS HE2 1 1 14 6350 1 1 4 HIS N N -5.072 -4.214 -0.899 1.00 . A A . 4 HIS N 1 1 14 6351 1 1 4 HIS ND1 N -4.265 -8.910 -0.908 1.00 . A A . 4 HIS ND1 1 1 14 6352 1 1 4 HIS NE2 N -3.985 -9.471 1.233 1.00 . A A . 4 HIS NE2 1 1 14 6353 1 1 4 HIS O O -2.185 -4.714 -1.099 1.00 . A A . 4 HIS O 1 1 14 6354 1 1 5 ALA C C -1.740 -5.094 -3.916 1.00 . A A . 5 ALA C 1 1 14 6355 1 1 5 ALA CA C -1.759 -6.457 -3.168 1.00 . A A . 5 ALA CA 1 1 14 6356 1 1 5 ALA CB C -1.847 -7.632 -4.151 1.00 . A A . 5 ALA CB 1 1 14 6357 1 1 5 ALA H H -3.424 -7.377 -2.113 1.00 . A A . 5 ALA H 1 1 14 6358 1 1 5 ALA HA H -0.814 -6.526 -2.629 1.00 . A A . 5 ALA HA 1 1 14 6359 1 1 5 ALA HB1 H -1.798 -8.580 -3.616 1.00 . A A . 5 ALA HB1 1 1 14 6360 1 1 5 ALA HB2 H -2.779 -7.586 -4.712 1.00 . A A . 5 ALA HB2 1 1 14 6361 1 1 5 ALA HB3 H -1.015 -7.587 -4.855 1.00 . A A . 5 ALA HB3 1 1 14 6362 1 1 5 ALA N N -2.836 -6.555 -2.161 1.00 . A A . 5 ALA N 1 1 14 6363 1 1 5 ALA O O -2.800 -4.513 -4.168 1.00 . A A . 5 ALA O 1 1 14 6364 1 1 6 GLY C C -0.330 -2.376 -3.108 1.00 . A A . 6 GLY C 1 1 14 6365 1 1 6 GLY CA C -0.318 -3.153 -4.442 1.00 . A A . 6 GLY CA 1 1 14 6366 1 1 6 GLY H H 0.271 -5.129 -3.995 1.00 . A A . 6 GLY H 1 1 14 6367 1 1 6 GLY HA2 H 0.662 -3.018 -4.897 1.00 . A A . 6 GLY HA2 1 1 14 6368 1 1 6 GLY HA3 H -1.072 -2.745 -5.119 1.00 . A A . 6 GLY HA3 1 1 14 6369 1 1 6 GLY N N -0.545 -4.589 -4.235 1.00 . A A . 6 GLY N 1 1 14 6370 1 1 6 GLY O O -0.059 -2.949 -2.054 1.00 . A A . 6 GLY O 1 1 14 6371 1 1 7 GLN C C -2.024 -0.785 -1.013 1.00 . A A . 7 GLN C 1 1 14 6372 1 1 7 GLN CA C -0.883 -0.265 -1.927 1.00 . A A . 7 GLN CA 1 1 14 6373 1 1 7 GLN CB C -0.987 1.213 -2.353 1.00 . A A . 7 GLN CB 1 1 14 6374 1 1 7 GLN CD C -1.246 3.662 -1.608 1.00 . A A . 7 GLN CD 1 1 14 6375 1 1 7 GLN CG C -1.356 2.190 -1.216 1.00 . A A . 7 GLN CG 1 1 14 6376 1 1 7 GLN H H -0.906 -0.685 -4.028 1.00 . A A . 7 GLN H 1 1 14 6377 1 1 7 GLN HA H 0.024 -0.324 -1.320 1.00 . A A . 7 GLN HA 1 1 14 6378 1 1 7 GLN HB2 H -0.014 1.511 -2.754 1.00 . A A . 7 GLN HB2 1 1 14 6379 1 1 7 GLN HB3 H -1.723 1.309 -3.147 1.00 . A A . 7 GLN HB3 1 1 14 6380 1 1 7 GLN HE21 H -1.648 4.313 0.276 1.00 . A A . 7 GLN HE21 1 1 14 6381 1 1 7 GLN HE22 H -1.368 5.526 -0.979 1.00 . A A . 7 GLN HE22 1 1 14 6382 1 1 7 GLN HG2 H -2.382 2.026 -0.896 1.00 . A A . 7 GLN HG2 1 1 14 6383 1 1 7 GLN HG3 H -0.705 2.021 -0.362 1.00 . A A . 7 GLN HG3 1 1 14 6384 1 1 7 GLN N N -0.710 -1.093 -3.133 1.00 . A A . 7 GLN N 1 1 14 6385 1 1 7 GLN NE2 N -1.469 4.568 -0.678 1.00 . A A . 7 GLN NE2 1 1 14 6386 1 1 7 GLN O O -3.165 -0.329 -1.068 1.00 . A A . 7 GLN O 1 1 14 6387 1 1 7 GLN OE1 O -0.949 4.027 -2.736 1.00 . A A . 7 GLN OE1 1 1 14 6388 1 1 8 CYS C C -3.330 -1.364 1.728 1.00 . A A . 8 CYS C 1 1 14 6389 1 1 8 CYS CA C -2.500 -2.369 0.895 1.00 . A A . 8 CYS CA 1 1 14 6390 1 1 8 CYS CB C -1.558 -3.217 1.779 1.00 . A A . 8 CYS CB 1 1 14 6391 1 1 8 CYS H H -0.800 -2.210 -0.388 1.00 . A A . 8 CYS H 1 1 14 6392 1 1 8 CYS HA H -3.224 -3.042 0.447 1.00 . A A . 8 CYS HA 1 1 14 6393 1 1 8 CYS HB2 H -2.079 -3.517 2.689 1.00 . A A . 8 CYS HB2 1 1 14 6394 1 1 8 CYS HB3 H -1.281 -4.122 1.241 1.00 . A A . 8 CYS HB3 1 1 14 6395 1 1 8 CYS N N -1.693 -1.773 -0.178 1.00 . A A . 8 CYS N 1 1 14 6396 1 1 8 CYS O O -4.549 -1.499 1.856 1.00 . A A . 8 CYS O 1 1 14 6397 1 1 8 CYS SG S 0.010 -2.430 2.263 1.00 . A A . 8 CYS SG 1 1 14 6398 1 1 9 GLY C C -2.273 0.437 4.625 1.00 . A A . 9 GLY C 1 1 14 6399 1 1 9 GLY CA C -3.141 0.517 3.353 1.00 . A A . 9 GLY CA 1 1 14 6400 1 1 9 GLY H H -1.656 -0.356 2.106 1.00 . A A . 9 GLY H 1 1 14 6401 1 1 9 GLY HA2 H -3.103 1.520 2.933 1.00 . A A . 9 GLY HA2 1 1 14 6402 1 1 9 GLY HA3 H -4.172 0.297 3.630 1.00 . A A . 9 GLY HA3 1 1 14 6403 1 1 9 GLY N N -2.642 -0.381 2.310 1.00 . A A . 9 GLY N 1 1 14 6404 1 1 9 GLY O O -2.085 -0.642 5.186 1.00 . A A . 9 GLY O 1 1 14 6405 1 1 10 GLY C C -1.383 2.170 7.471 1.00 . A A . 10 GLY C 1 1 14 6406 1 1 10 GLY CA C -0.744 1.641 6.174 1.00 . A A . 10 GLY CA 1 1 14 6407 1 1 10 GLY H H -1.953 2.416 4.569 1.00 . A A . 10 GLY H 1 1 14 6408 1 1 10 GLY HA2 H -0.312 0.662 6.398 1.00 . A A . 10 GLY HA2 1 1 14 6409 1 1 10 GLY HA3 H 0.083 2.290 5.879 1.00 . A A . 10 GLY HA3 1 1 14 6410 1 1 10 GLY N N -1.680 1.564 5.039 1.00 . A A . 10 GLY N 1 1 14 6411 1 1 10 GLY O O -2.401 1.663 7.935 1.00 . A A . 10 GLY O 1 1 14 6412 1 1 11 ILE C C -2.113 5.089 8.992 1.00 . A A . 11 ILE C 1 1 14 6413 1 1 11 ILE CA C -1.266 3.831 9.309 1.00 . A A . 11 ILE CA 1 1 14 6414 1 1 11 ILE CB C -0.060 4.099 10.244 1.00 . A A . 11 ILE CB 1 1 14 6415 1 1 11 ILE CD1 C 2.043 3.002 11.263 1.00 . A A . 11 ILE CD1 1 1 14 6416 1 1 11 ILE CG1 C 0.729 2.791 10.503 1.00 . A A . 11 ILE CG1 1 1 14 6417 1 1 11 ILE CG2 C -0.533 4.720 11.572 1.00 . A A . 11 ILE CG2 1 1 14 6418 1 1 11 ILE H H 0.017 3.616 7.614 1.00 . A A . 11 ILE H 1 1 14 6419 1 1 11 ILE HA H -1.904 3.134 9.858 1.00 . A A . 11 ILE HA 1 1 14 6420 1 1 11 ILE HB H 0.610 4.810 9.764 1.00 . A A . 11 ILE HB 1 1 14 6421 1 1 11 ILE HD11 H 2.650 3.747 10.749 1.00 . A A . 11 ILE HD11 1 1 14 6422 1 1 11 ILE HD12 H 1.851 3.326 12.283 1.00 . A A . 11 ILE HD12 1 1 14 6423 1 1 11 ILE HD13 H 2.595 2.062 11.294 1.00 . A A . 11 ILE HD13 1 1 14 6424 1 1 11 ILE HG12 H 0.103 2.086 11.052 1.00 . A A . 11 ILE HG12 1 1 14 6425 1 1 11 ILE HG13 H 1.003 2.329 9.552 1.00 . A A . 11 ILE HG13 1 1 14 6426 1 1 11 ILE HG21 H -1.105 5.629 11.390 1.00 . A A . 11 ILE HG21 1 1 14 6427 1 1 11 ILE HG22 H -1.161 4.009 12.111 1.00 . A A . 11 ILE HG22 1 1 14 6428 1 1 11 ILE HG23 H 0.318 4.988 12.197 1.00 . A A . 11 ILE HG23 1 1 14 6429 1 1 11 ILE N N -0.795 3.212 8.062 1.00 . A A . 11 ILE N 1 1 14 6430 1 1 11 ILE O O -1.576 6.154 8.707 1.00 . A A . 11 ILE O 1 1 14 6431 1 1 12 GLY C C -4.586 6.418 7.227 1.00 . A A . 12 GLY C 1 1 14 6432 1 1 12 GLY CA C -4.391 6.061 8.721 1.00 . A A . 12 GLY CA 1 1 14 6433 1 1 12 GLY H H -3.818 4.055 9.248 1.00 . A A . 12 GLY H 1 1 14 6434 1 1 12 GLY HA2 H -5.368 5.778 9.112 1.00 . A A . 12 GLY HA2 1 1 14 6435 1 1 12 GLY HA3 H -4.076 6.963 9.251 1.00 . A A . 12 GLY HA3 1 1 14 6436 1 1 12 GLY N N -3.448 4.966 9.018 1.00 . A A . 12 GLY N 1 1 14 6437 1 1 12 GLY O O -4.936 7.548 6.900 1.00 . A A . 12 GLY O 1 1 14 6438 1 1 13 TYR C C -5.016 4.251 4.230 1.00 . A A . 13 TYR C 1 1 14 6439 1 1 13 TYR CA C -4.544 5.589 4.861 1.00 . A A . 13 TYR CA 1 1 14 6440 1 1 13 TYR CB C -3.192 6.096 4.306 1.00 . A A . 13 TYR CB 1 1 14 6441 1 1 13 TYR CD1 C -4.149 6.369 1.917 1.00 . A A . 13 TYR CD1 1 1 14 6442 1 1 13 TYR CD2 C -1.913 7.199 2.423 1.00 . A A . 13 TYR CD2 1 1 14 6443 1 1 13 TYR CE1 C -3.967 6.728 0.563 1.00 . A A . 13 TYR CE1 1 1 14 6444 1 1 13 TYR CE2 C -1.716 7.508 1.058 1.00 . A A . 13 TYR CE2 1 1 14 6445 1 1 13 TYR CG C -3.101 6.561 2.851 1.00 . A A . 13 TYR CG 1 1 14 6446 1 1 13 TYR CZ C -2.731 7.234 0.126 1.00 . A A . 13 TYR CZ 1 1 14 6447 1 1 13 TYR H H -4.129 4.549 6.687 1.00 . A A . 13 TYR H 1 1 14 6448 1 1 13 TYR HA H -5.291 6.358 4.642 1.00 . A A . 13 TYR HA 1 1 14 6449 1 1 13 TYR HB2 H -2.893 6.951 4.914 1.00 . A A . 13 TYR HB2 1 1 14 6450 1 1 13 TYR HB3 H -2.435 5.322 4.455 1.00 . A A . 13 TYR HB3 1 1 14 6451 1 1 13 TYR HD1 H -5.103 5.961 2.215 1.00 . A A . 13 TYR HD1 1 1 14 6452 1 1 13 TYR HD2 H -1.145 7.440 3.144 1.00 . A A . 13 TYR HD2 1 1 14 6453 1 1 13 TYR HE1 H -4.766 6.589 -0.148 1.00 . A A . 13 TYR HE1 1 1 14 6454 1 1 13 TYR HE2 H -0.785 7.932 0.719 1.00 . A A . 13 TYR HE2 1 1 14 6455 1 1 13 TYR HH H -3.150 6.942 -1.736 1.00 . A A . 13 TYR HH 1 1 14 6456 1 1 13 TYR N N -4.414 5.445 6.324 1.00 . A A . 13 TYR N 1 1 14 6457 1 1 13 TYR O O -4.237 3.304 4.128 1.00 . A A . 13 TYR O 1 1 14 6458 1 1 13 TYR OH O -2.495 7.408 -1.201 1.00 . A A . 13 TYR OH 1 1 14 6459 1 1 14 SER C C -7.841 2.982 2.213 1.00 . A A . 14 SER C 1 1 14 6460 1 1 14 SER CA C -7.032 2.922 3.535 1.00 . A A . 14 SER CA 1 1 14 6461 1 1 14 SER CB C -8.007 2.636 4.699 1.00 . A A . 14 SER CB 1 1 14 6462 1 1 14 SER H H -6.852 5.004 3.948 1.00 . A A . 14 SER H 1 1 14 6463 1 1 14 SER HA H -6.333 2.086 3.469 1.00 . A A . 14 SER HA 1 1 14 6464 1 1 14 SER HB2 H -8.753 3.435 4.760 1.00 . A A . 14 SER HB2 1 1 14 6465 1 1 14 SER HB3 H -8.529 1.691 4.519 1.00 . A A . 14 SER HB3 1 1 14 6466 1 1 14 SER HG H -7.928 2.362 6.654 1.00 . A A . 14 SER HG 1 1 14 6467 1 1 14 SER N N -6.299 4.169 3.843 1.00 . A A . 14 SER N 1 1 14 6468 1 1 14 SER O O -8.339 4.047 1.851 1.00 . A A . 14 SER O 1 1 14 6469 1 1 14 SER OG O -7.315 2.553 5.937 1.00 . A A . 14 SER OG 1 1 14 6470 1 1 15 GLY C C -8.434 1.634 -0.997 1.00 . A A . 15 GLY C 1 1 14 6471 1 1 15 GLY CA C -9.035 1.733 0.425 1.00 . A A . 15 GLY CA 1 1 14 6472 1 1 15 GLY H H -7.572 1.001 1.801 1.00 . A A . 15 GLY H 1 1 14 6473 1 1 15 GLY HA2 H -9.607 0.819 0.592 1.00 . A A . 15 GLY HA2 1 1 14 6474 1 1 15 GLY HA3 H -9.739 2.563 0.472 1.00 . A A . 15 GLY HA3 1 1 14 6475 1 1 15 GLY N N -8.063 1.848 1.530 1.00 . A A . 15 GLY N 1 1 14 6476 1 1 15 GLY O O -7.266 1.273 -1.169 1.00 . A A . 15 GLY O 1 1 14 6477 1 1 16 PRO C C -7.760 2.609 -4.033 1.00 . A A . 16 PRO C 1 1 14 6478 1 1 16 PRO CA C -8.824 1.640 -3.450 1.00 . A A . 16 PRO CA 1 1 14 6479 1 1 16 PRO CB C -10.158 1.624 -4.219 1.00 . A A . 16 PRO CB 1 1 14 6480 1 1 16 PRO CD C -10.588 2.409 -2.010 1.00 . A A . 16 PRO CD 1 1 14 6481 1 1 16 PRO CG C -10.985 2.668 -3.465 1.00 . A A . 16 PRO CG 1 1 14 6482 1 1 16 PRO HA H -8.386 0.642 -3.521 1.00 . A A . 16 PRO HA 1 1 14 6483 1 1 16 PRO HB2 H -10.065 1.845 -5.288 1.00 . A A . 16 PRO HB2 1 1 14 6484 1 1 16 PRO HB3 H -10.626 0.644 -4.102 1.00 . A A . 16 PRO HB3 1 1 14 6485 1 1 16 PRO HD2 H -10.691 3.330 -1.432 1.00 . A A . 16 PRO HD2 1 1 14 6486 1 1 16 PRO HD3 H -11.235 1.634 -1.589 1.00 . A A . 16 PRO HD3 1 1 14 6487 1 1 16 PRO HG2 H -10.670 3.668 -3.771 1.00 . A A . 16 PRO HG2 1 1 14 6488 1 1 16 PRO HG3 H -12.060 2.559 -3.616 1.00 . A A . 16 PRO HG3 1 1 14 6489 1 1 16 PRO N N -9.214 1.922 -2.062 1.00 . A A . 16 PRO N 1 1 14 6490 1 1 16 PRO O O -7.686 2.811 -5.240 1.00 . A A . 16 PRO O 1 1 14 6491 1 1 17 THR C C -4.541 3.018 -4.135 1.00 . A A . 17 THR C 1 1 14 6492 1 1 17 THR CA C -5.665 3.921 -3.573 1.00 . A A . 17 THR CA 1 1 14 6493 1 1 17 THR CB C -5.195 4.716 -2.324 1.00 . A A . 17 THR CB 1 1 14 6494 1 1 17 THR CG2 C -4.978 3.824 -1.085 1.00 . A A . 17 THR CG2 1 1 14 6495 1 1 17 THR H H -6.876 2.775 -2.253 1.00 . A A . 17 THR H 1 1 14 6496 1 1 17 THR HA H -5.914 4.639 -4.358 1.00 . A A . 17 THR HA 1 1 14 6497 1 1 17 THR HB H -5.967 5.452 -2.078 1.00 . A A . 17 THR HB 1 1 14 6498 1 1 17 THR HG1 H -3.317 4.806 -2.827 1.00 . A A . 17 THR HG1 1 1 14 6499 1 1 17 THR HG21 H -4.600 2.844 -1.369 1.00 . A A . 17 THR HG21 1 1 14 6500 1 1 17 THR HG22 H -4.264 4.273 -0.394 1.00 . A A . 17 THR HG22 1 1 14 6501 1 1 17 THR HG23 H -5.920 3.686 -0.551 1.00 . A A . 17 THR HG23 1 1 14 6502 1 1 17 THR N N -6.861 3.135 -3.197 1.00 . A A . 17 THR N 1 1 14 6503 1 1 17 THR O O -3.394 3.097 -3.712 1.00 . A A . 17 THR O 1 1 14 6504 1 1 17 THR OG1 O -4.006 5.442 -2.574 1.00 . A A . 17 THR OG1 1 1 14 6505 1 1 18 VAL C C -3.306 0.651 -6.444 1.00 . A A . 18 VAL C 1 1 14 6506 1 1 18 VAL CA C -4.167 0.799 -5.162 1.00 . A A . 18 VAL CA 1 1 14 6507 1 1 18 VAL CB C -5.162 -0.364 -4.934 1.00 . A A . 18 VAL CB 1 1 14 6508 1 1 18 VAL CG1 C -6.189 -0.569 -6.060 1.00 . A A . 18 VAL CG1 1 1 14 6509 1 1 18 VAL CG2 C -4.424 -1.684 -4.668 1.00 . A A . 18 VAL CG2 1 1 14 6510 1 1 18 VAL H H -5.805 2.161 -5.428 1.00 . A A . 18 VAL H 1 1 14 6511 1 1 18 VAL HA H -3.488 0.709 -4.312 1.00 . A A . 18 VAL HA 1 1 14 6512 1 1 18 VAL HB H -5.723 -0.130 -4.027 1.00 . A A . 18 VAL HB 1 1 14 6513 1 1 18 VAL HG11 H -6.676 0.371 -6.323 1.00 . A A . 18 VAL HG11 1 1 14 6514 1 1 18 VAL HG12 H -5.707 -0.982 -6.947 1.00 . A A . 18 VAL HG12 1 1 14 6515 1 1 18 VAL HG13 H -6.953 -1.271 -5.728 1.00 . A A . 18 VAL HG13 1 1 14 6516 1 1 18 VAL HG21 H -3.760 -1.583 -3.808 1.00 . A A . 18 VAL HG21 1 1 14 6517 1 1 18 VAL HG22 H -5.142 -2.473 -4.458 1.00 . A A . 18 VAL HG22 1 1 14 6518 1 1 18 VAL HG23 H -3.835 -1.967 -5.540 1.00 . A A . 18 VAL HG23 1 1 14 6519 1 1 18 VAL N N -4.876 2.082 -5.033 1.00 . A A . 18 VAL N 1 1 14 6520 1 1 18 VAL O O -3.819 0.571 -7.557 1.00 . A A . 18 VAL O 1 1 14 6521 1 1 19 CYS C C -1.361 -1.194 -8.016 1.00 . A A . 19 CYS C 1 1 14 6522 1 1 19 CYS CA C -1.007 0.145 -7.296 1.00 . A A . 19 CYS CA 1 1 14 6523 1 1 19 CYS CB C 0.359 0.068 -6.584 1.00 . A A . 19 CYS CB 1 1 14 6524 1 1 19 CYS H H -1.635 0.791 -5.356 1.00 . A A . 19 CYS H 1 1 14 6525 1 1 19 CYS HA H -0.963 0.930 -8.054 1.00 . A A . 19 CYS HA 1 1 14 6526 1 1 19 CYS HB2 H 0.552 1.011 -6.070 1.00 . A A . 19 CYS HB2 1 1 14 6527 1 1 19 CYS HB3 H 0.315 -0.719 -5.834 1.00 . A A . 19 CYS HB3 1 1 14 6528 1 1 19 CYS N N -1.981 0.566 -6.274 1.00 . A A . 19 CYS N 1 1 14 6529 1 1 19 CYS O O -2.260 -1.932 -7.610 1.00 . A A . 19 CYS O 1 1 14 6530 1 1 19 CYS SG S 1.840 -0.244 -7.586 1.00 . A A . 19 CYS SG 1 1 14 6531 1 1 20 ALA C C -0.336 -4.036 -8.668 1.00 . A A . 20 ALA C 1 1 14 6532 1 1 20 ALA CA C -0.578 -2.878 -9.676 1.00 . A A . 20 ALA CA 1 1 14 6533 1 1 20 ALA CB C 0.482 -2.866 -10.790 1.00 . A A . 20 ALA CB 1 1 14 6534 1 1 20 ALA H H 0.089 -0.881 -9.371 1.00 . A A . 20 ALA H 1 1 14 6535 1 1 20 ALA HA H -1.552 -3.052 -10.139 1.00 . A A . 20 ALA HA 1 1 14 6536 1 1 20 ALA HB1 H 0.286 -2.052 -11.491 1.00 . A A . 20 ALA HB1 1 1 14 6537 1 1 20 ALA HB2 H 1.475 -2.726 -10.357 1.00 . A A . 20 ALA HB2 1 1 14 6538 1 1 20 ALA HB3 H 0.470 -3.807 -11.342 1.00 . A A . 20 ALA HB3 1 1 14 6539 1 1 20 ALA N N -0.614 -1.538 -9.073 1.00 . A A . 20 ALA N 1 1 14 6540 1 1 20 ALA O O -0.151 -3.830 -7.470 1.00 . A A . 20 ALA O 1 1 14 6541 1 1 21 SER C C 1.258 -6.650 -7.722 1.00 . A A . 21 SER C 1 1 14 6542 1 1 21 SER CA C -0.183 -6.464 -8.270 1.00 . A A . 21 SER CA 1 1 14 6543 1 1 21 SER CB C -0.690 -7.736 -8.968 1.00 . A A . 21 SER CB 1 1 14 6544 1 1 21 SER H H -0.419 -5.405 -10.140 1.00 . A A . 21 SER H 1 1 14 6545 1 1 21 SER HA H -0.816 -6.309 -7.393 1.00 . A A . 21 SER HA 1 1 14 6546 1 1 21 SER HB2 H -1.577 -7.520 -9.567 1.00 . A A . 21 SER HB2 1 1 14 6547 1 1 21 SER HB3 H 0.080 -8.128 -9.640 1.00 . A A . 21 SER HB3 1 1 14 6548 1 1 21 SER HG H -1.857 -8.492 -7.569 1.00 . A A . 21 SER HG 1 1 14 6549 1 1 21 SER N N -0.371 -5.289 -9.142 1.00 . A A . 21 SER N 1 1 14 6550 1 1 21 SER O O 2.171 -5.908 -8.064 1.00 . A A . 21 SER O 1 1 14 6551 1 1 21 SER OG O -1.011 -8.705 -7.979 1.00 . A A . 21 SER OG 1 1 14 6552 1 1 22 GLY C C 2.461 -8.769 -4.881 1.00 . A A . 22 GLY C 1 1 14 6553 1 1 22 GLY CA C 2.697 -7.961 -6.165 1.00 . A A . 22 GLY CA 1 1 14 6554 1 1 22 GLY H H 0.655 -8.293 -6.774 1.00 . A A . 22 GLY H 1 1 14 6555 1 1 22 GLY HA2 H 3.356 -8.526 -6.825 1.00 . A A . 22 GLY HA2 1 1 14 6556 1 1 22 GLY HA3 H 3.210 -7.038 -5.882 1.00 . A A . 22 GLY HA3 1 1 14 6557 1 1 22 GLY N N 1.438 -7.659 -6.869 1.00 . A A . 22 GLY N 1 1 14 6558 1 1 22 GLY O O 2.800 -9.946 -4.804 1.00 . A A . 22 GLY O 1 1 14 6559 1 1 23 THR C C 2.419 -8.450 -1.478 1.00 . A A . 23 THR C 1 1 14 6560 1 1 23 THR CA C 1.383 -8.738 -2.585 1.00 . A A . 23 THR CA 1 1 14 6561 1 1 23 THR CB C 0.974 -10.234 -2.638 1.00 . A A . 23 THR CB 1 1 14 6562 1 1 23 THR CG2 C 0.018 -10.615 -1.496 1.00 . A A . 23 THR CG2 1 1 14 6563 1 1 23 THR H H 1.501 -7.218 -4.112 1.00 . A A . 23 THR H 1 1 14 6564 1 1 23 THR HA H 0.491 -8.205 -2.270 1.00 . A A . 23 THR HA 1 1 14 6565 1 1 23 THR HB H 1.862 -10.873 -2.584 1.00 . A A . 23 THR HB 1 1 14 6566 1 1 23 THR HG1 H 0.955 -10.401 -4.546 1.00 . A A . 23 THR HG1 1 1 14 6567 1 1 23 THR HG21 H -0.885 -10.005 -1.533 1.00 . A A . 23 THR HG21 1 1 14 6568 1 1 23 THR HG22 H -0.259 -11.665 -1.587 1.00 . A A . 23 THR HG22 1 1 14 6569 1 1 23 THR HG23 H 0.497 -10.476 -0.527 1.00 . A A . 23 THR HG23 1 1 14 6570 1 1 23 THR N N 1.761 -8.168 -3.909 1.00 . A A . 23 THR N 1 1 14 6571 1 1 23 THR O O 2.679 -9.273 -0.608 1.00 . A A . 23 THR O 1 1 14 6572 1 1 23 THR OG1 O 0.293 -10.501 -3.848 1.00 . A A . 23 THR OG1 1 1 14 6573 1 1 24 THR C C 3.956 -5.519 0.021 1.00 . A A . 24 THR C 1 1 14 6574 1 1 24 THR CA C 4.194 -6.811 -0.789 1.00 . A A . 24 THR CA 1 1 14 6575 1 1 24 THR CB C 5.335 -6.632 -1.814 1.00 . A A . 24 THR CB 1 1 14 6576 1 1 24 THR CG2 C 5.872 -7.987 -2.291 1.00 . A A . 24 THR CG2 1 1 14 6577 1 1 24 THR H H 2.779 -6.670 -2.313 1.00 . A A . 24 THR H 1 1 14 6578 1 1 24 THR HA H 4.507 -7.572 -0.070 1.00 . A A . 24 THR HA 1 1 14 6579 1 1 24 THR HB H 6.165 -6.081 -1.357 1.00 . A A . 24 THR HB 1 1 14 6580 1 1 24 THR HG1 H 5.638 -5.799 -3.529 1.00 . A A . 24 THR HG1 1 1 14 6581 1 1 24 THR HG21 H 6.192 -8.593 -1.443 1.00 . A A . 24 THR HG21 1 1 14 6582 1 1 24 THR HG22 H 5.112 -8.525 -2.854 1.00 . A A . 24 THR HG22 1 1 14 6583 1 1 24 THR HG23 H 6.735 -7.820 -2.936 1.00 . A A . 24 THR HG23 1 1 14 6584 1 1 24 THR N N 2.989 -7.246 -1.513 1.00 . A A . 24 THR N 1 1 14 6585 1 1 24 THR O O 4.411 -4.431 -0.329 1.00 . A A . 24 THR O 1 1 14 6586 1 1 24 THR OG1 O 4.859 -5.937 -2.958 1.00 . A A . 24 THR OG1 1 1 14 6587 1 1 25 CYS C C 4.144 -3.963 2.826 1.00 . A A . 25 CYS C 1 1 14 6588 1 1 25 CYS CA C 2.909 -4.517 2.053 1.00 . A A . 25 CYS CA 1 1 14 6589 1 1 25 CYS CB C 1.754 -4.968 2.969 1.00 . A A . 25 CYS CB 1 1 14 6590 1 1 25 CYS H H 2.867 -6.548 1.359 1.00 . A A . 25 CYS H 1 1 14 6591 1 1 25 CYS HA H 2.535 -3.692 1.444 1.00 . A A . 25 CYS HA 1 1 14 6592 1 1 25 CYS HB2 H 1.014 -5.508 2.377 1.00 . A A . 25 CYS HB2 1 1 14 6593 1 1 25 CYS HB3 H 2.140 -5.643 3.732 1.00 . A A . 25 CYS HB3 1 1 14 6594 1 1 25 CYS N N 3.233 -5.633 1.145 1.00 . A A . 25 CYS N 1 1 14 6595 1 1 25 CYS O O 4.277 -4.142 4.036 1.00 . A A . 25 CYS O 1 1 14 6596 1 1 25 CYS SG S 0.835 -3.661 3.822 1.00 . A A . 25 CYS SG 1 1 14 6597 1 1 26 GLN C C 6.338 -1.165 2.504 1.00 . A A . 26 GLN C 1 1 14 6598 1 1 26 GLN CA C 6.322 -2.719 2.599 1.00 . A A . 26 GLN CA 1 1 14 6599 1 1 26 GLN CB C 7.483 -3.435 1.872 1.00 . A A . 26 GLN CB 1 1 14 6600 1 1 26 GLN CD C 9.241 -3.055 3.756 1.00 . A A . 26 GLN CD 1 1 14 6601 1 1 26 GLN CG C 8.908 -2.976 2.263 1.00 . A A . 26 GLN CG 1 1 14 6602 1 1 26 GLN H H 4.893 -3.281 1.105 1.00 . A A . 26 GLN H 1 1 14 6603 1 1 26 GLN HA H 6.412 -2.947 3.662 1.00 . A A . 26 GLN HA 1 1 14 6604 1 1 26 GLN HB2 H 7.394 -4.508 2.070 1.00 . A A . 26 GLN HB2 1 1 14 6605 1 1 26 GLN HB3 H 7.372 -3.307 0.793 1.00 . A A . 26 GLN HB3 1 1 14 6606 1 1 26 GLN HE21 H 8.066 -4.663 4.111 1.00 . A A . 26 GLN HE21 1 1 14 6607 1 1 26 GLN HE22 H 8.997 -4.007 5.465 1.00 . A A . 26 GLN HE22 1 1 14 6608 1 1 26 GLN HG2 H 9.638 -3.599 1.738 1.00 . A A . 26 GLN HG2 1 1 14 6609 1 1 26 GLN HG3 H 9.075 -1.951 1.922 1.00 . A A . 26 GLN HG3 1 1 14 6610 1 1 26 GLN N N 5.067 -3.310 2.105 1.00 . A A . 26 GLN N 1 1 14 6611 1 1 26 GLN NE2 N 8.694 -3.989 4.507 1.00 . A A . 26 GLN NE2 1 1 14 6612 1 1 26 GLN O O 5.566 -0.558 1.757 1.00 . A A . 26 GLN O 1 1 14 6613 1 1 26 GLN OE1 O 9.982 -2.248 4.287 1.00 . A A . 26 GLN OE1 1 1 14 6614 1 1 27 VAL C C 7.812 1.918 2.805 1.00 . A A . 27 VAL C 1 1 14 6615 1 1 27 VAL CA C 7.013 0.933 3.703 1.00 . A A . 27 VAL CA 1 1 14 6616 1 1 27 VAL CB C 7.386 1.094 5.195 1.00 . A A . 27 VAL CB 1 1 14 6617 1 1 27 VAL CG1 C 8.892 0.943 5.476 1.00 . A A . 27 VAL CG1 1 1 14 6618 1 1 27 VAL CG2 C 6.931 2.447 5.764 1.00 . A A . 27 VAL CG2 1 1 14 6619 1 1 27 VAL H H 7.781 -1.041 3.904 1.00 . A A . 27 VAL H 1 1 14 6620 1 1 27 VAL HA H 5.962 1.208 3.621 1.00 . A A . 27 VAL HA 1 1 14 6621 1 1 27 VAL HB H 6.854 0.332 5.770 1.00 . A A . 27 VAL HB 1 1 14 6622 1 1 27 VAL HG11 H 9.241 -0.020 5.114 1.00 . A A . 27 VAL HG11 1 1 14 6623 1 1 27 VAL HG12 H 9.460 1.732 4.983 1.00 . A A . 27 VAL HG12 1 1 14 6624 1 1 27 VAL HG13 H 9.081 1.002 6.547 1.00 . A A . 27 VAL HG13 1 1 14 6625 1 1 27 VAL HG21 H 5.871 2.611 5.561 1.00 . A A . 27 VAL HG21 1 1 14 6626 1 1 27 VAL HG22 H 7.100 2.460 6.841 1.00 . A A . 27 VAL HG22 1 1 14 6627 1 1 27 VAL HG23 H 7.517 3.246 5.318 1.00 . A A . 27 VAL HG23 1 1 14 6628 1 1 27 VAL N N 7.131 -0.499 3.354 1.00 . A A . 27 VAL N 1 1 14 6629 1 1 27 VAL O O 8.927 1.617 2.388 1.00 . A A . 27 VAL O 1 1 14 6630 1 1 28 LEU C C 8.335 5.106 3.638 1.00 . A A . 28 LEU C 1 1 14 6631 1 1 28 LEU CA C 8.090 4.344 2.313 1.00 . A A . 28 LEU CA 1 1 14 6632 1 1 28 LEU CB C 7.410 5.234 1.247 1.00 . A A . 28 LEU CB 1 1 14 6633 1 1 28 LEU CD1 C 6.696 3.571 -0.540 1.00 . A A . 28 LEU CD1 1 1 14 6634 1 1 28 LEU CD2 C 7.312 5.900 -1.186 1.00 . A A . 28 LEU CD2 1 1 14 6635 1 1 28 LEU CG C 7.607 4.755 -0.204 1.00 . A A . 28 LEU CG 1 1 14 6636 1 1 28 LEU H H 6.315 3.271 2.845 1.00 . A A . 28 LEU H 1 1 14 6637 1 1 28 LEU HA H 9.078 4.072 1.927 1.00 . A A . 28 LEU HA 1 1 14 6638 1 1 28 LEU HB2 H 6.344 5.346 1.456 1.00 . A A . 28 LEU HB2 1 1 14 6639 1 1 28 LEU HB3 H 7.861 6.228 1.310 1.00 . A A . 28 LEU HB3 1 1 14 6640 1 1 28 LEU HD11 H 5.661 3.841 -0.332 1.00 . A A . 28 LEU HD11 1 1 14 6641 1 1 28 LEU HD12 H 6.793 3.316 -1.596 1.00 . A A . 28 LEU HD12 1 1 14 6642 1 1 28 LEU HD13 H 6.962 2.693 0.043 1.00 . A A . 28 LEU HD13 1 1 14 6643 1 1 28 LEU HD21 H 6.287 6.250 -1.066 1.00 . A A . 28 LEU HD21 1 1 14 6644 1 1 28 LEU HD22 H 7.993 6.732 -1.009 1.00 . A A . 28 LEU HD22 1 1 14 6645 1 1 28 LEU HD23 H 7.448 5.560 -2.214 1.00 . A A . 28 LEU HD23 1 1 14 6646 1 1 28 LEU HG H 8.643 4.452 -0.348 1.00 . A A . 28 LEU HG 1 1 14 6647 1 1 28 LEU N N 7.283 3.135 2.589 1.00 . A A . 28 LEU N 1 1 14 6648 1 1 28 LEU O O 9.317 4.860 4.334 1.00 . A A . 28 LEU O 1 1 14 6649 1 1 29 ASN C C 6.099 5.535 6.131 1.00 . A A . 29 ASN C 1 1 14 6650 1 1 29 ASN CA C 7.195 6.399 5.432 1.00 . A A . 29 ASN CA 1 1 14 6651 1 1 29 ASN CB C 6.829 7.898 5.462 1.00 . A A . 29 ASN CB 1 1 14 6652 1 1 29 ASN CG C 5.530 8.225 4.725 1.00 . A A . 29 ASN CG 1 1 14 6653 1 1 29 ASN H H 6.634 6.156 3.401 1.00 . A A . 29 ASN H 1 1 14 6654 1 1 29 ASN HA H 8.139 6.300 5.971 1.00 . A A . 29 ASN HA 1 1 14 6655 1 1 29 ASN HB2 H 6.743 8.212 6.505 1.00 . A A . 29 ASN HB2 1 1 14 6656 1 1 29 ASN HB3 H 7.632 8.477 5.006 1.00 . A A . 29 ASN HB3 1 1 14 6657 1 1 29 ASN HD21 H 4.941 9.617 6.095 1.00 . A A . 29 ASN HD21 1 1 14 6658 1 1 29 ASN HD22 H 3.878 9.283 4.726 1.00 . A A . 29 ASN HD22 1 1 14 6659 1 1 29 ASN N N 7.396 5.972 4.042 1.00 . A A . 29 ASN N 1 1 14 6660 1 1 29 ASN ND2 N 4.712 9.109 5.262 1.00 . A A . 29 ASN ND2 1 1 14 6661 1 1 29 ASN O O 5.106 5.191 5.486 1.00 . A A . 29 ASN O 1 1 14 6662 1 1 29 ASN OD1 O 5.228 7.688 3.673 1.00 . A A . 29 ASN OD1 1 1 14 6663 1 1 30 PRO C C 3.737 4.725 7.882 1.00 . A A . 30 PRO C 1 1 14 6664 1 1 30 PRO CA C 5.222 4.523 8.257 1.00 . A A . 30 PRO CA 1 1 14 6665 1 1 30 PRO CB C 5.530 4.970 9.689 1.00 . A A . 30 PRO CB 1 1 14 6666 1 1 30 PRO CD C 7.372 5.585 8.275 1.00 . A A . 30 PRO CD 1 1 14 6667 1 1 30 PRO CG C 7.057 5.057 9.676 1.00 . A A . 30 PRO CG 1 1 14 6668 1 1 30 PRO HA H 5.432 3.455 8.186 1.00 . A A . 30 PRO HA 1 1 14 6669 1 1 30 PRO HB2 H 5.113 5.964 9.882 1.00 . A A . 30 PRO HB2 1 1 14 6670 1 1 30 PRO HB3 H 5.164 4.265 10.436 1.00 . A A . 30 PRO HB3 1 1 14 6671 1 1 30 PRO HD2 H 7.488 6.669 8.314 1.00 . A A . 30 PRO HD2 1 1 14 6672 1 1 30 PRO HD3 H 8.296 5.126 7.913 1.00 . A A . 30 PRO HD3 1 1 14 6673 1 1 30 PRO HG2 H 7.445 5.709 10.463 1.00 . A A . 30 PRO HG2 1 1 14 6674 1 1 30 PRO HG3 H 7.473 4.052 9.796 1.00 . A A . 30 PRO HG3 1 1 14 6675 1 1 30 PRO N N 6.226 5.232 7.442 1.00 . A A . 30 PRO N 1 1 14 6676 1 1 30 PRO O O 2.967 3.770 7.821 1.00 . A A . 30 PRO O 1 1 14 6677 1 1 31 TYR C C 1.388 5.730 5.952 1.00 . A A . 31 TYR C 1 1 14 6678 1 1 31 TYR CA C 1.942 6.326 7.277 1.00 . A A . 31 TYR CA 1 1 14 6679 1 1 31 TYR CB C 1.749 7.847 7.441 1.00 . A A . 31 TYR CB 1 1 14 6680 1 1 31 TYR CD1 C 0.771 8.194 9.758 1.00 . A A . 31 TYR CD1 1 1 14 6681 1 1 31 TYR CD2 C 3.154 8.604 9.436 1.00 . A A . 31 TYR CD2 1 1 14 6682 1 1 31 TYR CE1 C 0.940 8.299 11.155 1.00 . A A . 31 TYR CE1 1 1 14 6683 1 1 31 TYR CE2 C 3.312 8.752 10.832 1.00 . A A . 31 TYR CE2 1 1 14 6684 1 1 31 TYR CG C 1.883 8.303 8.891 1.00 . A A . 31 TYR CG 1 1 14 6685 1 1 31 TYR CZ C 2.209 8.574 11.689 1.00 . A A . 31 TYR CZ 1 1 14 6686 1 1 31 TYR H H 4.003 6.709 7.675 1.00 . A A . 31 TYR H 1 1 14 6687 1 1 31 TYR HA H 1.303 5.875 8.032 1.00 . A A . 31 TYR HA 1 1 14 6688 1 1 31 TYR HB2 H 2.457 8.383 6.808 1.00 . A A . 31 TYR HB2 1 1 14 6689 1 1 31 TYR HB3 H 0.746 8.107 7.095 1.00 . A A . 31 TYR HB3 1 1 14 6690 1 1 31 TYR HD1 H -0.213 8.014 9.355 1.00 . A A . 31 TYR HD1 1 1 14 6691 1 1 31 TYR HD2 H 4.013 8.698 8.786 1.00 . A A . 31 TYR HD2 1 1 14 6692 1 1 31 TYR HE1 H 0.099 8.160 11.818 1.00 . A A . 31 TYR HE1 1 1 14 6693 1 1 31 TYR HE2 H 4.280 8.991 11.246 1.00 . A A . 31 TYR HE2 1 1 14 6694 1 1 31 TYR HH H 3.274 8.870 13.268 1.00 . A A . 31 TYR HH 1 1 14 6695 1 1 31 TYR N N 3.326 5.971 7.618 1.00 . A A . 31 TYR N 1 1 14 6696 1 1 31 TYR O O 0.181 5.512 5.855 1.00 . A A . 31 TYR O 1 1 14 6697 1 1 31 TYR OH O 2.368 8.666 13.035 1.00 . A A . 31 TYR OH 1 1 14 6698 1 1 32 TYR C C 2.754 3.652 3.130 1.00 . A A . 32 TYR C 1 1 14 6699 1 1 32 TYR CA C 1.762 4.691 3.734 1.00 . A A . 32 TYR CA 1 1 14 6700 1 1 32 TYR CB C 1.078 5.672 2.744 1.00 . A A . 32 TYR CB 1 1 14 6701 1 1 32 TYR CD1 C 1.485 4.712 0.436 1.00 . A A . 32 TYR CD1 1 1 14 6702 1 1 32 TYR CD2 C 1.947 7.080 0.808 1.00 . A A . 32 TYR CD2 1 1 14 6703 1 1 32 TYR CE1 C 1.724 4.881 -0.943 1.00 . A A . 32 TYR CE1 1 1 14 6704 1 1 32 TYR CE2 C 2.163 7.247 -0.579 1.00 . A A . 32 TYR CE2 1 1 14 6705 1 1 32 TYR CG C 1.617 5.803 1.325 1.00 . A A . 32 TYR CG 1 1 14 6706 1 1 32 TYR CZ C 2.078 6.142 -1.445 1.00 . A A . 32 TYR CZ 1 1 14 6707 1 1 32 TYR H H 3.222 5.537 5.081 1.00 . A A . 32 TYR H 1 1 14 6708 1 1 32 TYR HA H 0.926 4.072 4.067 1.00 . A A . 32 TYR HA 1 1 14 6709 1 1 32 TYR HB2 H 0.048 5.329 2.608 1.00 . A A . 32 TYR HB2 1 1 14 6710 1 1 32 TYR HB3 H 1.009 6.662 3.198 1.00 . A A . 32 TYR HB3 1 1 14 6711 1 1 32 TYR HD1 H 1.149 3.756 0.805 1.00 . A A . 32 TYR HD1 1 1 14 6712 1 1 32 TYR HD2 H 1.973 7.939 1.465 1.00 . A A . 32 TYR HD2 1 1 14 6713 1 1 32 TYR HE1 H 1.592 4.054 -1.622 1.00 . A A . 32 TYR HE1 1 1 14 6714 1 1 32 TYR HE2 H 2.366 8.230 -0.972 1.00 . A A . 32 TYR HE2 1 1 14 6715 1 1 32 TYR HH H 2.583 7.194 -2.967 1.00 . A A . 32 TYR HH 1 1 14 6716 1 1 32 TYR N N 2.225 5.394 4.953 1.00 . A A . 32 TYR N 1 1 14 6717 1 1 32 TYR O O 3.759 3.986 2.504 1.00 . A A . 32 TYR O 1 1 14 6718 1 1 32 TYR OH O 2.347 6.288 -2.769 1.00 . A A . 32 TYR OH 1 1 14 6719 1 1 33 SER C C 2.432 1.019 1.166 1.00 . A A . 33 SER C 1 1 14 6720 1 1 33 SER CA C 2.996 1.203 2.596 1.00 . A A . 33 SER CA 1 1 14 6721 1 1 33 SER CB C 2.752 -0.055 3.443 1.00 . A A . 33 SER CB 1 1 14 6722 1 1 33 SER H H 1.595 2.194 3.852 1.00 . A A . 33 SER H 1 1 14 6723 1 1 33 SER HA H 4.070 1.361 2.501 1.00 . A A . 33 SER HA 1 1 14 6724 1 1 33 SER HB2 H 3.387 -0.029 4.334 1.00 . A A . 33 SER HB2 1 1 14 6725 1 1 33 SER HB3 H 1.709 -0.093 3.768 1.00 . A A . 33 SER HB3 1 1 14 6726 1 1 33 SER HG H 3.872 -1.144 2.250 1.00 . A A . 33 SER HG 1 1 14 6727 1 1 33 SER N N 2.424 2.362 3.303 1.00 . A A . 33 SER N 1 1 14 6728 1 1 33 SER O O 1.255 1.289 0.929 1.00 . A A . 33 SER O 1 1 14 6729 1 1 33 SER OG O 3.015 -1.222 2.690 1.00 . A A . 33 SER OG 1 1 14 6730 1 1 34 GLN C C 3.152 -0.432 -2.126 1.00 . A A . 34 GLN C 1 1 14 6731 1 1 34 GLN CA C 3.049 0.834 -1.228 1.00 . A A . 34 GLN CA 1 1 14 6732 1 1 34 GLN CB C 3.937 2.034 -1.618 1.00 . A A . 34 GLN CB 1 1 14 6733 1 1 34 GLN CD C 4.861 2.248 -4.029 1.00 . A A . 34 GLN CD 1 1 14 6734 1 1 34 GLN CG C 3.768 2.633 -3.037 1.00 . A A . 34 GLN CG 1 1 14 6735 1 1 34 GLN H H 4.197 0.311 0.513 1.00 . A A . 34 GLN H 1 1 14 6736 1 1 34 GLN HA H 2.023 1.179 -1.387 1.00 . A A . 34 GLN HA 1 1 14 6737 1 1 34 GLN HB2 H 3.681 2.835 -0.922 1.00 . A A . 34 GLN HB2 1 1 14 6738 1 1 34 GLN HB3 H 4.977 1.771 -1.424 1.00 . A A . 34 GLN HB3 1 1 14 6739 1 1 34 GLN HE21 H 4.110 3.443 -5.491 1.00 . A A . 34 GLN HE21 1 1 14 6740 1 1 34 GLN HE22 H 5.568 2.499 -5.844 1.00 . A A . 34 GLN HE22 1 1 14 6741 1 1 34 GLN HG2 H 2.797 2.383 -3.461 1.00 . A A . 34 GLN HG2 1 1 14 6742 1 1 34 GLN HG3 H 3.818 3.720 -2.951 1.00 . A A . 34 GLN HG3 1 1 14 6743 1 1 34 GLN N N 3.273 0.599 0.211 1.00 . A A . 34 GLN N 1 1 14 6744 1 1 34 GLN NE2 N 4.827 2.791 -5.228 1.00 . A A . 34 GLN NE2 1 1 14 6745 1 1 34 GLN O O 2.160 -1.134 -2.274 1.00 . A A . 34 GLN O 1 1 14 6746 1 1 34 GLN OE1 O 5.747 1.460 -3.748 1.00 . A A . 34 GLN OE1 1 1 14 6747 1 1 35 CYS C C 5.685 -2.119 -4.322 1.00 . A A . 35 CYS C 1 1 14 6748 1 1 35 CYS CA C 4.265 -1.609 -3.979 1.00 . A A . 35 CYS CA 1 1 14 6749 1 1 35 CYS CB C 3.595 -0.840 -5.139 1.00 . A A . 35 CYS CB 1 1 14 6750 1 1 35 CYS H H 5.060 -0.071 -2.726 1.00 . A A . 35 CYS H 1 1 14 6751 1 1 35 CYS HA H 3.664 -2.497 -3.758 1.00 . A A . 35 CYS HA 1 1 14 6752 1 1 35 CYS HB2 H 2.740 -0.285 -4.757 1.00 . A A . 35 CYS HB2 1 1 14 6753 1 1 35 CYS HB3 H 4.291 -0.118 -5.559 1.00 . A A . 35 CYS HB3 1 1 14 6754 1 1 35 CYS N N 4.264 -0.693 -2.822 1.00 . A A . 35 CYS N 1 1 14 6755 1 1 35 CYS O O 6.245 -1.742 -5.351 1.00 . A A . 35 CYS O 1 1 14 6756 1 1 35 CYS SG S 2.897 -1.783 -6.511 1.00 . A A . 35 CYS SG 1 1 14 6757 1 1 36 LEU C C 7.831 -4.874 -3.277 1.00 . A A . 36 LEU C 1 1 14 6758 1 1 36 LEU CA C 7.685 -3.340 -3.475 1.00 . A A . 36 LEU CA 1 1 14 6759 1 1 36 LEU CB C 8.549 -2.486 -2.499 1.00 . A A . 36 LEU CB 1 1 14 6760 1 1 36 LEU CD1 C 7.070 -0.998 -1.058 1.00 . A A . 36 LEU CD1 1 1 14 6761 1 1 36 LEU CD2 C 9.239 -0.111 -1.875 1.00 . A A . 36 LEU CD2 1 1 14 6762 1 1 36 LEU CG C 8.066 -1.038 -2.232 1.00 . A A . 36 LEU CG 1 1 14 6763 1 1 36 LEU H H 5.719 -3.258 -2.657 1.00 . A A . 36 LEU H 1 1 14 6764 1 1 36 LEU HA H 8.075 -3.161 -4.479 1.00 . A A . 36 LEU HA 1 1 14 6765 1 1 36 LEU HB2 H 8.638 -2.983 -1.532 1.00 . A A . 36 LEU HB2 1 1 14 6766 1 1 36 LEU HB3 H 9.553 -2.452 -2.928 1.00 . A A . 36 LEU HB3 1 1 14 6767 1 1 36 LEU HD11 H 6.300 -1.763 -1.156 1.00 . A A . 36 LEU HD11 1 1 14 6768 1 1 36 LEU HD12 H 7.609 -1.171 -0.128 1.00 . A A . 36 LEU HD12 1 1 14 6769 1 1 36 LEU HD13 H 6.593 -0.019 -1.006 1.00 . A A . 36 LEU HD13 1 1 14 6770 1 1 36 LEU HD21 H 9.773 -0.490 -1.001 1.00 . A A . 36 LEU HD21 1 1 14 6771 1 1 36 LEU HD22 H 9.933 -0.046 -2.715 1.00 . A A . 36 LEU HD22 1 1 14 6772 1 1 36 LEU HD23 H 8.867 0.891 -1.655 1.00 . A A . 36 LEU HD23 1 1 14 6773 1 1 36 LEU HG H 7.600 -0.631 -3.134 1.00 . A A . 36 LEU HG 1 1 14 6774 1 1 36 LEU N N 6.273 -2.921 -3.430 1.00 . A A . 36 LEU N 1 1 14 6775 1 1 36 LEU O O 8.409 -5.304 -2.255 1.00 . A A . 36 LEU O 1 1 14 6776 1 1 36 LEU OXT O 7.277 -5.614 -4.123 1.00 . A A . 36 LEU OXT 1 1 stop_ save_
Contact the webmaster for help, if required. Thursday, May 9, 2024 10:30:18 AM GMT (wattos1)