NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
584610 | 2mwd | 25313 | cing | 4-filtered-FRED | STAR | entry | full | 221 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mwd # This FRED archive file contains, for PDB entry <2mwd>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2mwd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mwd _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3454.67 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 $Transcription_elongation_regulator_1 A . 1 1 stop_ save_ save_Transcription_elongation_regulator_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Transcription elongation regulator 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code SEWTERKTADGKTYYYNNRTLESTWEKP _Entity.Number_of_monomers 28 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 SER . 1 1 2 GLU . 1 1 3 TRP . 1 1 4 THR . 1 1 5 GLU . 1 1 6 ARG . 1 1 7 LYS . 1 1 8 THR . 1 1 9 ALA . 1 1 10 ASP . 1 1 11 GLY . 1 1 12 LYS . 1 1 13 THR . 1 1 14 TYR . 1 1 15 TYR . 1 1 16 TYR . 1 1 17 ASN . 1 1 18 ASN . 1 1 19 ARG . 1 1 20 THR . 1 1 21 LEU . 1 1 22 GLU . 1 1 23 SER . 1 1 24 THR . 1 1 25 TRP . 1 1 26 GLU . 1 1 27 LYS . 1 1 28 PRO . 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 SER 1 1 1 1 GLU 2 2 1 1 TRP 3 3 1 1 THR 4 4 1 1 GLU 5 5 1 1 ARG 6 6 1 1 LYS 7 7 1 1 THR 8 8 1 1 ALA 9 9 1 1 ASP 10 10 1 1 GLY 11 11 1 1 LYS 12 12 1 1 THR 13 13 1 1 TYR 14 14 1 1 TYR 15 15 1 1 TYR 16 16 1 1 ASN 17 17 1 1 ASN 18 18 1 1 ARG 19 19 1 1 THR 20 20 1 1 LEU 21 21 1 1 GLU 22 22 1 1 SER 23 23 1 1 THR 24 24 1 1 TRP 25 25 1 1 GLU 26 26 1 1 LYS 27 27 1 1 PRO 28 28 1 1 stop_ save_ save_CNS/XPLOR_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 NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 SER HA A 433 . HA 1 1 1 1 2 1 1 2 GLU H A 434 . HN 1 1 2 1 1 1 1 1 SER HA A 433 . HA 1 1 2 1 2 1 1 3 TRP H A 435 . HN 1 1 3 1 1 1 1 1 SER HB2 A 433 . HB2 1 1 3 1 2 1 1 2 GLU H A 434 . HN 1 1 4 1 1 1 1 1 SER HB2 A 433 . HB2 1 1 4 1 2 1 1 3 TRP H A 435 . HN 1 1 5 1 1 1 1 1 SER HB3 A 433 . HB1 1 1 5 1 2 1 1 2 GLU H A 434 . HN 1 1 6 1 1 1 1 1 SER HB3 A 433 . HB1 1 1 6 1 2 1 1 3 TRP H A 435 . HN 1 1 7 1 1 1 1 2 GLU H A 434 . HN 1 1 7 1 2 1 1 3 TRP H A 435 . HN 1 1 8 1 1 1 1 2 GLU HA A 434 . HA 1 1 8 1 2 1 1 3 TRP H A 435 . HN 1 1 9 1 1 1 1 2 GLU HB2 A 434 . HB2 1 1 9 1 2 1 1 3 TRP H A 435 . HN 1 1 10 1 1 1 1 2 GLU HB2 A 434 . HB2 1 1 10 1 2 1 1 3 TRP HD1 A 435 . HD1 1 1 11 1 1 1 1 2 GLU HB3 A 434 . HB1 1 1 11 1 2 1 1 3 TRP H A 435 . HN 1 1 12 1 1 1 1 2 GLU HB3 A 434 . HB1 1 1 12 1 2 1 1 3 TRP HD1 A 435 . HD1 1 1 13 1 1 1 1 2 GLU HG2 A 434 . HG2 1 1 13 1 2 1 1 3 TRP H A 435 . HN 1 1 14 1 1 1 1 2 GLU HG2 A 434 . HG2 1 1 14 1 2 1 1 3 TRP HD1 A 435 . HD1 1 1 15 1 1 1 1 2 GLU HG2 A 434 . HG2 1 1 15 1 2 1 1 3 TRP HE1 A 435 . HE1 1 1 16 1 1 1 1 3 TRP HA A 435 . HA 1 1 16 1 2 1 1 4 THR H A 436 . HN 1 1 17 1 1 1 1 3 TRP HA A 435 . HA 1 1 17 1 2 1 1 17 ASN HA A 449 . HA 1 1 18 1 1 1 1 3 TRP HA A 435 . HA 1 1 18 1 2 1 1 18 ASN H A 450 . HN 1 1 19 1 1 1 1 3 TRP HB2 A 435 . HB2 1 1 19 1 2 1 1 4 THR H A 436 . HN 1 1 20 1 1 1 1 3 TRP HB3 A 435 . HB1 1 1 20 1 2 1 1 4 THR H A 436 . HN 1 1 21 1 1 1 1 3 TRP HD1 A 435 . HD1 1 1 21 1 2 1 1 28 PRO HB2 A 460 . HB2 1 1 22 1 1 1 1 3 TRP HD1 A 435 . HD1 1 1 22 1 2 1 1 28 PRO HB3 A 460 . HB1 1 1 23 1 1 1 1 3 TRP HD1 A 435 . HD1 1 1 23 1 2 1 1 28 PRO HG2 A 460 . HG2 1 1 24 1 1 1 1 3 TRP HD1 A 435 . HD1 1 1 24 1 2 1 1 28 PRO HG3 A 460 . HG1 1 1 25 1 1 1 1 3 TRP HE1 A 435 . HE1 1 1 25 1 2 1 1 17 ASN HD22 A 449 . HD22 1 1 26 1 1 1 1 3 TRP HE1 A 435 . HE1 1 1 26 1 2 1 1 28 PRO HB2 A 460 . HB2 1 1 27 1 1 1 1 3 TRP HE1 A 435 . HE1 1 1 27 1 2 1 1 28 PRO HB3 A 460 . HB1 1 1 28 1 1 1 1 3 TRP HE1 A 435 . HE1 1 1 28 1 2 1 1 28 PRO HG2 A 460 . HG2 1 1 29 1 1 1 1 3 TRP HE1 A 435 . HE1 1 1 29 1 2 1 1 28 PRO HG3 A 460 . HG1 1 1 30 1 1 1 1 3 TRP HE3 A 435 . HE3 1 1 30 1 2 1 1 15 TYR HA A 447 . HA 1 1 31 1 1 1 1 3 TRP HE3 A 435 . HE3 1 1 31 1 2 1 1 15 TYR HB2 A 447 . HB2 1 1 32 1 1 1 1 3 TRP HE3 A 435 . HE3 1 1 32 1 2 1 1 15 TYR QD A 447 . HD+ 1 1 33 1 1 1 1 3 TRP HE3 A 435 . HE3 1 1 33 1 2 1 1 17 ASN HB3 A 449 . HB1 1 1 34 1 1 1 1 3 TRP HE3 A 435 . HE3 1 1 34 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 35 1 1 1 1 3 TRP HH2 A 435 . HH2 1 1 35 1 2 1 1 17 ASN HB3 A 449 . HB1 1 1 36 1 1 1 1 3 TRP HH2 A 435 . HH2 1 1 36 1 2 1 1 19 ARG HA A 451 . HA 1 1 37 1 1 1 1 3 TRP HH2 A 435 . HH2 1 1 37 1 2 1 1 22 GLU HG3 A 454 . HG1 1 1 38 1 1 1 1 3 TRP HH2 A 435 . HH2 1 1 38 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 39 1 1 1 1 3 TRP HZ2 A 435 . HZ2 1 1 39 1 2 1 1 17 ASN HD22 A 449 . HD22 1 1 40 1 1 1 1 3 TRP HZ2 A 435 . HZ2 1 1 40 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 41 1 1 1 1 3 TRP HZ2 A 435 . HZ2 1 1 41 1 2 1 1 28 PRO HB2 A 460 . HB2 1 1 42 1 1 1 1 3 TRP HZ2 A 435 . HZ2 1 1 42 1 2 1 1 28 PRO HG3 A 460 . HG1 1 1 43 1 1 1 1 3 TRP HZ3 A 435 . HZ3 1 1 43 1 2 1 1 15 TYR HB2 A 447 . HB2 1 1 44 1 1 1 1 3 TRP HZ3 A 435 . HZ3 1 1 44 1 2 1 1 17 ASN HB3 A 449 . HB1 1 1 45 1 1 1 1 3 TRP HZ3 A 435 . HZ3 1 1 45 1 2 1 1 19 ARG HA A 451 . HA 1 1 46 1 1 1 1 3 TRP HZ3 A 435 . HZ3 1 1 46 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 47 1 1 1 1 4 THR H A 436 . HN 1 1 47 1 2 1 1 16 TYR H A 448 . HN 1 1 48 1 1 1 1 4 THR H A 436 . HN 1 1 48 1 2 1 1 17 ASN HA A 449 . HA 1 1 49 1 1 1 1 4 THR HA A 436 . HA 1 1 49 1 2 1 1 5 GLU H A 437 . HN 1 1 50 1 1 1 1 4 THR HB A 436 . HB 1 1 50 1 2 1 1 5 GLU H A 437 . HN 1 1 51 1 1 1 1 4 THR HB A 436 . HB 1 1 51 1 2 1 1 16 TYR QD A 448 . HD+ 1 1 52 1 1 1 1 4 THR MG A 436 . HG2+ 1 1 52 1 2 1 1 5 GLU H A 437 . HN 1 1 53 1 1 1 1 4 THR MG A 436 . HG2+ 1 1 53 1 2 1 1 8 THR H A 440 . HN 1 1 54 1 1 1 1 4 THR MG A 436 . HG2+ 1 1 54 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 55 1 1 1 1 4 THR MG A 436 . HG2+ 1 1 55 1 2 1 1 16 TYR QD A 448 . HD+ 1 1 56 1 1 1 1 4 THR MG A 436 . HG2+ 1 1 56 1 2 1 1 16 TYR QE A 448 . HE+ 1 1 57 1 1 1 1 5 GLU HA A 437 . HA 1 1 57 1 2 1 1 6 ARG H A 438 . HN 1 1 58 1 1 1 1 5 GLU HA A 437 . HA 1 1 58 1 2 1 1 15 TYR HA A 447 . HA 1 1 59 1 1 1 1 5 GLU HA A 437 . HA 1 1 59 1 2 1 1 15 TYR QD A 447 . HD+ 1 1 60 1 1 1 1 5 GLU HA A 437 . HA 1 1 60 1 2 1 1 15 TYR QE A 447 . HE+ 1 1 61 1 1 1 1 5 GLU HA A 437 . HA 1 1 61 1 2 1 1 16 TYR H A 448 . HN 1 1 62 1 1 1 1 5 GLU HB2 A 437 . HB2 1 1 62 1 2 1 1 6 ARG H A 438 . HN 1 1 63 1 1 1 1 5 GLU HB2 A 437 . HB2 1 1 63 1 2 1 1 13 THR MG A 445 . HG2+ 1 1 64 1 1 1 1 5 GLU HB2 A 437 . HB2 1 1 64 1 2 1 1 15 TYR QD A 447 . HD+ 1 1 65 1 1 1 1 5 GLU HB2 A 437 . HB2 1 1 65 1 2 1 1 15 TYR QE A 447 . HE+ 1 1 66 1 1 1 1 5 GLU HB3 A 437 . HB1 1 1 66 1 2 1 1 6 ARG H A 438 . HN 1 1 67 1 1 1 1 5 GLU HG2 A 437 . HG2 1 1 67 1 2 1 1 6 ARG H A 438 . HN 1 1 68 1 1 1 1 5 GLU HG2 A 437 . HG2 1 1 68 1 2 1 1 15 TYR QD A 447 . HD+ 1 1 69 1 1 1 1 5 GLU HG2 A 437 . HG2 1 1 69 1 2 1 1 15 TYR QE A 447 . HE+ 1 1 70 1 1 1 1 6 ARG H A 438 . HN 1 1 70 1 2 1 1 14 TYR H A 446 . HN 1 1 71 1 1 1 1 6 ARG H A 438 . HN 1 1 71 1 2 1 1 15 TYR HA A 447 . HA 1 1 72 1 1 1 1 6 ARG HA A 438 . HA 1 1 72 1 2 1 1 7 LYS H A 439 . HN 1 1 73 1 1 1 1 6 ARG HB2 A 438 . HB2 1 1 73 1 2 1 1 7 LYS H A 439 . HN 1 1 74 1 1 1 1 6 ARG HB2 A 438 . HB2 1 1 74 1 2 1 1 14 TYR QE A 446 . HE+ 1 1 75 1 1 1 1 6 ARG HB3 A 438 . HB1 1 1 75 1 2 1 1 7 LYS H A 439 . HN 1 1 76 1 1 1 1 6 ARG HB3 A 438 . HB1 1 1 76 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 77 1 1 1 1 6 ARG HB3 A 438 . HB1 1 1 77 1 2 1 1 14 TYR QE A 446 . HE+ 1 1 78 1 1 1 1 6 ARG QD A 438 . HD+ 1 1 78 1 2 1 1 16 TYR QB A 448 . HB2 1 1 79 1 1 1 1 6 ARG HE A 438 . HE+ 1 1 79 1 2 1 1 16 TYR QB A 448 . HB2 1 1 80 1 1 1 1 7 LYS HA A 439 . HA 1 1 80 1 2 1 1 8 THR H A 440 . HN 1 1 81 1 1 1 1 7 LYS HA A 439 . HA 1 1 81 1 2 1 1 13 THR HA A 445 . HA 1 1 82 1 1 1 1 7 LYS HA A 439 . HA 1 1 82 1 2 1 1 14 TYR H A 446 . HN 1 1 83 1 1 1 1 7 LYS HA A 439 . HA 1 1 83 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 84 1 1 1 1 7 LYS HA A 439 . HA 1 1 84 1 2 1 1 14 TYR QE A 446 . HE+ 1 1 85 1 1 1 1 7 LYS HB2 A 439 . HB2 1 1 85 1 2 1 1 8 THR H A 440 . HN 1 1 86 1 1 1 1 7 LYS HB2 A 439 . HB2 1 1 86 1 2 1 1 13 THR MG A 445 . HG2+ 1 1 87 1 1 1 1 7 LYS HB3 A 439 . HB1 1 1 87 1 2 1 1 8 THR H A 440 . HN 1 1 88 1 1 1 1 7 LYS HD2 A 439 . HD2 1 1 88 1 2 1 1 13 THR MG A 445 . HG2+ 1 1 89 1 1 1 1 7 LYS HG2 A 439 . HG2 1 1 89 1 2 1 1 8 THR H A 440 . HN 1 1 90 1 1 1 1 7 LYS HG3 A 439 . HG1 1 1 90 1 2 1 1 13 THR MG A 445 . HG2+ 1 1 91 1 1 1 1 8 THR H A 440 . HN 1 1 91 1 2 1 1 12 LYS H A 444 . HN 1 1 92 1 1 1 1 8 THR H A 440 . HN 1 1 92 1 2 1 1 13 THR HA A 445 . HA 1 1 93 1 1 1 1 8 THR HA A 440 . HA 1 1 93 1 2 1 1 9 ALA H A 441 . HN 1 1 94 1 1 1 1 8 THR HA A 440 . HA 1 1 94 1 2 1 1 10 ASP H A 442 . HN 1 1 95 1 1 1 1 8 THR HB A 440 . HB 1 1 95 1 2 1 1 9 ALA H A 441 . HN 1 1 96 1 1 1 1 8 THR HB A 440 . HB 1 1 96 1 2 1 1 14 TYR QE A 446 . HE+ 1 1 97 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 97 1 2 1 1 9 ALA H A 441 . HN 1 1 98 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 98 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 99 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 99 1 2 1 1 14 TYR QE A 446 . HE+ 1 1 100 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 100 1 2 1 1 25 TRP HH2 A 457 . HH2 1 1 101 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 101 1 2 1 1 25 TRP HZ2 A 457 . HZ2 1 1 102 1 1 1 1 8 THR MG A 440 . HG2+ 1 1 102 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 103 1 1 1 1 9 ALA H A 441 . HN 1 1 103 1 2 1 1 10 ASP H A 442 . HN 1 1 104 1 1 1 1 9 ALA HA A 441 . HA 1 1 104 1 2 1 1 10 ASP H A 442 . HN 1 1 105 1 1 1 1 9 ALA MB A 441 . HB+ 1 1 105 1 2 1 1 10 ASP H A 442 . HN 1 1 106 1 1 1 1 10 ASP H A 442 . HN 1 1 106 1 2 1 1 11 GLY H A 443 . HN 1 1 107 1 1 1 1 10 ASP HA A 442 . HA 1 1 107 1 2 1 1 11 GLY H A 443 . HN 1 1 108 1 1 1 1 10 ASP HB2 A 442 . HB2 1 1 108 1 2 1 1 11 GLY H A 443 . HN 1 1 109 1 1 1 1 10 ASP HB3 A 442 . HB1 1 1 109 1 2 1 1 11 GLY H A 443 . HN 1 1 110 1 1 1 1 11 GLY H A 443 . HN 1 1 110 1 2 1 1 12 LYS H A 444 . HN 1 1 111 1 1 1 1 11 GLY HA2 A 443 . HA2 1 1 111 1 2 1 1 12 LYS H A 444 . HN 1 1 112 1 1 1 1 11 GLY HA3 A 443 . HA1 1 1 112 1 2 1 1 12 LYS H A 444 . HN 1 1 113 1 1 1 1 12 LYS HA A 444 . HA 1 1 113 1 2 1 1 13 THR H A 445 . HN 1 1 114 1 1 1 1 12 LYS HA A 444 . HA 1 1 114 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 115 1 1 1 1 12 LYS HB2 A 444 . HB2 1 1 115 1 2 1 1 13 THR H A 445 . HN 1 1 116 1 1 1 1 12 LYS HB2 A 444 . HB2 1 1 116 1 2 1 1 14 TYR QD A 446 . HD+ 1 1 117 1 1 1 1 12 LYS HB2 A 444 . HB2 1 1 117 1 2 1 1 25 TRP HE3 A 457 . HE3 1 1 118 1 1 1 1 12 LYS HB2 A 444 . HB2 1 1 118 1 2 1 1 25 TRP HH2 A 457 . HH2 1 1 119 1 1 1 1 12 LYS HB2 A 444 . HB2 1 1 119 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 120 1 1 1 1 12 LYS HB3 A 444 . HB1 1 1 120 1 2 1 1 13 THR H A 445 . HN 1 1 121 1 1 1 1 12 LYS HB3 A 444 . HB1 1 1 121 1 2 1 1 25 TRP HH2 A 457 . HH2 1 1 122 1 1 1 1 12 LYS HB3 A 444 . HB1 1 1 122 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 123 1 1 1 1 12 LYS HG2 A 444 . HG2 1 1 123 1 2 1 1 13 THR H A 445 . HN 1 1 124 1 1 1 1 12 LYS HG2 A 444 . HG2 1 1 124 1 2 1 1 25 TRP HH2 A 457 . HH2 1 1 125 1 1 1 1 12 LYS HG2 A 444 . HG2 1 1 125 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 126 1 1 1 1 12 LYS HG3 A 444 . HG1 1 1 126 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 127 1 1 1 1 13 THR HA A 445 . HA 1 1 127 1 2 1 1 14 TYR H A 446 . HN 1 1 128 1 1 1 1 13 THR MG A 445 . HG2+ 1 1 128 1 2 1 1 14 TYR H A 446 . HN 1 1 129 1 1 1 1 13 THR MG A 445 . HG2+ 1 1 129 1 2 1 1 15 TYR QD A 447 . HD+ 1 1 130 1 1 1 1 13 THR MG A 445 . HG2+ 1 1 130 1 2 1 1 15 TYR QE A 447 . HE+ 1 1 131 1 1 1 1 14 TYR HA A 446 . HA 1 1 131 1 2 1 1 15 TYR H A 447 . HN 1 1 132 1 1 1 1 14 TYR HA A 446 . HA 1 1 132 1 2 1 1 25 TRP HE3 A 457 . HE3 1 1 133 1 1 1 1 14 TYR HB2 A 446 . HB2 1 1 133 1 2 1 1 15 TYR H A 447 . HN 1 1 134 1 1 1 1 14 TYR HB2 A 446 . HB2 1 1 134 1 2 1 1 24 THR H A 456 . HN 1 1 135 1 1 1 1 14 TYR HB2 A 446 . HB2 1 1 135 1 2 1 1 25 TRP HE3 A 457 . HE3 1 1 136 1 1 1 1 14 TYR HB2 A 446 . HB2 1 1 136 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 137 1 1 1 1 14 TYR HB3 A 446 . HB1 1 1 137 1 2 1 1 15 TYR H A 447 . HN 1 1 138 1 1 1 1 14 TYR HB3 A 446 . HB1 1 1 138 1 2 1 1 24 THR H A 456 . HN 1 1 139 1 1 1 1 14 TYR HB3 A 446 . HB1 1 1 139 1 2 1 1 25 TRP HE3 A 457 . HE3 1 1 140 1 1 1 1 14 TYR HB3 A 446 . HB1 1 1 140 1 2 1 1 25 TRP HZ3 A 457 . HZ3 1 1 141 1 1 1 1 14 TYR QD A 446 . HD+ 1 1 141 1 2 1 1 16 TYR H A 448 . HN 1 1 142 1 1 1 1 14 TYR QD A 446 . HD+ 1 1 142 1 2 1 1 23 SER HA A 455 . HA 1 1 143 1 1 1 1 14 TYR QD A 446 . HD+ 1 1 143 1 2 1 1 23 SER HB2 A 455 . HB2 1 1 144 1 1 1 1 14 TYR QE A 446 . HE+ 1 1 144 1 2 1 1 16 TYR QB A 448 . HB2 1 1 145 1 1 1 1 14 TYR QE A 446 . HE+ 1 1 145 1 2 1 1 16 TYR QD A 448 . HD+ 1 1 146 1 1 1 1 14 TYR QE A 446 . HE+ 1 1 146 1 2 1 1 23 SER HB2 A 455 . HB2 1 1 147 1 1 1 1 15 TYR H A 447 . HN 1 1 147 1 2 1 1 24 THR H A 456 . HN 1 1 148 1 1 1 1 15 TYR H A 447 . HN 1 1 148 1 2 1 1 25 TRP HA A 457 . HA 1 1 149 1 1 1 1 15 TYR HA A 447 . HA 1 1 149 1 2 1 1 16 TYR H A 448 . HN 1 1 150 1 1 1 1 15 TYR HB2 A 447 . HB2 1 1 150 1 2 1 1 16 TYR H A 448 . HN 1 1 151 1 1 1 1 15 TYR HB2 A 447 . HB2 1 1 151 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 152 1 1 1 1 15 TYR HB3 A 447 . HB1 1 1 152 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 153 1 1 1 1 15 TYR QD A 447 . HD+ 1 1 153 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 154 1 1 1 1 15 TYR QD A 447 . HD+ 1 1 154 1 2 1 1 26 GLU HA A 458 . HA 1 1 155 1 1 1 1 15 TYR QD A 447 . HD+ 1 1 155 1 2 1 1 27 LYS HG2 A 459 . HG2 1 1 156 1 1 1 1 15 TYR QD A 447 . HD+ 1 1 156 1 2 1 1 28 PRO HD2 A 460 . HD2 1 1 157 1 1 1 1 15 TYR QE A 447 . HE+ 1 1 157 1 2 1 1 24 THR MG A 456 . HG2+ 1 1 158 1 1 1 1 15 TYR QE A 447 . HE+ 1 1 158 1 2 1 1 26 GLU HA A 458 . HA 1 1 159 1 1 1 1 15 TYR QE A 447 . HE+ 1 1 159 1 2 1 1 27 LYS HG2 A 459 . HG2 1 1 160 1 1 1 1 15 TYR QE A 447 . HE+ 1 1 160 1 2 1 1 28 PRO HD2 A 460 . HD2 1 1 161 1 1 1 1 15 TYR QE A 447 . HE+ 1 1 161 1 2 1 1 28 PRO HD3 A 460 . HD1 1 1 162 1 1 1 1 16 TYR H A 448 . HN 1 1 162 1 2 1 1 25 TRP HZ2 A 457 . HZ2 1 1 163 1 1 1 1 16 TYR HA A 448 . HA 1 1 163 1 2 1 1 17 ASN H A 449 . HN 1 1 164 1 1 1 1 16 TYR HA A 448 . HA 1 1 164 1 2 1 1 23 SER HA A 455 . HA 1 1 165 1 1 1 1 16 TYR QB A 448 . HB2 1 1 165 1 2 1 1 17 ASN H A 449 . HN 1 1 166 1 1 1 1 16 TYR QD A 448 . HD+ 1 1 166 1 2 1 1 18 ASN HA A 450 . HA 1 1 167 1 1 1 1 16 TYR QD A 448 . HD+ 1 1 167 1 2 1 1 21 LEU MD2 A 453 . HD2+ 1 1 168 1 1 1 1 16 TYR QD A 448 . HD+ 1 1 168 1 2 1 1 23 SER HA A 455 . HA 1 1 169 1 1 1 1 16 TYR QD A 448 . HD+ 1 1 169 1 2 1 1 23 SER HB2 A 455 . HB2 1 1 170 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 170 1 2 1 1 18 ASN HA A 450 . HA 1 1 171 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 171 1 2 1 1 18 ASN HB3 A 450 . HB1 1 1 172 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 172 1 2 1 1 21 LEU HA A 453 . HA 1 1 173 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 173 1 2 1 1 21 LEU HB2 A 453 . HB2 1 1 174 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 174 1 2 1 1 21 LEU HB3 A 453 . HB1 1 1 175 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 175 1 2 1 1 21 LEU MD1 A 453 . HD1+ 1 1 176 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 176 1 2 1 1 21 LEU MD2 A 453 . HD2+ 1 1 177 1 1 1 1 16 TYR QE A 448 . HE+ 1 1 177 1 2 1 1 23 SER HB2 A 455 . HB2 1 1 178 1 1 1 1 17 ASN H A 449 . HN 1 1 178 1 2 1 1 23 SER HA A 455 . HA 1 1 179 1 1 1 1 17 ASN HA A 449 . HA 1 1 179 1 2 1 1 18 ASN H A 450 . HN 1 1 180 1 1 1 1 17 ASN HB2 A 449 . HB2 1 1 180 1 2 1 1 18 ASN H A 450 . HN 1 1 181 1 1 1 1 17 ASN HB3 A 449 . HB1 1 1 181 1 2 1 1 18 ASN H A 450 . HN 1 1 182 1 1 1 1 17 ASN HD21 A 449 . HD21 1 1 182 1 2 1 1 20 THR MG A 452 . HG2+ 1 1 183 1 1 1 1 18 ASN H A 450 . HN 1 1 183 1 2 1 1 19 ARG H A 451 . HN 1 1 184 1 1 1 1 18 ASN HA A 450 . HA 1 1 184 1 2 1 1 19 ARG H A 451 . HN 1 1 185 1 1 1 1 18 ASN HB2 A 450 . HB2 1 1 185 1 2 1 1 19 ARG H A 451 . HN 1 1 186 1 1 1 1 18 ASN HB3 A 450 . HB1 1 1 186 1 2 1 1 19 ARG H A 451 . HN 1 1 187 1 1 1 1 19 ARG H A 451 . HN 1 1 187 1 2 1 1 20 THR H A 452 . HN 1 1 188 1 1 1 1 19 ARG H A 451 . HN 1 1 188 1 2 1 1 21 LEU H A 453 . HN 1 1 189 1 1 1 1 19 ARG HA A 451 . HA 1 1 189 1 2 1 1 20 THR H A 452 . HN 1 1 190 1 1 1 1 19 ARG HB2 A 451 . HB2 1 1 190 1 2 1 1 20 THR H A 452 . HN 1 1 191 1 1 1 1 19 ARG HB3 A 451 . HB1 1 1 191 1 2 1 1 20 THR H A 452 . HN 1 1 192 1 1 1 1 19 ARG HG2 A 451 . HG2 1 1 192 1 2 1 1 20 THR H A 452 . HN 1 1 193 1 1 1 1 19 ARG HG3 A 451 . HG1 1 1 193 1 2 1 1 20 THR H A 452 . HN 1 1 194 1 1 1 1 20 THR H A 452 . HN 1 1 194 1 2 1 1 21 LEU H A 453 . HN 1 1 195 1 1 1 1 20 THR HA A 452 . HA 1 1 195 1 2 1 1 21 LEU H A 453 . HN 1 1 196 1 1 1 1 20 THR MG A 452 . HG2+ 1 1 196 1 2 1 1 21 LEU H A 453 . HN 1 1 197 1 1 1 1 21 LEU H A 453 . HN 1 1 197 1 2 1 1 22 GLU H A 454 . HN 1 1 198 1 1 1 1 21 LEU HA A 453 . HA 1 1 198 1 2 1 1 22 GLU H A 454 . HN 1 1 199 1 1 1 1 21 LEU MD1 A 453 . HD1+ 1 1 199 1 2 1 1 22 GLU H A 454 . HN 1 1 200 1 1 1 1 21 LEU MD2 A 453 . HD2+ 1 1 200 1 2 1 1 22 GLU H A 454 . HN 1 1 201 1 1 1 1 22 GLU HA A 454 . HA 1 1 201 1 2 1 1 23 SER H A 455 . HN 1 1 202 1 1 1 1 22 GLU HB2 A 454 . HB2 1 1 202 1 2 1 1 23 SER H A 455 . HN 1 1 203 1 1 1 1 22 GLU HB3 A 454 . HB1 1 1 203 1 2 1 1 23 SER H A 455 . HN 1 1 204 1 1 1 1 22 GLU HG2 A 454 . HG2 1 1 204 1 2 1 1 23 SER H A 455 . HN 1 1 205 1 1 1 1 22 GLU HG3 A 454 . HG1 1 1 205 1 2 1 1 23 SER H A 455 . HN 1 1 206 1 1 1 1 23 SER HA A 455 . HA 1 1 206 1 2 1 1 24 THR H A 456 . HN 1 1 207 1 1 1 1 23 SER HB2 A 455 . HB2 1 1 207 1 2 1 1 24 THR H A 456 . HN 1 1 208 1 1 1 1 24 THR HA A 456 . HA 1 1 208 1 2 1 1 25 TRP H A 457 . HN 1 1 209 1 1 1 1 24 THR HB A 456 . HB 1 1 209 1 2 1 1 25 TRP H A 457 . HN 1 1 210 1 1 1 1 24 THR MG A 456 . HG2+ 1 1 210 1 2 1 1 25 TRP H A 457 . HN 1 1 211 1 1 1 1 24 THR MG A 456 . HG2+ 1 1 211 1 2 1 1 26 GLU H A 458 . HN 1 1 212 1 1 1 1 24 THR MG A 456 . HG2+ 1 1 212 1 2 1 1 28 PRO HG2 A 460 . HG2 1 1 213 1 1 1 1 24 THR MG A 456 . HG2+ 1 1 213 1 2 1 1 28 PRO HG3 A 460 . HG1 1 1 214 1 1 1 1 25 TRP H A 457 . HN 1 1 214 1 2 1 1 26 GLU H A 458 . HN 1 1 215 1 1 1 1 25 TRP HA A 457 . HA 1 1 215 1 2 1 1 26 GLU H A 458 . HN 1 1 216 1 1 1 1 25 TRP HB2 A 457 . HB2 1 1 216 1 2 1 1 26 GLU H A 458 . HN 1 1 217 1 1 1 1 25 TRP HB3 A 457 . HB1 1 1 217 1 2 1 1 26 GLU H A 458 . HN 1 1 218 1 1 1 1 26 GLU HA A 458 . HA 1 1 218 1 2 1 1 27 LYS H A 459 . HN 1 1 219 1 1 1 1 26 GLU HB2 A 458 . HB2 1 1 219 1 2 1 1 27 LYS H A 459 . HN 1 1 220 1 1 1 1 26 GLU HG2 A 458 . HG2 1 1 220 1 2 1 1 27 LYS H A 459 . HN 1 1 221 1 1 1 1 27 LYS HA A 459 . HA 1 1 221 1 2 1 1 28 PRO HD3 A 460 . HD1 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 . . . . . 4.1569 2.1131308 6.2006693 1 1 2 1 . . . . . 5.1397 2.3399308 7.9394693 1 1 3 1 . . . . . 4.168 2.1156924 6.220308 1 1 4 1 . . . . . 5.2856 2.3736 8.1976 1 1 5 1 . . . . . 4.3295 2.1529615 6.5060387 1 1 6 1 . . . . . 4.9478 2.2956462 7.5999537 1 1 7 1 . . . . . 4.3307 2.1532385 6.5081615 1 1 8 1 . . . . . 4.4292 2.1759691 6.6824307 1 1 9 1 . . . . . 4.6231 2.2207153 7.0254846 1 1 10 1 . . . . . 4.676 2.232923 7.1190767 1 1 11 1 . . . . . 4.8663 2.2768385 7.4557614 1 1 12 1 . . . . . 4.3588 2.159723 6.557877 1 1 13 1 . . . . . 4.4755 2.1866539 6.764346 1 1 14 1 . . . . . 4.3065 2.1476538 6.4653463 1 1 15 1 . . . . . 4.676 2.232923 7.1190767 1 1 16 1 . . . . . 4.6224 2.2205539 7.024246 1 1 17 1 . . . . . 4.4838 2.1885693 6.779031 1 1 18 1 . . . . . 4.9359 2.2929 7.5789 1 1 19 1 . . . . . 4.6004 2.215477 6.985323 1 1 20 1 . . . . . 5.2675 2.3694232 8.165577 1 1 21 1 . . . . . 4.6437 2.225469 7.0619307 1 1 22 1 . . . . . 4.9623 2.2989924 7.6256075 1 1 23 1 . . . . . 4.6542 2.2278924 7.0805078 1 1 24 1 . . . . . 4.7238 2.243954 7.203646 1 1 25 1 . . . . . 5.185 2.3503847 8.019615 1 1 26 1 . . . . . 4.4433 2.179223 6.707377 1 1 27 1 . . . . . 4.7583 2.2519155 7.2646847 1 1 28 1 . . . . . 4.6401 2.2246385 7.0555615 1 1 29 1 . . . . . 4.9101 2.286946 7.5332537 1 1 30 1 . . . . . 4.603 2.2160769 6.989923 1 1 31 1 . . . . . 4.9458 2.2951846 7.5964155 1 1 32 1 . . . . . 4.5126 2.1952155 6.8299847 1 1 33 1 . . . . . 4.7833 2.2576847 7.3089156 1 1 34 1 . . . . . 4.5795 2.2106538 6.948346 1 1 35 1 . . . . . 4.7266 2.2446 7.2086 1 1 36 1 . . . . . 5.1023 2.3313 7.8733 1 1 37 1 . . . . . 4.7247 2.2441616 7.2052383 1 1 38 1 . . . . . 4.8232 2.2668922 7.3795075 1 1 39 1 . . . . . 4.6527 2.2275462 7.0778537 1 1 40 1 . . . . . 4.6895 2.2360384 7.1429615 1 1 41 1 . . . . . 4.3795 2.1645 6.5945 1 1 42 1 . . . . . 4.8284 2.2680924 7.3887076 1 1 43 1 . . . . . 4.3795 2.1645 6.5945 1 1 44 1 . . . . . 4.6542 2.2278924 7.0805078 1 1 45 1 . . . . . 4.6322 2.2228153 7.0415845 1 1 46 1 . . . . . 4.7167 2.2423153 7.1910844 1 1 47 1 . . . . . 5.0279 2.3141308 7.741669 1 1 48 1 . . . . . 4.8833 2.2807615 7.4858384 1 1 49 1 . . . . . 4.0995 2.0998845 6.0991154 1 1 50 1 . . . . . 4.3457 2.1567 6.5347 1 1 51 1 . . . . . 4.7381 2.247254 7.228946 1 1 52 1 . . . . . 4.6287 2.2220078 7.0353923 1 1 53 1 . . . . . 4.8219 2.2665923 7.3772078 1 1 54 1 . . . . . 4.6163 2.2191463 7.013454 1 1 55 1 . . . . . 4.8703 2.2777615 7.4628386 1 1 56 1 . . . . . 4.8333 2.269223 7.397377 1 1 57 1 . . . . . 4.3457 2.1567 6.5347 1 1 58 1 . . . . . 4.6943 2.2371461 7.151454 1 1 59 1 . . . . . 4.7214 2.2434 7.1994 1 1 60 1 . . . . . 4.5441 2.2024846 6.8857155 1 1 61 1 . . . . . 4.8258 2.2674923 7.3841076 1 1 62 1 . . . . . 5.1443 2.3409922 7.9476075 1 1 63 1 . . . . . 4.2016 2.1745155 6.2797537 1 1 64 1 . . . . . 4.3886 2.1666 6.6106 1 1 65 1 . . . . . 4.4337 2.1770077 6.6903925 1 1 66 1 . . . . . 4.7636 2.2531385 7.2740617 1 1 67 1 . . . . . 4.8914 2.2826307 7.5001693 1 1 68 1 . . . . . 4.4771 2.1870232 6.767177 1 1 69 1 . . . . . 4.6677 2.2310076 7.1043925 1 1 70 1 . . . . . 2.6833 1.7730693 3.5935307 1 1 71 1 . . . . . 5.2026 2.3544462 8.050754 1 1 72 1 . . . . . 5.4266 2.4061384 8.447062 1 1 73 1 . . . . . 4.0047 2.0780077 5.931392 1 1 74 1 . . . . . 4.6618 2.2296462 7.0939536 1 1 75 1 . . . . . 4.7228 2.2437232 7.201877 1 1 76 1 . . . . . 4.5239 2.197823 6.849977 1 1 77 1 . . . . . 5.3005 2.3770385 8.223962 1 1 78 1 . . . . . 4.2729 2.1399 6.4059 1 1 79 1 . . . . . 4.2718 2.2237153 6.403954 1 1 80 1 . . . . . 3.0557 1.8590077 4.2523923 1 1 81 1 . . . . . 4.276 2.1406155 6.4113846 1 1 82 1 . . . . . 4.7313 2.2456846 7.2169156 1 1 83 1 . . . . . 4.6482 2.2265077 7.0698924 1 1 84 1 . . . . . 4.6478 2.2264154 7.069185 1 1 85 1 . . . . . 4.5308 2.1994154 6.8621845 1 1 86 1 . . . . . 4.9894 2.305246 7.673554 1 1 87 1 . . . . . 4.344 2.1563077 6.5316925 1 1 88 1 . . . . . 6.0 2.5384614 9.461538 1 1 89 1 . . . . . 4.2777 2.1410077 6.4143925 1 1 90 1 . . . . . 6.0 2.5384614 9.461538 1 1 91 1 . . . . . 4.2128 2.1260307 6.299569 1 1 92 1 . . . . . 4.8105 2.2639616 7.3570385 1 1 93 1 . . . . . 4.6217 2.2203922 7.023008 1 1 94 1 . . . . . 4.6489 2.2266693 7.0711308 1 1 95 1 . . . . . 4.2771 2.1408691 6.4133306 1 1 96 1 . . . . . 4.8633 2.2761462 7.4504538 1 1 97 1 . . . . . 4.5297 2.1991615 6.8602386 1 1 98 1 . . . . . 4.6528 2.2275693 7.0780306 1 1 99 1 . . . . . 5.2921 2.3751 8.2091 1 1 100 1 . . . . . 4.8428 2.2714155 7.4141846 1 1 101 1 . . . . . 4.6083 2.2173 6.9993 1 1 102 1 . . . . . 4.8628 2.2760308 7.449569 1 1 103 1 . . . . . 5.1688 2.346646 7.990954 1 1 104 1 . . . . . 4.6474 2.2263231 7.068477 1 1 105 1 . . . . . 4.5351 2.2004077 6.8697925 1 1 106 1 . . . . . 4.3561 2.1591 6.5531 1 1 107 1 . . . . . 5.3286 2.383523 8.273677 1 1 108 1 . . . . . 4.6408 2.2248 7.0568 1 1 109 1 . . . . . 4.5405 2.201654 6.8793464 1 1 110 1 . . . . . 2.4862 1.7275846 3.2448153 1 1 111 1 . . . . . 4.451 2.181 6.721 1 1 112 1 . . . . . 3.5465 1.9722692 5.120731 1 1 113 1 . . . . . 4.1827 2.1190846 6.2463155 1 1 114 1 . . . . . 4.9227 2.2898538 7.5555463 1 1 115 1 . . . . . 4.2018 2.1234922 6.2801075 1 1 116 1 . . . . . 4.6922 2.2366614 7.1477385 1 1 117 1 . . . . . 4.1565 2.1130385 6.1999617 1 1 118 1 . . . . . 5.2591 2.3674846 8.150716 1 1 119 1 . . . . . 4.6176 2.2194462 7.0157537 1 1 120 1 . . . . . 4.8708 2.2778769 7.463723 1 1 121 1 . . . . . 5.0606 2.321677 7.799523 1 1 122 1 . . . . . 4.5516 2.2042153 6.8989844 1 1 123 1 . . . . . 5.1794 2.3490922 8.009707 1 1 124 1 . . . . . 5.1965 2.3530385 8.039962 1 1 125 1 . . . . . 4.8755 2.2789614 7.4720383 1 1 126 1 . . . . . 4.6542 2.2278924 7.0805078 1 1 127 1 . . . . . 4.594 2.214 6.974 1 1 128 1 . . . . . 4.4953 2.1912231 6.799377 1 1 129 1 . . . . . 4.6873 2.2355309 7.139069 1 1 130 1 . . . . . 4.8048 2.2626462 7.346954 1 1 131 1 . . . . . 4.6744 2.232554 7.116246 1 1 132 1 . . . . . 4.0172 2.0808923 5.953508 1 1 133 1 . . . . . 3.0475 1.8571154 4.2378845 1 1 134 1 . . . . . 4.6943 2.2371461 7.151454 1 1 135 1 . . . . . 4.3222 2.1512768 6.493123 1 1 136 1 . . . . . 4.6534 2.2277076 7.0790925 1 1 137 1 . . . . . 4.6252 2.2212 7.0292 1 1 138 1 . . . . . 4.6859 2.2352078 7.1365924 1 1 139 1 . . . . . 4.4773 2.1870692 6.767531 1 1 140 1 . . . . . 4.3188 2.1504922 6.4871078 1 1 141 1 . . . . . 5.3957 2.3990078 8.392392 1 1 142 1 . . . . . 4.8906 2.2824461 7.498754 1 1 143 1 . . . . . 4.5556 2.2051384 6.9060616 1 1 144 1 . . . . . 4.6301 2.2223308 7.0378695 1 1 145 1 . . . . . 4.4738 2.2097538 6.761338 1 1 146 1 . . . . . 4.3668 2.161569 6.5720305 1 1 147 1 . . . . . 4.919 2.289 7.549 1 1 148 1 . . . . . 4.5556 2.2051384 6.9060616 1 1 149 1 . . . . . 4.5743 2.2094538 6.939146 1 1 150 1 . . . . . 4.4857 2.1890078 6.7823925 1 1 151 1 . . . . . 4.6482 2.2265077 7.0698924 1 1 152 1 . . . . . 4.6966 2.2376769 7.1555233 1 1 153 1 . . . . . 4.9606 2.2986 7.6226 1 1 154 1 . . . . . 4.9273 2.2909155 7.5636845 1 1 155 1 . . . . . 5.067 2.3231537 7.8108463 1 1 156 1 . . . . . 4.5698 2.2084153 6.931185 1 1 157 1 . . . . . 4.9699 2.3007462 7.639054 1 1 158 1 . . . . . 4.5764 2.2099385 6.9428616 1 1 159 1 . . . . . 4.8802 2.2800462 7.480354 1 1 160 1 . . . . . 4.5613 2.2064538 6.9161463 1 1 161 1 . . . . . 4.8446 2.2718308 7.4173694 1 1 162 1 . . . . . 4.6329 2.222977 7.0428233 1 1 163 1 . . . . . 4.2946 2.1449077 6.4442925 1 1 164 1 . . . . . 5.2954 2.3758616 8.214938 1 1 165 1 . . . . . 4.3571 2.1593308 6.554869 1 1 166 1 . . . . . 4.4446 2.179523 6.7096767 1 1 167 1 . . . . . 4.9418 2.2942615 7.5893383 1 1 168 1 . . . . . 4.789 2.259 7.319 1 1 169 1 . . . . . 4.4936 2.1908307 6.796369 1 1 170 1 . . . . . 4.7275 2.2448077 7.210192 1 1 171 1 . . . . . 4.5221 2.1974077 6.846792 1 1 172 1 . . . . . 4.7038 2.2393384 7.1682615 1 1 173 1 . . . . . 5.0053 2.3089154 7.7016845 1 1 174 1 . . . . . 4.9468 2.2954154 7.5981846 1 1 175 1 . . . . . 5.2396 2.3629847 8.116216 1 1 176 1 . . . . . 5.1182 2.3349693 7.9014306 1 1 177 1 . . . . . 4.6587 2.2289307 7.088469 1 1 178 1 . . . . . 4.6329 2.222977 7.0428233 1 1 179 1 . . . . . 2.7729 1.7937461 3.7520537 1 1 180 1 . . . . . 4.2816 2.1419077 6.4212923 1 1 181 1 . . . . . 4.5909 2.2132847 6.9685154 1 1 182 1 . . . . . 4.7297 2.2453153 7.2140846 1 1 183 1 . . . . . 1.75 1.25 2.25 1 1 184 1 . . . . . 3.8345 2.0387309 5.630269 1 1 185 1 . . . . . 4.4017 2.1696231 6.633777 1 1 186 1 . . . . . 3.8514 2.0426307 5.660169 1 1 187 1 . . . . . 4.1905 2.1208847 6.260115 1 1 188 1 . . . . . 4.5157 2.1959307 6.8354692 1 1 189 1 . . . . . 4.3114 2.1487846 6.474015 1 1 190 1 . . . . . 4.5313 2.1995308 6.863069 1 1 191 1 . . . . . 5.2675 2.3694232 8.165577 1 1 192 1 . . . . . 4.6387 2.2243154 7.053085 1 1 193 1 . . . . . 4.8964 2.2837846 7.5090156 1 1 194 1 . . . . . 3.1641 1.8840231 4.444177 1 1 195 1 . . . . . 3.8088 2.0328 5.5848 1 1 196 1 . . . . . 4.9733 2.3015308 7.645069 1 1 197 1 . . . . . 4.5896 2.2129846 6.9662156 1 1 198 1 . . . . . 4.7145 2.2418077 7.1871924 1 1 199 1 . . . . . 5.0759 2.3252077 7.8265924 1 1 200 1 . . . . . 5.1011 2.331023 7.8711767 1 1 201 1 . . . . . 4.643 2.2253077 7.0606923 1 1 202 1 . . . . . 4.8865 2.2815 7.4915 1 1 203 1 . . . . . 5.0144 2.3110154 7.7177844 1 1 204 1 . . . . . 4.4002 2.169277 6.631123 1 1 205 1 . . . . . 5.0512 2.3195076 7.782892 1 1 206 1 . . . . . 4.3339 2.153977 6.513823 1 1 207 1 . . . . . 4.1612 2.114123 6.2082767 1 1 208 1 . . . . . 4.208 2.124923 6.291077 1 1 209 1 . . . . . 4.5061 2.1937153 6.818485 1 1 210 1 . . . . . 4.7504 2.2500923 7.2507076 1 1 211 1 . . . . . 4.9418 2.2942615 7.5893383 1 1 212 1 . . . . . 4.8122 2.2643538 7.3600464 1 1 213 1 . . . . . 4.8714 2.2780154 7.4647846 1 1 214 1 . . . . . 4.0354 2.0850923 5.9857078 1 1 215 1 . . . . . 4.9645 2.2995 7.6295 1 1 216 1 . . . . . 3.2283 1.8988385 4.5577617 1 1 217 1 . . . . . 4.661 2.2294614 7.0925384 1 1 218 1 . . . . . 3.9707 2.0701616 5.871238 1 1 219 1 . . . . . 4.9154 2.2881691 7.5426307 1 1 220 1 . . . . . 4.2099 2.1253614 6.2944384 1 1 221 1 . . . . . 4.7511 2.250254 7.251946 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 SER C C 8.528 -1.961 6.282 1.00 . A A . 433 SER C 1 1 1 2 1 1 1 SER CA C 9.259 -0.657 6.576 1.00 . A A . 433 SER CA 1 1 1 3 1 1 1 SER CB C 10.087 -0.231 5.361 1.00 . A A . 433 SER CB 1 1 1 4 1 1 1 SER H1 H 9.575 -1.131 8.579 1.00 . A A . 433 SER H1 1 1 1 5 1 1 1 SER H2 H 10.587 0.098 7.993 1.00 . A A . 433 SER H2 1 1 1 6 1 1 1 SER H3 H 10.874 -1.519 7.562 1.00 . A A . 433 SER H3 1 1 1 7 1 1 1 SER HA H 8.529 0.110 6.793 1.00 . A A . 433 SER HA 1 1 1 8 1 1 1 SER HB2 H 10.817 -0.995 5.140 1.00 . A A . 433 SER HB2 1 1 1 9 1 1 1 SER HB3 H 9.436 -0.098 4.510 1.00 . A A . 433 SER HB3 1 1 1 10 1 1 1 SER HG H 10.133 1.649 5.948 1.00 . A A . 433 SER HG 1 1 1 11 1 1 1 SER N N 10.133 -0.812 7.759 1.00 . A A . 433 SER N 1 1 1 12 1 1 1 SER O O 9.128 -2.939 5.832 1.00 . A A . 433 SER O 1 1 1 13 1 1 1 SER OG O 10.768 0.991 5.613 1.00 . A A . 433 SER OG 1 1 1 14 1 1 2 GLU C C 5.417 -2.973 5.280 1.00 . A A . 434 GLU C 1 1 1 15 1 1 2 GLU CA C 6.426 -3.170 6.406 1.00 . A A . 434 GLU CA 1 1 1 16 1 1 2 GLU CB C 5.687 -3.507 7.710 1.00 . A A . 434 GLU CB 1 1 1 17 1 1 2 GLU CD C 7.451 -2.707 9.371 1.00 . A A . 434 GLU CD 1 1 1 18 1 1 2 GLU CG C 6.593 -3.865 8.888 1.00 . A A . 434 GLU CG 1 1 1 19 1 1 2 GLU H H 6.816 -1.156 6.922 1.00 . A A . 434 GLU H 1 1 1 20 1 1 2 GLU HA H 7.082 -3.988 6.151 1.00 . A A . 434 GLU HA 1 1 1 21 1 1 2 GLU HB2 H 5.090 -2.655 7.998 1.00 . A A . 434 GLU HB2 1 1 1 22 1 1 2 GLU HB3 H 5.029 -4.345 7.526 1.00 . A A . 434 GLU HB3 1 1 1 23 1 1 2 GLU HG2 H 5.973 -4.192 9.709 1.00 . A A . 434 GLU HG2 1 1 1 24 1 1 2 GLU HG3 H 7.244 -4.675 8.590 1.00 . A A . 434 GLU HG3 1 1 1 25 1 1 2 GLU N N 7.237 -1.976 6.573 1.00 . A A . 434 GLU N 1 1 1 26 1 1 2 GLU O O 5.301 -3.804 4.380 1.00 . A A . 434 GLU O 1 1 1 27 1 1 2 GLU OE1 O 6.888 -1.675 9.792 1.00 . A A . 434 GLU OE1 1 1 1 28 1 1 2 GLU OE2 O 8.694 -2.823 9.337 1.00 . A A . 434 GLU OE2 1 1 1 29 1 1 3 TRP C C 4.015 -0.242 3.656 1.00 . A A . 435 TRP C 1 1 1 30 1 1 3 TRP CA C 3.670 -1.552 4.355 1.00 . A A . 435 TRP CA 1 1 1 31 1 1 3 TRP CB C 2.295 -1.446 5.032 1.00 . A A . 435 TRP CB 1 1 1 32 1 1 3 TRP CD1 C 1.551 -2.900 7.019 1.00 . A A . 435 TRP CD1 1 1 1 33 1 1 3 TRP CD2 C 1.688 -3.993 5.076 1.00 . A A . 435 TRP CD2 1 1 1 34 1 1 3 TRP CE2 C 1.274 -4.899 6.068 1.00 . A A . 435 TRP CE2 1 1 1 35 1 1 3 TRP CE3 C 1.844 -4.454 3.774 1.00 . A A . 435 TRP CE3 1 1 1 36 1 1 3 TRP CG C 1.856 -2.719 5.700 1.00 . A A . 435 TRP CG 1 1 1 37 1 1 3 TRP CH2 C 1.180 -6.661 4.505 1.00 . A A . 435 TRP CH2 1 1 1 38 1 1 3 TRP CZ2 C 1.017 -6.240 5.794 1.00 . A A . 435 TRP CZ2 1 1 1 39 1 1 3 TRP CZ3 C 1.590 -5.780 3.506 1.00 . A A . 435 TRP CZ3 1 1 1 40 1 1 3 TRP H H 4.840 -1.238 6.080 1.00 . A A . 435 TRP H 1 1 1 41 1 1 3 TRP HA H 3.649 -2.350 3.626 1.00 . A A . 435 TRP HA 1 1 1 42 1 1 3 TRP HB2 H 2.329 -0.671 5.783 1.00 . A A . 435 TRP HB2 1 1 1 43 1 1 3 TRP HB3 H 1.556 -1.188 4.288 1.00 . A A . 435 TRP HB3 1 1 1 44 1 1 3 TRP HD1 H 1.585 -2.120 7.764 1.00 . A A . 435 TRP HD1 1 1 1 45 1 1 3 TRP HE1 H 0.931 -4.594 8.109 1.00 . A A . 435 TRP HE1 1 1 1 46 1 1 3 TRP HE3 H 2.161 -3.792 2.981 1.00 . A A . 435 TRP HE3 1 1 1 47 1 1 3 TRP HH2 H 0.996 -7.692 4.237 1.00 . A A . 435 TRP HH2 1 1 1 48 1 1 3 TRP HZ2 H 0.697 -6.930 6.561 1.00 . A A . 435 TRP HZ2 1 1 1 49 1 1 3 TRP HZ3 H 1.709 -6.153 2.500 1.00 . A A . 435 TRP HZ3 1 1 1 50 1 1 3 TRP N N 4.688 -1.867 5.346 1.00 . A A . 435 TRP N 1 1 1 51 1 1 3 TRP NE1 N 1.197 -4.211 7.244 1.00 . A A . 435 TRP NE1 1 1 1 52 1 1 3 TRP O O 4.440 0.718 4.305 1.00 . A A . 435 TRP O 1 1 1 53 1 1 4 THR C C 2.900 1.922 1.519 1.00 . A A . 436 THR C 1 1 1 54 1 1 4 THR CA C 4.116 1.009 1.585 1.00 . A A . 436 THR CA 1 1 1 55 1 1 4 THR CB C 4.577 0.669 0.153 1.00 . A A . 436 THR CB 1 1 1 56 1 1 4 THR CG2 C 4.801 1.937 -0.669 1.00 . A A . 436 THR CG2 1 1 1 57 1 1 4 THR H H 3.472 -0.984 1.868 1.00 . A A . 436 THR H 1 1 1 58 1 1 4 THR HA H 4.918 1.531 2.086 1.00 . A A . 436 THR HA 1 1 1 59 1 1 4 THR HB H 3.806 0.080 -0.325 1.00 . A A . 436 THR HB 1 1 1 60 1 1 4 THR HG1 H 6.122 -0.118 1.114 1.00 . A A . 436 THR HG1 1 1 1 61 1 1 4 THR HG21 H 5.146 1.673 -1.658 1.00 . A A . 436 THR HG21 1 1 1 62 1 1 4 THR HG22 H 5.539 2.557 -0.183 1.00 . A A . 436 THR HG22 1 1 1 63 1 1 4 THR HG23 H 3.868 2.484 -0.748 1.00 . A A . 436 THR HG23 1 1 1 64 1 1 4 THR N N 3.820 -0.193 2.342 1.00 . A A . 436 THR N 1 1 1 65 1 1 4 THR O O 1.969 1.689 0.746 1.00 . A A . 436 THR O 1 1 1 66 1 1 4 THR OG1 O 5.788 -0.104 0.204 1.00 . A A . 436 THR OG1 1 1 1 67 1 1 5 GLU C C 2.313 5.064 1.355 1.00 . A A . 437 GLU C 1 1 1 68 1 1 5 GLU CA C 1.867 3.961 2.304 1.00 . A A . 437 GLU CA 1 1 1 69 1 1 5 GLU CB C 1.585 4.555 3.689 1.00 . A A . 437 GLU CB 1 1 1 70 1 1 5 GLU CD C 0.912 4.168 6.092 1.00 . A A . 437 GLU CD 1 1 1 71 1 1 5 GLU CG C 1.294 3.525 4.771 1.00 . A A . 437 GLU CG 1 1 1 72 1 1 5 GLU H H 3.623 3.031 3.016 1.00 . A A . 437 GLU H 1 1 1 73 1 1 5 GLU HA H 0.967 3.503 1.919 1.00 . A A . 437 GLU HA 1 1 1 74 1 1 5 GLU HB2 H 2.444 5.132 3.998 1.00 . A A . 437 GLU HB2 1 1 1 75 1 1 5 GLU HB3 H 0.733 5.214 3.613 1.00 . A A . 437 GLU HB3 1 1 1 76 1 1 5 GLU HG2 H 0.481 2.895 4.445 1.00 . A A . 437 GLU HG2 1 1 1 77 1 1 5 GLU HG3 H 2.178 2.923 4.923 1.00 . A A . 437 GLU HG3 1 1 1 78 1 1 5 GLU N N 2.901 2.948 2.357 1.00 . A A . 437 GLU N 1 1 1 79 1 1 5 GLU O O 3.121 5.918 1.721 1.00 . A A . 437 GLU O 1 1 1 80 1 1 5 GLU OE1 O 1.754 4.887 6.670 1.00 . A A . 437 GLU OE1 1 1 1 81 1 1 5 GLU OE2 O -0.228 3.961 6.558 1.00 . A A . 437 GLU OE2 1 1 1 82 1 1 6 ARG C C 0.994 6.697 -1.419 1.00 . A A . 438 ARG C 1 1 1 83 1 1 6 ARG CA C 2.238 6.001 -0.865 1.00 . A A . 438 ARG CA 1 1 1 84 1 1 6 ARG CB C 3.013 5.326 -2.000 1.00 . A A . 438 ARG CB 1 1 1 85 1 1 6 ARG CD C 4.085 5.599 -4.262 1.00 . A A . 438 ARG CD 1 1 1 86 1 1 6 ARG CG C 3.554 6.308 -3.027 1.00 . A A . 438 ARG CG 1 1 1 87 1 1 6 ARG CZ C 5.741 3.846 -4.786 1.00 . A A . 438 ARG CZ 1 1 1 88 1 1 6 ARG H H 1.200 4.310 -0.124 1.00 . A A . 438 ARG H 1 1 1 89 1 1 6 ARG HA H 2.879 6.716 -0.370 1.00 . A A . 438 ARG HA 1 1 1 90 1 1 6 ARG HB2 H 3.845 4.779 -1.580 1.00 . A A . 438 ARG HB2 1 1 1 91 1 1 6 ARG HB3 H 2.357 4.633 -2.507 1.00 . A A . 438 ARG HB3 1 1 1 92 1 1 6 ARG HD2 H 3.323 4.928 -4.624 1.00 . A A . 438 ARG HD2 1 1 1 93 1 1 6 ARG HD3 H 4.298 6.340 -5.021 1.00 . A A . 438 ARG HD3 1 1 1 94 1 1 6 ARG HE H 5.834 5.079 -3.206 1.00 . A A . 438 ARG HE 1 1 1 95 1 1 6 ARG HG2 H 2.759 6.975 -3.323 1.00 . A A . 438 ARG HG2 1 1 1 96 1 1 6 ARG HG3 H 4.355 6.878 -2.578 1.00 . A A . 438 ARG HG3 1 1 1 97 1 1 6 ARG HH11 H 4.131 3.888 -6.018 1.00 . A A . 438 ARG HH11 1 1 1 98 1 1 6 ARG HH12 H 5.351 2.728 -6.435 1.00 . A A . 438 ARG HH12 1 1 1 99 1 1 6 ARG HH21 H 7.443 3.532 -3.729 1.00 . A A . 438 ARG HH21 1 1 1 100 1 1 6 ARG HH22 H 7.228 2.507 -5.113 1.00 . A A . 438 ARG HH22 1 1 1 101 1 1 6 ARG N N 1.840 5.016 0.124 1.00 . A A . 438 ARG N 1 1 1 102 1 1 6 ARG NE N 5.301 4.829 -3.997 1.00 . A A . 438 ARG NE 1 1 1 103 1 1 6 ARG NH1 N 5.016 3.452 -5.827 1.00 . A A . 438 ARG NH1 1 1 1 104 1 1 6 ARG NH2 N 6.895 3.246 -4.523 1.00 . A A . 438 ARG NH2 1 1 1 105 1 1 6 ARG O O -0.067 6.080 -1.498 1.00 . A A . 438 ARG O 1 1 1 106 1 1 7 LYS C C -0.044 8.602 -3.877 1.00 . A A . 439 LYS C 1 1 1 107 1 1 7 LYS CA C -0.031 8.674 -2.359 1.00 . A A . 439 LYS CA 1 1 1 108 1 1 7 LYS CB C -0.031 10.133 -1.903 1.00 . A A . 439 LYS CB 1 1 1 109 1 1 7 LYS CD C -0.459 11.747 -0.036 1.00 . A A . 439 LYS CD 1 1 1 110 1 1 7 LYS CE C -0.558 11.938 1.465 1.00 . A A . 439 LYS CE 1 1 1 111 1 1 7 LYS CG C -0.156 10.306 -0.398 1.00 . A A . 439 LYS CG 1 1 1 112 1 1 7 LYS H H 1.970 8.429 -1.748 1.00 . A A . 439 LYS H 1 1 1 113 1 1 7 LYS HA H -0.923 8.195 -1.989 1.00 . A A . 439 LYS HA 1 1 1 114 1 1 7 LYS HB2 H 0.892 10.596 -2.220 1.00 . A A . 439 LYS HB2 1 1 1 115 1 1 7 LYS HB3 H -0.860 10.645 -2.372 1.00 . A A . 439 LYS HB3 1 1 1 116 1 1 7 LYS HD2 H 0.332 12.376 -0.416 1.00 . A A . 439 LYS HD2 1 1 1 117 1 1 7 LYS HD3 H -1.398 12.033 -0.489 1.00 . A A . 439 LYS HD3 1 1 1 118 1 1 7 LYS HE2 H -1.200 11.172 1.873 1.00 . A A . 439 LYS HE2 1 1 1 119 1 1 7 LYS HE3 H 0.429 11.848 1.895 1.00 . A A . 439 LYS HE3 1 1 1 120 1 1 7 LYS HG2 H -0.956 9.677 -0.036 1.00 . A A . 439 LYS HG2 1 1 1 121 1 1 7 LYS HG3 H 0.774 10.015 0.068 1.00 . A A . 439 LYS HG3 1 1 1 122 1 1 7 LYS HZ1 H -1.022 13.450 2.832 1.00 . A A . 439 LYS HZ1 1 1 1 123 1 1 7 LYS HZ2 H -2.127 13.308 1.553 1.00 . A A . 439 LYS HZ2 1 1 1 124 1 1 7 LYS HZ3 H -0.612 14.018 1.283 1.00 . A A . 439 LYS HZ3 1 1 1 125 1 1 7 LYS N N 1.107 7.962 -1.815 1.00 . A A . 439 LYS N 1 1 1 126 1 1 7 LYS NZ N -1.117 13.270 1.808 1.00 . A A . 439 LYS NZ 1 1 1 127 1 1 7 LYS O O 0.894 9.039 -4.544 1.00 . A A . 439 LYS O 1 1 1 128 1 1 8 THR C C -2.142 9.259 -6.232 1.00 . A A . 440 THR C 1 1 1 129 1 1 8 THR CA C -1.343 8.021 -5.837 1.00 . A A . 440 THR CA 1 1 1 130 1 1 8 THR CB C -2.080 6.745 -6.305 1.00 . A A . 440 THR CB 1 1 1 131 1 1 8 THR CG2 C -3.466 6.633 -5.681 1.00 . A A . 440 THR CG2 1 1 1 132 1 1 8 THR H H -1.753 7.588 -3.813 1.00 . A A . 440 THR H 1 1 1 133 1 1 8 THR HA H -0.379 8.058 -6.329 1.00 . A A . 440 THR HA 1 1 1 134 1 1 8 THR HB H -1.499 5.884 -6.004 1.00 . A A . 440 THR HB 1 1 1 135 1 1 8 THR HG1 H -1.466 6.247 -8.121 1.00 . A A . 440 THR HG1 1 1 1 136 1 1 8 THR HG21 H -3.946 5.730 -6.031 1.00 . A A . 440 THR HG21 1 1 1 137 1 1 8 THR HG22 H -4.060 7.489 -5.964 1.00 . A A . 440 THR HG22 1 1 1 138 1 1 8 THR HG23 H -3.374 6.598 -4.606 1.00 . A A . 440 THR HG23 1 1 1 139 1 1 8 THR N N -1.108 8.031 -4.407 1.00 . A A . 440 THR N 1 1 1 140 1 1 8 THR O O -2.925 9.786 -5.429 1.00 . A A . 440 THR O 1 1 1 141 1 1 8 THR OG1 O -2.202 6.748 -7.732 1.00 . A A . 440 THR OG1 1 1 1 142 1 1 9 ALA C C -4.001 11.036 -7.888 1.00 . A A . 441 ALA C 1 1 1 143 1 1 9 ALA CA C -2.473 10.993 -7.937 1.00 . A A . 441 ALA CA 1 1 1 144 1 1 9 ALA CB C -1.993 11.267 -9.350 1.00 . A A . 441 ALA CB 1 1 1 145 1 1 9 ALA H H -1.380 9.184 -8.076 1.00 . A A . 441 ALA H 1 1 1 146 1 1 9 ALA HA H -2.083 11.775 -7.299 1.00 . A A . 441 ALA HA 1 1 1 147 1 1 9 ALA HB1 H -0.913 11.251 -9.375 1.00 . A A . 441 ALA HB1 1 1 1 148 1 1 9 ALA HB2 H -2.345 12.237 -9.668 1.00 . A A . 441 ALA HB2 1 1 1 149 1 1 9 ALA HB3 H -2.379 10.508 -10.015 1.00 . A A . 441 ALA HB3 1 1 1 150 1 1 9 ALA N N -1.925 9.723 -7.460 1.00 . A A . 441 ALA N 1 1 1 151 1 1 9 ALA O O -4.596 12.104 -8.028 1.00 . A A . 441 ALA O 1 1 1 152 1 1 10 ASP C C -6.527 10.490 -6.231 1.00 . A A . 442 ASP C 1 1 1 153 1 1 10 ASP CA C -6.087 9.820 -7.537 1.00 . A A . 442 ASP CA 1 1 1 154 1 1 10 ASP CB C -6.562 8.361 -7.568 1.00 . A A . 442 ASP CB 1 1 1 155 1 1 10 ASP CG C -8.074 8.226 -7.643 1.00 . A A . 442 ASP CG 1 1 1 156 1 1 10 ASP H H -4.108 9.061 -7.609 1.00 . A A . 442 ASP H 1 1 1 157 1 1 10 ASP HA H -6.524 10.355 -8.368 1.00 . A A . 442 ASP HA 1 1 1 158 1 1 10 ASP HB2 H -6.136 7.870 -8.430 1.00 . A A . 442 ASP HB2 1 1 1 159 1 1 10 ASP HB3 H -6.222 7.863 -6.672 1.00 . A A . 442 ASP HB3 1 1 1 160 1 1 10 ASP N N -4.632 9.886 -7.675 1.00 . A A . 442 ASP N 1 1 1 161 1 1 10 ASP O O -7.715 10.695 -5.986 1.00 . A A . 442 ASP O 1 1 1 162 1 1 10 ASP OD1 O -8.630 8.296 -8.763 1.00 . A A . 442 ASP OD1 1 1 1 163 1 1 10 ASP OD2 O -8.718 8.045 -6.590 1.00 . A A . 442 ASP OD2 1 1 1 164 1 1 11 GLY C C -6.029 10.431 -3.028 1.00 . A A . 443 GLY C 1 1 1 165 1 1 11 GLY CA C -5.844 11.458 -4.121 1.00 . A A . 443 GLY CA 1 1 1 166 1 1 11 GLY H H -4.618 10.658 -5.650 1.00 . A A . 443 GLY H 1 1 1 167 1 1 11 GLY HA2 H -5.028 12.113 -3.854 1.00 . A A . 443 GLY HA2 1 1 1 168 1 1 11 GLY HA3 H -6.748 12.040 -4.213 1.00 . A A . 443 GLY HA3 1 1 1 169 1 1 11 GLY N N -5.550 10.833 -5.396 1.00 . A A . 443 GLY N 1 1 1 170 1 1 11 GLY O O -6.663 10.698 -2.007 1.00 . A A . 443 GLY O 1 1 1 171 1 1 12 LYS C C -4.247 7.692 -1.816 1.00 . A A . 444 LYS C 1 1 1 172 1 1 12 LYS CA C -5.605 8.160 -2.299 1.00 . A A . 444 LYS CA 1 1 1 173 1 1 12 LYS CB C -6.339 6.986 -2.947 1.00 . A A . 444 LYS CB 1 1 1 174 1 1 12 LYS CD C -8.480 6.004 -3.809 1.00 . A A . 444 LYS CD 1 1 1 175 1 1 12 LYS CE C -9.991 6.160 -3.915 1.00 . A A . 444 LYS CE 1 1 1 176 1 1 12 LYS CG C -7.822 7.222 -3.174 1.00 . A A . 444 LYS CG 1 1 1 177 1 1 12 LYS H H -4.914 9.130 -4.046 1.00 . A A . 444 LYS H 1 1 1 178 1 1 12 LYS HA H -6.178 8.513 -1.453 1.00 . A A . 444 LYS HA 1 1 1 179 1 1 12 LYS HB2 H -5.881 6.781 -3.904 1.00 . A A . 444 LYS HB2 1 1 1 180 1 1 12 LYS HB3 H -6.228 6.117 -2.315 1.00 . A A . 444 LYS HB3 1 1 1 181 1 1 12 LYS HD2 H -8.073 5.863 -4.800 1.00 . A A . 444 LYS HD2 1 1 1 182 1 1 12 LYS HD3 H -8.260 5.136 -3.204 1.00 . A A . 444 LYS HD3 1 1 1 183 1 1 12 LYS HE2 H -10.394 5.300 -4.429 1.00 . A A . 444 LYS HE2 1 1 1 184 1 1 12 LYS HE3 H -10.406 6.209 -2.918 1.00 . A A . 444 LYS HE3 1 1 1 185 1 1 12 LYS HG2 H -8.295 7.422 -2.224 1.00 . A A . 444 LYS HG2 1 1 1 186 1 1 12 LYS HG3 H -7.948 8.073 -3.829 1.00 . A A . 444 LYS HG3 1 1 1 187 1 1 12 LYS HZ1 H -10.191 8.230 -4.073 1.00 . A A . 444 LYS HZ1 1 1 1 188 1 1 12 LYS HZ2 H -11.389 7.360 -4.900 1.00 . A A . 444 LYS HZ2 1 1 1 189 1 1 12 LYS HZ3 H -9.816 7.464 -5.539 1.00 . A A . 444 LYS HZ3 1 1 1 190 1 1 12 LYS N N -5.463 9.257 -3.240 1.00 . A A . 444 LYS N 1 1 1 191 1 1 12 LYS NZ N -10.374 7.387 -4.658 1.00 . A A . 444 LYS NZ 1 1 1 192 1 1 12 LYS O O -3.306 7.570 -2.601 1.00 . A A . 444 LYS O 1 1 1 193 1 1 13 THR C C -3.092 5.298 -0.042 1.00 . A A . 445 THR C 1 1 1 194 1 1 13 THR CA C -2.956 6.815 0.021 1.00 . A A . 445 THR CA 1 1 1 195 1 1 13 THR CB C -2.718 7.259 1.476 1.00 . A A . 445 THR CB 1 1 1 196 1 1 13 THR CG2 C -1.326 6.852 1.941 1.00 . A A . 445 THR CG2 1 1 1 197 1 1 13 THR H H -4.915 7.601 0.062 1.00 . A A . 445 THR H 1 1 1 198 1 1 13 THR HA H -2.115 7.123 -0.578 1.00 . A A . 445 THR HA 1 1 1 199 1 1 13 THR HB H -3.453 6.786 2.112 1.00 . A A . 445 THR HB 1 1 1 200 1 1 13 THR HG1 H -3.443 8.996 0.871 1.00 . A A . 445 THR HG1 1 1 1 201 1 1 13 THR HG21 H -1.291 6.858 3.021 1.00 . A A . 445 THR HG21 1 1 1 202 1 1 13 THR HG22 H -0.602 7.553 1.556 1.00 . A A . 445 THR HG22 1 1 1 203 1 1 13 THR HG23 H -1.096 5.863 1.574 1.00 . A A . 445 THR HG23 1 1 1 204 1 1 13 THR N N -4.154 7.412 -0.530 1.00 . A A . 445 THR N 1 1 1 205 1 1 13 THR O O -3.760 4.692 0.795 1.00 . A A . 445 THR O 1 1 1 206 1 1 13 THR OG1 O -2.857 8.686 1.570 1.00 . A A . 445 THR OG1 1 1 1 207 1 1 14 TYR C C -1.558 2.501 -0.587 1.00 . A A . 446 TYR C 1 1 1 208 1 1 14 TYR CA C -2.669 3.271 -1.275 1.00 . A A . 446 TYR CA 1 1 1 209 1 1 14 TYR CB C -2.708 2.937 -2.771 1.00 . A A . 446 TYR CB 1 1 1 210 1 1 14 TYR CD1 C -0.986 4.444 -3.850 1.00 . A A . 446 TYR CD1 1 1 1 211 1 1 14 TYR CD2 C -0.653 2.089 -3.966 1.00 . A A . 446 TYR CD2 1 1 1 212 1 1 14 TYR CE1 C 0.176 4.647 -4.571 1.00 . A A . 446 TYR CE1 1 1 1 213 1 1 14 TYR CE2 C 0.512 2.283 -4.684 1.00 . A A . 446 TYR CE2 1 1 1 214 1 1 14 TYR CG C -1.419 3.165 -3.534 1.00 . A A . 446 TYR CG 1 1 1 215 1 1 14 TYR CZ C 0.922 3.564 -4.983 1.00 . A A . 446 TYR CZ 1 1 1 216 1 1 14 TYR H H -1.921 5.207 -1.662 1.00 . A A . 446 TYR H 1 1 1 217 1 1 14 TYR HA H -3.615 2.994 -0.834 1.00 . A A . 446 TYR HA 1 1 1 218 1 1 14 TYR HB2 H -2.966 1.895 -2.882 1.00 . A A . 446 TYR HB2 1 1 1 219 1 1 14 TYR HB3 H -3.475 3.536 -3.238 1.00 . A A . 446 TYR HB3 1 1 1 220 1 1 14 TYR HD1 H -1.569 5.291 -3.519 1.00 . A A . 446 TYR HD1 1 1 1 221 1 1 14 TYR HD2 H -0.978 1.086 -3.732 1.00 . A A . 446 TYR HD2 1 1 1 222 1 1 14 TYR HE1 H 0.495 5.652 -4.807 1.00 . A A . 446 TYR HE1 1 1 1 223 1 1 14 TYR HE2 H 1.094 1.433 -5.009 1.00 . A A . 446 TYR HE2 1 1 1 224 1 1 14 TYR HH H 1.966 3.373 -6.595 1.00 . A A . 446 TYR HH 1 1 1 225 1 1 14 TYR N N -2.502 4.693 -1.061 1.00 . A A . 446 TYR N 1 1 1 226 1 1 14 TYR O O -0.394 2.909 -0.623 1.00 . A A . 446 TYR O 1 1 1 227 1 1 14 TYR OH O 2.076 3.762 -5.712 1.00 . A A . 446 TYR OH 1 1 1 228 1 1 15 TYR C C -0.563 -0.607 -0.132 1.00 . A A . 447 TYR C 1 1 1 229 1 1 15 TYR CA C -0.950 0.580 0.735 1.00 . A A . 447 TYR CA 1 1 1 230 1 1 15 TYR CB C -1.518 0.127 2.084 1.00 . A A . 447 TYR CB 1 1 1 231 1 1 15 TYR CD1 C -2.109 2.393 3.045 1.00 . A A . 447 TYR CD1 1 1 1 232 1 1 15 TYR CD2 C -3.842 0.773 2.822 1.00 . A A . 447 TYR CD2 1 1 1 233 1 1 15 TYR CE1 C -3.020 3.300 3.556 1.00 . A A . 447 TYR CE1 1 1 1 234 1 1 15 TYR CE2 C -4.754 1.670 3.334 1.00 . A A . 447 TYR CE2 1 1 1 235 1 1 15 TYR CG C -2.505 1.115 2.668 1.00 . A A . 447 TYR CG 1 1 1 236 1 1 15 TYR CZ C -4.341 2.932 3.697 1.00 . A A . 447 TYR CZ 1 1 1 237 1 1 15 TYR H H -2.846 1.078 -0.017 1.00 . A A . 447 TYR H 1 1 1 238 1 1 15 TYR HA H -0.075 1.188 0.906 1.00 . A A . 447 TYR HA 1 1 1 239 1 1 15 TYR HB2 H -2.026 -0.818 1.959 1.00 . A A . 447 TYR HB2 1 1 1 240 1 1 15 TYR HB3 H -0.708 0.009 2.789 1.00 . A A . 447 TYR HB3 1 1 1 241 1 1 15 TYR HD1 H -1.075 2.677 2.930 1.00 . A A . 447 TYR HD1 1 1 1 242 1 1 15 TYR HD2 H -4.165 -0.218 2.538 1.00 . A A . 447 TYR HD2 1 1 1 243 1 1 15 TYR HE1 H -2.696 4.288 3.845 1.00 . A A . 447 TYR HE1 1 1 1 244 1 1 15 TYR HE2 H -5.788 1.381 3.446 1.00 . A A . 447 TYR HE2 1 1 1 245 1 1 15 TYR HH H -5.046 4.717 3.870 1.00 . A A . 447 TYR HH 1 1 1 246 1 1 15 TYR N N -1.915 1.382 0.023 1.00 . A A . 447 TYR N 1 1 1 247 1 1 15 TYR O O -1.235 -1.639 -0.152 1.00 . A A . 447 TYR O 1 1 1 248 1 1 15 TYR OH O -5.257 3.834 4.197 1.00 . A A . 447 TYR OH 1 1 1 249 1 1 16 TYR C C 1.961 -2.351 -1.080 1.00 . A A . 448 TYR C 1 1 1 250 1 1 16 TYR CA C 0.951 -1.464 -1.794 1.00 . A A . 448 TYR CA 1 1 1 251 1 1 16 TYR CB C 1.580 -0.840 -3.041 1.00 . A A . 448 TYR CB 1 1 1 252 1 1 16 TYR CD1 C 1.059 -2.583 -4.788 1.00 . A A . 448 TYR CD1 1 1 1 253 1 1 16 TYR CD2 C 3.348 -2.056 -4.381 1.00 . A A . 448 TYR CD2 1 1 1 254 1 1 16 TYR CE1 C 1.437 -3.501 -5.749 1.00 . A A . 448 TYR CE1 1 1 1 255 1 1 16 TYR CE2 C 3.734 -2.972 -5.342 1.00 . A A . 448 TYR CE2 1 1 1 256 1 1 16 TYR CG C 2.005 -1.846 -4.087 1.00 . A A . 448 TYR CG 1 1 1 257 1 1 16 TYR CZ C 2.775 -3.692 -6.022 1.00 . A A . 448 TYR CZ 1 1 1 258 1 1 16 TYR H H 0.926 0.447 -0.916 1.00 . A A . 448 TYR H 1 1 1 259 1 1 16 TYR HA H 0.098 -2.058 -2.085 1.00 . A A . 448 TYR HA 1 1 1 260 1 1 16 TYR HB2 H 0.863 -0.175 -3.497 1.00 . A A . 448 TYR HB2 1 1 1 261 1 1 16 TYR HB3 H 2.452 -0.275 -2.750 1.00 . A A . 448 TYR HB3 1 1 1 262 1 1 16 TYR HD1 H 0.011 -2.432 -4.573 1.00 . A A . 448 TYR HD1 1 1 1 263 1 1 16 TYR HD2 H 4.097 -1.492 -3.845 1.00 . A A . 448 TYR HD2 1 1 1 264 1 1 16 TYR HE1 H 0.685 -4.061 -6.285 1.00 . A A . 448 TYR HE1 1 1 1 265 1 1 16 TYR HE2 H 4.782 -3.120 -5.555 1.00 . A A . 448 TYR HE2 1 1 1 266 1 1 16 TYR HH H 3.879 -5.143 -6.636 1.00 . A A . 448 TYR HH 1 1 1 267 1 1 16 TYR N N 0.485 -0.425 -0.906 1.00 . A A . 448 TYR N 1 1 1 268 1 1 16 TYR O O 2.875 -1.871 -0.403 1.00 . A A . 448 TYR O 1 1 1 269 1 1 16 TYR OH O 3.156 -4.606 -6.979 1.00 . A A . 448 TYR OH 1 1 1 270 1 1 17 ASN C C 3.416 -5.403 -1.623 1.00 . A A . 449 ASN C 1 1 1 271 1 1 17 ASN CA C 2.609 -4.634 -0.589 1.00 . A A . 449 ASN CA 1 1 1 272 1 1 17 ASN CB C 1.728 -5.570 0.236 1.00 . A A . 449 ASN CB 1 1 1 273 1 1 17 ASN CG C 2.426 -6.834 0.698 1.00 . A A . 449 ASN CG 1 1 1 274 1 1 17 ASN H H 1.029 -3.962 -1.797 1.00 . A A . 449 ASN H 1 1 1 275 1 1 17 ASN HA H 3.288 -4.115 0.071 1.00 . A A . 449 ASN HA 1 1 1 276 1 1 17 ASN HB2 H 1.382 -5.041 1.111 1.00 . A A . 449 ASN HB2 1 1 1 277 1 1 17 ASN HB3 H 0.873 -5.855 -0.360 1.00 . A A . 449 ASN HB3 1 1 1 278 1 1 17 ASN HD21 H 0.667 -7.730 0.880 1.00 . A A . 449 ASN HD21 1 1 1 279 1 1 17 ASN HD22 H 2.048 -8.690 1.296 1.00 . A A . 449 ASN HD22 1 1 1 280 1 1 17 ASN N N 1.771 -3.649 -1.232 1.00 . A A . 449 ASN N 1 1 1 281 1 1 17 ASN ND2 N 1.637 -7.852 0.983 1.00 . A A . 449 ASN ND2 1 1 1 282 1 1 17 ASN O O 2.865 -6.132 -2.447 1.00 . A A . 449 ASN O 1 1 1 283 1 1 17 ASN OD1 O 3.649 -6.890 0.825 1.00 . A A . 449 ASN OD1 1 1 1 284 1 1 18 ASN C C 6.367 -7.019 -1.767 1.00 . A A . 450 ASN C 1 1 1 285 1 1 18 ASN CA C 5.628 -5.901 -2.494 1.00 . A A . 450 ASN CA 1 1 1 286 1 1 18 ASN CB C 6.621 -4.908 -3.106 1.00 . A A . 450 ASN CB 1 1 1 287 1 1 18 ASN CG C 7.500 -4.235 -2.068 1.00 . A A . 450 ASN CG 1 1 1 288 1 1 18 ASN H H 5.098 -4.582 -0.932 1.00 . A A . 450 ASN H 1 1 1 289 1 1 18 ASN HA H 5.033 -6.335 -3.284 1.00 . A A . 450 ASN HA 1 1 1 290 1 1 18 ASN HB2 H 7.257 -5.430 -3.803 1.00 . A A . 450 ASN HB2 1 1 1 291 1 1 18 ASN HB3 H 6.070 -4.142 -3.633 1.00 . A A . 450 ASN HB3 1 1 1 292 1 1 18 ASN HD21 H 8.919 -3.950 -3.432 1.00 . A A . 450 ASN HD21 1 1 1 293 1 1 18 ASN HD22 H 9.264 -3.359 -1.839 1.00 . A A . 450 ASN HD22 1 1 1 294 1 1 18 ASN N N 4.724 -5.214 -1.585 1.00 . A A . 450 ASN N 1 1 1 295 1 1 18 ASN ND2 N 8.678 -3.809 -2.484 1.00 . A A . 450 ASN ND2 1 1 1 296 1 1 18 ASN O O 7.201 -7.708 -2.349 1.00 . A A . 450 ASN O 1 1 1 297 1 1 18 ASN OD1 O 7.113 -4.084 -0.909 1.00 . A A . 450 ASN OD1 1 1 1 298 1 1 19 ARG C C 6.058 -9.625 -0.113 1.00 . A A . 451 ARG C 1 1 1 299 1 1 19 ARG CA C 6.629 -8.275 0.304 1.00 . A A . 451 ARG CA 1 1 1 300 1 1 19 ARG CB C 6.396 -8.049 1.804 1.00 . A A . 451 ARG CB 1 1 1 301 1 1 19 ARG CD C 7.534 -5.791 1.968 1.00 . A A . 451 ARG CD 1 1 1 302 1 1 19 ARG CG C 7.471 -7.217 2.493 1.00 . A A . 451 ARG CG 1 1 1 303 1 1 19 ARG CZ C 9.025 -3.829 2.252 1.00 . A A . 451 ARG CZ 1 1 1 304 1 1 19 ARG H H 5.361 -6.622 -0.082 1.00 . A A . 451 ARG H 1 1 1 305 1 1 19 ARG HA H 7.689 -8.274 0.113 1.00 . A A . 451 ARG HA 1 1 1 306 1 1 19 ARG HB2 H 5.449 -7.547 1.933 1.00 . A A . 451 ARG HB2 1 1 1 307 1 1 19 ARG HB3 H 6.349 -9.011 2.293 1.00 . A A . 451 ARG HB3 1 1 1 308 1 1 19 ARG HD2 H 7.758 -5.818 0.911 1.00 . A A . 451 ARG HD2 1 1 1 309 1 1 19 ARG HD3 H 6.574 -5.320 2.122 1.00 . A A . 451 ARG HD3 1 1 1 310 1 1 19 ARG HE H 8.950 -5.411 3.482 1.00 . A A . 451 ARG HE 1 1 1 311 1 1 19 ARG HG2 H 7.258 -7.185 3.551 1.00 . A A . 451 ARG HG2 1 1 1 312 1 1 19 ARG HG3 H 8.430 -7.690 2.335 1.00 . A A . 451 ARG HG3 1 1 1 313 1 1 19 ARG HH11 H 7.819 -3.714 0.626 1.00 . A A . 451 ARG HH11 1 1 1 314 1 1 19 ARG HH12 H 8.889 -2.368 0.861 1.00 . A A . 451 ARG HH12 1 1 1 315 1 1 19 ARG HH21 H 10.362 -3.643 3.767 1.00 . A A . 451 ARG HH21 1 1 1 316 1 1 19 ARG HH22 H 10.333 -2.327 2.630 1.00 . A A . 451 ARG HH22 1 1 1 317 1 1 19 ARG N N 6.034 -7.207 -0.493 1.00 . A A . 451 ARG N 1 1 1 318 1 1 19 ARG NE N 8.567 -5.014 2.658 1.00 . A A . 451 ARG NE 1 1 1 319 1 1 19 ARG NH1 N 8.539 -3.258 1.161 1.00 . A A . 451 ARG NH1 1 1 1 320 1 1 19 ARG NH2 N 9.981 -3.215 2.940 1.00 . A A . 451 ARG NH2 1 1 1 321 1 1 19 ARG O O 6.792 -10.597 -0.291 1.00 . A A . 451 ARG O 1 1 1 322 1 1 20 THR C C 3.304 -10.647 -1.994 1.00 . A A . 452 THR C 1 1 1 323 1 1 20 THR CA C 4.072 -10.896 -0.696 1.00 . A A . 452 THR CA 1 1 1 324 1 1 20 THR CB C 3.130 -11.454 0.388 1.00 . A A . 452 THR CB 1 1 1 325 1 1 20 THR CG2 C 3.909 -12.205 1.457 1.00 . A A . 452 THR CG2 1 1 1 326 1 1 20 THR H H 4.200 -8.902 -0.010 1.00 . A A . 452 THR H 1 1 1 327 1 1 20 THR HA H 4.837 -11.636 -0.889 1.00 . A A . 452 THR HA 1 1 1 328 1 1 20 THR HB H 2.436 -12.140 -0.078 1.00 . A A . 452 THR HB 1 1 1 329 1 1 20 THR HG1 H 1.527 -10.717 1.284 1.00 . A A . 452 THR HG1 1 1 1 330 1 1 20 THR HG21 H 4.446 -13.024 1.004 1.00 . A A . 452 THR HG21 1 1 1 331 1 1 20 THR HG22 H 3.223 -12.588 2.198 1.00 . A A . 452 THR HG22 1 1 1 332 1 1 20 THR HG23 H 4.611 -11.534 1.930 1.00 . A A . 452 THR HG23 1 1 1 333 1 1 20 THR N N 4.742 -9.685 -0.245 1.00 . A A . 452 THR N 1 1 1 334 1 1 20 THR O O 2.662 -11.555 -2.526 1.00 . A A . 452 THR O 1 1 1 335 1 1 20 THR OG1 O 2.393 -10.387 0.992 1.00 . A A . 452 THR OG1 1 1 1 336 1 1 21 LEU C C 1.212 -8.952 -3.582 1.00 . A A . 453 LEU C 1 1 1 337 1 1 21 LEU CA C 2.727 -9.000 -3.736 1.00 . A A . 453 LEU CA 1 1 1 338 1 1 21 LEU CB C 3.131 -9.907 -4.904 1.00 . A A . 453 LEU CB 1 1 1 339 1 1 21 LEU CD1 C 4.929 -10.933 -6.313 1.00 . A A . 453 LEU CD1 1 1 1 340 1 1 21 LEU CD2 C 5.084 -8.527 -5.661 1.00 . A A . 453 LEU CD2 1 1 1 341 1 1 21 LEU CG C 4.626 -9.912 -5.230 1.00 . A A . 453 LEU CG 1 1 1 342 1 1 21 LEU H H 3.881 -8.734 -1.983 1.00 . A A . 453 LEU H 1 1 1 343 1 1 21 LEU HA H 3.067 -7.996 -3.954 1.00 . A A . 453 LEU HA 1 1 1 344 1 1 21 LEU HB2 H 2.830 -10.918 -4.668 1.00 . A A . 453 LEU HB2 1 1 1 345 1 1 21 LEU HB3 H 2.595 -9.586 -5.784 1.00 . A A . 453 LEU HB3 1 1 1 346 1 1 21 LEU HD11 H 4.626 -11.914 -5.979 1.00 . A A . 453 LEU HD11 1 1 1 347 1 1 21 LEU HD12 H 5.989 -10.933 -6.520 1.00 . A A . 453 LEU HD12 1 1 1 348 1 1 21 LEU HD13 H 4.387 -10.676 -7.212 1.00 . A A . 453 LEU HD13 1 1 1 349 1 1 21 LEU HD21 H 4.899 -7.823 -4.862 1.00 . A A . 453 LEU HD21 1 1 1 350 1 1 21 LEU HD22 H 4.538 -8.224 -6.542 1.00 . A A . 453 LEU HD22 1 1 1 351 1 1 21 LEU HD23 H 6.140 -8.551 -5.882 1.00 . A A . 453 LEU HD23 1 1 1 352 1 1 21 LEU HG H 5.179 -10.190 -4.344 1.00 . A A . 453 LEU HG 1 1 1 353 1 1 21 LEU N N 3.376 -9.404 -2.484 1.00 . A A . 453 LEU N 1 1 1 354 1 1 21 LEU O O 0.498 -9.863 -4.003 1.00 . A A . 453 LEU O 1 1 1 355 1 1 22 GLU C C -1.024 -6.269 -2.527 1.00 . A A . 454 GLU C 1 1 1 356 1 1 22 GLU CA C -0.672 -7.755 -2.604 1.00 . A A . 454 GLU CA 1 1 1 357 1 1 22 GLU CB C -0.975 -8.464 -1.278 1.00 . A A . 454 GLU CB 1 1 1 358 1 1 22 GLU CD C -2.735 -9.328 0.299 1.00 . A A . 454 GLU CD 1 1 1 359 1 1 22 GLU CG C -2.419 -8.362 -0.821 1.00 . A A . 454 GLU CG 1 1 1 360 1 1 22 GLU H H 1.370 -7.214 -2.617 1.00 . A A . 454 GLU H 1 1 1 361 1 1 22 GLU HA H -1.242 -8.216 -3.396 1.00 . A A . 454 GLU HA 1 1 1 362 1 1 22 GLU HB2 H -0.732 -9.511 -1.383 1.00 . A A . 454 GLU HB2 1 1 1 363 1 1 22 GLU HB3 H -0.347 -8.037 -0.509 1.00 . A A . 454 GLU HB3 1 1 1 364 1 1 22 GLU HG2 H -2.604 -7.359 -0.472 1.00 . A A . 454 GLU HG2 1 1 1 365 1 1 22 GLU HG3 H -3.064 -8.578 -1.656 1.00 . A A . 454 GLU HG3 1 1 1 366 1 1 22 GLU N N 0.743 -7.913 -2.909 1.00 . A A . 454 GLU N 1 1 1 367 1 1 22 GLU O O -0.237 -5.467 -2.029 1.00 . A A . 454 GLU O 1 1 1 368 1 1 22 GLU OE1 O -2.117 -9.221 1.374 1.00 . A A . 454 GLU OE1 1 1 1 369 1 1 22 GLU OE2 O -3.601 -10.209 0.100 1.00 . A A . 454 GLU OE2 1 1 1 370 1 1 23 SER C C -3.655 -4.354 -1.815 1.00 . A A . 455 SER C 1 1 1 371 1 1 23 SER CA C -2.634 -4.517 -2.938 1.00 . A A . 455 SER CA 1 1 1 372 1 1 23 SER CB C -3.216 -4.061 -4.278 1.00 . A A . 455 SER CB 1 1 1 373 1 1 23 SER H H -2.772 -6.567 -3.452 1.00 . A A . 455 SER H 1 1 1 374 1 1 23 SER HA H -1.768 -3.910 -2.711 1.00 . A A . 455 SER HA 1 1 1 375 1 1 23 SER HB2 H -3.719 -3.114 -4.145 1.00 . A A . 455 SER HB2 1 1 1 376 1 1 23 SER HB3 H -2.414 -3.944 -4.991 1.00 . A A . 455 SER HB3 1 1 1 377 1 1 23 SER HG H -4.491 -5.543 -4.070 1.00 . A A . 455 SER HG 1 1 1 378 1 1 23 SER N N -2.191 -5.897 -3.022 1.00 . A A . 455 SER N 1 1 1 379 1 1 23 SER O O -4.742 -4.933 -1.865 1.00 . A A . 455 SER O 1 1 1 380 1 1 23 SER OG O -4.145 -5.004 -4.792 1.00 . A A . 455 SER OG 1 1 1 381 1 1 24 THR C C -4.663 -1.962 0.423 1.00 . A A . 456 THR C 1 1 1 382 1 1 24 THR CA C -4.149 -3.399 0.361 1.00 . A A . 456 THR CA 1 1 1 383 1 1 24 THR CB C -3.374 -3.730 1.650 1.00 . A A . 456 THR CB 1 1 1 384 1 1 24 THR CG2 C -4.324 -3.916 2.821 1.00 . A A . 456 THR CG2 1 1 1 385 1 1 24 THR H H -2.436 -3.105 -0.831 1.00 . A A . 456 THR H 1 1 1 386 1 1 24 THR HA H -4.986 -4.076 0.279 1.00 . A A . 456 THR HA 1 1 1 387 1 1 24 THR HB H -2.702 -2.914 1.874 1.00 . A A . 456 THR HB 1 1 1 388 1 1 24 THR HG1 H -3.209 -5.668 1.298 1.00 . A A . 456 THR HG1 1 1 1 389 1 1 24 THR HG21 H -4.838 -2.987 3.021 1.00 . A A . 456 THR HG21 1 1 1 390 1 1 24 THR HG22 H -3.764 -4.214 3.694 1.00 . A A . 456 THR HG22 1 1 1 391 1 1 24 THR HG23 H -5.046 -4.681 2.579 1.00 . A A . 456 THR HG23 1 1 1 392 1 1 24 THR N N -3.297 -3.579 -0.800 1.00 . A A . 456 THR N 1 1 1 393 1 1 24 THR O O -3.886 -1.015 0.357 1.00 . A A . 456 THR O 1 1 1 394 1 1 24 THR OG1 O -2.612 -4.932 1.462 1.00 . A A . 456 THR OG1 1 1 1 395 1 1 25 TRP C C -7.289 -0.205 1.873 1.00 . A A . 457 TRP C 1 1 1 396 1 1 25 TRP CA C -6.559 -0.460 0.551 1.00 . A A . 457 TRP CA 1 1 1 397 1 1 25 TRP CB C -7.467 -0.258 -0.668 1.00 . A A . 457 TRP CB 1 1 1 398 1 1 25 TRP CD1 C -6.134 -1.393 -2.544 1.00 . A A . 457 TRP CD1 1 1 1 399 1 1 25 TRP CD2 C -6.306 0.830 -2.754 1.00 . A A . 457 TRP CD2 1 1 1 400 1 1 25 TRP CE2 C -5.524 0.331 -3.815 1.00 . A A . 457 TRP CE2 1 1 1 401 1 1 25 TRP CE3 C -6.552 2.205 -2.688 1.00 . A A . 457 TRP CE3 1 1 1 402 1 1 25 TRP CG C -6.675 -0.289 -1.942 1.00 . A A . 457 TRP CG 1 1 1 403 1 1 25 TRP CH2 C -5.243 2.493 -4.707 1.00 . A A . 457 TRP CH2 1 1 1 404 1 1 25 TRP CZ2 C -4.987 1.154 -4.793 1.00 . A A . 457 TRP CZ2 1 1 1 405 1 1 25 TRP CZ3 C -6.022 3.022 -3.669 1.00 . A A . 457 TRP CZ3 1 1 1 406 1 1 25 TRP H H -6.565 -2.586 0.495 1.00 . A A . 457 TRP H 1 1 1 407 1 1 25 TRP HA H -5.743 0.244 0.485 1.00 . A A . 457 TRP HA 1 1 1 408 1 1 25 TRP HB2 H -8.205 -1.045 -0.704 1.00 . A A . 457 TRP HB2 1 1 1 409 1 1 25 TRP HB3 H -7.960 0.701 -0.598 1.00 . A A . 457 TRP HB3 1 1 1 410 1 1 25 TRP HD1 H -6.239 -2.402 -2.172 1.00 . A A . 457 TRP HD1 1 1 1 411 1 1 25 TRP HE1 H -4.948 -1.632 -4.257 1.00 . A A . 457 TRP HE1 1 1 1 412 1 1 25 TRP HE3 H -7.152 2.629 -1.895 1.00 . A A . 457 TRP HE3 1 1 1 413 1 1 25 TRP HH2 H -4.846 3.168 -5.451 1.00 . A A . 457 TRP HH2 1 1 1 414 1 1 25 TRP HZ2 H -4.368 0.763 -5.586 1.00 . A A . 457 TRP HZ2 1 1 1 415 1 1 25 TRP HZ3 H -6.199 4.087 -3.636 1.00 . A A . 457 TRP HZ3 1 1 1 416 1 1 25 TRP N N -5.975 -1.797 0.503 1.00 . A A . 457 TRP N 1 1 1 417 1 1 25 TRP NE1 N -5.431 -1.024 -3.661 1.00 . A A . 457 TRP NE1 1 1 1 418 1 1 25 TRP O O -7.832 0.878 2.098 1.00 . A A . 457 TRP O 1 1 1 419 1 1 26 GLU C C -6.693 -1.404 5.085 1.00 . A A . 458 GLU C 1 1 1 420 1 1 26 GLU CA C -7.809 -1.079 4.092 1.00 . A A . 458 GLU CA 1 1 1 421 1 1 26 GLU CB C -9.021 -2.001 4.309 1.00 . A A . 458 GLU CB 1 1 1 422 1 1 26 GLU CD C -8.815 -3.604 2.350 1.00 . A A . 458 GLU CD 1 1 1 423 1 1 26 GLU CG C -8.814 -3.447 3.861 1.00 . A A . 458 GLU CG 1 1 1 424 1 1 26 GLU H H -6.946 -2.079 2.462 1.00 . A A . 458 GLU H 1 1 1 425 1 1 26 GLU HA H -8.114 -0.052 4.235 1.00 . A A . 458 GLU HA 1 1 1 426 1 1 26 GLU HB2 H -9.260 -2.010 5.360 1.00 . A A . 458 GLU HB2 1 1 1 427 1 1 26 GLU HB3 H -9.863 -1.598 3.764 1.00 . A A . 458 GLU HB3 1 1 1 428 1 1 26 GLU HG2 H -7.864 -3.793 4.240 1.00 . A A . 458 GLU HG2 1 1 1 429 1 1 26 GLU HG3 H -9.606 -4.055 4.273 1.00 . A A . 458 GLU HG3 1 1 1 430 1 1 26 GLU N N -7.300 -1.210 2.737 1.00 . A A . 458 GLU N 1 1 1 431 1 1 26 GLU O O -6.124 -2.493 5.039 1.00 . A A . 458 GLU O 1 1 1 432 1 1 26 GLU OE1 O -9.908 -3.558 1.746 1.00 . A A . 458 GLU OE1 1 1 1 433 1 1 26 GLU OE2 O -7.724 -3.749 1.759 1.00 . A A . 458 GLU OE2 1 1 1 434 1 1 27 LYS C C -5.639 -1.740 7.949 1.00 . A A . 459 LYS C 1 1 1 435 1 1 27 LYS CA C -5.284 -0.662 6.927 1.00 . A A . 459 LYS CA 1 1 1 436 1 1 27 LYS CB C -4.946 0.641 7.652 1.00 . A A . 459 LYS CB 1 1 1 437 1 1 27 LYS CD C -3.734 2.849 7.498 1.00 . A A . 459 LYS CD 1 1 1 438 1 1 27 LYS CE C -2.517 2.383 8.283 1.00 . A A . 459 LYS CE 1 1 1 439 1 1 27 LYS CG C -4.377 1.704 6.732 1.00 . A A . 459 LYS CG 1 1 1 440 1 1 27 LYS H H -6.858 0.393 5.956 1.00 . A A . 459 LYS H 1 1 1 441 1 1 27 LYS HA H -4.416 -0.977 6.375 1.00 . A A . 459 LYS HA 1 1 1 442 1 1 27 LYS HB2 H -5.844 1.031 8.107 1.00 . A A . 459 LYS HB2 1 1 1 443 1 1 27 LYS HB3 H -4.220 0.435 8.424 1.00 . A A . 459 LYS HB3 1 1 1 444 1 1 27 LYS HD2 H -3.428 3.612 6.798 1.00 . A A . 459 LYS HD2 1 1 1 445 1 1 27 LYS HD3 H -4.459 3.259 8.185 1.00 . A A . 459 LYS HD3 1 1 1 446 1 1 27 LYS HE2 H -2.852 1.815 9.139 1.00 . A A . 459 LYS HE2 1 1 1 447 1 1 27 LYS HE3 H -1.914 1.753 7.647 1.00 . A A . 459 LYS HE3 1 1 1 448 1 1 27 LYS HG2 H -3.630 1.251 6.096 1.00 . A A . 459 LYS HG2 1 1 1 449 1 1 27 LYS HG3 H -5.176 2.098 6.121 1.00 . A A . 459 LYS HG3 1 1 1 450 1 1 27 LYS HZ1 H -2.302 4.249 9.198 1.00 . A A . 459 LYS HZ1 1 1 1 451 1 1 27 LYS HZ2 H -1.179 3.952 7.952 1.00 . A A . 459 LYS HZ2 1 1 1 452 1 1 27 LYS HZ3 H -0.998 3.196 9.460 1.00 . A A . 459 LYS HZ3 1 1 1 453 1 1 27 LYS N N -6.366 -0.461 5.961 1.00 . A A . 459 LYS N 1 1 1 454 1 1 27 LYS NZ N -1.694 3.523 8.755 1.00 . A A . 459 LYS NZ 1 1 1 455 1 1 27 LYS O O -6.615 -1.593 8.686 1.00 . A A . 459 LYS O 1 1 1 456 1 1 28 PRO C C -5.200 -3.372 10.399 1.00 . A A . 460 PRO C 1 1 1 457 1 1 28 PRO CA C -5.036 -3.912 8.981 1.00 . A A . 460 PRO CA 1 1 1 458 1 1 28 PRO CB C -3.741 -4.717 8.870 1.00 . A A . 460 PRO CB 1 1 1 459 1 1 28 PRO CD C -3.748 -3.141 7.061 1.00 . A A . 460 PRO CD 1 1 1 460 1 1 28 PRO CG C -3.284 -4.514 7.468 1.00 . A A . 460 PRO CG 1 1 1 461 1 1 28 PRO HA H -5.878 -4.541 8.735 1.00 . A A . 460 PRO HA 1 1 1 462 1 1 28 PRO HB2 H -3.019 -4.341 9.579 1.00 . A A . 460 PRO HB2 1 1 1 463 1 1 28 PRO HB3 H -3.942 -5.759 9.072 1.00 . A A . 460 PRO HB3 1 1 1 464 1 1 28 PRO HD2 H -2.945 -2.422 7.172 1.00 . A A . 460 PRO HD2 1 1 1 465 1 1 28 PRO HD3 H -4.098 -3.164 6.039 1.00 . A A . 460 PRO HD3 1 1 1 466 1 1 28 PRO HG2 H -2.207 -4.573 7.423 1.00 . A A . 460 PRO HG2 1 1 1 467 1 1 28 PRO HG3 H -3.727 -5.262 6.826 1.00 . A A . 460 PRO HG3 1 1 1 468 1 1 28 PRO N N -4.858 -2.842 7.993 1.00 . A A . 460 PRO N 1 1 1 469 1 1 28 PRO O O -6.297 -3.536 10.975 1.00 . A A . 460 PRO O 1 1 1 470 1 1 28 PRO OXT O -4.236 -2.768 10.921 1.00 . A A . 460 PRO OXT 1 1 2 471 1 1 1 SER C C 8.287 -2.765 4.808 1.00 . A A . 433 SER C 1 1 2 472 1 1 1 SER CA C 9.053 -1.971 5.862 1.00 . A A . 433 SER CA 1 1 2 473 1 1 1 SER CB C 10.359 -2.688 6.207 1.00 . A A . 433 SER CB 1 1 2 474 1 1 1 SER H1 H 8.798 -1.293 7.810 1.00 . A A . 433 SER H1 1 1 2 475 1 1 1 SER H2 H 7.959 -2.724 7.467 1.00 . A A . 433 SER H2 1 1 2 476 1 1 1 SER H3 H 7.386 -1.241 6.876 1.00 . A A . 433 SER H3 1 1 2 477 1 1 1 SER HA H 9.281 -0.993 5.463 1.00 . A A . 433 SER HA 1 1 2 478 1 1 1 SER HB2 H 10.138 -3.684 6.561 1.00 . A A . 433 SER HB2 1 1 2 479 1 1 1 SER HB3 H 10.979 -2.749 5.324 1.00 . A A . 433 SER HB3 1 1 2 480 1 1 1 SER HG H 11.845 -1.561 6.825 1.00 . A A . 433 SER HG 1 1 2 481 1 1 1 SER N N 8.243 -1.796 7.086 1.00 . A A . 433 SER N 1 1 2 482 1 1 1 SER O O 8.681 -2.818 3.643 1.00 . A A . 433 SER O 1 1 2 483 1 1 1 SER OG O 11.072 -1.993 7.220 1.00 . A A . 433 SER OG 1 1 2 484 1 1 2 GLU C C 5.225 -3.479 3.748 1.00 . A A . 434 GLU C 1 1 2 485 1 1 2 GLU CA C 6.412 -4.232 4.340 1.00 . A A . 434 GLU CA 1 1 2 486 1 1 2 GLU CB C 5.930 -5.494 5.074 1.00 . A A . 434 GLU CB 1 1 2 487 1 1 2 GLU CD C 6.319 -5.066 7.547 1.00 . A A . 434 GLU CD 1 1 2 488 1 1 2 GLU CG C 5.297 -5.234 6.437 1.00 . A A . 434 GLU CG 1 1 2 489 1 1 2 GLU H H 6.913 -3.296 6.165 1.00 . A A . 434 GLU H 1 1 2 490 1 1 2 GLU HA H 7.059 -4.534 3.530 1.00 . A A . 434 GLU HA 1 1 2 491 1 1 2 GLU HB2 H 5.199 -5.997 4.456 1.00 . A A . 434 GLU HB2 1 1 2 492 1 1 2 GLU HB3 H 6.773 -6.152 5.216 1.00 . A A . 434 GLU HB3 1 1 2 493 1 1 2 GLU HG2 H 4.708 -4.333 6.376 1.00 . A A . 434 GLU HG2 1 1 2 494 1 1 2 GLU HG3 H 4.653 -6.066 6.684 1.00 . A A . 434 GLU HG3 1 1 2 495 1 1 2 GLU N N 7.195 -3.389 5.226 1.00 . A A . 434 GLU N 1 1 2 496 1 1 2 GLU O O 4.712 -3.855 2.691 1.00 . A A . 434 GLU O 1 1 2 497 1 1 2 GLU OE1 O 6.782 -3.925 7.775 1.00 . A A . 434 GLU OE1 1 1 2 498 1 1 2 GLU OE2 O 6.661 -6.073 8.202 1.00 . A A . 434 GLU OE2 1 1 2 499 1 1 3 TRP C C 4.010 -0.341 3.376 1.00 . A A . 435 TRP C 1 1 2 500 1 1 3 TRP CA C 3.611 -1.682 3.998 1.00 . A A . 435 TRP CA 1 1 2 501 1 1 3 TRP CB C 2.674 -1.443 5.190 1.00 . A A . 435 TRP CB 1 1 2 502 1 1 3 TRP CD1 C 2.291 -2.831 7.315 1.00 . A A . 435 TRP CD1 1 1 2 503 1 1 3 TRP CD2 C 2.013 -3.972 5.412 1.00 . A A . 435 TRP CD2 1 1 2 504 1 1 3 TRP CE2 C 1.773 -4.841 6.492 1.00 . A A . 435 TRP CE2 1 1 2 505 1 1 3 TRP CE3 C 1.901 -4.470 4.116 1.00 . A A . 435 TRP CE3 1 1 2 506 1 1 3 TRP CG C 2.335 -2.688 5.956 1.00 . A A . 435 TRP CG 1 1 2 507 1 1 3 TRP CH2 C 1.334 -6.636 5.025 1.00 . A A . 435 TRP CH2 1 1 2 508 1 1 3 TRP CZ2 C 1.430 -6.179 6.311 1.00 . A A . 435 TRP CZ2 1 1 2 509 1 1 3 TRP CZ3 C 1.566 -5.792 3.940 1.00 . A A . 435 TRP CZ3 1 1 2 510 1 1 3 TRP H H 5.277 -2.127 5.225 1.00 . A A . 435 TRP H 1 1 2 511 1 1 3 TRP HA H 3.095 -2.283 3.264 1.00 . A A . 435 TRP HA 1 1 2 512 1 1 3 TRP HB2 H 3.145 -0.751 5.873 1.00 . A A . 435 TRP HB2 1 1 2 513 1 1 3 TRP HB3 H 1.751 -1.010 4.831 1.00 . A A . 435 TRP HB3 1 1 2 514 1 1 3 TRP HD1 H 2.495 -2.036 8.015 1.00 . A A . 435 TRP HD1 1 1 2 515 1 1 3 TRP HE1 H 1.841 -4.473 8.562 1.00 . A A . 435 TRP HE1 1 1 2 516 1 1 3 TRP HE3 H 2.077 -3.837 3.258 1.00 . A A . 435 TRP HE3 1 1 2 517 1 1 3 TRP HH2 H 1.078 -7.669 4.828 1.00 . A A . 435 TRP HH2 1 1 2 518 1 1 3 TRP HZ2 H 1.247 -6.841 7.144 1.00 . A A . 435 TRP HZ2 1 1 2 519 1 1 3 TRP HZ3 H 1.490 -6.195 2.939 1.00 . A A . 435 TRP HZ3 1 1 2 520 1 1 3 TRP N N 4.792 -2.421 4.425 1.00 . A A . 435 TRP N 1 1 2 521 1 1 3 TRP NE1 N 1.946 -4.120 7.643 1.00 . A A . 435 TRP NE1 1 1 2 522 1 1 3 TRP O O 4.639 0.489 4.036 1.00 . A A . 435 TRP O 1 1 2 523 1 1 4 THR C C 2.798 2.106 1.579 1.00 . A A . 436 THR C 1 1 2 524 1 1 4 THR CA C 3.959 1.129 1.448 1.00 . A A . 436 THR CA 1 1 2 525 1 1 4 THR CB C 4.262 0.908 -0.048 1.00 . A A . 436 THR CB 1 1 2 526 1 1 4 THR CG2 C 4.503 2.231 -0.768 1.00 . A A . 436 THR CG2 1 1 2 527 1 1 4 THR H H 3.185 -0.826 1.612 1.00 . A A . 436 THR H 1 1 2 528 1 1 4 THR HA H 4.834 1.556 1.914 1.00 . A A . 436 THR HA 1 1 2 529 1 1 4 THR HB H 3.408 0.422 -0.501 1.00 . A A . 436 THR HB 1 1 2 530 1 1 4 THR HG1 H 5.202 -0.813 0.155 1.00 . A A . 436 THR HG1 1 1 2 531 1 1 4 THR HG21 H 5.326 2.750 -0.304 1.00 . A A . 436 THR HG21 1 1 2 532 1 1 4 THR HG22 H 3.612 2.844 -0.708 1.00 . A A . 436 THR HG22 1 1 2 533 1 1 4 THR HG23 H 4.737 2.039 -1.805 1.00 . A A . 436 THR HG23 1 1 2 534 1 1 4 THR N N 3.659 -0.126 2.113 1.00 . A A . 436 THR N 1 1 2 535 1 1 4 THR O O 1.747 1.911 0.971 1.00 . A A . 436 THR O 1 1 2 536 1 1 4 THR OG1 O 5.408 0.061 -0.193 1.00 . A A . 436 THR OG1 1 1 2 537 1 1 5 GLU C C 2.283 5.257 1.415 1.00 . A A . 437 GLU C 1 1 2 538 1 1 5 GLU CA C 1.991 4.206 2.478 1.00 . A A . 437 GLU CA 1 1 2 539 1 1 5 GLU CB C 2.029 4.873 3.860 1.00 . A A . 437 GLU CB 1 1 2 540 1 1 5 GLU CD C 0.936 3.111 5.336 1.00 . A A . 437 GLU CD 1 1 2 541 1 1 5 GLU CG C 2.181 3.921 5.038 1.00 . A A . 437 GLU CG 1 1 2 542 1 1 5 GLU H H 3.819 3.222 2.884 1.00 . A A . 437 GLU H 1 1 2 543 1 1 5 GLU HA H 1.016 3.775 2.304 1.00 . A A . 437 GLU HA 1 1 2 544 1 1 5 GLU HB2 H 2.858 5.563 3.884 1.00 . A A . 437 GLU HB2 1 1 2 545 1 1 5 GLU HB3 H 1.112 5.429 3.996 1.00 . A A . 437 GLU HB3 1 1 2 546 1 1 5 GLU HG2 H 2.988 3.237 4.823 1.00 . A A . 437 GLU HG2 1 1 2 547 1 1 5 GLU HG3 H 2.433 4.500 5.916 1.00 . A A . 437 GLU HG3 1 1 2 548 1 1 5 GLU N N 2.990 3.154 2.366 1.00 . A A . 437 GLU N 1 1 2 549 1 1 5 GLU O O 3.106 6.149 1.632 1.00 . A A . 437 GLU O 1 1 2 550 1 1 5 GLU OE1 O -0.156 3.707 5.450 1.00 . A A . 437 GLU OE1 1 1 2 551 1 1 5 GLU OE2 O 1.051 1.879 5.492 1.00 . A A . 437 GLU OE2 1 1 2 552 1 1 6 ARG C C 0.690 6.707 -1.358 1.00 . A A . 438 ARG C 1 1 2 553 1 1 6 ARG CA C 1.970 6.026 -0.859 1.00 . A A . 438 ARG CA 1 1 2 554 1 1 6 ARG CB C 2.636 5.254 -2.004 1.00 . A A . 438 ARG CB 1 1 2 555 1 1 6 ARG CD C 3.603 5.331 -4.333 1.00 . A A . 438 ARG CD 1 1 2 556 1 1 6 ARG CG C 2.962 6.125 -3.208 1.00 . A A . 438 ARG CG 1 1 2 557 1 1 6 ARG CZ C 5.975 4.939 -4.869 1.00 . A A . 438 ARG CZ 1 1 2 558 1 1 6 ARG H H 0.994 4.419 0.128 1.00 . A A . 438 ARG H 1 1 2 559 1 1 6 ARG HA H 2.663 6.765 -0.483 1.00 . A A . 438 ARG HA 1 1 2 560 1 1 6 ARG HB2 H 3.557 4.818 -1.642 1.00 . A A . 438 ARG HB2 1 1 2 561 1 1 6 ARG HB3 H 1.975 4.464 -2.325 1.00 . A A . 438 ARG HB3 1 1 2 562 1 1 6 ARG HD2 H 2.994 4.464 -4.534 1.00 . A A . 438 ARG HD2 1 1 2 563 1 1 6 ARG HD3 H 3.642 5.951 -5.216 1.00 . A A . 438 ARG HD3 1 1 2 564 1 1 6 ARG HE H 5.115 4.533 -3.104 1.00 . A A . 438 ARG HE 1 1 2 565 1 1 6 ARG HG2 H 2.047 6.568 -3.574 1.00 . A A . 438 ARG HG2 1 1 2 566 1 1 6 ARG HG3 H 3.641 6.906 -2.899 1.00 . A A . 438 ARG HG3 1 1 2 567 1 1 6 ARG HH11 H 4.865 5.705 -6.386 1.00 . A A . 438 ARG HH11 1 1 2 568 1 1 6 ARG HH12 H 6.549 5.458 -6.750 1.00 . A A . 438 ARG HH12 1 1 2 569 1 1 6 ARG HH21 H 7.332 4.138 -3.583 1.00 . A A . 438 ARG HH21 1 1 2 570 1 1 6 ARG HH22 H 7.944 4.551 -5.160 1.00 . A A . 438 ARG HH22 1 1 2 571 1 1 6 ARG N N 1.671 5.126 0.247 1.00 . A A . 438 ARG N 1 1 2 572 1 1 6 ARG NE N 4.957 4.887 -4.007 1.00 . A A . 438 ARG NE 1 1 2 573 1 1 6 ARG NH1 N 5.778 5.401 -6.099 1.00 . A A . 438 ARG NH1 1 1 2 574 1 1 6 ARG NH2 N 7.179 4.509 -4.511 1.00 . A A . 438 ARG NH2 1 1 2 575 1 1 6 ARG O O -0.367 6.079 -1.383 1.00 . A A . 438 ARG O 1 1 2 576 1 1 7 LYS C C -0.262 9.133 -3.672 1.00 . A A . 439 LYS C 1 1 2 577 1 1 7 LYS CA C -0.396 8.698 -2.222 1.00 . A A . 439 LYS CA 1 1 2 578 1 1 7 LYS CB C -0.623 9.916 -1.321 1.00 . A A . 439 LYS CB 1 1 2 579 1 1 7 LYS CD C -2.049 11.905 -0.745 1.00 . A A . 439 LYS CD 1 1 2 580 1 1 7 LYS CE C -2.344 11.459 0.679 1.00 . A A . 439 LYS CE 1 1 2 581 1 1 7 LYS CG C -1.864 10.720 -1.679 1.00 . A A . 439 LYS CG 1 1 2 582 1 1 7 LYS H H 1.653 8.405 -1.869 1.00 . A A . 439 LYS H 1 1 2 583 1 1 7 LYS HA H -1.244 8.038 -2.137 1.00 . A A . 439 LYS HA 1 1 2 584 1 1 7 LYS HB2 H -0.719 9.581 -0.299 1.00 . A A . 439 LYS HB2 1 1 2 585 1 1 7 LYS HB3 H 0.234 10.569 -1.396 1.00 . A A . 439 LYS HB3 1 1 2 586 1 1 7 LYS HD2 H -1.142 12.493 -0.743 1.00 . A A . 439 LYS HD2 1 1 2 587 1 1 7 LYS HD3 H -2.871 12.507 -1.103 1.00 . A A . 439 LYS HD3 1 1 2 588 1 1 7 LYS HE2 H -3.248 10.869 0.677 1.00 . A A . 439 LYS HE2 1 1 2 589 1 1 7 LYS HE3 H -1.520 10.854 1.032 1.00 . A A . 439 LYS HE3 1 1 2 590 1 1 7 LYS HG2 H -1.766 11.083 -2.691 1.00 . A A . 439 LYS HG2 1 1 2 591 1 1 7 LYS HG3 H -2.729 10.078 -1.608 1.00 . A A . 439 LYS HG3 1 1 2 592 1 1 7 LYS HZ1 H -1.632 13.143 1.685 1.00 . A A . 439 LYS HZ1 1 1 2 593 1 1 7 LYS HZ2 H -2.813 12.285 2.540 1.00 . A A . 439 LYS HZ2 1 1 2 594 1 1 7 LYS HZ3 H -3.261 13.254 1.223 1.00 . A A . 439 LYS HZ3 1 1 2 595 1 1 7 LYS N N 0.780 7.967 -1.796 1.00 . A A . 439 LYS N 1 1 2 596 1 1 7 LYS NZ N -2.525 12.614 1.594 1.00 . A A . 439 LYS NZ 1 1 2 597 1 1 7 LYS O O 0.653 9.877 -4.030 1.00 . A A . 439 LYS O 1 1 2 598 1 1 8 THR C C -2.147 10.262 -6.047 1.00 . A A . 440 THR C 1 1 2 599 1 1 8 THR CA C -1.234 9.047 -5.894 1.00 . A A . 440 THR CA 1 1 2 600 1 1 8 THR CB C -1.728 7.890 -6.795 1.00 . A A . 440 THR CB 1 1 2 601 1 1 8 THR CG2 C -3.066 7.348 -6.314 1.00 . A A . 440 THR CG2 1 1 2 602 1 1 8 THR H H -1.812 7.985 -4.159 1.00 . A A . 440 THR H 1 1 2 603 1 1 8 THR HA H -0.235 9.320 -6.207 1.00 . A A . 440 THR HA 1 1 2 604 1 1 8 THR HB H -1.000 7.092 -6.753 1.00 . A A . 440 THR HB 1 1 2 605 1 1 8 THR HG1 H -1.005 8.680 -8.460 1.00 . A A . 440 THR HG1 1 1 2 606 1 1 8 THR HG21 H -3.378 6.537 -6.954 1.00 . A A . 440 THR HG21 1 1 2 607 1 1 8 THR HG22 H -3.805 8.135 -6.343 1.00 . A A . 440 THR HG22 1 1 2 608 1 1 8 THR HG23 H -2.965 6.988 -5.300 1.00 . A A . 440 THR HG23 1 1 2 609 1 1 8 THR N N -1.168 8.645 -4.498 1.00 . A A . 440 THR N 1 1 2 610 1 1 8 THR O O -3.086 10.443 -5.262 1.00 . A A . 440 THR O 1 1 2 611 1 1 8 THR OG1 O -1.853 8.333 -8.151 1.00 . A A . 440 THR OG1 1 1 2 612 1 1 9 ALA C C -4.080 12.079 -7.595 1.00 . A A . 441 ALA C 1 1 2 613 1 1 9 ALA CA C -2.608 12.340 -7.270 1.00 . A A . 441 ALA CA 1 1 2 614 1 1 9 ALA CB C -1.963 13.152 -8.381 1.00 . A A . 441 ALA CB 1 1 2 615 1 1 9 ALA H H -1.128 10.871 -7.662 1.00 . A A . 441 ALA H 1 1 2 616 1 1 9 ALA HA H -2.555 12.923 -6.360 1.00 . A A . 441 ALA HA 1 1 2 617 1 1 9 ALA HB1 H -2.469 14.102 -8.475 1.00 . A A . 441 ALA HB1 1 1 2 618 1 1 9 ALA HB2 H -2.037 12.611 -9.313 1.00 . A A . 441 ALA HB2 1 1 2 619 1 1 9 ALA HB3 H -0.922 13.322 -8.146 1.00 . A A . 441 ALA HB3 1 1 2 620 1 1 9 ALA N N -1.863 11.099 -7.047 1.00 . A A . 441 ALA N 1 1 2 621 1 1 9 ALA O O -4.874 13.012 -7.702 1.00 . A A . 441 ALA O 1 1 2 622 1 1 10 ASP C C -6.623 10.627 -6.652 1.00 . A A . 442 ASP C 1 1 2 623 1 1 10 ASP CA C -5.831 10.420 -7.948 1.00 . A A . 442 ASP CA 1 1 2 624 1 1 10 ASP CB C -5.900 8.952 -8.392 1.00 . A A . 442 ASP CB 1 1 2 625 1 1 10 ASP CG C -7.298 8.514 -8.792 1.00 . A A . 442 ASP CG 1 1 2 626 1 1 10 ASP H H -3.746 10.119 -7.742 1.00 . A A . 442 ASP H 1 1 2 627 1 1 10 ASP HA H -6.251 11.047 -8.721 1.00 . A A . 442 ASP HA 1 1 2 628 1 1 10 ASP HB2 H -5.247 8.811 -9.239 1.00 . A A . 442 ASP HB2 1 1 2 629 1 1 10 ASP HB3 H -5.566 8.322 -7.580 1.00 . A A . 442 ASP HB3 1 1 2 630 1 1 10 ASP N N -4.438 10.811 -7.752 1.00 . A A . 442 ASP N 1 1 2 631 1 1 10 ASP O O -7.849 10.524 -6.626 1.00 . A A . 442 ASP O 1 1 2 632 1 1 10 ASP OD1 O -8.065 8.065 -7.914 1.00 . A A . 442 ASP OD1 1 1 2 633 1 1 10 ASP OD2 O -7.636 8.605 -9.989 1.00 . A A . 442 ASP OD2 1 1 2 634 1 1 11 GLY C C -6.659 9.858 -3.511 1.00 . A A . 443 GLY C 1 1 2 635 1 1 11 GLY CA C -6.530 11.143 -4.294 1.00 . A A . 443 GLY CA 1 1 2 636 1 1 11 GLY H H -4.924 10.992 -5.659 1.00 . A A . 443 GLY H 1 1 2 637 1 1 11 GLY HA2 H -5.937 11.846 -3.727 1.00 . A A . 443 GLY HA2 1 1 2 638 1 1 11 GLY HA3 H -7.515 11.557 -4.451 1.00 . A A . 443 GLY HA3 1 1 2 639 1 1 11 GLY N N -5.901 10.922 -5.578 1.00 . A A . 443 GLY N 1 1 2 640 1 1 11 GLY O O -7.560 9.709 -2.686 1.00 . A A . 443 GLY O 1 1 2 641 1 1 12 LYS C C -4.510 7.296 -2.439 1.00 . A A . 444 LYS C 1 1 2 642 1 1 12 LYS CA C -5.816 7.616 -3.151 1.00 . A A . 444 LYS CA 1 1 2 643 1 1 12 LYS CB C -6.095 6.532 -4.197 1.00 . A A . 444 LYS CB 1 1 2 644 1 1 12 LYS CD C -8.599 6.824 -4.271 1.00 . A A . 444 LYS CD 1 1 2 645 1 1 12 LYS CE C -9.803 7.105 -5.156 1.00 . A A . 444 LYS CE 1 1 2 646 1 1 12 LYS CG C -7.310 6.801 -5.074 1.00 . A A . 444 LYS CG 1 1 2 647 1 1 12 LYS H H -5.028 9.127 -4.399 1.00 . A A . 444 LYS H 1 1 2 648 1 1 12 LYS HA H -6.618 7.626 -2.428 1.00 . A A . 444 LYS HA 1 1 2 649 1 1 12 LYS HB2 H -5.232 6.438 -4.841 1.00 . A A . 444 LYS HB2 1 1 2 650 1 1 12 LYS HB3 H -6.254 5.595 -3.685 1.00 . A A . 444 LYS HB3 1 1 2 651 1 1 12 LYS HD2 H -8.731 5.865 -3.795 1.00 . A A . 444 LYS HD2 1 1 2 652 1 1 12 LYS HD3 H -8.528 7.597 -3.519 1.00 . A A . 444 LYS HD3 1 1 2 653 1 1 12 LYS HE2 H -9.843 6.358 -5.935 1.00 . A A . 444 LYS HE2 1 1 2 654 1 1 12 LYS HE3 H -10.697 7.043 -4.554 1.00 . A A . 444 LYS HE3 1 1 2 655 1 1 12 LYS HG2 H -7.185 7.758 -5.559 1.00 . A A . 444 LYS HG2 1 1 2 656 1 1 12 LYS HG3 H -7.378 6.026 -5.822 1.00 . A A . 444 LYS HG3 1 1 2 657 1 1 12 LYS HZ1 H -10.578 8.615 -6.376 1.00 . A A . 444 LYS HZ1 1 1 2 658 1 1 12 LYS HZ2 H -8.887 8.528 -6.384 1.00 . A A . 444 LYS HZ2 1 1 2 659 1 1 12 LYS HZ3 H -9.694 9.188 -5.048 1.00 . A A . 444 LYS HZ3 1 1 2 660 1 1 12 LYS N N -5.757 8.926 -3.776 1.00 . A A . 444 LYS N 1 1 2 661 1 1 12 LYS NZ N -9.736 8.452 -5.782 1.00 . A A . 444 LYS NZ 1 1 2 662 1 1 12 LYS O O -3.449 7.226 -3.065 1.00 . A A . 444 LYS O 1 1 2 663 1 1 13 THR C C -3.529 5.100 -0.330 1.00 . A A . 445 THR C 1 1 2 664 1 1 13 THR CA C -3.458 6.621 -0.374 1.00 . A A . 445 THR CA 1 1 2 665 1 1 13 THR CB C -3.454 7.182 1.059 1.00 . A A . 445 THR CB 1 1 2 666 1 1 13 THR CG2 C -2.129 6.891 1.751 1.00 . A A . 445 THR CG2 1 1 2 667 1 1 13 THR H H -5.420 7.339 -0.661 1.00 . A A . 445 THR H 1 1 2 668 1 1 13 THR HA H -2.550 6.925 -0.871 1.00 . A A . 445 THR HA 1 1 2 669 1 1 13 THR HB H -4.248 6.712 1.619 1.00 . A A . 445 THR HB 1 1 2 670 1 1 13 THR HG1 H -4.619 8.770 0.896 1.00 . A A . 445 THR HG1 1 1 2 671 1 1 13 THR HG21 H -1.972 5.823 1.789 1.00 . A A . 445 THR HG21 1 1 2 672 1 1 13 THR HG22 H -2.150 7.288 2.755 1.00 . A A . 445 THR HG22 1 1 2 673 1 1 13 THR HG23 H -1.324 7.352 1.198 1.00 . A A . 445 THR HG23 1 1 2 674 1 1 13 THR N N -4.586 7.118 -1.133 1.00 . A A . 445 THR N 1 1 2 675 1 1 13 THR O O -4.322 4.528 0.418 1.00 . A A . 445 THR O 1 1 2 676 1 1 13 THR OG1 O -3.676 8.599 1.021 1.00 . A A . 445 THR OG1 1 1 2 677 1 1 14 TYR C C -1.630 2.355 -0.582 1.00 . A A . 446 TYR C 1 1 2 678 1 1 14 TYR CA C -2.815 3.000 -1.263 1.00 . A A . 446 TYR CA 1 1 2 679 1 1 14 TYR CB C -2.918 2.549 -2.721 1.00 . A A . 446 TYR CB 1 1 2 680 1 1 14 TYR CD1 C -1.496 3.987 -4.247 1.00 . A A . 446 TYR CD1 1 1 2 681 1 1 14 TYR CD2 C -0.734 1.788 -3.733 1.00 . A A . 446 TYR CD2 1 1 2 682 1 1 14 TYR CE1 C -0.389 4.185 -5.050 1.00 . A A . 446 TYR CE1 1 1 2 683 1 1 14 TYR CE2 C 0.377 1.979 -4.528 1.00 . A A . 446 TYR CE2 1 1 2 684 1 1 14 TYR CG C -1.688 2.786 -3.574 1.00 . A A . 446 TYR CG 1 1 2 685 1 1 14 TYR CZ C 0.544 3.177 -5.186 1.00 . A A . 446 TYR CZ 1 1 2 686 1 1 14 TYR H H -2.069 4.930 -1.688 1.00 . A A . 446 TYR H 1 1 2 687 1 1 14 TYR HA H -3.711 2.690 -0.746 1.00 . A A . 446 TYR HA 1 1 2 688 1 1 14 TYR HB2 H -3.120 1.489 -2.739 1.00 . A A . 446 TYR HB2 1 1 2 689 1 1 14 TYR HB3 H -3.745 3.066 -3.184 1.00 . A A . 446 TYR HB3 1 1 2 690 1 1 14 TYR HD1 H -2.228 4.775 -4.135 1.00 . A A . 446 TYR HD1 1 1 2 691 1 1 14 TYR HD2 H -0.869 0.848 -3.215 1.00 . A A . 446 TYR HD2 1 1 2 692 1 1 14 TYR HE1 H -0.257 5.123 -5.566 1.00 . A A . 446 TYR HE1 1 1 2 693 1 1 14 TYR HE2 H 1.106 1.190 -4.635 1.00 . A A . 446 TYR HE2 1 1 2 694 1 1 14 TYR HH H 1.912 4.290 -5.964 1.00 . A A . 446 TYR HH 1 1 2 695 1 1 14 TYR N N -2.738 4.441 -1.160 1.00 . A A . 446 TYR N 1 1 2 696 1 1 14 TYR O O -0.517 2.885 -0.613 1.00 . A A . 446 TYR O 1 1 2 697 1 1 14 TYR OH O 1.644 3.365 -5.990 1.00 . A A . 446 TYR OH 1 1 2 698 1 1 15 TYR C C -0.441 -0.744 0.077 1.00 . A A . 447 TYR C 1 1 2 699 1 1 15 TYR CA C -0.862 0.532 0.791 1.00 . A A . 447 TYR CA 1 1 2 700 1 1 15 TYR CB C -1.396 0.232 2.193 1.00 . A A . 447 TYR CB 1 1 2 701 1 1 15 TYR CD1 C -2.052 2.556 2.970 1.00 . A A . 447 TYR CD1 1 1 2 702 1 1 15 TYR CD2 C -3.761 0.909 2.746 1.00 . A A . 447 TYR CD2 1 1 2 703 1 1 15 TYR CE1 C -2.999 3.486 3.363 1.00 . A A . 447 TYR CE1 1 1 2 704 1 1 15 TYR CE2 C -4.709 1.829 3.140 1.00 . A A . 447 TYR CE2 1 1 2 705 1 1 15 TYR CG C -2.419 1.251 2.655 1.00 . A A . 447 TYR CG 1 1 2 706 1 1 15 TYR CZ C -4.327 3.116 3.445 1.00 . A A . 447 TYR CZ 1 1 2 707 1 1 15 TYR H H -2.757 0.787 -0.076 1.00 . A A . 447 TYR H 1 1 2 708 1 1 15 TYR HA H -0.010 1.191 0.870 1.00 . A A . 447 TYR HA 1 1 2 709 1 1 15 TYR HB2 H -1.867 -0.740 2.195 1.00 . A A . 447 TYR HB2 1 1 2 710 1 1 15 TYR HB3 H -0.577 0.235 2.897 1.00 . A A . 447 TYR HB3 1 1 2 711 1 1 15 TYR HD1 H -1.012 2.839 2.907 1.00 . A A . 447 TYR HD1 1 1 2 712 1 1 15 TYR HD2 H -4.060 -0.100 2.506 1.00 . A A . 447 TYR HD2 1 1 2 713 1 1 15 TYR HE1 H -2.696 4.495 3.606 1.00 . A A . 447 TYR HE1 1 1 2 714 1 1 15 TYR HE2 H -5.746 1.538 3.206 1.00 . A A . 447 TYR HE2 1 1 2 715 1 1 15 TYR HH H -5.875 3.622 4.478 1.00 . A A . 447 TYR HH 1 1 2 716 1 1 15 TYR N N -1.874 1.205 0.016 1.00 . A A . 447 TYR N 1 1 2 717 1 1 15 TYR O O -1.118 -1.770 0.144 1.00 . A A . 447 TYR O 1 1 2 718 1 1 15 TYR OH O -5.280 4.033 3.837 1.00 . A A . 447 TYR OH 1 1 2 719 1 1 16 TYR C C 2.064 -2.672 -0.534 1.00 . A A . 448 TYR C 1 1 2 720 1 1 16 TYR CA C 1.128 -1.823 -1.391 1.00 . A A . 448 TYR CA 1 1 2 721 1 1 16 TYR CB C 1.842 -1.375 -2.670 1.00 . A A . 448 TYR CB 1 1 2 722 1 1 16 TYR CD1 C 1.496 -3.407 -4.136 1.00 . A A . 448 TYR CD1 1 1 2 723 1 1 16 TYR CD2 C 3.731 -2.735 -3.655 1.00 . A A . 448 TYR CD2 1 1 2 724 1 1 16 TYR CE1 C 1.971 -4.462 -4.892 1.00 . A A . 448 TYR CE1 1 1 2 725 1 1 16 TYR CE2 C 4.215 -3.786 -4.411 1.00 . A A . 448 TYR CE2 1 1 2 726 1 1 16 TYR CG C 2.367 -2.527 -3.504 1.00 . A A . 448 TYR CG 1 1 2 727 1 1 16 TYR CZ C 3.331 -4.648 -5.027 1.00 . A A . 448 TYR CZ 1 1 2 728 1 1 16 TYR H H 1.123 0.184 -0.731 1.00 . A A . 448 TYR H 1 1 2 729 1 1 16 TYR HA H 0.263 -2.410 -1.661 1.00 . A A . 448 TYR HA 1 1 2 730 1 1 16 TYR HB2 H 1.153 -0.811 -3.281 1.00 . A A . 448 TYR HB2 1 1 2 731 1 1 16 TYR HB3 H 2.679 -0.748 -2.406 1.00 . A A . 448 TYR HB3 1 1 2 732 1 1 16 TYR HD1 H 0.431 -3.260 -4.030 1.00 . A A . 448 TYR HD1 1 1 2 733 1 1 16 TYR HD2 H 4.421 -2.059 -3.172 1.00 . A A . 448 TYR HD2 1 1 2 734 1 1 16 TYR HE1 H 1.279 -5.135 -5.376 1.00 . A A . 448 TYR HE1 1 1 2 735 1 1 16 TYR HE2 H 5.280 -3.930 -4.516 1.00 . A A . 448 TYR HE2 1 1 2 736 1 1 16 TYR HH H 4.595 -6.059 -5.364 1.00 . A A . 448 TYR HH 1 1 2 737 1 1 16 TYR N N 0.657 -0.672 -0.647 1.00 . A A . 448 TYR N 1 1 2 738 1 1 16 TYR O O 2.980 -2.164 0.115 1.00 . A A . 448 TYR O 1 1 2 739 1 1 16 TYR OH O 3.807 -5.698 -5.780 1.00 . A A . 448 TYR OH 1 1 2 740 1 1 17 ASN C C 3.755 -5.431 -0.637 1.00 . A A . 449 ASN C 1 1 2 741 1 1 17 ASN CA C 2.573 -4.955 0.192 1.00 . A A . 449 ASN CA 1 1 2 742 1 1 17 ASN CB C 1.655 -6.139 0.526 1.00 . A A . 449 ASN CB 1 1 2 743 1 1 17 ASN CG C 2.322 -7.243 1.325 1.00 . A A . 449 ASN CG 1 1 2 744 1 1 17 ASN H H 1.093 -4.304 -1.145 1.00 . A A . 449 ASN H 1 1 2 745 1 1 17 ASN HA H 2.924 -4.494 1.104 1.00 . A A . 449 ASN HA 1 1 2 746 1 1 17 ASN HB2 H 0.818 -5.776 1.101 1.00 . A A . 449 ASN HB2 1 1 2 747 1 1 17 ASN HB3 H 1.283 -6.564 -0.397 1.00 . A A . 449 ASN HB3 1 1 2 748 1 1 17 ASN HD21 H 0.540 -7.936 1.870 1.00 . A A . 449 ASN HD21 1 1 2 749 1 1 17 ASN HD22 H 1.911 -8.815 2.466 1.00 . A A . 449 ASN HD22 1 1 2 750 1 1 17 ASN N N 1.820 -3.975 -0.567 1.00 . A A . 449 ASN N 1 1 2 751 1 1 17 ASN ND2 N 1.512 -8.079 1.952 1.00 . A A . 449 ASN ND2 1 1 2 752 1 1 17 ASN O O 3.579 -6.074 -1.675 1.00 . A A . 449 ASN O 1 1 2 753 1 1 17 ASN OD1 O 3.543 -7.368 1.358 1.00 . A A . 449 ASN OD1 1 1 2 754 1 1 18 ASN C C 6.717 -6.771 -0.557 1.00 . A A . 450 ASN C 1 1 2 755 1 1 18 ASN CA C 6.161 -5.402 -0.921 1.00 . A A . 450 ASN CA 1 1 2 756 1 1 18 ASN CB C 7.201 -4.309 -0.639 1.00 . A A . 450 ASN CB 1 1 2 757 1 1 18 ASN CG C 8.428 -4.402 -1.531 1.00 . A A . 450 ASN CG 1 1 2 758 1 1 18 ASN H H 5.023 -4.749 0.738 1.00 . A A . 450 ASN H 1 1 2 759 1 1 18 ASN HA H 5.908 -5.391 -1.971 1.00 . A A . 450 ASN HA 1 1 2 760 1 1 18 ASN HB2 H 6.745 -3.343 -0.794 1.00 . A A . 450 ASN HB2 1 1 2 761 1 1 18 ASN HB3 H 7.522 -4.386 0.390 1.00 . A A . 450 ASN HB3 1 1 2 762 1 1 18 ASN HD21 H 9.566 -3.629 -0.097 1.00 . A A . 450 ASN HD21 1 1 2 763 1 1 18 ASN HD22 H 10.376 -4.016 -1.575 1.00 . A A . 450 ASN HD22 1 1 2 764 1 1 18 ASN N N 4.950 -5.137 -0.160 1.00 . A A . 450 ASN N 1 1 2 765 1 1 18 ASN ND2 N 9.571 -3.976 -1.014 1.00 . A A . 450 ASN ND2 1 1 2 766 1 1 18 ASN O O 7.687 -7.248 -1.145 1.00 . A A . 450 ASN O 1 1 2 767 1 1 18 ASN OD1 O 8.351 -4.846 -2.676 1.00 . A A . 450 ASN OD1 1 1 2 768 1 1 19 ARG C C 5.698 -9.851 0.433 1.00 . A A . 451 ARG C 1 1 2 769 1 1 19 ARG CA C 6.577 -8.695 0.902 1.00 . A A . 451 ARG CA 1 1 2 770 1 1 19 ARG CB C 6.711 -8.690 2.426 1.00 . A A . 451 ARG CB 1 1 2 771 1 1 19 ARG CD C 9.136 -7.921 2.557 1.00 . A A . 451 ARG CD 1 1 2 772 1 1 19 ARG CG C 7.687 -7.638 2.953 1.00 . A A . 451 ARG CG 1 1 2 773 1 1 19 ARG CZ C 10.555 -7.848 0.525 1.00 . A A . 451 ARG CZ 1 1 2 774 1 1 19 ARG H H 5.305 -6.992 0.842 1.00 . A A . 451 ARG H 1 1 2 775 1 1 19 ARG HA H 7.553 -8.833 0.484 1.00 . A A . 451 ARG HA 1 1 2 776 1 1 19 ARG HB2 H 5.741 -8.500 2.858 1.00 . A A . 451 ARG HB2 1 1 2 777 1 1 19 ARG HB3 H 7.055 -9.662 2.748 1.00 . A A . 451 ARG HB3 1 1 2 778 1 1 19 ARG HD2 H 9.773 -7.195 3.040 1.00 . A A . 451 ARG HD2 1 1 2 779 1 1 19 ARG HD3 H 9.400 -8.910 2.900 1.00 . A A . 451 ARG HD3 1 1 2 780 1 1 19 ARG HE H 8.555 -7.829 0.533 1.00 . A A . 451 ARG HE 1 1 2 781 1 1 19 ARG HG2 H 7.406 -6.675 2.557 1.00 . A A . 451 ARG HG2 1 1 2 782 1 1 19 ARG HG3 H 7.618 -7.613 4.031 1.00 . A A . 451 ARG HG3 1 1 2 783 1 1 19 ARG HH11 H 11.599 -7.728 2.263 1.00 . A A . 451 ARG HH11 1 1 2 784 1 1 19 ARG HH12 H 12.565 -7.785 0.814 1.00 . A A . 451 ARG HH12 1 1 2 785 1 1 19 ARG HH21 H 9.806 -7.894 -1.359 1.00 . A A . 451 ARG HH21 1 1 2 786 1 1 19 ARG HH22 H 11.539 -7.884 -1.253 1.00 . A A . 451 ARG HH22 1 1 2 787 1 1 19 ARG N N 6.100 -7.405 0.426 1.00 . A A . 451 ARG N 1 1 2 788 1 1 19 ARG NE N 9.354 -7.848 1.108 1.00 . A A . 451 ARG NE 1 1 2 789 1 1 19 ARG NH1 N 11.659 -7.782 1.258 1.00 . A A . 451 ARG NH1 1 1 2 790 1 1 19 ARG NH2 N 10.640 -7.874 -0.801 1.00 . A A . 451 ARG NH2 1 1 2 791 1 1 19 ARG O O 6.131 -11.001 0.424 1.00 . A A . 451 ARG O 1 1 2 792 1 1 20 THR C C 3.093 -10.243 -1.859 1.00 . A A . 452 THR C 1 1 2 793 1 1 20 THR CA C 3.558 -10.578 -0.435 1.00 . A A . 452 THR CA 1 1 2 794 1 1 20 THR CB C 2.334 -10.733 0.495 1.00 . A A . 452 THR CB 1 1 2 795 1 1 20 THR CG2 C 1.610 -12.048 0.245 1.00 . A A . 452 THR CG2 1 1 2 796 1 1 20 THR H H 4.137 -8.636 0.174 1.00 . A A . 452 THR H 1 1 2 797 1 1 20 THR HA H 4.092 -11.517 -0.453 1.00 . A A . 452 THR HA 1 1 2 798 1 1 20 THR HB H 1.649 -9.918 0.310 1.00 . A A . 452 THR HB 1 1 2 799 1 1 20 THR HG1 H 3.300 -11.462 2.059 1.00 . A A . 452 THR HG1 1 1 2 800 1 1 20 THR HG21 H 0.758 -12.122 0.906 1.00 . A A . 452 THR HG21 1 1 2 801 1 1 20 THR HG22 H 2.284 -12.870 0.432 1.00 . A A . 452 THR HG22 1 1 2 802 1 1 20 THR HG23 H 1.273 -12.084 -0.780 1.00 . A A . 452 THR HG23 1 1 2 803 1 1 20 THR N N 4.461 -9.556 0.071 1.00 . A A . 452 THR N 1 1 2 804 1 1 20 THR O O 2.327 -10.997 -2.463 1.00 . A A . 452 THR O 1 1 2 805 1 1 20 THR OG1 O 2.759 -10.689 1.868 1.00 . A A . 452 THR OG1 1 1 2 806 1 1 21 LEU C C 1.642 -8.393 -3.730 1.00 . A A . 453 LEU C 1 1 2 807 1 1 21 LEU CA C 3.151 -8.624 -3.715 1.00 . A A . 453 LEU CA 1 1 2 808 1 1 21 LEU CB C 3.557 -9.627 -4.803 1.00 . A A . 453 LEU CB 1 1 2 809 1 1 21 LEU CD1 C 5.347 -10.892 -6.023 1.00 . A A . 453 LEU CD1 1 1 2 810 1 1 21 LEU CD2 C 5.777 -8.548 -5.262 1.00 . A A . 453 LEU CD2 1 1 2 811 1 1 21 LEU CG C 5.065 -9.856 -4.946 1.00 . A A . 453 LEU CG 1 1 2 812 1 1 21 LEU H H 4.216 -8.578 -1.877 1.00 . A A . 453 LEU H 1 1 2 813 1 1 21 LEU HA H 3.649 -7.682 -3.897 1.00 . A A . 453 LEU HA 1 1 2 814 1 1 21 LEU HB2 H 3.088 -10.575 -4.581 1.00 . A A . 453 LEU HB2 1 1 2 815 1 1 21 LEU HB3 H 3.179 -9.271 -5.751 1.00 . A A . 453 LEU HB3 1 1 2 816 1 1 21 LEU HD11 H 4.945 -10.551 -6.967 1.00 . A A . 453 LEU HD11 1 1 2 817 1 1 21 LEU HD12 H 4.887 -11.830 -5.751 1.00 . A A . 453 LEU HD12 1 1 2 818 1 1 21 LEU HD13 H 6.414 -11.030 -6.118 1.00 . A A . 453 LEU HD13 1 1 2 819 1 1 21 LEU HD21 H 5.395 -8.146 -6.189 1.00 . A A . 453 LEU HD21 1 1 2 820 1 1 21 LEU HD22 H 6.838 -8.729 -5.358 1.00 . A A . 453 LEU HD22 1 1 2 821 1 1 21 LEU HD23 H 5.603 -7.841 -4.465 1.00 . A A . 453 LEU HD23 1 1 2 822 1 1 21 LEU HG H 5.454 -10.232 -4.011 1.00 . A A . 453 LEU HG 1 1 2 823 1 1 21 LEU N N 3.568 -9.104 -2.388 1.00 . A A . 453 LEU N 1 1 2 824 1 1 21 LEU O O 0.983 -8.494 -4.763 1.00 . A A . 453 LEU O 1 1 2 825 1 1 22 GLU C C -0.700 -6.413 -2.400 1.00 . A A . 454 GLU C 1 1 2 826 1 1 22 GLU CA C -0.296 -7.884 -2.341 1.00 . A A . 454 GLU CA 1 1 2 827 1 1 22 GLU CB C -0.606 -8.486 -0.963 1.00 . A A . 454 GLU CB 1 1 2 828 1 1 22 GLU CD C -2.271 -8.960 0.859 1.00 . A A . 454 GLU CD 1 1 2 829 1 1 22 GLU CG C -2.043 -8.334 -0.500 1.00 . A A . 454 GLU CG 1 1 2 830 1 1 22 GLU H H 1.747 -7.776 -1.851 1.00 . A A . 454 GLU H 1 1 2 831 1 1 22 GLU HA H -0.822 -8.436 -3.104 1.00 . A A . 454 GLU HA 1 1 2 832 1 1 22 GLU HB2 H -0.378 -9.541 -0.990 1.00 . A A . 454 GLU HB2 1 1 2 833 1 1 22 GLU HB3 H 0.033 -8.012 -0.232 1.00 . A A . 454 GLU HB3 1 1 2 834 1 1 22 GLU HG2 H -2.283 -7.284 -0.445 1.00 . A A . 454 GLU HG2 1 1 2 835 1 1 22 GLU HG3 H -2.690 -8.817 -1.214 1.00 . A A . 454 GLU HG3 1 1 2 836 1 1 22 GLU N N 1.131 -8.013 -2.574 1.00 . A A . 454 GLU N 1 1 2 837 1 1 22 GLU O O 0.094 -5.542 -2.079 1.00 . A A . 454 GLU O 1 1 2 838 1 1 22 GLU OE1 O -1.541 -8.607 1.814 1.00 . A A . 454 GLU OE1 1 1 2 839 1 1 22 GLU OE2 O -3.180 -9.808 0.985 1.00 . A A . 454 GLU OE2 1 1 2 840 1 1 23 SER C C -3.497 -4.588 -1.759 1.00 . A A . 455 SER C 1 1 2 841 1 1 23 SER CA C -2.410 -4.764 -2.818 1.00 . A A . 455 SER CA 1 1 2 842 1 1 23 SER CB C -2.915 -4.389 -4.212 1.00 . A A . 455 SER CB 1 1 2 843 1 1 23 SER H H -2.505 -6.857 -3.127 1.00 . A A . 455 SER H 1 1 2 844 1 1 23 SER HA H -1.578 -4.122 -2.564 1.00 . A A . 455 SER HA 1 1 2 845 1 1 23 SER HB2 H -3.606 -3.563 -4.133 1.00 . A A . 455 SER HB2 1 1 2 846 1 1 23 SER HB3 H -2.077 -4.098 -4.830 1.00 . A A . 455 SER HB3 1 1 2 847 1 1 23 SER HG H -2.916 -6.123 -5.124 1.00 . A A . 455 SER HG 1 1 2 848 1 1 23 SER N N -1.918 -6.131 -2.817 1.00 . A A . 455 SER N 1 1 2 849 1 1 23 SER O O -4.606 -5.099 -1.901 1.00 . A A . 455 SER O 1 1 2 850 1 1 23 SER OG O -3.577 -5.482 -4.830 1.00 . A A . 455 SER OG 1 1 2 851 1 1 24 THR C C -4.511 -2.260 0.554 1.00 . A A . 456 THR C 1 1 2 852 1 1 24 THR CA C -4.073 -3.718 0.440 1.00 . A A . 456 THR CA 1 1 2 853 1 1 24 THR CB C -3.395 -4.174 1.749 1.00 . A A . 456 THR CB 1 1 2 854 1 1 24 THR CG2 C -4.392 -4.238 2.893 1.00 . A A . 456 THR CG2 1 1 2 855 1 1 24 THR H H -2.285 -3.447 -0.648 1.00 . A A . 456 THR H 1 1 2 856 1 1 24 THR HA H -4.941 -4.339 0.266 1.00 . A A . 456 THR HA 1 1 2 857 1 1 24 THR HB H -2.620 -3.465 2.003 1.00 . A A . 456 THR HB 1 1 2 858 1 1 24 THR HG1 H -2.838 -5.957 2.399 1.00 . A A . 456 THR HG1 1 1 2 859 1 1 24 THR HG21 H -4.746 -3.244 3.115 1.00 . A A . 456 THR HG21 1 1 2 860 1 1 24 THR HG22 H -3.912 -4.653 3.767 1.00 . A A . 456 THR HG22 1 1 2 861 1 1 24 THR HG23 H -5.225 -4.863 2.608 1.00 . A A . 456 THR HG23 1 1 2 862 1 1 24 THR N N -3.164 -3.881 -0.685 1.00 . A A . 456 THR N 1 1 2 863 1 1 24 THR O O -3.687 -1.362 0.678 1.00 . A A . 456 THR O 1 1 2 864 1 1 24 THR OG1 O -2.803 -5.468 1.566 1.00 . A A . 456 THR OG1 1 1 2 865 1 1 25 TRP C C -7.096 -0.313 1.718 1.00 . A A . 457 TRP C 1 1 2 866 1 1 25 TRP CA C -6.307 -0.647 0.455 1.00 . A A . 457 TRP CA 1 1 2 867 1 1 25 TRP CB C -7.112 -0.422 -0.833 1.00 . A A . 457 TRP CB 1 1 2 868 1 1 25 TRP CD1 C -5.374 -1.450 -2.421 1.00 . A A . 457 TRP CD1 1 1 2 869 1 1 25 TRP CD2 C -6.052 0.593 -3.031 1.00 . A A . 457 TRP CD2 1 1 2 870 1 1 25 TRP CE2 C -5.077 0.143 -3.943 1.00 . A A . 457 TRP CE2 1 1 2 871 1 1 25 TRP CE3 C -6.625 1.854 -3.231 1.00 . A A . 457 TRP CE3 1 1 2 872 1 1 25 TRP CG C -6.215 -0.438 -2.046 1.00 . A A . 457 TRP CG 1 1 2 873 1 1 25 TRP CH2 C -5.232 2.130 -5.201 1.00 . A A . 457 TRP CH2 1 1 2 874 1 1 25 TRP CZ2 C -4.657 0.900 -5.026 1.00 . A A . 457 TRP CZ2 1 1 2 875 1 1 25 TRP CZ3 C -6.210 2.607 -4.317 1.00 . A A . 457 TRP CZ3 1 1 2 876 1 1 25 TRP H H -6.446 -2.772 0.451 1.00 . A A . 457 TRP H 1 1 2 877 1 1 25 TRP HA H -5.442 0.000 0.429 1.00 . A A . 457 TRP HA 1 1 2 878 1 1 25 TRP HB2 H -7.848 -1.205 -0.940 1.00 . A A . 457 TRP HB2 1 1 2 879 1 1 25 TRP HB3 H -7.604 0.538 -0.789 1.00 . A A . 457 TRP HB3 1 1 2 880 1 1 25 TRP HD1 H -5.264 -2.379 -1.881 1.00 . A A . 457 TRP HD1 1 1 2 881 1 1 25 TRP HE1 H -3.999 -1.648 -3.996 1.00 . A A . 457 TRP HE1 1 1 2 882 1 1 25 TRP HE3 H -7.379 2.239 -2.561 1.00 . A A . 457 TRP HE3 1 1 2 883 1 1 25 TRP HH2 H -4.938 2.750 -6.034 1.00 . A A . 457 TRP HH2 1 1 2 884 1 1 25 TRP HZ2 H -3.890 0.546 -5.701 1.00 . A A . 457 TRP HZ2 1 1 2 885 1 1 25 TRP HZ3 H -6.640 3.584 -4.489 1.00 . A A . 457 TRP HZ3 1 1 2 886 1 1 25 TRP N N -5.809 -2.016 0.487 1.00 . A A . 457 TRP N 1 1 2 887 1 1 25 TRP NE1 N -4.674 -1.096 -3.543 1.00 . A A . 457 TRP NE1 1 1 2 888 1 1 25 TRP O O -7.653 0.776 1.855 1.00 . A A . 457 TRP O 1 1 2 889 1 1 26 GLU C C -6.461 -1.175 4.995 1.00 . A A . 458 GLU C 1 1 2 890 1 1 26 GLU CA C -7.610 -1.031 3.998 1.00 . A A . 458 GLU CA 1 1 2 891 1 1 26 GLU CB C -8.705 -2.053 4.328 1.00 . A A . 458 GLU CB 1 1 2 892 1 1 26 GLU CD C -10.603 -0.717 3.334 1.00 . A A . 458 GLU CD 1 1 2 893 1 1 26 GLU CG C -9.879 -2.045 3.361 1.00 . A A . 458 GLU CG 1 1 2 894 1 1 26 GLU H H -6.723 -2.129 2.434 1.00 . A A . 458 GLU H 1 1 2 895 1 1 26 GLU HA H -8.013 -0.031 4.052 1.00 . A A . 458 GLU HA 1 1 2 896 1 1 26 GLU HB2 H -8.269 -3.041 4.317 1.00 . A A . 458 GLU HB2 1 1 2 897 1 1 26 GLU HB3 H -9.081 -1.848 5.319 1.00 . A A . 458 GLU HB3 1 1 2 898 1 1 26 GLU HG2 H -9.511 -2.256 2.369 1.00 . A A . 458 GLU HG2 1 1 2 899 1 1 26 GLU HG3 H -10.578 -2.813 3.657 1.00 . A A . 458 GLU HG3 1 1 2 900 1 1 26 GLU N N -7.091 -1.252 2.653 1.00 . A A . 458 GLU N 1 1 2 901 1 1 26 GLU O O -5.757 -2.180 4.973 1.00 . A A . 458 GLU O 1 1 2 902 1 1 26 GLU OE1 O -11.078 -0.272 4.396 1.00 . A A . 458 GLU OE1 1 1 2 903 1 1 26 GLU OE2 O -10.708 -0.115 2.246 1.00 . A A . 458 GLU OE2 1 1 2 904 1 1 27 LYS C C -5.440 -1.196 7.962 1.00 . A A . 459 LYS C 1 1 2 905 1 1 27 LYS CA C -5.158 -0.219 6.822 1.00 . A A . 459 LYS CA 1 1 2 906 1 1 27 LYS CB C -4.883 1.160 7.424 1.00 . A A . 459 LYS CB 1 1 2 907 1 1 27 LYS CD C -3.672 3.354 7.146 1.00 . A A . 459 LYS CD 1 1 2 908 1 1 27 LYS CE C -2.496 2.972 8.036 1.00 . A A . 459 LYS CE 1 1 2 909 1 1 27 LYS CG C -4.270 2.141 6.446 1.00 . A A . 459 LYS CG 1 1 2 910 1 1 27 LYS H H -6.858 0.604 5.837 1.00 . A A . 459 LYS H 1 1 2 911 1 1 27 LYS HA H -4.276 -0.540 6.295 1.00 . A A . 459 LYS HA 1 1 2 912 1 1 27 LYS HB2 H -5.814 1.575 7.781 1.00 . A A . 459 LYS HB2 1 1 2 913 1 1 27 LYS HB3 H -4.207 1.047 8.258 1.00 . A A . 459 LYS HB3 1 1 2 914 1 1 27 LYS HD2 H -3.330 4.053 6.398 1.00 . A A . 459 LYS HD2 1 1 2 915 1 1 27 LYS HD3 H -4.434 3.819 7.754 1.00 . A A . 459 LYS HD3 1 1 2 916 1 1 27 LYS HE2 H -2.080 3.871 8.464 1.00 . A A . 459 LYS HE2 1 1 2 917 1 1 27 LYS HE3 H -2.856 2.332 8.828 1.00 . A A . 459 LYS HE3 1 1 2 918 1 1 27 LYS HG2 H -3.493 1.639 5.890 1.00 . A A . 459 LYS HG2 1 1 2 919 1 1 27 LYS HG3 H -5.040 2.476 5.764 1.00 . A A . 459 LYS HG3 1 1 2 920 1 1 27 LYS HZ1 H -1.803 1.389 6.863 1.00 . A A . 459 LYS HZ1 1 1 2 921 1 1 27 LYS HZ2 H -0.649 2.005 7.924 1.00 . A A . 459 LYS HZ2 1 1 2 922 1 1 27 LYS HZ3 H -1.046 2.867 6.520 1.00 . A A . 459 LYS HZ3 1 1 2 923 1 1 27 LYS N N -6.259 -0.177 5.853 1.00 . A A . 459 LYS N 1 1 2 924 1 1 27 LYS NZ N -1.426 2.258 7.285 1.00 . A A . 459 LYS NZ 1 1 2 925 1 1 27 LYS O O -6.398 -1.008 8.712 1.00 . A A . 459 LYS O 1 1 2 926 1 1 28 PRO C C -4.379 -2.339 10.564 1.00 . A A . 460 PRO C 1 1 2 927 1 1 28 PRO CA C -4.651 -3.122 9.283 1.00 . A A . 460 PRO CA 1 1 2 928 1 1 28 PRO CB C -3.521 -4.129 9.040 1.00 . A A . 460 PRO CB 1 1 2 929 1 1 28 PRO CD C -3.622 -2.710 7.113 1.00 . A A . 460 PRO CD 1 1 2 930 1 1 28 PRO CG C -3.266 -4.093 7.575 1.00 . A A . 460 PRO CG 1 1 2 931 1 1 28 PRO HA H -5.594 -3.643 9.369 1.00 . A A . 460 PRO HA 1 1 2 932 1 1 28 PRO HB2 H -2.646 -3.830 9.597 1.00 . A A . 460 PRO HB2 1 1 2 933 1 1 28 PRO HB3 H -3.837 -5.111 9.359 1.00 . A A . 460 PRO HB3 1 1 2 934 1 1 28 PRO HD2 H -2.750 -2.073 7.119 1.00 . A A . 460 PRO HD2 1 1 2 935 1 1 28 PRO HD3 H -4.055 -2.757 6.124 1.00 . A A . 460 PRO HD3 1 1 2 936 1 1 28 PRO HG2 H -2.222 -4.295 7.381 1.00 . A A . 460 PRO HG2 1 1 2 937 1 1 28 PRO HG3 H -3.886 -4.823 7.079 1.00 . A A . 460 PRO HG3 1 1 2 938 1 1 28 PRO N N -4.618 -2.253 8.103 1.00 . A A . 460 PRO N 1 1 2 939 1 1 28 PRO O O -5.311 -2.172 11.377 1.00 . A A . 460 PRO O 1 1 2 940 1 1 28 PRO OXT O -3.232 -1.878 10.747 1.00 . A A . 460 PRO OXT 1 1 3 941 1 1 1 SER C C 5.935 -2.989 8.039 1.00 . A A . 433 SER C 1 1 3 942 1 1 1 SER CA C 5.252 -3.886 9.071 1.00 . A A . 433 SER CA 1 1 3 943 1 1 1 SER CB C 6.165 -4.113 10.270 1.00 . A A . 433 SER CB 1 1 3 944 1 1 1 SER H1 H 4.169 -5.072 7.747 1.00 . A A . 433 SER H1 1 1 3 945 1 1 1 SER H2 H 4.521 -5.825 9.220 1.00 . A A . 433 SER H2 1 1 3 946 1 1 1 SER H3 H 5.734 -5.642 8.052 1.00 . A A . 433 SER H3 1 1 3 947 1 1 1 SER HA H 4.344 -3.403 9.405 1.00 . A A . 433 SER HA 1 1 3 948 1 1 1 SER HB2 H 7.130 -4.458 9.927 1.00 . A A . 433 SER HB2 1 1 3 949 1 1 1 SER HB3 H 6.281 -3.189 10.815 1.00 . A A . 433 SER HB3 1 1 3 950 1 1 1 SER HG H 5.603 -4.748 12.040 1.00 . A A . 433 SER HG 1 1 3 951 1 1 1 SER N N 4.891 -5.194 8.482 1.00 . A A . 433 SER N 1 1 3 952 1 1 1 SER O O 6.161 -1.801 8.274 1.00 . A A . 433 SER O 1 1 3 953 1 1 1 SER OG O 5.609 -5.089 11.133 1.00 . A A . 433 SER OG 1 1 3 954 1 1 2 GLU C C 5.886 -2.602 4.697 1.00 . A A . 434 GLU C 1 1 3 955 1 1 2 GLU CA C 6.899 -2.843 5.814 1.00 . A A . 434 GLU CA 1 1 3 956 1 1 2 GLU CB C 8.128 -3.606 5.288 1.00 . A A . 434 GLU CB 1 1 3 957 1 1 2 GLU CD C 7.742 -5.936 6.238 1.00 . A A . 434 GLU CD 1 1 3 958 1 1 2 GLU CG C 7.891 -5.088 4.987 1.00 . A A . 434 GLU CG 1 1 3 959 1 1 2 GLU H H 6.111 -4.537 6.788 1.00 . A A . 434 GLU H 1 1 3 960 1 1 2 GLU HA H 7.222 -1.891 6.205 1.00 . A A . 434 GLU HA 1 1 3 961 1 1 2 GLU HB2 H 8.464 -3.130 4.380 1.00 . A A . 434 GLU HB2 1 1 3 962 1 1 2 GLU HB3 H 8.911 -3.535 6.027 1.00 . A A . 434 GLU HB3 1 1 3 963 1 1 2 GLU HG2 H 6.990 -5.181 4.402 1.00 . A A . 434 GLU HG2 1 1 3 964 1 1 2 GLU HG3 H 8.728 -5.464 4.414 1.00 . A A . 434 GLU HG3 1 1 3 965 1 1 2 GLU N N 6.274 -3.571 6.901 1.00 . A A . 434 GLU N 1 1 3 966 1 1 2 GLU O O 5.446 -3.537 4.030 1.00 . A A . 434 GLU O 1 1 3 967 1 1 2 GLU OE1 O 8.769 -6.391 6.774 1.00 . A A . 434 GLU OE1 1 1 3 968 1 1 2 GLU OE2 O 6.591 -6.135 6.697 1.00 . A A . 434 GLU OE2 1 1 3 969 1 1 3 TRP C C 4.815 0.213 2.762 1.00 . A A . 435 TRP C 1 1 3 970 1 1 3 TRP CA C 4.436 -1.010 3.578 1.00 . A A . 435 TRP CA 1 1 3 971 1 1 3 TRP CB C 3.137 -0.722 4.338 1.00 . A A . 435 TRP CB 1 1 3 972 1 1 3 TRP CD1 C 2.669 -1.828 6.601 1.00 . A A . 435 TRP CD1 1 1 3 973 1 1 3 TRP CD2 C 2.218 -3.122 4.834 1.00 . A A . 435 TRP CD2 1 1 3 974 1 1 3 TRP CE2 C 1.910 -3.840 6.003 1.00 . A A . 435 TRP CE2 1 1 3 975 1 1 3 TRP CE3 C 2.016 -3.732 3.596 1.00 . A A . 435 TRP CE3 1 1 3 976 1 1 3 TRP CG C 2.693 -1.836 5.237 1.00 . A A . 435 TRP CG 1 1 3 977 1 1 3 TRP CH2 C 1.227 -5.712 4.741 1.00 . A A . 435 TRP CH2 1 1 3 978 1 1 3 TRP CZ2 C 1.411 -5.140 5.969 1.00 . A A . 435 TRP CZ2 1 1 3 979 1 1 3 TRP CZ3 C 1.524 -5.021 3.565 1.00 . A A . 435 TRP CZ3 1 1 3 980 1 1 3 TRP H H 5.927 -0.627 5.019 1.00 . A A . 435 TRP H 1 1 3 981 1 1 3 TRP HA H 4.285 -1.850 2.918 1.00 . A A . 435 TRP HA 1 1 3 982 1 1 3 TRP HB2 H 3.277 0.157 4.949 1.00 . A A . 435 TRP HB2 1 1 3 983 1 1 3 TRP HB3 H 2.347 -0.534 3.626 1.00 . A A . 435 TRP HB3 1 1 3 984 1 1 3 TRP HD1 H 2.978 -0.992 7.210 1.00 . A A . 435 TRP HD1 1 1 3 985 1 1 3 TRP HE1 H 2.067 -3.265 8.021 1.00 . A A . 435 TRP HE1 1 1 3 986 1 1 3 TRP HE3 H 2.241 -3.214 2.674 1.00 . A A . 435 TRP HE3 1 1 3 987 1 1 3 TRP HH2 H 0.838 -6.718 4.662 1.00 . A A . 435 TRP HH2 1 1 3 988 1 1 3 TRP HZ2 H 1.177 -5.686 6.870 1.00 . A A . 435 TRP HZ2 1 1 3 989 1 1 3 TRP HZ3 H 1.372 -5.514 2.616 1.00 . A A . 435 TRP HZ3 1 1 3 990 1 1 3 TRP N N 5.493 -1.348 4.516 1.00 . A A . 435 TRP N 1 1 3 991 1 1 3 TRP NE1 N 2.193 -3.029 7.070 1.00 . A A . 435 TRP NE1 1 1 3 992 1 1 3 TRP O O 5.409 1.155 3.288 1.00 . A A . 435 TRP O 1 1 3 993 1 1 4 THR C C 3.369 2.242 0.731 1.00 . A A . 436 THR C 1 1 3 994 1 1 4 THR CA C 4.623 1.384 0.652 1.00 . A A . 436 THR CA 1 1 3 995 1 1 4 THR CB C 4.903 1.018 -0.822 1.00 . A A . 436 THR CB 1 1 3 996 1 1 4 THR CG2 C 4.932 2.269 -1.705 1.00 . A A . 436 THR CG2 1 1 3 997 1 1 4 THR H H 4.069 -0.604 1.095 1.00 . A A . 436 THR H 1 1 3 998 1 1 4 THR HA H 5.463 1.950 1.034 1.00 . A A . 436 THR HA 1 1 3 999 1 1 4 THR HB H 4.110 0.371 -1.170 1.00 . A A . 436 THR HB 1 1 3 1000 1 1 4 THR HG1 H 6.827 0.779 -0.412 1.00 . A A . 436 THR HG1 1 1 3 1001 1 1 4 THR HG21 H 5.115 1.984 -2.730 1.00 . A A . 436 THR HG21 1 1 3 1002 1 1 4 THR HG22 H 5.717 2.931 -1.370 1.00 . A A . 436 THR HG22 1 1 3 1003 1 1 4 THR HG23 H 3.979 2.780 -1.639 1.00 . A A . 436 THR HG23 1 1 3 1004 1 1 4 THR N N 4.459 0.209 1.487 1.00 . A A . 436 THR N 1 1 3 1005 1 1 4 THR O O 2.406 2.021 -0.007 1.00 . A A . 436 THR O 1 1 3 1006 1 1 4 THR OG1 O 6.152 0.313 -0.929 1.00 . A A . 436 THR OG1 1 1 3 1007 1 1 5 GLU C C 2.536 5.327 0.932 1.00 . A A . 437 GLU C 1 1 3 1008 1 1 5 GLU CA C 2.258 4.109 1.798 1.00 . A A . 437 GLU CA 1 1 3 1009 1 1 5 GLU CB C 2.051 4.530 3.259 1.00 . A A . 437 GLU CB 1 1 3 1010 1 1 5 GLU CD C 1.510 3.773 5.603 1.00 . A A . 437 GLU CD 1 1 3 1011 1 1 5 GLU CG C 2.045 3.370 4.244 1.00 . A A . 437 GLU CG 1 1 3 1012 1 1 5 GLU H H 4.134 3.259 2.275 1.00 . A A . 437 GLU H 1 1 3 1013 1 1 5 GLU HA H 1.365 3.619 1.436 1.00 . A A . 437 GLU HA 1 1 3 1014 1 1 5 GLU HB2 H 2.843 5.206 3.540 1.00 . A A . 437 GLU HB2 1 1 3 1015 1 1 5 GLU HB3 H 1.106 5.045 3.341 1.00 . A A . 437 GLU HB3 1 1 3 1016 1 1 5 GLU HG2 H 1.433 2.576 3.851 1.00 . A A . 437 GLU HG2 1 1 3 1017 1 1 5 GLU HG3 H 3.059 3.015 4.365 1.00 . A A . 437 GLU HG3 1 1 3 1018 1 1 5 GLU N N 3.365 3.181 1.664 1.00 . A A . 437 GLU N 1 1 3 1019 1 1 5 GLU O O 3.339 6.191 1.294 1.00 . A A . 437 GLU O 1 1 3 1020 1 1 5 GLU OE1 O 2.290 4.291 6.427 1.00 . A A . 437 GLU OE1 1 1 3 1021 1 1 5 GLU OE2 O 0.299 3.586 5.853 1.00 . A A . 437 GLU OE2 1 1 3 1022 1 1 6 ARG C C 0.850 7.008 -1.685 1.00 . A A . 438 ARG C 1 1 3 1023 1 1 6 ARG CA C 2.176 6.424 -1.196 1.00 . A A . 438 ARG CA 1 1 3 1024 1 1 6 ARG CB C 2.978 5.860 -2.373 1.00 . A A . 438 ARG CB 1 1 3 1025 1 1 6 ARG CD C 4.169 6.267 -4.542 1.00 . A A . 438 ARG CD 1 1 3 1026 1 1 6 ARG CG C 3.409 6.903 -3.391 1.00 . A A . 438 ARG CG 1 1 3 1027 1 1 6 ARG CZ C 6.143 4.824 -4.877 1.00 . A A . 438 ARG CZ 1 1 3 1028 1 1 6 ARG H H 1.264 4.664 -0.455 1.00 . A A . 438 ARG H 1 1 3 1029 1 1 6 ARG HA H 2.756 7.187 -0.696 1.00 . A A . 438 ARG HA 1 1 3 1030 1 1 6 ARG HB2 H 3.866 5.379 -1.990 1.00 . A A . 438 ARG HB2 1 1 3 1031 1 1 6 ARG HB3 H 2.374 5.123 -2.881 1.00 . A A . 438 ARG HB3 1 1 3 1032 1 1 6 ARG HD2 H 3.514 5.573 -5.051 1.00 . A A . 438 ARG HD2 1 1 3 1033 1 1 6 ARG HD3 H 4.476 7.043 -5.228 1.00 . A A . 438 ARG HD3 1 1 3 1034 1 1 6 ARG HE H 5.561 5.583 -3.119 1.00 . A A . 438 ARG HE 1 1 3 1035 1 1 6 ARG HG2 H 2.531 7.397 -3.780 1.00 . A A . 438 ARG HG2 1 1 3 1036 1 1 6 ARG HG3 H 4.046 7.627 -2.905 1.00 . A A . 438 ARG HG3 1 1 3 1037 1 1 6 ARG HH11 H 5.173 5.326 -6.589 1.00 . A A . 438 ARG HH11 1 1 3 1038 1 1 6 ARG HH12 H 6.530 4.255 -6.789 1.00 . A A . 438 ARG HH12 1 1 3 1039 1 1 6 ARG HH21 H 7.343 4.200 -3.372 1.00 . A A . 438 ARG HH21 1 1 3 1040 1 1 6 ARG HH22 H 7.768 3.607 -4.949 1.00 . A A . 438 ARG HH22 1 1 3 1041 1 1 6 ARG N N 1.919 5.365 -0.234 1.00 . A A . 438 ARG N 1 1 3 1042 1 1 6 ARG NE N 5.352 5.543 -4.083 1.00 . A A . 438 ARG NE 1 1 3 1043 1 1 6 ARG NH1 N 5.931 4.798 -6.187 1.00 . A A . 438 ARG NH1 1 1 3 1044 1 1 6 ARG NH2 N 7.165 4.159 -4.358 1.00 . A A . 438 ARG NH2 1 1 3 1045 1 1 6 ARG O O -0.144 6.287 -1.767 1.00 . A A . 438 ARG O 1 1 3 1046 1 1 7 LYS C C -0.409 9.084 -3.995 1.00 . A A . 439 LYS C 1 1 3 1047 1 1 7 LYS CA C -0.414 8.899 -2.488 1.00 . A A . 439 LYS CA 1 1 3 1048 1 1 7 LYS CB C -0.677 10.232 -1.775 1.00 . A A . 439 LYS CB 1 1 3 1049 1 1 7 LYS CD C 0.048 12.576 -1.279 1.00 . A A . 439 LYS CD 1 1 3 1050 1 1 7 LYS CE C 1.148 13.613 -1.426 1.00 . A A . 439 LYS CE 1 1 3 1051 1 1 7 LYS CG C 0.424 11.264 -1.942 1.00 . A A . 439 LYS CG 1 1 3 1052 1 1 7 LYS H H 1.635 8.834 -2.004 1.00 . A A . 439 LYS H 1 1 3 1053 1 1 7 LYS HA H -1.209 8.222 -2.249 1.00 . A A . 439 LYS HA 1 1 3 1054 1 1 7 LYS HB2 H -1.592 10.652 -2.162 1.00 . A A . 439 LYS HB2 1 1 3 1055 1 1 7 LYS HB3 H -0.802 10.040 -0.719 1.00 . A A . 439 LYS HB3 1 1 3 1056 1 1 7 LYS HD2 H -0.853 12.956 -1.738 1.00 . A A . 439 LYS HD2 1 1 3 1057 1 1 7 LYS HD3 H -0.129 12.399 -0.227 1.00 . A A . 439 LYS HD3 1 1 3 1058 1 1 7 LYS HE2 H 1.351 13.758 -2.477 1.00 . A A . 439 LYS HE2 1 1 3 1059 1 1 7 LYS HE3 H 0.808 14.542 -0.995 1.00 . A A . 439 LYS HE3 1 1 3 1060 1 1 7 LYS HG2 H 1.331 10.888 -1.490 1.00 . A A . 439 LYS HG2 1 1 3 1061 1 1 7 LYS HG3 H 0.588 11.436 -2.995 1.00 . A A . 439 LYS HG3 1 1 3 1062 1 1 7 LYS HZ1 H 3.124 13.939 -0.836 1.00 . A A . 439 LYS HZ1 1 1 3 1063 1 1 7 LYS HZ2 H 2.768 12.315 -1.173 1.00 . A A . 439 LYS HZ2 1 1 3 1064 1 1 7 LYS HZ3 H 2.218 13.022 0.268 1.00 . A A . 439 LYS HZ3 1 1 3 1065 1 1 7 LYS N N 0.820 8.292 -2.032 1.00 . A A . 439 LYS N 1 1 3 1066 1 1 7 LYS NZ N 2.402 13.193 -0.745 1.00 . A A . 439 LYS NZ 1 1 3 1067 1 1 7 LYS O O 0.456 9.754 -4.557 1.00 . A A . 439 LYS O 1 1 3 1068 1 1 8 THR C C -2.546 9.845 -6.263 1.00 . A A . 440 THR C 1 1 3 1069 1 1 8 THR CA C -1.599 8.668 -6.057 1.00 . A A . 440 THR CA 1 1 3 1070 1 1 8 THR CB C -2.174 7.401 -6.739 1.00 . A A . 440 THR CB 1 1 3 1071 1 1 8 THR CG2 C -3.460 6.942 -6.064 1.00 . A A . 440 THR CG2 1 1 3 1072 1 1 8 THR H H -1.970 7.859 -4.143 1.00 . A A . 440 THR H 1 1 3 1073 1 1 8 THR HA H -0.647 8.900 -6.511 1.00 . A A . 440 THR HA 1 1 3 1074 1 1 8 THR HB H -1.443 6.608 -6.660 1.00 . A A . 440 THR HB 1 1 3 1075 1 1 8 THR HG1 H -2.507 6.815 -8.599 1.00 . A A . 440 THR HG1 1 1 3 1076 1 1 8 THR HG21 H -3.833 6.057 -6.561 1.00 . A A . 440 THR HG21 1 1 3 1077 1 1 8 THR HG22 H -4.199 7.726 -6.125 1.00 . A A . 440 THR HG22 1 1 3 1078 1 1 8 THR HG23 H -3.260 6.715 -5.028 1.00 . A A . 440 THR HG23 1 1 3 1079 1 1 8 THR N N -1.384 8.472 -4.638 1.00 . A A . 440 THR N 1 1 3 1080 1 1 8 THR O O -3.400 10.122 -5.412 1.00 . A A . 440 THR O 1 1 3 1081 1 1 8 THR OG1 O -2.425 7.659 -8.125 1.00 . A A . 440 THR OG1 1 1 3 1082 1 1 9 ALA C C -4.611 11.558 -7.778 1.00 . A A . 441 ALA C 1 1 3 1083 1 1 9 ALA CA C -3.103 11.775 -7.668 1.00 . A A . 441 ALA CA 1 1 3 1084 1 1 9 ALA CB C -2.567 12.414 -8.939 1.00 . A A . 441 ALA CB 1 1 3 1085 1 1 9 ALA H H -1.757 10.191 -8.062 1.00 . A A . 441 ALA H 1 1 3 1086 1 1 9 ALA HA H -2.914 12.455 -6.852 1.00 . A A . 441 ALA HA 1 1 3 1087 1 1 9 ALA HB1 H -2.777 11.773 -9.782 1.00 . A A . 441 ALA HB1 1 1 3 1088 1 1 9 ALA HB2 H -1.501 12.553 -8.848 1.00 . A A . 441 ALA HB2 1 1 3 1089 1 1 9 ALA HB3 H -3.043 13.372 -9.088 1.00 . A A . 441 ALA HB3 1 1 3 1090 1 1 9 ALA N N -2.381 10.534 -7.389 1.00 . A A . 441 ALA N 1 1 3 1091 1 1 9 ALA O O -5.367 12.513 -7.939 1.00 . A A . 441 ALA O 1 1 3 1092 1 1 10 ASP C C -7.077 10.302 -6.318 1.00 . A A . 442 ASP C 1 1 3 1093 1 1 10 ASP CA C -6.463 9.982 -7.685 1.00 . A A . 442 ASP CA 1 1 3 1094 1 1 10 ASP CB C -6.667 8.503 -8.038 1.00 . A A . 442 ASP CB 1 1 3 1095 1 1 10 ASP CG C -8.114 8.161 -8.341 1.00 . A A . 442 ASP CG 1 1 3 1096 1 1 10 ASP H H -4.384 9.584 -7.613 1.00 . A A . 442 ASP H 1 1 3 1097 1 1 10 ASP HA H -6.940 10.596 -8.436 1.00 . A A . 442 ASP HA 1 1 3 1098 1 1 10 ASP HB2 H -6.072 8.264 -8.906 1.00 . A A . 442 ASP HB2 1 1 3 1099 1 1 10 ASP HB3 H -6.339 7.895 -7.206 1.00 . A A . 442 ASP HB3 1 1 3 1100 1 1 10 ASP N N -5.041 10.308 -7.683 1.00 . A A . 442 ASP N 1 1 3 1101 1 1 10 ASP O O -8.280 10.141 -6.102 1.00 . A A . 442 ASP O 1 1 3 1102 1 1 10 ASP OD1 O -8.639 8.636 -9.370 1.00 . A A . 442 ASP OD1 1 1 3 1103 1 1 10 ASP OD2 O -8.728 7.397 -7.570 1.00 . A A . 442 ASP OD2 1 1 3 1104 1 1 11 GLY C C -6.783 10.015 -3.117 1.00 . A A . 443 GLY C 1 1 3 1105 1 1 11 GLY CA C -6.692 11.171 -4.083 1.00 . A A . 443 GLY CA 1 1 3 1106 1 1 11 GLY H H -5.275 10.811 -5.612 1.00 . A A . 443 GLY H 1 1 3 1107 1 1 11 GLY HA2 H -6.002 11.902 -3.686 1.00 . A A . 443 GLY HA2 1 1 3 1108 1 1 11 GLY HA3 H -7.666 11.625 -4.178 1.00 . A A . 443 GLY HA3 1 1 3 1109 1 1 11 GLY N N -6.232 10.756 -5.396 1.00 . A A . 443 GLY N 1 1 3 1110 1 1 11 GLY O O -7.638 9.992 -2.231 1.00 . A A . 443 GLY O 1 1 3 1111 1 1 12 LYS C C -4.541 7.433 -2.051 1.00 . A A . 444 LYS C 1 1 3 1112 1 1 12 LYS CA C -5.942 7.845 -2.472 1.00 . A A . 444 LYS CA 1 1 3 1113 1 1 12 LYS CB C -6.625 6.713 -3.247 1.00 . A A . 444 LYS CB 1 1 3 1114 1 1 12 LYS CD C -8.702 5.922 -4.437 1.00 . A A . 444 LYS CD 1 1 3 1115 1 1 12 LYS CE C -10.153 6.244 -4.768 1.00 . A A . 444 LYS CE 1 1 3 1116 1 1 12 LYS CG C -8.085 7.000 -3.564 1.00 . A A . 444 LYS CG 1 1 3 1117 1 1 12 LYS H H -5.192 9.152 -3.957 1.00 . A A . 444 LYS H 1 1 3 1118 1 1 12 LYS HA H -6.520 8.064 -1.587 1.00 . A A . 444 LYS HA 1 1 3 1119 1 1 12 LYS HB2 H -6.098 6.556 -4.177 1.00 . A A . 444 LYS HB2 1 1 3 1120 1 1 12 LYS HB3 H -6.578 5.809 -2.657 1.00 . A A . 444 LYS HB3 1 1 3 1121 1 1 12 LYS HD2 H -8.139 5.850 -5.356 1.00 . A A . 444 LYS HD2 1 1 3 1122 1 1 12 LYS HD3 H -8.661 4.978 -3.912 1.00 . A A . 444 LYS HD3 1 1 3 1123 1 1 12 LYS HE2 H -10.545 5.468 -5.407 1.00 . A A . 444 LYS HE2 1 1 3 1124 1 1 12 LYS HE3 H -10.721 6.273 -3.850 1.00 . A A . 444 LYS HE3 1 1 3 1125 1 1 12 LYS HG2 H -8.637 7.058 -2.641 1.00 . A A . 444 LYS HG2 1 1 3 1126 1 1 12 LYS HG3 H -8.148 7.947 -4.082 1.00 . A A . 444 LYS HG3 1 1 3 1127 1 1 12 LYS HZ1 H -9.736 7.545 -6.351 1.00 . A A . 444 LYS HZ1 1 1 3 1128 1 1 12 LYS HZ2 H -9.936 8.322 -4.859 1.00 . A A . 444 LYS HZ2 1 1 3 1129 1 1 12 LYS HZ3 H -11.290 7.740 -5.690 1.00 . A A . 444 LYS HZ3 1 1 3 1130 1 1 12 LYS N N -5.899 9.049 -3.282 1.00 . A A . 444 LYS N 1 1 3 1131 1 1 12 LYS NZ N -10.288 7.553 -5.462 1.00 . A A . 444 LYS NZ 1 1 3 1132 1 1 12 LYS O O -3.623 7.375 -2.873 1.00 . A A . 444 LYS O 1 1 3 1133 1 1 13 THR C C -3.091 5.142 -0.345 1.00 . A A . 445 THR C 1 1 3 1134 1 1 13 THR CA C -3.120 6.661 -0.260 1.00 . A A . 445 THR CA 1 1 3 1135 1 1 13 THR CB C -2.899 7.118 1.192 1.00 . A A . 445 THR CB 1 1 3 1136 1 1 13 THR CG2 C -1.434 6.981 1.592 1.00 . A A . 445 THR CG2 1 1 3 1137 1 1 13 THR H H -5.132 7.256 -0.153 1.00 . A A . 445 THR H 1 1 3 1138 1 1 13 THR HA H -2.334 7.065 -0.869 1.00 . A A . 445 THR HA 1 1 3 1139 1 1 13 THR HB H -3.498 6.503 1.846 1.00 . A A . 445 THR HB 1 1 3 1140 1 1 13 THR HG1 H -3.090 8.967 0.521 1.00 . A A . 445 THR HG1 1 1 3 1141 1 1 13 THR HG21 H -0.814 7.473 0.858 1.00 . A A . 445 THR HG21 1 1 3 1142 1 1 13 THR HG22 H -1.170 5.933 1.644 1.00 . A A . 445 THR HG22 1 1 3 1143 1 1 13 THR HG23 H -1.281 7.440 2.556 1.00 . A A . 445 THR HG23 1 1 3 1144 1 1 13 THR N N -4.382 7.142 -0.772 1.00 . A A . 445 THR N 1 1 3 1145 1 1 13 THR O O -3.690 4.457 0.480 1.00 . A A . 445 THR O 1 1 3 1146 1 1 13 THR OG1 O -3.301 8.489 1.329 1.00 . A A . 445 THR OG1 1 1 3 1147 1 1 14 TYR C C -1.278 2.543 -0.868 1.00 . A A . 446 TYR C 1 1 3 1148 1 1 14 TYR CA C -2.441 3.188 -1.597 1.00 . A A . 446 TYR CA 1 1 3 1149 1 1 14 TYR CB C -2.388 2.857 -3.095 1.00 . A A . 446 TYR CB 1 1 3 1150 1 1 14 TYR CD1 C -0.565 4.286 -4.122 1.00 . A A . 446 TYR CD1 1 1 3 1151 1 1 14 TYR CD2 C -0.256 1.924 -4.064 1.00 . A A . 446 TYR CD2 1 1 3 1152 1 1 14 TYR CE1 C 0.656 4.433 -4.749 1.00 . A A . 446 TYR CE1 1 1 3 1153 1 1 14 TYR CE2 C 0.965 2.060 -4.687 1.00 . A A . 446 TYR CE2 1 1 3 1154 1 1 14 TYR CG C -1.041 3.031 -3.766 1.00 . A A . 446 TYR CG 1 1 3 1155 1 1 14 TYR CZ C 1.419 3.318 -5.031 1.00 . A A . 446 TYR CZ 1 1 3 1156 1 1 14 TYR H H -1.917 5.198 -1.968 1.00 . A A . 446 TYR H 1 1 3 1157 1 1 14 TYR HA H -3.366 2.806 -1.192 1.00 . A A . 446 TYR HA 1 1 3 1158 1 1 14 TYR HB2 H -2.679 1.828 -3.230 1.00 . A A . 446 TYR HB2 1 1 3 1159 1 1 14 TYR HB3 H -3.096 3.486 -3.611 1.00 . A A . 446 TYR HB3 1 1 3 1160 1 1 14 TYR HD1 H -1.163 5.156 -3.897 1.00 . A A . 446 TYR HD1 1 1 3 1161 1 1 14 TYR HD2 H -0.614 0.942 -3.795 1.00 . A A . 446 TYR HD2 1 1 3 1162 1 1 14 TYR HE1 H 1.010 5.418 -5.017 1.00 . A A . 446 TYR HE1 1 1 3 1163 1 1 14 TYR HE2 H 1.556 1.183 -4.906 1.00 . A A . 446 TYR HE2 1 1 3 1164 1 1 14 TYR HH H 2.701 2.842 -6.386 1.00 . A A . 446 TYR HH 1 1 3 1165 1 1 14 TYR N N -2.435 4.617 -1.372 1.00 . A A . 446 TYR N 1 1 3 1166 1 1 14 TYR O O -0.172 3.089 -0.836 1.00 . A A . 446 TYR O 1 1 3 1167 1 1 14 TYR OH O 2.636 3.465 -5.654 1.00 . A A . 446 TYR OH 1 1 3 1168 1 1 15 TYR C C -0.130 -0.576 -0.342 1.00 . A A . 447 TYR C 1 1 3 1169 1 1 15 TYR CA C -0.497 0.680 0.433 1.00 . A A . 447 TYR CA 1 1 3 1170 1 1 15 TYR CB C -0.989 0.328 1.844 1.00 . A A . 447 TYR CB 1 1 3 1171 1 1 15 TYR CD1 C -1.479 2.610 2.830 1.00 . A A . 447 TYR CD1 1 1 3 1172 1 1 15 TYR CD2 C -3.297 1.096 2.541 1.00 . A A . 447 TYR CD2 1 1 3 1173 1 1 15 TYR CE1 C -2.346 3.558 3.334 1.00 . A A . 447 TYR CE1 1 1 3 1174 1 1 15 TYR CE2 C -4.169 2.040 3.050 1.00 . A A . 447 TYR CE2 1 1 3 1175 1 1 15 TYR CG C -1.936 1.364 2.422 1.00 . A A . 447 TYR CG 1 1 3 1176 1 1 15 TYR CZ C -3.688 3.271 3.442 1.00 . A A . 447 TYR CZ 1 1 3 1177 1 1 15 TYR H H -2.419 0.987 -0.345 1.00 . A A . 447 TYR H 1 1 3 1178 1 1 15 TYR HA H 0.368 1.323 0.505 1.00 . A A . 447 TYR HA 1 1 3 1179 1 1 15 TYR HB2 H -1.507 -0.618 1.812 1.00 . A A . 447 TYR HB2 1 1 3 1180 1 1 15 TYR HB3 H -0.138 0.247 2.506 1.00 . A A . 447 TYR HB3 1 1 3 1181 1 1 15 TYR HD1 H -0.430 2.838 2.744 1.00 . A A . 447 TYR HD1 1 1 3 1182 1 1 15 TYR HD2 H -3.669 0.130 2.234 1.00 . A A . 447 TYR HD2 1 1 3 1183 1 1 15 TYR HE1 H -1.970 4.517 3.647 1.00 . A A . 447 TYR HE1 1 1 3 1184 1 1 15 TYR HE2 H -5.221 1.811 3.136 1.00 . A A . 447 TYR HE2 1 1 3 1185 1 1 15 TYR HH H -5.222 3.802 4.481 1.00 . A A . 447 TYR HH 1 1 3 1186 1 1 15 TYR N N -1.525 1.385 -0.285 1.00 . A A . 447 TYR N 1 1 3 1187 1 1 15 TYR O O -0.876 -1.547 -0.360 1.00 . A A . 447 TYR O 1 1 3 1188 1 1 15 TYR OH O -4.554 4.223 3.936 1.00 . A A . 447 TYR OH 1 1 3 1189 1 1 16 TYR C C 2.271 -2.635 -0.911 1.00 . A A . 448 TYR C 1 1 3 1190 1 1 16 TYR CA C 1.422 -1.705 -1.780 1.00 . A A . 448 TYR CA 1 1 3 1191 1 1 16 TYR CB C 2.221 -1.271 -3.014 1.00 . A A . 448 TYR CB 1 1 3 1192 1 1 16 TYR CD1 C 1.801 -3.207 -4.583 1.00 . A A . 448 TYR CD1 1 1 3 1193 1 1 16 TYR CD2 C 4.050 -2.772 -3.919 1.00 . A A . 448 TYR CD2 1 1 3 1194 1 1 16 TYR CE1 C 2.228 -4.279 -5.343 1.00 . A A . 448 TYR CE1 1 1 3 1195 1 1 16 TYR CE2 C 4.485 -3.842 -4.680 1.00 . A A . 448 TYR CE2 1 1 3 1196 1 1 16 TYR CG C 2.701 -2.437 -3.857 1.00 . A A . 448 TYR CG 1 1 3 1197 1 1 16 TYR CZ C 3.571 -4.592 -5.388 1.00 . A A . 448 TYR CZ 1 1 3 1198 1 1 16 TYR H H 1.494 0.288 -1.085 1.00 . A A . 448 TYR H 1 1 3 1199 1 1 16 TYR HA H 0.535 -2.226 -2.105 1.00 . A A . 448 TYR HA 1 1 3 1200 1 1 16 TYR HB2 H 1.600 -0.642 -3.635 1.00 . A A . 448 TYR HB2 1 1 3 1201 1 1 16 TYR HB3 H 3.089 -0.711 -2.694 1.00 . A A . 448 TYR HB3 1 1 3 1202 1 1 16 TYR HD1 H 0.749 -2.960 -4.545 1.00 . A A . 448 TYR HD1 1 1 3 1203 1 1 16 TYR HD2 H 4.763 -2.182 -3.363 1.00 . A A . 448 TYR HD2 1 1 3 1204 1 1 16 TYR HE1 H 1.512 -4.865 -5.902 1.00 . A A . 448 TYR HE1 1 1 3 1205 1 1 16 TYR HE2 H 5.535 -4.087 -4.715 1.00 . A A . 448 TYR HE2 1 1 3 1206 1 1 16 TYR HH H 4.658 -6.154 -5.650 1.00 . A A . 448 TYR HH 1 1 3 1207 1 1 16 TYR N N 0.994 -0.546 -1.022 1.00 . A A . 448 TYR N 1 1 3 1208 1 1 16 TYR O O 3.254 -2.216 -0.294 1.00 . A A . 448 TYR O 1 1 3 1209 1 1 16 TYR OH O 3.998 -5.660 -6.143 1.00 . A A . 448 TYR OH 1 1 3 1210 1 1 17 ASN C C 3.616 -5.580 -0.970 1.00 . A A . 449 ASN C 1 1 3 1211 1 1 17 ASN CA C 2.536 -4.935 -0.115 1.00 . A A . 449 ASN CA 1 1 3 1212 1 1 17 ASN CB C 1.487 -5.978 0.320 1.00 . A A . 449 ASN CB 1 1 3 1213 1 1 17 ASN CG C 2.045 -7.143 1.122 1.00 . A A . 449 ASN CG 1 1 3 1214 1 1 17 ASN H H 1.091 -4.164 -1.422 1.00 . A A . 449 ASN H 1 1 3 1215 1 1 17 ASN HA H 2.982 -4.485 0.756 1.00 . A A . 449 ASN HA 1 1 3 1216 1 1 17 ASN HB2 H 0.744 -5.487 0.928 1.00 . A A . 449 ASN HB2 1 1 3 1217 1 1 17 ASN HB3 H 1.007 -6.376 -0.563 1.00 . A A . 449 ASN HB3 1 1 3 1218 1 1 17 ASN HD21 H 0.291 -7.369 2.021 1.00 . A A . 449 ASN HD21 1 1 3 1219 1 1 17 ASN HD22 H 1.531 -8.477 2.497 1.00 . A A . 449 ASN HD22 1 1 3 1220 1 1 17 ASN N N 1.873 -3.903 -0.886 1.00 . A A . 449 ASN N 1 1 3 1221 1 1 17 ASN ND2 N 1.207 -7.722 1.964 1.00 . A A . 449 ASN ND2 1 1 3 1222 1 1 17 ASN O O 3.322 -6.264 -1.949 1.00 . A A . 449 ASN O 1 1 3 1223 1 1 17 ASN OD1 O 3.199 -7.532 0.977 1.00 . A A . 449 ASN OD1 1 1 3 1224 1 1 18 ASN C C 6.468 -7.168 -0.875 1.00 . A A . 450 ASN C 1 1 3 1225 1 1 18 ASN CA C 5.999 -5.813 -1.390 1.00 . A A . 450 ASN CA 1 1 3 1226 1 1 18 ASN CB C 7.135 -4.785 -1.329 1.00 . A A . 450 ASN CB 1 1 3 1227 1 1 18 ASN CG C 8.213 -5.033 -2.370 1.00 . A A . 450 ASN CG 1 1 3 1228 1 1 18 ASN H H 5.036 -4.877 0.242 1.00 . A A . 450 ASN H 1 1 3 1229 1 1 18 ASN HA H 5.669 -5.920 -2.413 1.00 . A A . 450 ASN HA 1 1 3 1230 1 1 18 ASN HB2 H 6.726 -3.800 -1.492 1.00 . A A . 450 ASN HB2 1 1 3 1231 1 1 18 ASN HB3 H 7.588 -4.822 -0.349 1.00 . A A . 450 ASN HB3 1 1 3 1232 1 1 18 ASN HD21 H 9.586 -4.200 -1.187 1.00 . A A . 450 ASN HD21 1 1 3 1233 1 1 18 ASN HD22 H 10.152 -4.789 -2.716 1.00 . A A . 450 ASN HD22 1 1 3 1234 1 1 18 ASN N N 4.868 -5.352 -0.596 1.00 . A A . 450 ASN N 1 1 3 1235 1 1 18 ASN ND2 N 9.439 -4.634 -2.062 1.00 . A A . 450 ASN ND2 1 1 3 1236 1 1 18 ASN O O 7.418 -7.759 -1.389 1.00 . A A . 450 ASN O 1 1 3 1237 1 1 18 ASN OD1 O 7.945 -5.562 -3.448 1.00 . A A . 450 ASN OD1 1 1 3 1238 1 1 19 ARG C C 5.464 -10.055 -0.142 1.00 . A A . 451 ARG C 1 1 3 1239 1 1 19 ARG CA C 6.083 -8.960 0.719 1.00 . A A . 451 ARG CA 1 1 3 1240 1 1 19 ARG CB C 5.546 -9.085 2.151 1.00 . A A . 451 ARG CB 1 1 3 1241 1 1 19 ARG CD C 5.376 -8.142 4.471 1.00 . A A . 451 ARG CD 1 1 3 1242 1 1 19 ARG CG C 5.862 -7.902 3.048 1.00 . A A . 451 ARG CG 1 1 3 1243 1 1 19 ARG CZ C 5.586 -9.961 6.130 1.00 . A A . 451 ARG CZ 1 1 3 1244 1 1 19 ARG H H 5.044 -7.121 0.524 1.00 . A A . 451 ARG H 1 1 3 1245 1 1 19 ARG HA H 7.153 -9.080 0.729 1.00 . A A . 451 ARG HA 1 1 3 1246 1 1 19 ARG HB2 H 4.473 -9.196 2.110 1.00 . A A . 451 ARG HB2 1 1 3 1247 1 1 19 ARG HB3 H 5.969 -9.971 2.602 1.00 . A A . 451 ARG HB3 1 1 3 1248 1 1 19 ARG HD2 H 5.545 -7.248 5.053 1.00 . A A . 451 ARG HD2 1 1 3 1249 1 1 19 ARG HD3 H 4.318 -8.357 4.444 1.00 . A A . 451 ARG HD3 1 1 3 1250 1 1 19 ARG HE H 6.960 -9.500 4.743 1.00 . A A . 451 ARG HE 1 1 3 1251 1 1 19 ARG HG2 H 6.928 -7.746 3.062 1.00 . A A . 451 ARG HG2 1 1 3 1252 1 1 19 ARG HG3 H 5.372 -7.023 2.653 1.00 . A A . 451 ARG HG3 1 1 3 1253 1 1 19 ARG HH11 H 3.836 -8.937 6.245 1.00 . A A . 451 ARG HH11 1 1 3 1254 1 1 19 ARG HH12 H 4.025 -10.211 7.409 1.00 . A A . 451 ARG HH12 1 1 3 1255 1 1 19 ARG HH21 H 7.207 -11.168 6.269 1.00 . A A . 451 ARG HH21 1 1 3 1256 1 1 19 ARG HH22 H 5.941 -11.492 7.416 1.00 . A A . 451 ARG HH22 1 1 3 1257 1 1 19 ARG N N 5.781 -7.655 0.149 1.00 . A A . 451 ARG N 1 1 3 1258 1 1 19 ARG NE N 6.071 -9.261 5.104 1.00 . A A . 451 ARG NE 1 1 3 1259 1 1 19 ARG NH1 N 4.388 -9.679 6.634 1.00 . A A . 451 ARG NH1 1 1 3 1260 1 1 19 ARG NH2 N 6.303 -10.949 6.647 1.00 . A A . 451 ARG NH2 1 1 3 1261 1 1 19 ARG O O 6.155 -10.944 -0.634 1.00 . A A . 451 ARG O 1 1 3 1262 1 1 20 THR C C 2.904 -10.451 -2.400 1.00 . A A . 452 THR C 1 1 3 1263 1 1 20 THR CA C 3.406 -10.978 -1.058 1.00 . A A . 452 THR CA 1 1 3 1264 1 1 20 THR CB C 2.208 -11.483 -0.236 1.00 . A A . 452 THR CB 1 1 3 1265 1 1 20 THR CG2 C 2.674 -12.300 0.959 1.00 . A A . 452 THR CG2 1 1 3 1266 1 1 20 THR H H 3.665 -9.208 0.065 1.00 . A A . 452 THR H 1 1 3 1267 1 1 20 THR HA H 4.066 -11.815 -1.236 1.00 . A A . 452 THR HA 1 1 3 1268 1 1 20 THR HB H 1.599 -12.114 -0.868 1.00 . A A . 452 THR HB 1 1 3 1269 1 1 20 THR HG1 H 0.493 -10.527 -0.015 1.00 . A A . 452 THR HG1 1 1 3 1270 1 1 20 THR HG21 H 3.207 -13.174 0.613 1.00 . A A . 452 THR HG21 1 1 3 1271 1 1 20 THR HG22 H 1.818 -12.608 1.542 1.00 . A A . 452 THR HG22 1 1 3 1272 1 1 20 THR HG23 H 3.330 -11.699 1.571 1.00 . A A . 452 THR HG23 1 1 3 1273 1 1 20 THR N N 4.153 -9.969 -0.323 1.00 . A A . 452 THR N 1 1 3 1274 1 1 20 THR O O 2.223 -11.170 -3.135 1.00 . A A . 452 THR O 1 1 3 1275 1 1 20 THR OG1 O 1.420 -10.373 0.213 1.00 . A A . 452 THR OG1 1 1 3 1276 1 1 21 LEU C C 1.272 -8.256 -3.871 1.00 . A A . 453 LEU C 1 1 3 1277 1 1 21 LEU CA C 2.775 -8.518 -3.930 1.00 . A A . 453 LEU CA 1 1 3 1278 1 1 21 LEU CB C 3.138 -9.342 -5.180 1.00 . A A . 453 LEU CB 1 1 3 1279 1 1 21 LEU CD1 C 5.528 -9.949 -4.606 1.00 . A A . 453 LEU CD1 1 1 3 1280 1 1 21 LEU CD2 C 4.779 -9.919 -6.990 1.00 . A A . 453 LEU CD2 1 1 3 1281 1 1 21 LEU CG C 4.610 -9.278 -5.619 1.00 . A A . 453 LEU CG 1 1 3 1282 1 1 21 LEU H H 3.773 -8.678 -2.064 1.00 . A A . 453 LEU H 1 1 3 1283 1 1 21 LEU HA H 3.281 -7.565 -3.982 1.00 . A A . 453 LEU HA 1 1 3 1284 1 1 21 LEU HB2 H 2.889 -10.375 -4.985 1.00 . A A . 453 LEU HB2 1 1 3 1285 1 1 21 LEU HB3 H 2.527 -8.993 -5.999 1.00 . A A . 453 LEU HB3 1 1 3 1286 1 1 21 LEU HD11 H 5.254 -10.989 -4.504 1.00 . A A . 453 LEU HD11 1 1 3 1287 1 1 21 LEU HD12 H 5.430 -9.457 -3.649 1.00 . A A . 453 LEU HD12 1 1 3 1288 1 1 21 LEU HD13 H 6.552 -9.878 -4.944 1.00 . A A . 453 LEU HD13 1 1 3 1289 1 1 21 LEU HD21 H 4.163 -9.399 -7.708 1.00 . A A . 453 LEU HD21 1 1 3 1290 1 1 21 LEU HD22 H 4.478 -10.955 -6.942 1.00 . A A . 453 LEU HD22 1 1 3 1291 1 1 21 LEU HD23 H 5.814 -9.859 -7.291 1.00 . A A . 453 LEU HD23 1 1 3 1292 1 1 21 LEU HG H 4.907 -8.243 -5.700 1.00 . A A . 453 LEU HG 1 1 3 1293 1 1 21 LEU N N 3.220 -9.183 -2.696 1.00 . A A . 453 LEU N 1 1 3 1294 1 1 21 LEU O O 0.575 -8.259 -4.887 1.00 . A A . 453 LEU O 1 1 3 1295 1 1 22 GLU C C -0.892 -6.216 -2.571 1.00 . A A . 454 GLU C 1 1 3 1296 1 1 22 GLU CA C -0.607 -7.705 -2.416 1.00 . A A . 454 GLU CA 1 1 3 1297 1 1 22 GLU CB C -0.963 -8.159 -0.990 1.00 . A A . 454 GLU CB 1 1 3 1298 1 1 22 GLU CD C -2.668 -8.163 0.889 1.00 . A A . 454 GLU CD 1 1 3 1299 1 1 22 GLU CG C -2.367 -7.774 -0.545 1.00 . A A . 454 GLU CG 1 1 3 1300 1 1 22 GLU H H 1.434 -7.910 -1.922 1.00 . A A . 454 GLU H 1 1 3 1301 1 1 22 GLU HA H -1.192 -8.262 -3.129 1.00 . A A . 454 GLU HA 1 1 3 1302 1 1 22 GLU HB2 H -0.877 -9.234 -0.936 1.00 . A A . 454 GLU HB2 1 1 3 1303 1 1 22 GLU HB3 H -0.258 -7.718 -0.300 1.00 . A A . 454 GLU HB3 1 1 3 1304 1 1 22 GLU HG2 H -2.480 -6.704 -0.638 1.00 . A A . 454 GLU HG2 1 1 3 1305 1 1 22 GLU HG3 H -3.081 -8.265 -1.188 1.00 . A A . 454 GLU HG3 1 1 3 1306 1 1 22 GLU N N 0.803 -7.970 -2.667 1.00 . A A . 454 GLU N 1 1 3 1307 1 1 22 GLU O O -0.055 -5.384 -2.249 1.00 . A A . 454 GLU O 1 1 3 1308 1 1 22 GLU OE1 O -2.338 -7.383 1.809 1.00 . A A . 454 GLU OE1 1 1 3 1309 1 1 22 GLU OE2 O -3.254 -9.245 1.104 1.00 . A A . 454 GLU OE2 1 1 3 1310 1 1 23 SER C C -3.347 -4.242 -1.820 1.00 . A A . 455 SER C 1 1 3 1311 1 1 23 SER CA C -2.489 -4.490 -3.061 1.00 . A A . 455 SER CA 1 1 3 1312 1 1 23 SER CB C -3.243 -4.142 -4.347 1.00 . A A . 455 SER CB 1 1 3 1313 1 1 23 SER H H -2.656 -6.567 -3.450 1.00 . A A . 455 SER H 1 1 3 1314 1 1 23 SER HA H -1.601 -3.877 -2.996 1.00 . A A . 455 SER HA 1 1 3 1315 1 1 23 SER HB2 H -3.550 -3.106 -4.314 1.00 . A A . 455 SER HB2 1 1 3 1316 1 1 23 SER HB3 H -2.589 -4.294 -5.193 1.00 . A A . 455 SER HB3 1 1 3 1317 1 1 23 SER HG H -4.809 -5.101 -3.648 1.00 . A A . 455 SER HG 1 1 3 1318 1 1 23 SER N N -2.064 -5.873 -3.069 1.00 . A A . 455 SER N 1 1 3 1319 1 1 23 SER O O -4.470 -4.738 -1.720 1.00 . A A . 455 SER O 1 1 3 1320 1 1 23 SER OG O -4.390 -4.963 -4.509 1.00 . A A . 455 SER OG 1 1 3 1321 1 1 24 THR C C -4.131 -1.949 0.457 1.00 . A A . 456 THR C 1 1 3 1322 1 1 24 THR CA C -3.437 -3.307 0.418 1.00 . A A . 456 THR CA 1 1 3 1323 1 1 24 THR CB C -2.393 -3.387 1.552 1.00 . A A . 456 THR CB 1 1 3 1324 1 1 24 THR CG2 C -3.062 -3.358 2.921 1.00 . A A . 456 THR CG2 1 1 3 1325 1 1 24 THR H H -1.931 -3.071 -1.032 1.00 . A A . 456 THR H 1 1 3 1326 1 1 24 THR HA H -4.165 -4.089 0.564 1.00 . A A . 456 THR HA 1 1 3 1327 1 1 24 THR HB H -1.734 -2.533 1.470 1.00 . A A . 456 THR HB 1 1 3 1328 1 1 24 THR HG1 H -2.154 -5.355 1.643 1.00 . A A . 456 THR HG1 1 1 3 1329 1 1 24 THR HG21 H -2.307 -3.339 3.691 1.00 . A A . 456 THR HG21 1 1 3 1330 1 1 24 THR HG22 H -3.677 -4.237 3.041 1.00 . A A . 456 THR HG22 1 1 3 1331 1 1 24 THR HG23 H -3.679 -2.475 3.000 1.00 . A A . 456 THR HG23 1 1 3 1332 1 1 24 THR N N -2.795 -3.510 -0.867 1.00 . A A . 456 THR N 1 1 3 1333 1 1 24 THR O O -3.500 -0.912 0.272 1.00 . A A . 456 THR O 1 1 3 1334 1 1 24 THR OG1 O -1.616 -4.588 1.414 1.00 . A A . 456 THR OG1 1 1 3 1335 1 1 25 TRP C C -6.914 -0.573 2.052 1.00 . A A . 457 TRP C 1 1 3 1336 1 1 25 TRP CA C -6.195 -0.716 0.713 1.00 . A A . 457 TRP CA 1 1 3 1337 1 1 25 TRP CB C -7.147 -0.651 -0.486 1.00 . A A . 457 TRP CB 1 1 3 1338 1 1 25 TRP CD1 C -5.770 -1.686 -2.375 1.00 . A A . 457 TRP CD1 1 1 3 1339 1 1 25 TRP CD2 C -6.070 0.519 -2.569 1.00 . A A . 457 TRP CD2 1 1 3 1340 1 1 25 TRP CE2 C -5.259 0.077 -3.633 1.00 . A A . 457 TRP CE2 1 1 3 1341 1 1 25 TRP CE3 C -6.400 1.872 -2.494 1.00 . A A . 457 TRP CE3 1 1 3 1342 1 1 25 TRP CG C -6.369 -0.625 -1.767 1.00 . A A . 457 TRP CG 1 1 3 1343 1 1 25 TRP CH2 C -5.106 2.257 -4.509 1.00 . A A . 457 TRP CH2 1 1 3 1344 1 1 25 TRP CZ2 C -4.767 0.936 -4.603 1.00 . A A . 457 TRP CZ2 1 1 3 1345 1 1 25 TRP CZ3 C -5.919 2.728 -3.468 1.00 . A A . 457 TRP CZ3 1 1 3 1346 1 1 25 TRP H H -5.906 -2.821 0.733 1.00 . A A . 457 TRP H 1 1 3 1347 1 1 25 TRP HA H -5.484 0.092 0.627 1.00 . A A . 457 TRP HA 1 1 3 1348 1 1 25 TRP HB2 H -7.788 -1.522 -0.489 1.00 . A A . 457 TRP HB2 1 1 3 1349 1 1 25 TRP HB3 H -7.746 0.245 -0.430 1.00 . A A . 457 TRP HB3 1 1 3 1350 1 1 25 TRP HD1 H -5.818 -2.701 -2.009 1.00 . A A . 457 TRP HD1 1 1 3 1351 1 1 25 TRP HE1 H -4.565 -1.844 -4.082 1.00 . A A . 457 TRP HE1 1 1 3 1352 1 1 25 TRP HE3 H -7.025 2.251 -1.699 1.00 . A A . 457 TRP HE3 1 1 3 1353 1 1 25 TRP HH2 H -4.752 2.961 -5.247 1.00 . A A . 457 TRP HH2 1 1 3 1354 1 1 25 TRP HZ2 H -4.115 0.589 -5.393 1.00 . A A . 457 TRP HZ2 1 1 3 1355 1 1 25 TRP HZ3 H -6.165 3.779 -3.428 1.00 . A A . 457 TRP HZ3 1 1 3 1356 1 1 25 TRP N N -5.437 -1.959 0.655 1.00 . A A . 457 TRP N 1 1 3 1357 1 1 25 TRP NE1 N -5.085 -1.270 -3.485 1.00 . A A . 457 TRP NE1 1 1 3 1358 1 1 25 TRP O O -7.683 0.363 2.266 1.00 . A A . 457 TRP O 1 1 3 1359 1 1 26 GLU C C -5.873 -1.364 5.254 1.00 . A A . 458 GLU C 1 1 3 1360 1 1 26 GLU CA C -7.085 -1.434 4.331 1.00 . A A . 458 GLU CA 1 1 3 1361 1 1 26 GLU CB C -7.918 -2.679 4.649 1.00 . A A . 458 GLU CB 1 1 3 1362 1 1 26 GLU CD C -10.206 -1.840 3.989 1.00 . A A . 458 GLU CD 1 1 3 1363 1 1 26 GLU CG C -9.122 -2.868 3.742 1.00 . A A . 458 GLU CG 1 1 3 1364 1 1 26 GLU H H -6.025 -2.232 2.710 1.00 . A A . 458 GLU H 1 1 3 1365 1 1 26 GLU HA H -7.688 -0.546 4.453 1.00 . A A . 458 GLU HA 1 1 3 1366 1 1 26 GLU HB2 H -7.288 -3.551 4.557 1.00 . A A . 458 GLU HB2 1 1 3 1367 1 1 26 GLU HB3 H -8.271 -2.608 5.668 1.00 . A A . 458 GLU HB3 1 1 3 1368 1 1 26 GLU HG2 H -8.799 -2.787 2.714 1.00 . A A . 458 GLU HG2 1 1 3 1369 1 1 26 GLU HG3 H -9.533 -3.851 3.912 1.00 . A A . 458 GLU HG3 1 1 3 1370 1 1 26 GLU N N -6.608 -1.489 2.962 1.00 . A A . 458 GLU N 1 1 3 1371 1 1 26 GLU O O -5.030 -2.259 5.227 1.00 . A A . 458 GLU O 1 1 3 1372 1 1 26 GLU OE1 O -10.887 -1.937 5.030 1.00 . A A . 458 GLU OE1 1 1 3 1373 1 1 26 GLU OE2 O -10.400 -0.947 3.139 1.00 . A A . 458 GLU OE2 1 1 3 1374 1 1 27 LYS C C -4.475 -1.170 7.974 1.00 . A A . 459 LYS C 1 1 3 1375 1 1 27 LYS CA C -4.598 -0.093 6.900 1.00 . A A . 459 LYS CA 1 1 3 1376 1 1 27 LYS CB C -4.635 1.290 7.558 1.00 . A A . 459 LYS CB 1 1 3 1377 1 1 27 LYS CD C -4.226 3.763 7.300 1.00 . A A . 459 LYS CD 1 1 3 1378 1 1 27 LYS CE C -3.119 3.765 8.343 1.00 . A A . 459 LYS CE 1 1 3 1379 1 1 27 LYS CG C -4.329 2.421 6.592 1.00 . A A . 459 LYS CG 1 1 3 1380 1 1 27 LYS H H -6.498 0.352 6.067 1.00 . A A . 459 LYS H 1 1 3 1381 1 1 27 LYS HA H -3.727 -0.143 6.267 1.00 . A A . 459 LYS HA 1 1 3 1382 1 1 27 LYS HB2 H -5.618 1.454 7.976 1.00 . A A . 459 LYS HB2 1 1 3 1383 1 1 27 LYS HB3 H -3.906 1.317 8.355 1.00 . A A . 459 LYS HB3 1 1 3 1384 1 1 27 LYS HD2 H -4.013 4.527 6.566 1.00 . A A . 459 LYS HD2 1 1 3 1385 1 1 27 LYS HD3 H -5.168 3.980 7.784 1.00 . A A . 459 LYS HD3 1 1 3 1386 1 1 27 LYS HE2 H -3.171 4.687 8.902 1.00 . A A . 459 LYS HE2 1 1 3 1387 1 1 27 LYS HE3 H -3.276 2.932 9.012 1.00 . A A . 459 LYS HE3 1 1 3 1388 1 1 27 LYS HG2 H -3.393 2.215 6.098 1.00 . A A . 459 LYS HG2 1 1 3 1389 1 1 27 LYS HG3 H -5.118 2.473 5.857 1.00 . A A . 459 LYS HG3 1 1 3 1390 1 1 27 LYS HZ1 H -1.505 4.535 7.254 1.00 . A A . 459 LYS HZ1 1 1 3 1391 1 1 27 LYS HZ2 H -1.742 2.876 7.041 1.00 . A A . 459 LYS HZ2 1 1 3 1392 1 1 27 LYS HZ3 H -1.057 3.449 8.476 1.00 . A A . 459 LYS HZ3 1 1 3 1393 1 1 27 LYS N N -5.770 -0.301 6.047 1.00 . A A . 459 LYS N 1 1 3 1394 1 1 27 LYS NZ N -1.765 3.646 7.736 1.00 . A A . 459 LYS NZ 1 1 3 1395 1 1 27 LYS O O -5.351 -1.306 8.827 1.00 . A A . 459 LYS O 1 1 3 1396 1 1 28 PRO C C -2.433 -2.358 10.186 1.00 . A A . 460 PRO C 1 1 3 1397 1 1 28 PRO CA C -3.092 -2.964 8.945 1.00 . A A . 460 PRO CA 1 1 3 1398 1 1 28 PRO CB C -2.136 -3.912 8.225 1.00 . A A . 460 PRO CB 1 1 3 1399 1 1 28 PRO CD C -2.358 -1.941 6.865 1.00 . A A . 460 PRO CD 1 1 3 1400 1 1 28 PRO CG C -1.408 -3.044 7.254 1.00 . A A . 460 PRO CG 1 1 3 1401 1 1 28 PRO HA H -3.983 -3.499 9.240 1.00 . A A . 460 PRO HA 1 1 3 1402 1 1 28 PRO HB2 H -1.461 -4.362 8.940 1.00 . A A . 460 PRO HB2 1 1 3 1403 1 1 28 PRO HB3 H -2.700 -4.682 7.719 1.00 . A A . 460 PRO HB3 1 1 3 1404 1 1 28 PRO HD2 H -1.843 -0.992 6.842 1.00 . A A . 460 PRO HD2 1 1 3 1405 1 1 28 PRO HD3 H -2.800 -2.154 5.903 1.00 . A A . 460 PRO HD3 1 1 3 1406 1 1 28 PRO HG2 H -0.529 -2.629 7.726 1.00 . A A . 460 PRO HG2 1 1 3 1407 1 1 28 PRO HG3 H -1.128 -3.621 6.385 1.00 . A A . 460 PRO HG3 1 1 3 1408 1 1 28 PRO N N -3.385 -1.956 7.930 1.00 . A A . 460 PRO N 1 1 3 1409 1 1 28 PRO O O -1.238 -1.998 10.120 1.00 . A A . 460 PRO O 1 1 3 1410 1 1 28 PRO OXT O -3.119 -2.247 11.225 1.00 . A A . 460 PRO OXT 1 1 4 1411 1 1 1 SER C C 7.681 -1.637 5.835 1.00 . A A . 433 SER C 1 1 4 1412 1 1 1 SER CA C 7.986 -1.270 7.291 1.00 . A A . 433 SER CA 1 1 4 1413 1 1 1 SER CB C 9.240 -0.397 7.366 1.00 . A A . 433 SER CB 1 1 4 1414 1 1 1 SER H1 H 7.343 -3.077 8.109 1.00 . A A . 433 SER H1 1 1 4 1415 1 1 1 SER H2 H 8.449 -2.238 9.076 1.00 . A A . 433 SER H2 1 1 4 1416 1 1 1 SER H3 H 8.986 -3.051 7.690 1.00 . A A . 433 SER H3 1 1 4 1417 1 1 1 SER HA H 7.146 -0.728 7.704 1.00 . A A . 433 SER HA 1 1 4 1418 1 1 1 SER HB2 H 10.058 -0.898 6.866 1.00 . A A . 433 SER HB2 1 1 4 1419 1 1 1 SER HB3 H 9.047 0.550 6.881 1.00 . A A . 433 SER HB3 1 1 4 1420 1 1 1 SER HG H 10.563 -0.299 8.820 1.00 . A A . 433 SER HG 1 1 4 1421 1 1 1 SER N N 8.205 -2.491 8.097 1.00 . A A . 433 SER N 1 1 4 1422 1 1 1 SER O O 7.777 -0.803 4.936 1.00 . A A . 433 SER O 1 1 4 1423 1 1 1 SER OG O 9.609 -0.153 8.715 1.00 . A A . 433 SER OG 1 1 4 1424 1 1 2 GLU C C 5.762 -2.987 3.644 1.00 . A A . 434 GLU C 1 1 4 1425 1 1 2 GLU CA C 7.072 -3.432 4.288 1.00 . A A . 434 GLU CA 1 1 4 1426 1 1 2 GLU CB C 7.122 -4.961 4.339 1.00 . A A . 434 GLU CB 1 1 4 1427 1 1 2 GLU CD C 6.843 -5.565 6.769 1.00 . A A . 434 GLU CD 1 1 4 1428 1 1 2 GLU CG C 6.213 -5.579 5.391 1.00 . A A . 434 GLU CG 1 1 4 1429 1 1 2 GLU H H 7.038 -3.444 6.404 1.00 . A A . 434 GLU H 1 1 4 1430 1 1 2 GLU HA H 7.890 -3.084 3.679 1.00 . A A . 434 GLU HA 1 1 4 1431 1 1 2 GLU HB2 H 6.836 -5.352 3.375 1.00 . A A . 434 GLU HB2 1 1 4 1432 1 1 2 GLU HB3 H 8.133 -5.263 4.555 1.00 . A A . 434 GLU HB3 1 1 4 1433 1 1 2 GLU HG2 H 5.292 -5.018 5.425 1.00 . A A . 434 GLU HG2 1 1 4 1434 1 1 2 GLU HG3 H 6.003 -6.602 5.114 1.00 . A A . 434 GLU HG3 1 1 4 1435 1 1 2 GLU N N 7.251 -2.876 5.625 1.00 . A A . 434 GLU N 1 1 4 1436 1 1 2 GLU O O 5.502 -3.298 2.480 1.00 . A A . 434 GLU O 1 1 4 1437 1 1 2 GLU OE1 O 7.612 -6.500 7.079 1.00 . A A . 434 GLU OE1 1 1 4 1438 1 1 2 GLU OE2 O 6.598 -4.603 7.526 1.00 . A A . 434 GLU OE2 1 1 4 1439 1 1 3 TRP C C 3.880 -0.374 3.312 1.00 . A A . 435 TRP C 1 1 4 1440 1 1 3 TRP CA C 3.673 -1.786 3.868 1.00 . A A . 435 TRP CA 1 1 4 1441 1 1 3 TRP CB C 2.589 -1.774 4.953 1.00 . A A . 435 TRP CB 1 1 4 1442 1 1 3 TRP CD1 C 2.762 -3.234 7.045 1.00 . A A . 435 TRP CD1 1 1 4 1443 1 1 3 TRP CD2 C 2.081 -4.346 5.229 1.00 . A A . 435 TRP CD2 1 1 4 1444 1 1 3 TRP CE2 C 2.133 -5.245 6.315 1.00 . A A . 435 TRP CE2 1 1 4 1445 1 1 3 TRP CE3 C 1.682 -4.826 3.983 1.00 . A A . 435 TRP CE3 1 1 4 1446 1 1 3 TRP CG C 2.481 -3.060 5.724 1.00 . A A . 435 TRP CG 1 1 4 1447 1 1 3 TRP CH2 C 1.419 -7.035 4.949 1.00 . A A . 435 TRP CH2 1 1 4 1448 1 1 3 TRP CZ2 C 1.802 -6.594 6.186 1.00 . A A . 435 TRP CZ2 1 1 4 1449 1 1 3 TRP CZ3 C 1.357 -6.167 3.856 1.00 . A A . 435 TRP CZ3 1 1 4 1450 1 1 3 TRP H H 5.162 -2.113 5.337 1.00 . A A . 435 TRP H 1 1 4 1451 1 1 3 TRP HA H 3.366 -2.445 3.070 1.00 . A A . 435 TRP HA 1 1 4 1452 1 1 3 TRP HB2 H 2.807 -0.986 5.659 1.00 . A A . 435 TRP HB2 1 1 4 1453 1 1 3 TRP HB3 H 1.632 -1.580 4.492 1.00 . A A . 435 TRP HB3 1 1 4 1454 1 1 3 TRP HD1 H 3.101 -2.446 7.699 1.00 . A A . 435 TRP HD1 1 1 4 1455 1 1 3 TRP HE1 H 2.673 -4.905 8.313 1.00 . A A . 435 TRP HE1 1 1 4 1456 1 1 3 TRP HE3 H 1.625 -4.172 3.124 1.00 . A A . 435 TRP HE3 1 1 4 1457 1 1 3 TRP HH2 H 1.157 -8.073 4.797 1.00 . A A . 435 TRP HH2 1 1 4 1458 1 1 3 TRP HZ2 H 1.844 -7.275 7.025 1.00 . A A . 435 TRP HZ2 1 1 4 1459 1 1 3 TRP HZ3 H 1.071 -6.561 2.890 1.00 . A A . 435 TRP HZ3 1 1 4 1460 1 1 3 TRP N N 4.929 -2.293 4.402 1.00 . A A . 435 TRP N 1 1 4 1461 1 1 3 TRP NE1 N 2.548 -4.538 7.411 1.00 . A A . 435 TRP NE1 1 1 4 1462 1 1 3 TRP O O 4.178 0.551 4.067 1.00 . A A . 435 TRP O 1 1 4 1463 1 1 4 THR C C 2.711 1.917 1.313 1.00 . A A . 436 THR C 1 1 4 1464 1 1 4 THR CA C 3.983 1.087 1.374 1.00 . A A . 436 THR CA 1 1 4 1465 1 1 4 THR CB C 4.545 0.933 -0.055 1.00 . A A . 436 THR CB 1 1 4 1466 1 1 4 THR CG2 C 4.715 2.290 -0.739 1.00 . A A . 436 THR CG2 1 1 4 1467 1 1 4 THR H H 3.478 -0.963 1.437 1.00 . A A . 436 THR H 1 1 4 1468 1 1 4 THR HA H 4.714 1.612 1.969 1.00 . A A . 436 THR HA 1 1 4 1469 1 1 4 THR HB H 3.846 0.343 -0.633 1.00 . A A . 436 THR HB 1 1 4 1470 1 1 4 THR HG1 H 5.682 -0.657 -0.316 1.00 . A A . 436 THR HG1 1 1 4 1471 1 1 4 THR HG21 H 5.146 2.147 -1.719 1.00 . A A . 436 THR HG21 1 1 4 1472 1 1 4 THR HG22 H 5.365 2.917 -0.146 1.00 . A A . 436 THR HG22 1 1 4 1473 1 1 4 THR HG23 H 3.747 2.769 -0.840 1.00 . A A . 436 THR HG23 1 1 4 1474 1 1 4 THR N N 3.747 -0.207 1.999 1.00 . A A . 436 THR N 1 1 4 1475 1 1 4 THR O O 1.775 1.584 0.583 1.00 . A A . 436 THR O 1 1 4 1476 1 1 4 THR OG1 O 5.805 0.249 -0.013 1.00 . A A . 436 THR OG1 1 1 4 1477 1 1 5 GLU C C 1.961 5.041 1.029 1.00 . A A . 437 GLU C 1 1 4 1478 1 1 5 GLU CA C 1.584 3.940 2.010 1.00 . A A . 437 GLU CA 1 1 4 1479 1 1 5 GLU CB C 1.260 4.547 3.382 1.00 . A A . 437 GLU CB 1 1 4 1480 1 1 5 GLU CD C 0.687 4.159 5.818 1.00 . A A . 437 GLU CD 1 1 4 1481 1 1 5 GLU CG C 1.115 3.528 4.508 1.00 . A A . 437 GLU CG 1 1 4 1482 1 1 5 GLU H H 3.399 3.142 2.735 1.00 . A A . 437 GLU H 1 1 4 1483 1 1 5 GLU HA H 0.718 3.425 1.632 1.00 . A A . 437 GLU HA 1 1 4 1484 1 1 5 GLU HB2 H 2.050 5.232 3.652 1.00 . A A . 437 GLU HB2 1 1 4 1485 1 1 5 GLU HB3 H 0.333 5.098 3.306 1.00 . A A . 437 GLU HB3 1 1 4 1486 1 1 5 GLU HG2 H 0.381 2.794 4.228 1.00 . A A . 437 GLU HG2 1 1 4 1487 1 1 5 GLU HG3 H 2.067 3.042 4.656 1.00 . A A . 437 GLU HG3 1 1 4 1488 1 1 5 GLU N N 2.675 2.988 2.094 1.00 . A A . 437 GLU N 1 1 4 1489 1 1 5 GLU O O 2.595 6.029 1.401 1.00 . A A . 437 GLU O 1 1 4 1490 1 1 5 GLU OE1 O -0.533 4.322 6.034 1.00 . A A . 437 GLU OE1 1 1 4 1491 1 1 5 GLU OE2 O 1.568 4.495 6.637 1.00 . A A . 437 GLU OE2 1 1 4 1492 1 1 6 ARG C C 0.772 6.611 -1.702 1.00 . A A . 438 ARG C 1 1 4 1493 1 1 6 ARG CA C 1.997 5.782 -1.270 1.00 . A A . 438 ARG CA 1 1 4 1494 1 1 6 ARG CB C 2.569 5.042 -2.479 1.00 . A A . 438 ARG CB 1 1 4 1495 1 1 6 ARG CD C 3.695 5.218 -4.724 1.00 . A A . 438 ARG CD 1 1 4 1496 1 1 6 ARG CG C 3.025 5.976 -3.592 1.00 . A A . 438 ARG CG 1 1 4 1497 1 1 6 ARG CZ C 5.317 3.361 -4.747 1.00 . A A . 438 ARG CZ 1 1 4 1498 1 1 6 ARG H H 1.094 4.044 -0.469 1.00 . A A . 438 ARG H 1 1 4 1499 1 1 6 ARG HA H 2.770 6.408 -0.852 1.00 . A A . 438 ARG HA 1 1 4 1500 1 1 6 ARG HB2 H 3.418 4.454 -2.159 1.00 . A A . 438 ARG HB2 1 1 4 1501 1 1 6 ARG HB3 H 1.813 4.382 -2.878 1.00 . A A . 438 ARG HB3 1 1 4 1502 1 1 6 ARG HD2 H 3.004 4.482 -5.106 1.00 . A A . 438 ARG HD2 1 1 4 1503 1 1 6 ARG HD3 H 3.946 5.917 -5.509 1.00 . A A . 438 ARG HD3 1 1 4 1504 1 1 6 ARG HE H 5.468 5.010 -3.611 1.00 . A A . 438 ARG HE 1 1 4 1505 1 1 6 ARG HG2 H 2.166 6.499 -3.982 1.00 . A A . 438 ARG HG2 1 1 4 1506 1 1 6 ARG HG3 H 3.726 6.689 -3.182 1.00 . A A . 438 ARG HG3 1 1 4 1507 1 1 6 ARG HH11 H 3.696 3.077 -5.940 1.00 . A A . 438 ARG HH11 1 1 4 1508 1 1 6 ARG HH12 H 4.882 1.804 -5.979 1.00 . A A . 438 ARG HH12 1 1 4 1509 1 1 6 ARG HH21 H 7.029 3.349 -3.660 1.00 . A A . 438 ARG HH21 1 1 4 1510 1 1 6 ARG HH22 H 6.769 1.943 -4.660 1.00 . A A . 438 ARG HH22 1 1 4 1511 1 1 6 ARG N N 1.620 4.839 -0.233 1.00 . A A . 438 ARG N 1 1 4 1512 1 1 6 ARG NE N 4.912 4.542 -4.285 1.00 . A A . 438 ARG NE 1 1 4 1513 1 1 6 ARG NH1 N 4.573 2.692 -5.623 1.00 . A A . 438 ARG NH1 1 1 4 1514 1 1 6 ARG NH2 N 6.461 2.846 -4.325 1.00 . A A . 438 ARG NH2 1 1 4 1515 1 1 6 ARG O O -0.249 6.030 -2.076 1.00 . A A . 438 ARG O 1 1 4 1516 1 1 7 LYS C C -0.235 9.120 -3.524 1.00 . A A . 439 LYS C 1 1 4 1517 1 1 7 LYS CA C -0.281 8.776 -2.043 1.00 . A A . 439 LYS CA 1 1 4 1518 1 1 7 LYS CB C -0.287 10.046 -1.190 1.00 . A A . 439 LYS CB 1 1 4 1519 1 1 7 LYS CD C 1.073 11.899 -0.169 1.00 . A A . 439 LYS CD 1 1 4 1520 1 1 7 LYS CE C 2.486 12.405 0.060 1.00 . A A . 439 LYS CE 1 1 4 1521 1 1 7 LYS CG C 1.072 10.717 -1.116 1.00 . A A . 439 LYS CG 1 1 4 1522 1 1 7 LYS H H 1.690 8.403 -1.451 1.00 . A A . 439 LYS H 1 1 4 1523 1 1 7 LYS HA H -1.179 8.215 -1.843 1.00 . A A . 439 LYS HA 1 1 4 1524 1 1 7 LYS HB2 H -0.992 10.747 -1.614 1.00 . A A . 439 LYS HB2 1 1 4 1525 1 1 7 LYS HB3 H -0.599 9.794 -0.188 1.00 . A A . 439 LYS HB3 1 1 4 1526 1 1 7 LYS HD2 H 0.477 12.692 -0.593 1.00 . A A . 439 LYS HD2 1 1 4 1527 1 1 7 LYS HD3 H 0.651 11.590 0.776 1.00 . A A . 439 LYS HD3 1 1 4 1528 1 1 7 LYS HE2 H 2.912 12.683 -0.892 1.00 . A A . 439 LYS HE2 1 1 4 1529 1 1 7 LYS HE3 H 2.445 13.273 0.704 1.00 . A A . 439 LYS HE3 1 1 4 1530 1 1 7 LYS HG2 H 1.798 9.997 -0.773 1.00 . A A . 439 LYS HG2 1 1 4 1531 1 1 7 LYS HG3 H 1.345 11.061 -2.103 1.00 . A A . 439 LYS HG3 1 1 4 1532 1 1 7 LYS HZ1 H 2.963 11.107 1.628 1.00 . A A . 439 LYS HZ1 1 1 4 1533 1 1 7 LYS HZ2 H 4.317 11.735 0.822 1.00 . A A . 439 LYS HZ2 1 1 4 1534 1 1 7 LYS HZ3 H 3.387 10.517 0.096 1.00 . A A . 439 LYS HZ3 1 1 4 1535 1 1 7 LYS N N 0.854 7.951 -1.682 1.00 . A A . 439 LYS N 1 1 4 1536 1 1 7 LYS NZ N 3.348 11.370 0.694 1.00 . A A . 439 LYS NZ 1 1 4 1537 1 1 7 LYS O O 0.657 9.836 -3.977 1.00 . A A . 439 LYS O 1 1 4 1538 1 1 8 THR C C -2.112 10.113 -5.947 1.00 . A A . 440 THR C 1 1 4 1539 1 1 8 THR CA C -1.239 8.881 -5.701 1.00 . A A . 440 THR CA 1 1 4 1540 1 1 8 THR CB C -1.753 7.674 -6.531 1.00 . A A . 440 THR CB 1 1 4 1541 1 1 8 THR CG2 C -3.254 7.474 -6.376 1.00 . A A . 440 THR CG2 1 1 4 1542 1 1 8 THR H H -1.825 7.966 -3.879 1.00 . A A . 440 THR H 1 1 4 1543 1 1 8 THR HA H -0.234 9.108 -6.027 1.00 . A A . 440 THR HA 1 1 4 1544 1 1 8 THR HB H -1.250 6.781 -6.186 1.00 . A A . 440 THR HB 1 1 4 1545 1 1 8 THR HG1 H -2.244 8.150 -8.393 1.00 . A A . 440 THR HG1 1 1 4 1546 1 1 8 THR HG21 H -3.569 6.638 -6.982 1.00 . A A . 440 THR HG21 1 1 4 1547 1 1 8 THR HG22 H -3.770 8.367 -6.696 1.00 . A A . 440 THR HG22 1 1 4 1548 1 1 8 THR HG23 H -3.486 7.275 -5.340 1.00 . A A . 440 THR HG23 1 1 4 1549 1 1 8 THR N N -1.177 8.586 -4.280 1.00 . A A . 440 THR N 1 1 4 1550 1 1 8 THR O O -3.057 10.387 -5.197 1.00 . A A . 440 THR O 1 1 4 1551 1 1 8 THR OG1 O -1.448 7.871 -7.918 1.00 . A A . 440 THR OG1 1 1 4 1552 1 1 9 ALA C C -3.874 12.075 -7.577 1.00 . A A . 441 ALA C 1 1 4 1553 1 1 9 ALA CA C -2.374 12.150 -7.300 1.00 . A A . 441 ALA CA 1 1 4 1554 1 1 9 ALA CB C -1.657 12.792 -8.477 1.00 . A A . 441 ALA CB 1 1 4 1555 1 1 9 ALA H H -1.110 10.485 -7.630 1.00 . A A . 441 ALA H 1 1 4 1556 1 1 9 ALA HA H -2.214 12.780 -6.438 1.00 . A A . 441 ALA HA 1 1 4 1557 1 1 9 ALA HB1 H -1.835 12.209 -9.369 1.00 . A A . 441 ALA HB1 1 1 4 1558 1 1 9 ALA HB2 H -0.596 12.828 -8.276 1.00 . A A . 441 ALA HB2 1 1 4 1559 1 1 9 ALA HB3 H -2.032 13.795 -8.621 1.00 . A A . 441 ALA HB3 1 1 4 1560 1 1 9 ALA N N -1.781 10.842 -7.010 1.00 . A A . 441 ALA N 1 1 4 1561 1 1 9 ALA O O -4.537 13.104 -7.686 1.00 . A A . 441 ALA O 1 1 4 1562 1 1 10 ASP C C -6.572 11.020 -6.557 1.00 . A A . 442 ASP C 1 1 4 1563 1 1 10 ASP CA C -5.838 10.653 -7.848 1.00 . A A . 442 ASP CA 1 1 4 1564 1 1 10 ASP CB C -6.119 9.193 -8.220 1.00 . A A . 442 ASP CB 1 1 4 1565 1 1 10 ASP CG C -7.540 8.972 -8.694 1.00 . A A . 442 ASP CG 1 1 4 1566 1 1 10 ASP H H -3.807 10.084 -7.666 1.00 . A A . 442 ASP H 1 1 4 1567 1 1 10 ASP HA H -6.183 11.295 -8.645 1.00 . A A . 442 ASP HA 1 1 4 1568 1 1 10 ASP HB2 H -5.446 8.893 -9.009 1.00 . A A . 442 ASP HB2 1 1 4 1569 1 1 10 ASP HB3 H -5.948 8.570 -7.352 1.00 . A A . 442 ASP HB3 1 1 4 1570 1 1 10 ASP N N -4.401 10.862 -7.684 1.00 . A A . 442 ASP N 1 1 4 1571 1 1 10 ASP O O -7.803 11.047 -6.500 1.00 . A A . 442 ASP O 1 1 4 1572 1 1 10 ASP OD1 O -7.823 9.248 -9.880 1.00 . A A . 442 ASP OD1 1 1 4 1573 1 1 10 ASP OD2 O -8.367 8.497 -7.891 1.00 . A A . 442 ASP OD2 1 1 4 1574 1 1 11 GLY C C -6.654 10.534 -3.347 1.00 . A A . 443 GLY C 1 1 4 1575 1 1 11 GLY CA C -6.368 11.706 -4.255 1.00 . A A . 443 GLY CA 1 1 4 1576 1 1 11 GLY H H -4.823 11.222 -5.610 1.00 . A A . 443 GLY H 1 1 4 1577 1 1 11 GLY HA2 H -5.678 12.371 -3.759 1.00 . A A . 443 GLY HA2 1 1 4 1578 1 1 11 GLY HA3 H -7.291 12.236 -4.442 1.00 . A A . 443 GLY HA3 1 1 4 1579 1 1 11 GLY N N -5.799 11.299 -5.517 1.00 . A A . 443 GLY N 1 1 4 1580 1 1 11 GLY O O -7.571 10.582 -2.530 1.00 . A A . 443 GLY O 1 1 4 1581 1 1 12 LYS C C -4.693 7.598 -2.446 1.00 . A A . 444 LYS C 1 1 4 1582 1 1 12 LYS CA C -6.024 8.308 -2.638 1.00 . A A . 444 LYS CA 1 1 4 1583 1 1 12 LYS CB C -7.071 7.336 -3.202 1.00 . A A . 444 LYS CB 1 1 4 1584 1 1 12 LYS CD C -7.615 5.628 -4.940 1.00 . A A . 444 LYS CD 1 1 4 1585 1 1 12 LYS CE C -7.552 5.250 -6.410 1.00 . A A . 444 LYS CE 1 1 4 1586 1 1 12 LYS CG C -6.831 6.896 -4.634 1.00 . A A . 444 LYS CG 1 1 4 1587 1 1 12 LYS H H -5.159 9.489 -4.166 1.00 . A A . 444 LYS H 1 1 4 1588 1 1 12 LYS HA H -6.364 8.656 -1.672 1.00 . A A . 444 LYS HA 1 1 4 1589 1 1 12 LYS HB2 H -7.087 6.454 -2.585 1.00 . A A . 444 LYS HB2 1 1 4 1590 1 1 12 LYS HB3 H -8.041 7.809 -3.155 1.00 . A A . 444 LYS HB3 1 1 4 1591 1 1 12 LYS HD2 H -7.205 4.818 -4.358 1.00 . A A . 444 LYS HD2 1 1 4 1592 1 1 12 LYS HD3 H -8.648 5.781 -4.663 1.00 . A A . 444 LYS HD3 1 1 4 1593 1 1 12 LYS HE2 H -6.562 5.466 -6.780 1.00 . A A . 444 LYS HE2 1 1 4 1594 1 1 12 LYS HE3 H -7.749 4.193 -6.504 1.00 . A A . 444 LYS HE3 1 1 4 1595 1 1 12 LYS HG2 H -7.146 7.681 -5.304 1.00 . A A . 444 LYS HG2 1 1 4 1596 1 1 12 LYS HG3 H -5.777 6.701 -4.770 1.00 . A A . 444 LYS HG3 1 1 4 1597 1 1 12 LYS HZ1 H -8.255 6.999 -7.332 1.00 . A A . 444 LYS HZ1 1 1 4 1598 1 1 12 LYS HZ2 H -9.480 5.980 -6.755 1.00 . A A . 444 LYS HZ2 1 1 4 1599 1 1 12 LYS HZ3 H -8.641 5.574 -8.167 1.00 . A A . 444 LYS HZ3 1 1 4 1600 1 1 12 LYS N N -5.872 9.476 -3.488 1.00 . A A . 444 LYS N 1 1 4 1601 1 1 12 LYS NZ N -8.546 6.002 -7.222 1.00 . A A . 444 LYS NZ 1 1 4 1602 1 1 12 LYS O O -3.858 7.564 -3.350 1.00 . A A . 444 LYS O 1 1 4 1603 1 1 13 THR C C -3.578 4.785 -1.174 1.00 . A A . 445 THR C 1 1 4 1604 1 1 13 THR CA C -3.308 6.272 -0.978 1.00 . A A . 445 THR CA 1 1 4 1605 1 1 13 THR CB C -2.813 6.545 0.465 1.00 . A A . 445 THR CB 1 1 4 1606 1 1 13 THR CG2 C -3.815 6.042 1.494 1.00 . A A . 445 THR CG2 1 1 4 1607 1 1 13 THR H H -5.203 7.107 -0.584 1.00 . A A . 445 THR H 1 1 4 1608 1 1 13 THR HA H -2.540 6.580 -1.669 1.00 . A A . 445 THR HA 1 1 4 1609 1 1 13 THR HB H -2.706 7.613 0.590 1.00 . A A . 445 THR HB 1 1 4 1610 1 1 13 THR HG1 H -1.160 6.278 1.504 1.00 . A A . 445 THR HG1 1 1 4 1611 1 1 13 THR HG21 H -3.452 6.265 2.486 1.00 . A A . 445 THR HG21 1 1 4 1612 1 1 13 THR HG22 H -3.937 4.974 1.388 1.00 . A A . 445 THR HG22 1 1 4 1613 1 1 13 THR HG23 H -4.764 6.531 1.341 1.00 . A A . 445 THR HG23 1 1 4 1614 1 1 13 THR N N -4.506 7.028 -1.273 1.00 . A A . 445 THR N 1 1 4 1615 1 1 13 THR O O -4.692 4.314 -0.940 1.00 . A A . 445 THR O 1 1 4 1616 1 1 13 THR OG1 O -1.542 5.924 0.694 1.00 . A A . 445 THR OG1 1 1 4 1617 1 1 14 TYR C C -1.606 1.895 -1.103 1.00 . A A . 446 TYR C 1 1 4 1618 1 1 14 TYR CA C -2.719 2.628 -1.829 1.00 . A A . 446 TYR CA 1 1 4 1619 1 1 14 TYR CB C -2.732 2.255 -3.315 1.00 . A A . 446 TYR CB 1 1 4 1620 1 1 14 TYR CD1 C -1.175 3.817 -4.567 1.00 . A A . 446 TYR CD1 1 1 4 1621 1 1 14 TYR CD2 C -0.570 1.518 -4.381 1.00 . A A . 446 TYR CD2 1 1 4 1622 1 1 14 TYR CE1 C -0.033 4.059 -5.308 1.00 . A A . 446 TYR CE1 1 1 4 1623 1 1 14 TYR CE2 C 0.575 1.756 -5.113 1.00 . A A . 446 TYR CE2 1 1 4 1624 1 1 14 TYR CG C -1.463 2.542 -4.093 1.00 . A A . 446 TYR CG 1 1 4 1625 1 1 14 TYR CZ C 0.838 3.023 -5.576 1.00 . A A . 446 TYR CZ 1 1 4 1626 1 1 14 TYR H H -1.723 4.496 -1.856 1.00 . A A . 446 TYR H 1 1 4 1627 1 1 14 TYR HA H -3.666 2.344 -1.394 1.00 . A A . 446 TYR HA 1 1 4 1628 1 1 14 TYR HB2 H -2.925 1.198 -3.401 1.00 . A A . 446 TYR HB2 1 1 4 1629 1 1 14 TYR HB3 H -3.535 2.790 -3.794 1.00 . A A . 446 TYR HB3 1 1 4 1630 1 1 14 TYR HD1 H -1.859 4.625 -4.354 1.00 . A A . 446 TYR HD1 1 1 4 1631 1 1 14 TYR HD2 H -0.779 0.523 -4.019 1.00 . A A . 446 TYR HD2 1 1 4 1632 1 1 14 TYR HE1 H 0.175 5.055 -5.670 1.00 . A A . 446 TYR HE1 1 1 4 1633 1 1 14 TYR HE2 H 1.258 0.947 -5.322 1.00 . A A . 446 TYR HE2 1 1 4 1634 1 1 14 TYR HH H 2.016 2.599 -7.040 1.00 . A A . 446 TYR HH 1 1 4 1635 1 1 14 TYR N N -2.579 4.060 -1.644 1.00 . A A . 446 TYR N 1 1 4 1636 1 1 14 TYR O O -0.438 2.276 -1.208 1.00 . A A . 446 TYR O 1 1 4 1637 1 1 14 TYR OH O 1.971 3.252 -6.320 1.00 . A A . 446 TYR OH 1 1 4 1638 1 1 15 TYR C C -0.442 -1.050 -0.448 1.00 . A A . 447 TYR C 1 1 4 1639 1 1 15 TYR CA C -0.965 0.112 0.379 1.00 . A A . 447 TYR CA 1 1 4 1640 1 1 15 TYR CB C -1.547 -0.370 1.715 1.00 . A A . 447 TYR CB 1 1 4 1641 1 1 15 TYR CD1 C -1.840 1.906 2.751 1.00 . A A . 447 TYR CD1 1 1 4 1642 1 1 15 TYR CD2 C -3.738 0.480 2.666 1.00 . A A . 447 TYR CD2 1 1 4 1643 1 1 15 TYR CE1 C -2.595 2.893 3.347 1.00 . A A . 447 TYR CE1 1 1 4 1644 1 1 15 TYR CE2 C -4.504 1.462 3.270 1.00 . A A . 447 TYR CE2 1 1 4 1645 1 1 15 TYR CG C -2.393 0.688 2.396 1.00 . A A . 447 TYR CG 1 1 4 1646 1 1 15 TYR CZ C -3.926 2.668 3.604 1.00 . A A . 447 TYR CZ 1 1 4 1647 1 1 15 TYR H H -2.890 0.547 -0.354 1.00 . A A . 447 TYR H 1 1 4 1648 1 1 15 TYR HA H -0.144 0.786 0.581 1.00 . A A . 447 TYR HA 1 1 4 1649 1 1 15 TYR HB2 H -2.170 -1.237 1.541 1.00 . A A . 447 TYR HB2 1 1 4 1650 1 1 15 TYR HB3 H -0.741 -0.636 2.382 1.00 . A A . 447 TYR HB3 1 1 4 1651 1 1 15 TYR HD1 H -0.805 2.078 2.550 1.00 . A A . 447 TYR HD1 1 1 4 1652 1 1 15 TYR HD2 H -4.184 -0.466 2.401 1.00 . A A . 447 TYR HD2 1 1 4 1653 1 1 15 TYR HE1 H -2.140 3.835 3.613 1.00 . A A . 447 TYR HE1 1 1 4 1654 1 1 15 TYR HE2 H -5.548 1.280 3.477 1.00 . A A . 447 TYR HE2 1 1 4 1655 1 1 15 TYR HH H -4.522 4.498 3.750 1.00 . A A . 447 TYR HH 1 1 4 1656 1 1 15 TYR N N -1.956 0.843 -0.376 1.00 . A A . 447 TYR N 1 1 4 1657 1 1 15 TYR O O -1.015 -2.136 -0.459 1.00 . A A . 447 TYR O 1 1 4 1658 1 1 15 TYR OH O -4.686 3.658 4.193 1.00 . A A . 447 TYR OH 1 1 4 1659 1 1 16 TYR C C 2.378 -2.459 -1.144 1.00 . A A . 448 TYR C 1 1 4 1660 1 1 16 TYR CA C 1.275 -1.812 -1.977 1.00 . A A . 448 TYR CA 1 1 4 1661 1 1 16 TYR CB C 1.867 -1.218 -3.261 1.00 . A A . 448 TYR CB 1 1 4 1662 1 1 16 TYR CD1 C 1.850 -3.106 -4.944 1.00 . A A . 448 TYR CD1 1 1 4 1663 1 1 16 TYR CD2 C 3.959 -2.323 -4.153 1.00 . A A . 448 TYR CD2 1 1 4 1664 1 1 16 TYR CE1 C 2.490 -4.034 -5.743 1.00 . A A . 448 TYR CE1 1 1 4 1665 1 1 16 TYR CE2 C 4.607 -3.249 -4.948 1.00 . A A . 448 TYR CE2 1 1 4 1666 1 1 16 TYR CG C 2.572 -2.236 -4.136 1.00 . A A . 448 TYR CG 1 1 4 1667 1 1 16 TYR CZ C 3.868 -4.100 -5.743 1.00 . A A . 448 TYR CZ 1 1 4 1668 1 1 16 TYR H H 0.906 0.152 -1.278 1.00 . A A . 448 TYR H 1 1 4 1669 1 1 16 TYR HA H 0.538 -2.557 -2.239 1.00 . A A . 448 TYR HA 1 1 4 1670 1 1 16 TYR HB2 H 1.075 -0.772 -3.845 1.00 . A A . 448 TYR HB2 1 1 4 1671 1 1 16 TYR HB3 H 2.584 -0.454 -2.997 1.00 . A A . 448 TYR HB3 1 1 4 1672 1 1 16 TYR HD1 H 0.771 -3.051 -4.944 1.00 . A A . 448 TYR HD1 1 1 4 1673 1 1 16 TYR HD2 H 4.533 -1.654 -3.529 1.00 . A A . 448 TYR HD2 1 1 4 1674 1 1 16 TYR HE1 H 1.913 -4.703 -6.362 1.00 . A A . 448 TYR HE1 1 1 4 1675 1 1 16 TYR HE2 H 5.686 -3.299 -4.948 1.00 . A A . 448 TYR HE2 1 1 4 1676 1 1 16 TYR HH H 5.149 -5.510 -6.019 1.00 . A A . 448 TYR HH 1 1 4 1677 1 1 16 TYR N N 0.608 -0.780 -1.202 1.00 . A A . 448 TYR N 1 1 4 1678 1 1 16 TYR O O 3.280 -1.783 -0.646 1.00 . A A . 448 TYR O 1 1 4 1679 1 1 16 TYR OH O 4.505 -5.022 -6.542 1.00 . A A . 448 TYR OH 1 1 4 1680 1 1 17 ASN C C 4.208 -5.316 -1.063 1.00 . A A . 449 ASN C 1 1 4 1681 1 1 17 ASN CA C 3.242 -4.522 -0.189 1.00 . A A . 449 ASN CA 1 1 4 1682 1 1 17 ASN CB C 2.474 -5.460 0.736 1.00 . A A . 449 ASN CB 1 1 4 1683 1 1 17 ASN CG C 3.356 -6.518 1.356 1.00 . A A . 449 ASN CG 1 1 4 1684 1 1 17 ASN H H 1.567 -4.259 -1.445 1.00 . A A . 449 ASN H 1 1 4 1685 1 1 17 ASN HA H 3.805 -3.819 0.409 1.00 . A A . 449 ASN HA 1 1 4 1686 1 1 17 ASN HB2 H 2.020 -4.885 1.529 1.00 . A A . 449 ASN HB2 1 1 4 1687 1 1 17 ASN HB3 H 1.700 -5.954 0.169 1.00 . A A . 449 ASN HB3 1 1 4 1688 1 1 17 ASN HD21 H 3.989 -5.236 2.741 1.00 . A A . 449 ASN HD21 1 1 4 1689 1 1 17 ASN HD22 H 4.624 -6.841 2.850 1.00 . A A . 449 ASN HD22 1 1 4 1690 1 1 17 ASN N N 2.298 -3.772 -0.997 1.00 . A A . 449 ASN N 1 1 4 1691 1 1 17 ASN ND2 N 4.066 -6.161 2.418 1.00 . A A . 449 ASN ND2 1 1 4 1692 1 1 17 ASN O O 3.814 -5.891 -2.077 1.00 . A A . 449 ASN O 1 1 4 1693 1 1 17 ASN OD1 O 3.424 -7.639 0.866 1.00 . A A . 449 ASN OD1 1 1 4 1694 1 1 18 ASN C C 6.866 -7.399 -0.737 1.00 . A A . 450 ASN C 1 1 4 1695 1 1 18 ASN CA C 6.506 -6.064 -1.397 1.00 . A A . 450 ASN CA 1 1 4 1696 1 1 18 ASN CB C 7.748 -5.167 -1.502 1.00 . A A . 450 ASN CB 1 1 4 1697 1 1 18 ASN CG C 8.744 -5.650 -2.548 1.00 . A A . 450 ASN CG 1 1 4 1698 1 1 18 ASN H H 5.693 -4.984 0.232 1.00 . A A . 450 ASN H 1 1 4 1699 1 1 18 ASN HA H 6.123 -6.253 -2.389 1.00 . A A . 450 ASN HA 1 1 4 1700 1 1 18 ASN HB2 H 7.440 -4.164 -1.765 1.00 . A A . 450 ASN HB2 1 1 4 1701 1 1 18 ASN HB3 H 8.244 -5.144 -0.543 1.00 . A A . 450 ASN HB3 1 1 4 1702 1 1 18 ASN HD21 H 10.259 -4.940 -1.479 1.00 . A A . 450 ASN HD21 1 1 4 1703 1 1 18 ASN HD22 H 10.687 -5.701 -2.972 1.00 . A A . 450 ASN HD22 1 1 4 1704 1 1 18 ASN N N 5.464 -5.385 -0.631 1.00 . A A . 450 ASN N 1 1 4 1705 1 1 18 ASN ND2 N 10.025 -5.408 -2.307 1.00 . A A . 450 ASN ND2 1 1 4 1706 1 1 18 ASN O O 7.824 -8.063 -1.123 1.00 . A A . 450 ASN O 1 1 4 1707 1 1 18 ASN OD1 O 8.364 -6.237 -3.562 1.00 . A A . 450 ASN OD1 1 1 4 1708 1 1 19 ARG C C 5.652 -10.196 0.085 1.00 . A A . 451 ARG C 1 1 4 1709 1 1 19 ARG CA C 6.269 -9.084 0.922 1.00 . A A . 451 ARG CA 1 1 4 1710 1 1 19 ARG CB C 5.646 -9.102 2.317 1.00 . A A . 451 ARG CB 1 1 4 1711 1 1 19 ARG CD C 7.751 -8.882 3.671 1.00 . A A . 451 ARG CD 1 1 4 1712 1 1 19 ARG CG C 6.395 -8.285 3.348 1.00 . A A . 451 ARG CG 1 1 4 1713 1 1 19 ARG CZ C 9.676 -8.243 5.077 1.00 . A A . 451 ARG CZ 1 1 4 1714 1 1 19 ARG H H 5.364 -7.194 0.567 1.00 . A A . 451 ARG H 1 1 4 1715 1 1 19 ARG HA H 7.320 -9.259 1.012 1.00 . A A . 451 ARG HA 1 1 4 1716 1 1 19 ARG HB2 H 4.640 -8.714 2.253 1.00 . A A . 451 ARG HB2 1 1 4 1717 1 1 19 ARG HB3 H 5.604 -10.123 2.664 1.00 . A A . 451 ARG HB3 1 1 4 1718 1 1 19 ARG HD2 H 7.624 -9.927 3.914 1.00 . A A . 451 ARG HD2 1 1 4 1719 1 1 19 ARG HD3 H 8.390 -8.788 2.806 1.00 . A A . 451 ARG HD3 1 1 4 1720 1 1 19 ARG HE H 7.789 -7.678 5.397 1.00 . A A . 451 ARG HE 1 1 4 1721 1 1 19 ARG HG2 H 6.537 -7.286 2.965 1.00 . A A . 451 ARG HG2 1 1 4 1722 1 1 19 ARG HG3 H 5.808 -8.243 4.253 1.00 . A A . 451 ARG HG3 1 1 4 1723 1 1 19 ARG HH11 H 10.150 -9.458 3.527 1.00 . A A . 451 ARG HH11 1 1 4 1724 1 1 19 ARG HH12 H 11.481 -8.988 4.534 1.00 . A A . 451 ARG HH12 1 1 4 1725 1 1 19 ARG HH21 H 9.513 -7.053 6.707 1.00 . A A . 451 ARG HH21 1 1 4 1726 1 1 19 ARG HH22 H 11.122 -7.600 6.345 1.00 . A A . 451 ARG HH22 1 1 4 1727 1 1 19 ARG N N 6.086 -7.788 0.267 1.00 . A A . 451 ARG N 1 1 4 1728 1 1 19 ARG NE N 8.378 -8.201 4.801 1.00 . A A . 451 ARG NE 1 1 4 1729 1 1 19 ARG NH1 N 10.502 -8.950 4.316 1.00 . A A . 451 ARG NH1 1 1 4 1730 1 1 19 ARG NH2 N 10.142 -7.583 6.125 1.00 . A A . 451 ARG NH2 1 1 4 1731 1 1 19 ARG O O 6.346 -11.087 -0.400 1.00 . A A . 451 ARG O 1 1 4 1732 1 1 20 THR C C 3.157 -10.552 -2.171 1.00 . A A . 452 THR C 1 1 4 1733 1 1 20 THR CA C 3.602 -11.124 -0.834 1.00 . A A . 452 THR CA 1 1 4 1734 1 1 20 THR CB C 2.375 -11.600 -0.036 1.00 . A A . 452 THR CB 1 1 4 1735 1 1 20 THR CG2 C 2.779 -12.596 1.040 1.00 . A A . 452 THR CG2 1 1 4 1736 1 1 20 THR H H 3.844 -9.382 0.319 1.00 . A A . 452 THR H 1 1 4 1737 1 1 20 THR HA H 4.251 -11.972 -1.007 1.00 . A A . 452 THR HA 1 1 4 1738 1 1 20 THR HB H 1.685 -12.081 -0.714 1.00 . A A . 452 THR HB 1 1 4 1739 1 1 20 THR HG1 H 0.779 -10.629 0.618 1.00 . A A . 452 THR HG1 1 1 4 1740 1 1 20 THR HG21 H 1.904 -12.905 1.590 1.00 . A A . 452 THR HG21 1 1 4 1741 1 1 20 THR HG22 H 3.482 -12.132 1.715 1.00 . A A . 452 THR HG22 1 1 4 1742 1 1 20 THR HG23 H 3.238 -13.459 0.580 1.00 . A A . 452 THR HG23 1 1 4 1743 1 1 20 THR N N 4.342 -10.129 -0.081 1.00 . A A . 452 THR N 1 1 4 1744 1 1 20 THR O O 2.509 -11.237 -2.970 1.00 . A A . 452 THR O 1 1 4 1745 1 1 20 THR OG1 O 1.729 -10.470 0.571 1.00 . A A . 452 THR OG1 1 1 4 1746 1 1 21 LEU C C 1.562 -8.393 -3.536 1.00 . A A . 453 LEU C 1 1 4 1747 1 1 21 LEU CA C 3.073 -8.542 -3.571 1.00 . A A . 453 LEU CA 1 1 4 1748 1 1 21 LEU CB C 3.531 -9.207 -4.874 1.00 . A A . 453 LEU CB 1 1 4 1749 1 1 21 LEU CD1 C 5.388 -10.042 -6.338 1.00 . A A . 453 LEU CD1 1 1 4 1750 1 1 21 LEU CD2 C 5.691 -7.937 -5.027 1.00 . A A . 453 LEU CD2 1 1 4 1751 1 1 21 LEU CG C 5.048 -9.316 -5.046 1.00 . A A . 453 LEU CG 1 1 4 1752 1 1 21 LEU H H 4.096 -8.843 -1.749 1.00 . A A . 453 LEU H 1 1 4 1753 1 1 21 LEU HA H 3.512 -7.557 -3.511 1.00 . A A . 453 LEU HA 1 1 4 1754 1 1 21 LEU HB2 H 3.110 -10.201 -4.912 1.00 . A A . 453 LEU HB2 1 1 4 1755 1 1 21 LEU HB3 H 3.138 -8.635 -5.701 1.00 . A A . 453 LEU HB3 1 1 4 1756 1 1 21 LEU HD11 H 4.993 -11.047 -6.301 1.00 . A A . 453 LEU HD11 1 1 4 1757 1 1 21 LEU HD12 H 6.460 -10.081 -6.458 1.00 . A A . 453 LEU HD12 1 1 4 1758 1 1 21 LEU HD13 H 4.951 -9.515 -7.173 1.00 . A A . 453 LEU HD13 1 1 4 1759 1 1 21 LEU HD21 H 6.757 -8.035 -5.173 1.00 . A A . 453 LEU HD21 1 1 4 1760 1 1 21 LEU HD22 H 5.500 -7.462 -4.076 1.00 . A A . 453 LEU HD22 1 1 4 1761 1 1 21 LEU HD23 H 5.274 -7.334 -5.821 1.00 . A A . 453 LEU HD23 1 1 4 1762 1 1 21 LEU HG H 5.456 -9.888 -4.225 1.00 . A A . 453 LEU HG 1 1 4 1763 1 1 21 LEU N N 3.515 -9.287 -2.398 1.00 . A A . 453 LEU N 1 1 4 1764 1 1 21 LEU O O 0.840 -8.952 -4.359 1.00 . A A . 453 LEU O 1 1 4 1765 1 1 22 GLU C C -0.710 -6.036 -2.312 1.00 . A A . 454 GLU C 1 1 4 1766 1 1 22 GLU CA C -0.324 -7.508 -2.288 1.00 . A A . 454 GLU CA 1 1 4 1767 1 1 22 GLU CB C -0.656 -8.113 -0.918 1.00 . A A . 454 GLU CB 1 1 4 1768 1 1 22 GLU CD C -2.421 -8.640 0.808 1.00 . A A . 454 GLU CD 1 1 4 1769 1 1 22 GLU CG C -2.141 -8.132 -0.588 1.00 . A A . 454 GLU CG 1 1 4 1770 1 1 22 GLU H H 1.735 -7.190 -1.966 1.00 . A A . 454 GLU H 1 1 4 1771 1 1 22 GLU HA H -0.867 -8.038 -3.056 1.00 . A A . 454 GLU HA 1 1 4 1772 1 1 22 GLU HB2 H -0.295 -9.131 -0.894 1.00 . A A . 454 GLU HB2 1 1 4 1773 1 1 22 GLU HB3 H -0.147 -7.544 -0.155 1.00 . A A . 454 GLU HB3 1 1 4 1774 1 1 22 GLU HG2 H -2.534 -7.129 -0.676 1.00 . A A . 454 GLU HG2 1 1 4 1775 1 1 22 GLU HG3 H -2.640 -8.776 -1.294 1.00 . A A . 454 GLU HG3 1 1 4 1776 1 1 22 GLU N N 1.098 -7.656 -2.545 1.00 . A A . 454 GLU N 1 1 4 1777 1 1 22 GLU O O 0.034 -5.186 -1.828 1.00 . A A . 454 GLU O 1 1 4 1778 1 1 22 GLU OE1 O -2.066 -9.804 1.098 1.00 . A A . 454 GLU OE1 1 1 4 1779 1 1 22 GLU OE2 O -2.991 -7.883 1.621 1.00 . A A . 454 GLU OE2 1 1 4 1780 1 1 23 SER C C -3.541 -4.309 -1.850 1.00 . A A . 455 SER C 1 1 4 1781 1 1 23 SER CA C -2.382 -4.380 -2.841 1.00 . A A . 455 SER CA 1 1 4 1782 1 1 23 SER CB C -2.822 -3.939 -4.240 1.00 . A A . 455 SER CB 1 1 4 1783 1 1 23 SER H H -2.388 -6.436 -3.315 1.00 . A A . 455 SER H 1 1 4 1784 1 1 23 SER HA H -1.586 -3.731 -2.500 1.00 . A A . 455 SER HA 1 1 4 1785 1 1 23 SER HB2 H -2.016 -4.118 -4.937 1.00 . A A . 455 SER HB2 1 1 4 1786 1 1 23 SER HB3 H -3.688 -4.515 -4.539 1.00 . A A . 455 SER HB3 1 1 4 1787 1 1 23 SER HG H -3.013 -2.173 -3.403 1.00 . A A . 455 SER HG 1 1 4 1788 1 1 23 SER N N -1.865 -5.734 -2.875 1.00 . A A . 455 SER N 1 1 4 1789 1 1 23 SER O O -4.657 -4.736 -2.149 1.00 . A A . 455 SER O 1 1 4 1790 1 1 23 SER OG O -3.158 -2.559 -4.276 1.00 . A A . 455 SER OG 1 1 4 1791 1 1 24 THR C C -4.773 -2.323 0.525 1.00 . A A . 456 THR C 1 1 4 1792 1 1 24 THR CA C -4.217 -3.742 0.419 1.00 . A A . 456 THR CA 1 1 4 1793 1 1 24 THR CB C -3.538 -4.149 1.741 1.00 . A A . 456 THR CB 1 1 4 1794 1 1 24 THR CG2 C -4.541 -4.737 2.723 1.00 . A A . 456 THR CG2 1 1 4 1795 1 1 24 THR H H -2.349 -3.439 -0.508 1.00 . A A . 456 THR H 1 1 4 1796 1 1 24 THR HA H -5.019 -4.430 0.207 1.00 . A A . 456 THR HA 1 1 4 1797 1 1 24 THR HB H -3.088 -3.273 2.184 1.00 . A A . 456 THR HB 1 1 4 1798 1 1 24 THR HG1 H -2.872 -6.015 1.594 1.00 . A A . 456 THR HG1 1 1 4 1799 1 1 24 THR HG21 H -5.276 -3.990 2.979 1.00 . A A . 456 THR HG21 1 1 4 1800 1 1 24 THR HG22 H -4.025 -5.056 3.616 1.00 . A A . 456 THR HG22 1 1 4 1801 1 1 24 THR HG23 H -5.034 -5.584 2.270 1.00 . A A . 456 THR HG23 1 1 4 1802 1 1 24 THR N N -3.251 -3.801 -0.665 1.00 . A A . 456 THR N 1 1 4 1803 1 1 24 THR O O -4.056 -1.358 0.257 1.00 . A A . 456 THR O 1 1 4 1804 1 1 24 THR OG1 O -2.516 -5.122 1.471 1.00 . A A . 456 THR OG1 1 1 4 1805 1 1 25 TRP C C -7.336 -0.521 2.219 1.00 . A A . 457 TRP C 1 1 4 1806 1 1 25 TRP CA C -6.680 -0.863 0.879 1.00 . A A . 457 TRP CA 1 1 4 1807 1 1 25 TRP CB C -7.677 -0.759 -0.281 1.00 . A A . 457 TRP CB 1 1 4 1808 1 1 25 TRP CD1 C -6.505 -1.912 -2.240 1.00 . A A . 457 TRP CD1 1 1 4 1809 1 1 25 TRP CD2 C -6.623 0.313 -2.426 1.00 . A A . 457 TRP CD2 1 1 4 1810 1 1 25 TRP CE2 C -5.923 -0.195 -3.537 1.00 . A A . 457 TRP CE2 1 1 4 1811 1 1 25 TRP CE3 C -6.830 1.691 -2.330 1.00 . A A . 457 TRP CE3 1 1 4 1812 1 1 25 TRP CG C -6.972 -0.802 -1.602 1.00 . A A . 457 TRP CG 1 1 4 1813 1 1 25 TRP CH2 C -5.642 1.977 -4.422 1.00 . A A . 457 TRP CH2 1 1 4 1814 1 1 25 TRP CZ2 C -5.422 0.630 -4.540 1.00 . A A . 457 TRP CZ2 1 1 4 1815 1 1 25 TRP CZ3 C -6.340 2.508 -3.331 1.00 . A A . 457 TRP CZ3 1 1 4 1816 1 1 25 TRP H H -6.594 -2.989 1.057 1.00 . A A . 457 TRP H 1 1 4 1817 1 1 25 TRP HA H -5.893 -0.142 0.706 1.00 . A A . 457 TRP HA 1 1 4 1818 1 1 25 TRP HB2 H -8.369 -1.588 -0.235 1.00 . A A . 457 TRP HB2 1 1 4 1819 1 1 25 TRP HB3 H -8.218 0.172 -0.214 1.00 . A A . 457 TRP HB3 1 1 4 1820 1 1 25 TRP HD1 H -6.617 -2.919 -1.865 1.00 . A A . 457 TRP HD1 1 1 4 1821 1 1 25 TRP HE1 H -5.432 -2.177 -4.022 1.00 . A A . 457 TRP HE1 1 1 4 1822 1 1 25 TRP HE3 H -7.368 2.118 -1.497 1.00 . A A . 457 TRP HE3 1 1 4 1823 1 1 25 TRP HH2 H -5.276 2.655 -5.180 1.00 . A A . 457 TRP HH2 1 1 4 1824 1 1 25 TRP HZ2 H -4.859 0.238 -5.375 1.00 . A A . 457 TRP HZ2 1 1 4 1825 1 1 25 TRP HZ3 H -6.491 3.575 -3.272 1.00 . A A . 457 TRP HZ3 1 1 4 1826 1 1 25 TRP N N -6.052 -2.187 0.861 1.00 . A A . 457 TRP N 1 1 4 1827 1 1 25 TRP NE1 N -5.860 -1.556 -3.395 1.00 . A A . 457 TRP NE1 1 1 4 1828 1 1 25 TRP O O -7.913 0.553 2.376 1.00 . A A . 457 TRP O 1 1 4 1829 1 1 26 GLU C C -6.507 -1.284 5.499 1.00 . A A . 458 GLU C 1 1 4 1830 1 1 26 GLU CA C -7.687 -1.146 4.538 1.00 . A A . 458 GLU CA 1 1 4 1831 1 1 26 GLU CB C -8.838 -2.086 4.912 1.00 . A A . 458 GLU CB 1 1 4 1832 1 1 26 GLU CD C -9.764 -4.429 4.756 1.00 . A A . 458 GLU CD 1 1 4 1833 1 1 26 GLU CG C -8.524 -3.561 4.716 1.00 . A A . 458 GLU CG 1 1 4 1834 1 1 26 GLU H H -6.852 -2.292 2.989 1.00 . A A . 458 GLU H 1 1 4 1835 1 1 26 GLU HA H -8.041 -0.124 4.568 1.00 . A A . 458 GLU HA 1 1 4 1836 1 1 26 GLU HB2 H -9.089 -1.933 5.951 1.00 . A A . 458 GLU HB2 1 1 4 1837 1 1 26 GLU HB3 H -9.696 -1.840 4.303 1.00 . A A . 458 GLU HB3 1 1 4 1838 1 1 26 GLU HG2 H -8.043 -3.691 3.758 1.00 . A A . 458 GLU HG2 1 1 4 1839 1 1 26 GLU HG3 H -7.852 -3.880 5.500 1.00 . A A . 458 GLU HG3 1 1 4 1840 1 1 26 GLU N N -7.239 -1.421 3.183 1.00 . A A . 458 GLU N 1 1 4 1841 1 1 26 GLU O O -5.717 -2.220 5.378 1.00 . A A . 458 GLU O 1 1 4 1842 1 1 26 GLU OE1 O -10.301 -4.663 5.856 1.00 . A A . 458 GLU OE1 1 1 4 1843 1 1 26 GLU OE2 O -10.201 -4.894 3.681 1.00 . A A . 458 GLU OE2 1 1 4 1844 1 1 27 LYS C C -5.431 -1.324 8.499 1.00 . A A . 459 LYS C 1 1 4 1845 1 1 27 LYS CA C -5.233 -0.351 7.345 1.00 . A A . 459 LYS CA 1 1 4 1846 1 1 27 LYS CB C -4.978 1.053 7.899 1.00 . A A . 459 LYS CB 1 1 4 1847 1 1 27 LYS CD C -4.200 3.413 7.441 1.00 . A A . 459 LYS CD 1 1 4 1848 1 1 27 LYS CE C -3.068 3.350 8.458 1.00 . A A . 459 LYS CE 1 1 4 1849 1 1 27 LYS CG C -4.512 2.045 6.849 1.00 . A A . 459 LYS CG 1 1 4 1850 1 1 27 LYS H H -7.083 0.326 6.548 1.00 . A A . 459 LYS H 1 1 4 1851 1 1 27 LYS HA H -4.370 -0.661 6.775 1.00 . A A . 459 LYS HA 1 1 4 1852 1 1 27 LYS HB2 H -5.893 1.427 8.335 1.00 . A A . 459 LYS HB2 1 1 4 1853 1 1 27 LYS HB3 H -4.221 0.991 8.669 1.00 . A A . 459 LYS HB3 1 1 4 1854 1 1 27 LYS HD2 H -3.908 4.076 6.637 1.00 . A A . 459 LYS HD2 1 1 4 1855 1 1 27 LYS HD3 H -5.087 3.797 7.925 1.00 . A A . 459 LYS HD3 1 1 4 1856 1 1 27 LYS HE2 H -2.926 4.334 8.883 1.00 . A A . 459 LYS HE2 1 1 4 1857 1 1 27 LYS HE3 H -3.343 2.660 9.239 1.00 . A A . 459 LYS HE3 1 1 4 1858 1 1 27 LYS HG2 H -3.622 1.662 6.377 1.00 . A A . 459 LYS HG2 1 1 4 1859 1 1 27 LYS HG3 H -5.292 2.154 6.110 1.00 . A A . 459 LYS HG3 1 1 4 1860 1 1 27 LYS HZ1 H -1.512 3.536 7.059 1.00 . A A . 459 LYS HZ1 1 1 4 1861 1 1 27 LYS HZ2 H -1.880 1.935 7.483 1.00 . A A . 459 LYS HZ2 1 1 4 1862 1 1 27 LYS HZ3 H -1.024 2.913 8.562 1.00 . A A . 459 LYS HZ3 1 1 4 1863 1 1 27 LYS N N -6.380 -0.358 6.441 1.00 . A A . 459 LYS N 1 1 4 1864 1 1 27 LYS NZ N -1.787 2.900 7.847 1.00 . A A . 459 LYS NZ 1 1 4 1865 1 1 27 LYS O O -6.395 -1.210 9.256 1.00 . A A . 459 LYS O 1 1 4 1866 1 1 28 PRO C C -4.169 -2.564 11.084 1.00 . A A . 460 PRO C 1 1 4 1867 1 1 28 PRO CA C -4.534 -3.238 9.764 1.00 . A A . 460 PRO CA 1 1 4 1868 1 1 28 PRO CB C -3.476 -4.275 9.372 1.00 . A A . 460 PRO CB 1 1 4 1869 1 1 28 PRO CD C -3.389 -2.550 7.726 1.00 . A A . 460 PRO CD 1 1 4 1870 1 1 28 PRO CG C -2.544 -3.542 8.473 1.00 . A A . 460 PRO CG 1 1 4 1871 1 1 28 PRO HA H -5.497 -3.717 9.860 1.00 . A A . 460 PRO HA 1 1 4 1872 1 1 28 PRO HB2 H -2.972 -4.632 10.260 1.00 . A A . 460 PRO HB2 1 1 4 1873 1 1 28 PRO HB3 H -3.950 -5.099 8.862 1.00 . A A . 460 PRO HB3 1 1 4 1874 1 1 28 PRO HD2 H -2.831 -1.645 7.535 1.00 . A A . 460 PRO HD2 1 1 4 1875 1 1 28 PRO HD3 H -3.743 -2.978 6.799 1.00 . A A . 460 PRO HD3 1 1 4 1876 1 1 28 PRO HG2 H -1.795 -3.029 9.060 1.00 . A A . 460 PRO HG2 1 1 4 1877 1 1 28 PRO HG3 H -2.077 -4.232 7.786 1.00 . A A . 460 PRO HG3 1 1 4 1878 1 1 28 PRO N N -4.514 -2.292 8.647 1.00 . A A . 460 PRO N 1 1 4 1879 1 1 28 PRO O O -5.088 -2.275 11.878 1.00 . A A . 460 PRO O 1 1 4 1880 1 1 28 PRO OXT O -2.968 -2.293 11.310 1.00 . A A . 460 PRO OXT 1 1 5 1881 1 1 1 SER C C 8.370 -2.803 5.037 1.00 . A A . 433 SER C 1 1 5 1882 1 1 1 SER CA C 9.262 -2.007 5.978 1.00 . A A . 433 SER CA 1 1 5 1883 1 1 1 SER CB C 9.453 -0.578 5.461 1.00 . A A . 433 SER CB 1 1 5 1884 1 1 1 SER H1 H 11.161 -2.192 6.796 1.00 . A A . 433 SER H1 1 1 5 1885 1 1 1 SER H2 H 11.059 -2.653 5.168 1.00 . A A . 433 SER H2 1 1 5 1886 1 1 1 SER H3 H 10.446 -3.669 6.378 1.00 . A A . 433 SER H3 1 1 5 1887 1 1 1 SER HA H 8.804 -1.978 6.956 1.00 . A A . 433 SER HA 1 1 5 1888 1 1 1 SER HB2 H 10.258 -0.108 6.005 1.00 . A A . 433 SER HB2 1 1 5 1889 1 1 1 SER HB3 H 9.702 -0.613 4.411 1.00 . A A . 433 SER HB3 1 1 5 1890 1 1 1 SER HG H 8.535 1.121 5.810 1.00 . A A . 433 SER HG 1 1 5 1891 1 1 1 SER N N 10.571 -2.677 6.090 1.00 . A A . 433 SER N 1 1 5 1892 1 1 1 SER O O 8.680 -2.966 3.854 1.00 . A A . 433 SER O 1 1 5 1893 1 1 1 SER OG O 8.279 0.204 5.624 1.00 . A A . 433 SER OG 1 1 5 1894 1 1 2 GLU C C 5.317 -3.479 4.091 1.00 . A A . 434 GLU C 1 1 5 1895 1 1 2 GLU CA C 6.425 -4.226 4.820 1.00 . A A . 434 GLU CA 1 1 5 1896 1 1 2 GLU CB C 5.806 -5.261 5.765 1.00 . A A . 434 GLU CB 1 1 5 1897 1 1 2 GLU CD C 7.960 -6.484 6.324 1.00 . A A . 434 GLU CD 1 1 5 1898 1 1 2 GLU CG C 6.750 -5.745 6.859 1.00 . A A . 434 GLU CG 1 1 5 1899 1 1 2 GLU H H 7.004 -3.045 6.476 1.00 . A A . 434 GLU H 1 1 5 1900 1 1 2 GLU HA H 7.041 -4.735 4.095 1.00 . A A . 434 GLU HA 1 1 5 1901 1 1 2 GLU HB2 H 4.939 -4.823 6.239 1.00 . A A . 434 GLU HB2 1 1 5 1902 1 1 2 GLU HB3 H 5.491 -6.117 5.186 1.00 . A A . 434 GLU HB3 1 1 5 1903 1 1 2 GLU HG2 H 7.094 -4.890 7.417 1.00 . A A . 434 GLU HG2 1 1 5 1904 1 1 2 GLU HG3 H 6.206 -6.407 7.519 1.00 . A A . 434 GLU HG3 1 1 5 1905 1 1 2 GLU N N 7.267 -3.306 5.563 1.00 . A A . 434 GLU N 1 1 5 1906 1 1 2 GLU O O 4.889 -3.880 3.007 1.00 . A A . 434 GLU O 1 1 5 1907 1 1 2 GLU OE1 O 7.884 -7.720 6.174 1.00 . A A . 434 GLU OE1 1 1 5 1908 1 1 2 GLU OE2 O 9.000 -5.840 6.077 1.00 . A A . 434 GLU OE2 1 1 5 1909 1 1 3 TRP C C 4.110 -0.358 3.539 1.00 . A A . 435 TRP C 1 1 5 1910 1 1 3 TRP CA C 3.693 -1.680 4.186 1.00 . A A . 435 TRP CA 1 1 5 1911 1 1 3 TRP CB C 2.699 -1.418 5.326 1.00 . A A . 435 TRP CB 1 1 5 1912 1 1 3 TRP CD1 C 2.400 -2.772 7.489 1.00 . A A . 435 TRP CD1 1 1 5 1913 1 1 3 TRP CD2 C 2.036 -3.939 5.616 1.00 . A A . 435 TRP CD2 1 1 5 1914 1 1 3 TRP CE2 C 1.849 -4.794 6.718 1.00 . A A . 435 TRP CE2 1 1 5 1915 1 1 3 TRP CE3 C 1.861 -4.451 4.332 1.00 . A A . 435 TRP CE3 1 1 5 1916 1 1 3 TRP CG C 2.385 -2.649 6.129 1.00 . A A . 435 TRP CG 1 1 5 1917 1 1 3 TRP CH2 C 1.337 -6.609 5.293 1.00 . A A . 435 TRP CH2 1 1 5 1918 1 1 3 TRP CZ2 C 1.496 -6.135 6.568 1.00 . A A . 435 TRP CZ2 1 1 5 1919 1 1 3 TRP CZ3 C 1.517 -5.777 4.186 1.00 . A A . 435 TRP CZ3 1 1 5 1920 1 1 3 TRP H H 5.292 -2.074 5.511 1.00 . A A . 435 TRP H 1 1 5 1921 1 1 3 TRP HA H 3.216 -2.309 3.451 1.00 . A A . 435 TRP HA 1 1 5 1922 1 1 3 TRP HB2 H 3.117 -0.680 5.994 1.00 . A A . 435 TRP HB2 1 1 5 1923 1 1 3 TRP HB3 H 1.775 -1.041 4.911 1.00 . A A . 435 TRP HB3 1 1 5 1924 1 1 3 TRP HD1 H 2.635 -1.966 8.172 1.00 . A A . 435 TRP HD1 1 1 5 1925 1 1 3 TRP HE1 H 2.020 -4.396 8.770 1.00 . A A . 435 TRP HE1 1 1 5 1926 1 1 3 TRP HE3 H 1.995 -3.829 3.459 1.00 . A A . 435 TRP HE3 1 1 5 1927 1 1 3 TRP HH2 H 1.068 -7.643 5.123 1.00 . A A . 435 TRP HH2 1 1 5 1928 1 1 3 TRP HZ2 H 1.354 -6.787 7.417 1.00 . A A . 435 TRP HZ2 1 1 5 1929 1 1 3 TRP HZ3 H 1.387 -6.190 3.194 1.00 . A A . 435 TRP HZ3 1 1 5 1930 1 1 3 TRP N N 4.850 -2.397 4.698 1.00 . A A . 435 TRP N 1 1 5 1931 1 1 3 TRP NE1 N 2.076 -4.059 7.850 1.00 . A A . 435 TRP NE1 1 1 5 1932 1 1 3 TRP O O 4.646 0.524 4.216 1.00 . A A . 435 TRP O 1 1 5 1933 1 1 4 THR C C 2.948 1.939 1.559 1.00 . A A . 436 THR C 1 1 5 1934 1 1 4 THR CA C 4.165 1.019 1.534 1.00 . A A . 436 THR CA 1 1 5 1935 1 1 4 THR CB C 4.557 0.755 0.061 1.00 . A A . 436 THR CB 1 1 5 1936 1 1 4 THR CG2 C 4.794 2.065 -0.692 1.00 . A A . 436 THR CG2 1 1 5 1937 1 1 4 THR H H 3.511 -0.974 1.720 1.00 . A A . 436 THR H 1 1 5 1938 1 1 4 THR HA H 4.991 1.506 2.030 1.00 . A A . 436 THR HA 1 1 5 1939 1 1 4 THR HB H 3.740 0.235 -0.417 1.00 . A A . 436 THR HB 1 1 5 1940 1 1 4 THR HG1 H 6.415 0.286 0.581 1.00 . A A . 436 THR HG1 1 1 5 1941 1 1 4 THR HG21 H 3.881 2.650 -0.699 1.00 . A A . 436 THR HG21 1 1 5 1942 1 1 4 THR HG22 H 5.087 1.851 -1.708 1.00 . A A . 436 THR HG22 1 1 5 1943 1 1 4 THR HG23 H 5.576 2.628 -0.203 1.00 . A A . 436 THR HG23 1 1 5 1944 1 1 4 THR N N 3.878 -0.221 2.233 1.00 . A A . 436 THR N 1 1 5 1945 1 1 4 THR O O 1.964 1.701 0.857 1.00 . A A . 436 THR O 1 1 5 1946 1 1 4 THR OG1 O 5.730 -0.073 -0.004 1.00 . A A . 436 THR OG1 1 1 5 1947 1 1 5 GLU C C 2.331 5.072 1.375 1.00 . A A . 437 GLU C 1 1 5 1948 1 1 5 GLU CA C 1.967 3.992 2.383 1.00 . A A . 437 GLU CA 1 1 5 1949 1 1 5 GLU CB C 1.792 4.608 3.776 1.00 . A A . 437 GLU CB 1 1 5 1950 1 1 5 GLU CD C 1.297 4.218 6.223 1.00 . A A . 437 GLU CD 1 1 5 1951 1 1 5 GLU CG C 1.685 3.588 4.901 1.00 . A A . 437 GLU CG 1 1 5 1952 1 1 5 GLU H H 3.772 3.070 2.985 1.00 . A A . 437 GLU H 1 1 5 1953 1 1 5 GLU HA H 1.042 3.522 2.077 1.00 . A A . 437 GLU HA 1 1 5 1954 1 1 5 GLU HB2 H 2.639 5.246 3.980 1.00 . A A . 437 GLU HB2 1 1 5 1955 1 1 5 GLU HB3 H 0.894 5.208 3.780 1.00 . A A . 437 GLU HB3 1 1 5 1956 1 1 5 GLU HG2 H 0.941 2.854 4.638 1.00 . A A . 437 GLU HG2 1 1 5 1957 1 1 5 GLU HG3 H 2.643 3.101 5.020 1.00 . A A . 437 GLU HG3 1 1 5 1958 1 1 5 GLU N N 3.010 2.981 2.376 1.00 . A A . 437 GLU N 1 1 5 1959 1 1 5 GLU O O 3.183 5.922 1.645 1.00 . A A . 437 GLU O 1 1 5 1960 1 1 5 GLU OE1 O 2.006 5.141 6.675 1.00 . A A . 437 GLU OE1 1 1 5 1961 1 1 5 GLU OE2 O 0.279 3.798 6.812 1.00 . A A . 437 GLU OE2 1 1 5 1962 1 1 6 ARG C C 0.861 6.671 -1.386 1.00 . A A . 438 ARG C 1 1 5 1963 1 1 6 ARG CA C 2.097 5.908 -0.885 1.00 . A A . 438 ARG CA 1 1 5 1964 1 1 6 ARG CB C 2.719 5.105 -2.033 1.00 . A A . 438 ARG CB 1 1 5 1965 1 1 6 ARG CD C 3.854 5.127 -4.277 1.00 . A A . 438 ARG CD 1 1 5 1966 1 1 6 ARG CG C 3.207 5.965 -3.189 1.00 . A A . 438 ARG CG 1 1 5 1967 1 1 6 ARG CZ C 5.605 3.402 -4.453 1.00 . A A . 438 ARG CZ 1 1 5 1968 1 1 6 ARG H H 1.015 4.344 0.051 1.00 . A A . 438 ARG H 1 1 5 1969 1 1 6 ARG HA H 2.835 6.589 -0.490 1.00 . A A . 438 ARG HA 1 1 5 1970 1 1 6 ARG HB2 H 3.559 4.545 -1.651 1.00 . A A . 438 ARG HB2 1 1 5 1971 1 1 6 ARG HB3 H 1.981 4.416 -2.415 1.00 . A A . 438 ARG HB3 1 1 5 1972 1 1 6 ARG HD2 H 3.142 4.390 -4.616 1.00 . A A . 438 ARG HD2 1 1 5 1973 1 1 6 ARG HD3 H 4.117 5.774 -5.102 1.00 . A A . 438 ARG HD3 1 1 5 1974 1 1 6 ARG HE H 5.494 4.780 -2.998 1.00 . A A . 438 ARG HE 1 1 5 1975 1 1 6 ARG HG2 H 2.366 6.496 -3.610 1.00 . A A . 438 ARG HG2 1 1 5 1976 1 1 6 ARG HG3 H 3.930 6.674 -2.814 1.00 . A A . 438 ARG HG3 1 1 5 1977 1 1 6 ARG HH11 H 4.173 3.311 -5.885 1.00 . A A . 438 ARG HH11 1 1 5 1978 1 1 6 ARG HH12 H 5.436 2.127 -6.033 1.00 . A A . 438 ARG HH12 1 1 5 1979 1 1 6 ARG HH21 H 7.162 3.222 -3.165 1.00 . A A . 438 ARG HH21 1 1 5 1980 1 1 6 ARG HH22 H 7.149 2.084 -4.480 1.00 . A A . 438 ARG HH22 1 1 5 1981 1 1 6 ARG N N 1.729 5.008 0.197 1.00 . A A . 438 ARG N 1 1 5 1982 1 1 6 ARG NE N 5.058 4.438 -3.819 1.00 . A A . 438 ARG NE 1 1 5 1983 1 1 6 ARG NH1 N 5.023 2.909 -5.543 1.00 . A A . 438 ARG NH1 1 1 5 1984 1 1 6 ARG NH2 N 6.724 2.858 -3.995 1.00 . A A . 438 ARG NH2 1 1 5 1985 1 1 6 ARG O O -0.208 6.073 -1.521 1.00 . A A . 438 ARG O 1 1 5 1986 1 1 7 LYS C C -0.078 8.955 -3.655 1.00 . A A . 439 LYS C 1 1 5 1987 1 1 7 LYS CA C -0.152 8.736 -2.153 1.00 . A A . 439 LYS CA 1 1 5 1988 1 1 7 LYS CB C -0.233 10.076 -1.416 1.00 . A A . 439 LYS CB 1 1 5 1989 1 1 7 LYS CD C -1.562 12.160 -0.940 1.00 . A A . 439 LYS CD 1 1 5 1990 1 1 7 LYS CE C -0.344 13.062 -1.066 1.00 . A A . 439 LYS CE 1 1 5 1991 1 1 7 LYS CG C -1.438 10.918 -1.811 1.00 . A A . 439 LYS CG 1 1 5 1992 1 1 7 LYS H H 1.857 8.414 -1.635 1.00 . A A . 439 LYS H 1 1 5 1993 1 1 7 LYS HA H -1.036 8.168 -1.937 1.00 . A A . 439 LYS HA 1 1 5 1994 1 1 7 LYS HB2 H -0.286 9.887 -0.354 1.00 . A A . 439 LYS HB2 1 1 5 1995 1 1 7 LYS HB3 H 0.661 10.645 -1.628 1.00 . A A . 439 LYS HB3 1 1 5 1996 1 1 7 LYS HD2 H -2.438 12.714 -1.243 1.00 . A A . 439 LYS HD2 1 1 5 1997 1 1 7 LYS HD3 H -1.666 11.854 0.091 1.00 . A A . 439 LYS HD3 1 1 5 1998 1 1 7 LYS HE2 H 0.539 12.492 -0.818 1.00 . A A . 439 LYS HE2 1 1 5 1999 1 1 7 LYS HE3 H -0.274 13.411 -2.087 1.00 . A A . 439 LYS HE3 1 1 5 2000 1 1 7 LYS HG2 H -1.331 11.223 -2.841 1.00 . A A . 439 LYS HG2 1 1 5 2001 1 1 7 LYS HG3 H -2.331 10.322 -1.700 1.00 . A A . 439 LYS HG3 1 1 5 2002 1 1 7 LYS HZ1 H -1.213 14.863 -0.453 1.00 . A A . 439 LYS HZ1 1 1 5 2003 1 1 7 LYS HZ2 H 0.461 14.775 -0.177 1.00 . A A . 439 LYS HZ2 1 1 5 2004 1 1 7 LYS HZ3 H -0.608 13.919 0.822 1.00 . A A . 439 LYS HZ3 1 1 5 2005 1 1 7 LYS N N 0.989 7.968 -1.694 1.00 . A A . 439 LYS N 1 1 5 2006 1 1 7 LYS NZ N -0.432 14.235 -0.158 1.00 . A A . 439 LYS NZ 1 1 5 2007 1 1 7 LYS O O 0.838 9.607 -4.158 1.00 . A A . 439 LYS O 1 1 5 2008 1 1 8 THR C C -2.053 9.812 -6.063 1.00 . A A . 440 THR C 1 1 5 2009 1 1 8 THR CA C -1.155 8.610 -5.796 1.00 . A A . 440 THR CA 1 1 5 2010 1 1 8 THR CB C -1.712 7.369 -6.539 1.00 . A A . 440 THR CB 1 1 5 2011 1 1 8 THR CG2 C -3.014 6.882 -5.916 1.00 . A A . 440 THR CG2 1 1 5 2012 1 1 8 THR H H -1.665 7.778 -3.917 1.00 . A A . 440 THR H 1 1 5 2013 1 1 8 THR HA H -0.168 8.822 -6.182 1.00 . A A . 440 THR HA 1 1 5 2014 1 1 8 THR HB H -0.983 6.576 -6.474 1.00 . A A . 440 THR HB 1 1 5 2015 1 1 8 THR HG1 H -1.393 7.084 -8.474 1.00 . A A . 440 THR HG1 1 1 5 2016 1 1 8 THR HG21 H -3.363 6.007 -6.444 1.00 . A A . 440 THR HG21 1 1 5 2017 1 1 8 THR HG22 H -3.759 7.661 -5.981 1.00 . A A . 440 THR HG22 1 1 5 2018 1 1 8 THR HG23 H -2.846 6.633 -4.879 1.00 . A A . 440 THR HG23 1 1 5 2019 1 1 8 THR N N -1.032 8.383 -4.366 1.00 . A A . 440 THR N 1 1 5 2020 1 1 8 THR O O -2.975 10.097 -5.288 1.00 . A A . 440 THR O 1 1 5 2021 1 1 8 THR OG1 O -1.933 7.678 -7.922 1.00 . A A . 440 THR OG1 1 1 5 2022 1 1 9 ALA C C -3.979 11.380 -7.907 1.00 . A A . 441 ALA C 1 1 5 2023 1 1 9 ALA CA C -2.533 11.708 -7.537 1.00 . A A . 441 ALA CA 1 1 5 2024 1 1 9 ALA CB C -1.842 12.424 -8.687 1.00 . A A . 441 ALA CB 1 1 5 2025 1 1 9 ALA H H -1.076 10.192 -7.762 1.00 . A A . 441 ALA H 1 1 5 2026 1 1 9 ALA HA H -2.536 12.369 -6.685 1.00 . A A . 441 ALA HA 1 1 5 2027 1 1 9 ALA HB1 H -1.843 11.786 -9.558 1.00 . A A . 441 ALA HB1 1 1 5 2028 1 1 9 ALA HB2 H -0.823 12.653 -8.409 1.00 . A A . 441 ALA HB2 1 1 5 2029 1 1 9 ALA HB3 H -2.369 13.339 -8.909 1.00 . A A . 441 ALA HB3 1 1 5 2030 1 1 9 ALA N N -1.789 10.505 -7.169 1.00 . A A . 441 ALA N 1 1 5 2031 1 1 9 ALA O O -4.753 12.263 -8.270 1.00 . A A . 441 ALA O 1 1 5 2032 1 1 10 ASP C C -6.577 10.146 -6.854 1.00 . A A . 442 ASP C 1 1 5 2033 1 1 10 ASP CA C -5.703 9.654 -8.005 1.00 . A A . 442 ASP CA 1 1 5 2034 1 1 10 ASP CB C -5.744 8.122 -8.069 1.00 . A A . 442 ASP CB 1 1 5 2035 1 1 10 ASP CG C -7.013 7.580 -8.699 1.00 . A A . 442 ASP CG 1 1 5 2036 1 1 10 ASP H H -3.639 9.442 -7.594 1.00 . A A . 442 ASP H 1 1 5 2037 1 1 10 ASP HA H -6.067 10.065 -8.934 1.00 . A A . 442 ASP HA 1 1 5 2038 1 1 10 ASP HB2 H -4.904 7.773 -8.649 1.00 . A A . 442 ASP HB2 1 1 5 2039 1 1 10 ASP HB3 H -5.668 7.726 -7.067 1.00 . A A . 442 ASP HB3 1 1 5 2040 1 1 10 ASP N N -4.331 10.104 -7.807 1.00 . A A . 442 ASP N 1 1 5 2041 1 1 10 ASP O O -7.803 10.065 -6.901 1.00 . A A . 442 ASP O 1 1 5 2042 1 1 10 ASP OD1 O -8.025 7.406 -7.988 1.00 . A A . 442 ASP OD1 1 1 5 2043 1 1 10 ASP OD2 O -6.994 7.302 -9.916 1.00 . A A . 442 ASP OD2 1 1 5 2044 1 1 11 GLY C C -6.774 9.989 -3.628 1.00 . A A . 443 GLY C 1 1 5 2045 1 1 11 GLY CA C -6.625 11.107 -4.633 1.00 . A A . 443 GLY CA 1 1 5 2046 1 1 11 GLY H H -4.943 10.731 -5.856 1.00 . A A . 443 GLY H 1 1 5 2047 1 1 11 GLY HA2 H -6.075 11.919 -4.181 1.00 . A A . 443 GLY HA2 1 1 5 2048 1 1 11 GLY HA3 H -7.606 11.459 -4.918 1.00 . A A . 443 GLY HA3 1 1 5 2049 1 1 11 GLY N N -5.921 10.657 -5.814 1.00 . A A . 443 GLY N 1 1 5 2050 1 1 11 GLY O O -7.714 9.970 -2.836 1.00 . A A . 443 GLY O 1 1 5 2051 1 1 12 LYS C C -4.546 7.520 -2.243 1.00 . A A . 444 LYS C 1 1 5 2052 1 1 12 LYS CA C -5.909 7.860 -2.830 1.00 . A A . 444 LYS CA 1 1 5 2053 1 1 12 LYS CB C -6.409 6.667 -3.654 1.00 . A A . 444 LYS CB 1 1 5 2054 1 1 12 LYS CD C -8.250 5.590 -4.976 1.00 . A A . 444 LYS CD 1 1 5 2055 1 1 12 LYS CE C -9.705 5.663 -5.404 1.00 . A A . 444 LYS CE 1 1 5 2056 1 1 12 LYS CG C -7.835 6.807 -4.166 1.00 . A A . 444 LYS CG 1 1 5 2057 1 1 12 LYS H H -5.060 9.173 -4.254 1.00 . A A . 444 LYS H 1 1 5 2058 1 1 12 LYS HA H -6.604 8.051 -2.027 1.00 . A A . 444 LYS HA 1 1 5 2059 1 1 12 LYS HB2 H -5.759 6.538 -4.506 1.00 . A A . 444 LYS HB2 1 1 5 2060 1 1 12 LYS HB3 H -6.359 5.777 -3.041 1.00 . A A . 444 LYS HB3 1 1 5 2061 1 1 12 LYS HD2 H -7.632 5.531 -5.860 1.00 . A A . 444 LYS HD2 1 1 5 2062 1 1 12 LYS HD3 H -8.105 4.704 -4.374 1.00 . A A . 444 LYS HD3 1 1 5 2063 1 1 12 LYS HE2 H -9.958 4.753 -5.928 1.00 . A A . 444 LYS HE2 1 1 5 2064 1 1 12 LYS HE3 H -10.322 5.750 -4.520 1.00 . A A . 444 LYS HE3 1 1 5 2065 1 1 12 LYS HG2 H -8.503 6.913 -3.325 1.00 . A A . 444 LYS HG2 1 1 5 2066 1 1 12 LYS HG3 H -7.898 7.685 -4.793 1.00 . A A . 444 LYS HG3 1 1 5 2067 1 1 12 LYS HZ1 H -9.870 7.713 -5.770 1.00 . A A . 444 LYS HZ1 1 1 5 2068 1 1 12 LYS HZ2 H -10.938 6.764 -6.675 1.00 . A A . 444 LYS HZ2 1 1 5 2069 1 1 12 LYS HZ3 H -9.293 6.824 -7.092 1.00 . A A . 444 LYS HZ3 1 1 5 2070 1 1 12 LYS N N -5.835 9.052 -3.663 1.00 . A A . 444 LYS N 1 1 5 2071 1 1 12 LYS NZ N -9.970 6.819 -6.295 1.00 . A A . 444 LYS NZ 1 1 5 2072 1 1 12 LYS O O -3.535 7.535 -2.942 1.00 . A A . 444 LYS O 1 1 5 2073 1 1 13 THR C C -3.413 5.163 -0.273 1.00 . A A . 445 THR C 1 1 5 2074 1 1 13 THR CA C -3.321 6.683 -0.339 1.00 . A A . 445 THR CA 1 1 5 2075 1 1 13 THR CB C -3.116 7.258 1.073 1.00 . A A . 445 THR CB 1 1 5 2076 1 1 13 THR CG2 C -1.772 6.825 1.642 1.00 . A A . 445 THR CG2 1 1 5 2077 1 1 13 THR H H -5.331 7.316 -0.418 1.00 . A A . 445 THR H 1 1 5 2078 1 1 13 THR HA H -2.482 6.962 -0.947 1.00 . A A . 445 THR HA 1 1 5 2079 1 1 13 THR HB H -3.902 6.892 1.716 1.00 . A A . 445 THR HB 1 1 5 2080 1 1 13 THR HG1 H -3.642 8.960 0.219 1.00 . A A . 445 THR HG1 1 1 5 2081 1 1 13 THR HG21 H -1.736 5.747 1.699 1.00 . A A . 445 THR HG21 1 1 5 2082 1 1 13 THR HG22 H -1.647 7.242 2.630 1.00 . A A . 445 THR HG22 1 1 5 2083 1 1 13 THR HG23 H -0.979 7.178 0.999 1.00 . A A . 445 THR HG23 1 1 5 2084 1 1 13 THR N N -4.521 7.205 -0.959 1.00 . A A . 445 THR N 1 1 5 2085 1 1 13 THR O O -4.151 4.618 0.546 1.00 . A A . 445 THR O 1 1 5 2086 1 1 13 THR OG1 O -3.178 8.691 1.020 1.00 . A A . 445 THR OG1 1 1 5 2087 1 1 14 TYR C C -1.647 2.375 -0.520 1.00 . A A . 446 TYR C 1 1 5 2088 1 1 14 TYR CA C -2.801 3.038 -1.246 1.00 . A A . 446 TYR CA 1 1 5 2089 1 1 14 TYR CB C -2.857 2.580 -2.710 1.00 . A A . 446 TYR CB 1 1 5 2090 1 1 14 TYR CD1 C -1.225 3.965 -4.066 1.00 . A A . 446 TYR CD1 1 1 5 2091 1 1 14 TYR CD2 C -0.749 1.652 -3.749 1.00 . A A . 446 TYR CD2 1 1 5 2092 1 1 14 TYR CE1 C -0.080 4.096 -4.830 1.00 . A A . 446 TYR CE1 1 1 5 2093 1 1 14 TYR CE2 C 0.400 1.779 -4.504 1.00 . A A . 446 TYR CE2 1 1 5 2094 1 1 14 TYR CG C -1.580 2.742 -3.512 1.00 . A A . 446 TYR CG 1 1 5 2095 1 1 14 TYR CZ C 0.727 3.000 -5.046 1.00 . A A . 446 TYR CZ 1 1 5 2096 1 1 14 TYR H H -2.052 4.949 -1.730 1.00 . A A . 446 TYR H 1 1 5 2097 1 1 14 TYR HA H -3.723 2.756 -0.760 1.00 . A A . 446 TYR HA 1 1 5 2098 1 1 14 TYR HB2 H -3.118 1.535 -2.732 1.00 . A A . 446 TYR HB2 1 1 5 2099 1 1 14 TYR HB3 H -3.631 3.141 -3.215 1.00 . A A . 446 TYR HB3 1 1 5 2100 1 1 14 TYR HD1 H -1.859 4.824 -3.894 1.00 . A A . 446 TYR HD1 1 1 5 2101 1 1 14 TYR HD2 H -1.008 0.694 -3.325 1.00 . A A . 446 TYR HD2 1 1 5 2102 1 1 14 TYR HE1 H 0.181 5.055 -5.250 1.00 . A A . 446 TYR HE1 1 1 5 2103 1 1 14 TYR HE2 H 1.031 0.922 -4.675 1.00 . A A . 446 TYR HE2 1 1 5 2104 1 1 14 TYR HH H 2.038 4.067 -5.980 1.00 . A A . 446 TYR HH 1 1 5 2105 1 1 14 TYR N N -2.691 4.481 -1.154 1.00 . A A . 446 TYR N 1 1 5 2106 1 1 14 TYR O O -0.516 2.868 -0.544 1.00 . A A . 446 TYR O 1 1 5 2107 1 1 14 TYR OH O 1.864 3.124 -5.813 1.00 . A A . 446 TYR OH 1 1 5 2108 1 1 15 TYR C C -0.527 -0.715 0.154 1.00 . A A . 447 TYR C 1 1 5 2109 1 1 15 TYR CA C -0.940 0.552 0.886 1.00 . A A . 447 TYR CA 1 1 5 2110 1 1 15 TYR CB C -1.483 0.240 2.281 1.00 . A A . 447 TYR CB 1 1 5 2111 1 1 15 TYR CD1 C -1.766 2.557 3.252 1.00 . A A . 447 TYR CD1 1 1 5 2112 1 1 15 TYR CD2 C -3.722 1.245 2.897 1.00 . A A . 447 TYR CD2 1 1 5 2113 1 1 15 TYR CE1 C -2.541 3.596 3.728 1.00 . A A . 447 TYR CE1 1 1 5 2114 1 1 15 TYR CE2 C -4.505 2.279 3.374 1.00 . A A . 447 TYR CE2 1 1 5 2115 1 1 15 TYR CG C -2.339 1.365 2.830 1.00 . A A . 447 TYR CG 1 1 5 2116 1 1 15 TYR CZ C -3.910 3.453 3.786 1.00 . A A . 447 TYR CZ 1 1 5 2117 1 1 15 TYR H H -2.839 0.878 0.051 1.00 . A A . 447 TYR H 1 1 5 2118 1 1 15 TYR HA H -0.080 1.199 0.981 1.00 . A A . 447 TYR HA 1 1 5 2119 1 1 15 TYR HB2 H -2.082 -0.658 2.241 1.00 . A A . 447 TYR HB2 1 1 5 2120 1 1 15 TYR HB3 H -0.656 0.089 2.958 1.00 . A A . 447 TYR HB3 1 1 5 2121 1 1 15 TYR HD1 H -0.695 2.668 3.206 1.00 . A A . 447 TYR HD1 1 1 5 2122 1 1 15 TYR HD2 H -4.186 0.326 2.574 1.00 . A A . 447 TYR HD2 1 1 5 2123 1 1 15 TYR HE1 H -2.075 4.515 4.050 1.00 . A A . 447 TYR HE1 1 1 5 2124 1 1 15 TYR HE2 H -5.579 2.166 3.422 1.00 . A A . 447 TYR HE2 1 1 5 2125 1 1 15 TYR HH H -4.328 5.326 3.959 1.00 . A A . 447 TYR HH 1 1 5 2126 1 1 15 TYR N N -1.934 1.253 0.113 1.00 . A A . 447 TYR N 1 1 5 2127 1 1 15 TYR O O -1.191 -1.747 0.233 1.00 . A A . 447 TYR O 1 1 5 2128 1 1 15 TYR OH O -4.687 4.483 4.262 1.00 . A A . 447 TYR OH 1 1 5 2129 1 1 16 TYR C C 2.057 -2.520 -0.514 1.00 . A A . 448 TYR C 1 1 5 2130 1 1 16 TYR CA C 1.049 -1.739 -1.355 1.00 . A A . 448 TYR CA 1 1 5 2131 1 1 16 TYR CB C 1.695 -1.236 -2.649 1.00 . A A . 448 TYR CB 1 1 5 2132 1 1 16 TYR CD1 C 1.623 -3.202 -4.235 1.00 . A A . 448 TYR CD1 1 1 5 2133 1 1 16 TYR CD2 C 3.756 -2.410 -3.519 1.00 . A A . 448 TYR CD2 1 1 5 2134 1 1 16 TYR CE1 C 2.240 -4.170 -5.006 1.00 . A A . 448 TYR CE1 1 1 5 2135 1 1 16 TYR CE2 C 4.378 -3.376 -4.285 1.00 . A A . 448 TYR CE2 1 1 5 2136 1 1 16 TYR CG C 2.370 -2.307 -3.479 1.00 . A A . 448 TYR CG 1 1 5 2137 1 1 16 TYR CZ C 3.617 -4.253 -5.027 1.00 . A A . 448 TYR CZ 1 1 5 2138 1 1 16 TYR H H 0.965 0.262 -0.716 1.00 . A A . 448 TYR H 1 1 5 2139 1 1 16 TYR HA H 0.214 -2.378 -1.604 1.00 . A A . 448 TYR HA 1 1 5 2140 1 1 16 TYR HB2 H 0.933 -0.784 -3.261 1.00 . A A . 448 TYR HB2 1 1 5 2141 1 1 16 TYR HB3 H 2.437 -0.489 -2.403 1.00 . A A . 448 TYR HB3 1 1 5 2142 1 1 16 TYR HD1 H 0.545 -3.134 -4.215 1.00 . A A . 448 TYR HD1 1 1 5 2143 1 1 16 TYR HD2 H 4.351 -1.722 -2.933 1.00 . A A . 448 TYR HD2 1 1 5 2144 1 1 16 TYR HE1 H 1.642 -4.858 -5.588 1.00 . A A . 448 TYR HE1 1 1 5 2145 1 1 16 TYR HE2 H 5.455 -3.441 -4.300 1.00 . A A . 448 TYR HE2 1 1 5 2146 1 1 16 TYR HH H 3.781 -5.287 -6.649 1.00 . A A . 448 TYR HH 1 1 5 2147 1 1 16 TYR N N 0.538 -0.610 -0.610 1.00 . A A . 448 TYR N 1 1 5 2148 1 1 16 TYR O O 3.012 -1.957 0.022 1.00 . A A . 448 TYR O 1 1 5 2149 1 1 16 TYR OH O 4.236 -5.213 -5.796 1.00 . A A . 448 TYR OH 1 1 5 2150 1 1 17 ASN C C 3.782 -5.243 -0.550 1.00 . A A . 449 ASN C 1 1 5 2151 1 1 17 ASN CA C 2.689 -4.699 0.350 1.00 . A A . 449 ASN CA 1 1 5 2152 1 1 17 ASN CB C 1.854 -5.842 0.934 1.00 . A A . 449 ASN CB 1 1 5 2153 1 1 17 ASN CG C 2.688 -6.948 1.554 1.00 . A A . 449 ASN CG 1 1 5 2154 1 1 17 ASN H H 1.041 -4.201 -0.855 1.00 . A A . 449 ASN H 1 1 5 2155 1 1 17 ASN HA H 3.135 -4.132 1.153 1.00 . A A . 449 ASN HA 1 1 5 2156 1 1 17 ASN HB2 H 1.203 -5.444 1.698 1.00 . A A . 449 ASN HB2 1 1 5 2157 1 1 17 ASN HB3 H 1.249 -6.273 0.147 1.00 . A A . 449 ASN HB3 1 1 5 2158 1 1 17 ASN HD21 H 1.156 -8.208 1.414 1.00 . A A . 449 ASN HD21 1 1 5 2159 1 1 17 ASN HD22 H 2.598 -8.852 2.123 1.00 . A A . 449 ASN HD22 1 1 5 2160 1 1 17 ASN N N 1.830 -3.817 -0.409 1.00 . A A . 449 ASN N 1 1 5 2161 1 1 17 ASN ND2 N 2.092 -8.122 1.705 1.00 . A A . 449 ASN ND2 1 1 5 2162 1 1 17 ASN O O 3.505 -5.918 -1.542 1.00 . A A . 449 ASN O 1 1 5 2163 1 1 17 ASN OD1 O 3.839 -6.746 1.930 1.00 . A A . 449 ASN OD1 1 1 5 2164 1 1 18 ASN C C 6.653 -6.708 -0.666 1.00 . A A . 450 ASN C 1 1 5 2165 1 1 18 ASN CA C 6.161 -5.319 -1.020 1.00 . A A . 450 ASN CA 1 1 5 2166 1 1 18 ASN CB C 7.296 -4.293 -0.875 1.00 . A A . 450 ASN CB 1 1 5 2167 1 1 18 ASN CG C 7.854 -4.206 0.535 1.00 . A A . 450 ASN CG 1 1 5 2168 1 1 18 ASN H H 5.183 -4.551 0.690 1.00 . A A . 450 ASN H 1 1 5 2169 1 1 18 ASN HA H 5.823 -5.324 -2.045 1.00 . A A . 450 ASN HA 1 1 5 2170 1 1 18 ASN HB2 H 8.101 -4.564 -1.539 1.00 . A A . 450 ASN HB2 1 1 5 2171 1 1 18 ASN HB3 H 6.923 -3.318 -1.153 1.00 . A A . 450 ASN HB3 1 1 5 2172 1 1 18 ASN HD21 H 6.641 -2.688 0.951 1.00 . A A . 450 ASN HD21 1 1 5 2173 1 1 18 ASN HD22 H 7.698 -3.182 2.232 1.00 . A A . 450 ASN HD22 1 1 5 2174 1 1 18 ASN N N 5.024 -4.968 -0.183 1.00 . A A . 450 ASN N 1 1 5 2175 1 1 18 ASN ND2 N 7.344 -3.269 1.317 1.00 . A A . 450 ASN ND2 1 1 5 2176 1 1 18 ASN O O 7.568 -7.238 -1.291 1.00 . A A . 450 ASN O 1 1 5 2177 1 1 18 ASN OD1 O 8.753 -4.956 0.911 1.00 . A A . 450 ASN OD1 1 1 5 2178 1 1 19 ARG C C 5.694 -9.689 -0.126 1.00 . A A . 451 ARG C 1 1 5 2179 1 1 19 ARG CA C 6.384 -8.650 0.749 1.00 . A A . 451 ARG CA 1 1 5 2180 1 1 19 ARG CB C 6.040 -8.908 2.217 1.00 . A A . 451 ARG CB 1 1 5 2181 1 1 19 ARG CD C 8.236 -7.885 2.930 1.00 . A A . 451 ARG CD 1 1 5 2182 1 1 19 ARG CG C 6.739 -7.978 3.193 1.00 . A A . 451 ARG CG 1 1 5 2183 1 1 19 ARG CZ C 9.675 -9.748 3.675 1.00 . A A . 451 ARG CZ 1 1 5 2184 1 1 19 ARG H H 5.330 -6.805 0.833 1.00 . A A . 451 ARG H 1 1 5 2185 1 1 19 ARG HA H 7.442 -8.750 0.627 1.00 . A A . 451 ARG HA 1 1 5 2186 1 1 19 ARG HB2 H 4.974 -8.793 2.347 1.00 . A A . 451 ARG HB2 1 1 5 2187 1 1 19 ARG HB3 H 6.314 -9.923 2.462 1.00 . A A . 451 ARG HB3 1 1 5 2188 1 1 19 ARG HD2 H 8.391 -7.316 2.025 1.00 . A A . 451 ARG HD2 1 1 5 2189 1 1 19 ARG HD3 H 8.700 -7.369 3.758 1.00 . A A . 451 ARG HD3 1 1 5 2190 1 1 19 ARG HE H 8.726 -9.668 1.917 1.00 . A A . 451 ARG HE 1 1 5 2191 1 1 19 ARG HG2 H 6.310 -6.992 3.103 1.00 . A A . 451 ARG HG2 1 1 5 2192 1 1 19 ARG HG3 H 6.582 -8.348 4.197 1.00 . A A . 451 ARG HG3 1 1 5 2193 1 1 19 ARG HH11 H 9.324 -8.351 5.106 1.00 . A A . 451 ARG HH11 1 1 5 2194 1 1 19 ARG HH12 H 10.442 -9.611 5.550 1.00 . A A . 451 ARG HH12 1 1 5 2195 1 1 19 ARG HH21 H 10.162 -11.320 2.493 1.00 . A A . 451 ARG HH21 1 1 5 2196 1 1 19 ARG HH22 H 10.920 -11.307 4.058 1.00 . A A . 451 ARG HH22 1 1 5 2197 1 1 19 ARG N N 6.030 -7.299 0.342 1.00 . A A . 451 ARG N 1 1 5 2198 1 1 19 ARG NE N 8.870 -9.195 2.771 1.00 . A A . 451 ARG NE 1 1 5 2199 1 1 19 ARG NH1 N 9.826 -9.193 4.871 1.00 . A A . 451 ARG NH1 1 1 5 2200 1 1 19 ARG NH2 N 10.301 -10.883 3.387 1.00 . A A . 451 ARG NH2 1 1 5 2201 1 1 19 ARG O O 6.285 -10.708 -0.480 1.00 . A A . 451 ARG O 1 1 5 2202 1 1 20 THR C C 3.138 -9.835 -2.513 1.00 . A A . 452 THR C 1 1 5 2203 1 1 20 THR CA C 3.638 -10.413 -1.185 1.00 . A A . 452 THR CA 1 1 5 2204 1 1 20 THR CB C 2.448 -10.879 -0.321 1.00 . A A . 452 THR CB 1 1 5 2205 1 1 20 THR CG2 C 1.866 -12.188 -0.834 1.00 . A A . 452 THR CG2 1 1 5 2206 1 1 20 THR H H 4.023 -8.600 -0.169 1.00 . A A . 452 THR H 1 1 5 2207 1 1 20 THR HA H 4.263 -11.271 -1.390 1.00 . A A . 452 THR HA 1 1 5 2208 1 1 20 THR HB H 1.678 -10.119 -0.344 1.00 . A A . 452 THR HB 1 1 5 2209 1 1 20 THR HG1 H 2.125 -11.215 1.611 1.00 . A A . 452 THR HG1 1 1 5 2210 1 1 20 THR HG21 H 2.628 -12.953 -0.814 1.00 . A A . 452 THR HG21 1 1 5 2211 1 1 20 THR HG22 H 1.519 -12.053 -1.848 1.00 . A A . 452 THR HG22 1 1 5 2212 1 1 20 THR HG23 H 1.040 -12.487 -0.206 1.00 . A A . 452 THR HG23 1 1 5 2213 1 1 20 THR N N 4.433 -9.445 -0.445 1.00 . A A . 452 THR N 1 1 5 2214 1 1 20 THR O O 2.459 -10.521 -3.280 1.00 . A A . 452 THR O 1 1 5 2215 1 1 20 THR OG1 O 2.893 -11.059 1.032 1.00 . A A . 452 THR OG1 1 1 5 2216 1 1 21 LEU C C 1.461 -7.702 -3.816 1.00 . A A . 453 LEU C 1 1 5 2217 1 1 21 LEU CA C 2.974 -7.846 -3.950 1.00 . A A . 453 LEU CA 1 1 5 2218 1 1 21 LEU CB C 3.340 -8.553 -5.269 1.00 . A A . 453 LEU CB 1 1 5 2219 1 1 21 LEU CD1 C 5.685 -9.387 -4.837 1.00 . A A . 453 LEU CD1 1 1 5 2220 1 1 21 LEU CD2 C 4.967 -8.807 -7.161 1.00 . A A . 453 LEU CD2 1 1 5 2221 1 1 21 LEU CG C 4.816 -8.471 -5.686 1.00 . A A . 453 LEU CG 1 1 5 2222 1 1 21 LEU H H 4.120 -8.117 -2.184 1.00 . A A . 453 LEU H 1 1 5 2223 1 1 21 LEU HA H 3.415 -6.860 -3.944 1.00 . A A . 453 LEU HA 1 1 5 2224 1 1 21 LEU HB2 H 3.076 -9.596 -5.175 1.00 . A A . 453 LEU HB2 1 1 5 2225 1 1 21 LEU HB3 H 2.743 -8.120 -6.058 1.00 . A A . 453 LEU HB3 1 1 5 2226 1 1 21 LEU HD11 H 5.597 -9.105 -3.797 1.00 . A A . 453 LEU HD11 1 1 5 2227 1 1 21 LEU HD12 H 6.715 -9.300 -5.148 1.00 . A A . 453 LEU HD12 1 1 5 2228 1 1 21 LEU HD13 H 5.358 -10.409 -4.960 1.00 . A A . 453 LEU HD13 1 1 5 2229 1 1 21 LEU HD21 H 4.573 -9.794 -7.346 1.00 . A A . 453 LEU HD21 1 1 5 2230 1 1 21 LEU HD22 H 6.012 -8.778 -7.432 1.00 . A A . 453 LEU HD22 1 1 5 2231 1 1 21 LEU HD23 H 4.422 -8.085 -7.753 1.00 . A A . 453 LEU HD23 1 1 5 2232 1 1 21 LEU HG H 5.164 -7.458 -5.540 1.00 . A A . 453 LEU HG 1 1 5 2233 1 1 21 LEU N N 3.493 -8.573 -2.782 1.00 . A A . 453 LEU N 1 1 5 2234 1 1 21 LEU O O 0.731 -7.585 -4.799 1.00 . A A . 453 LEU O 1 1 5 2235 1 1 22 GLU C C -0.869 -6.183 -2.137 1.00 . A A . 454 GLU C 1 1 5 2236 1 1 22 GLU CA C -0.382 -7.625 -2.213 1.00 . A A . 454 GLU CA 1 1 5 2237 1 1 22 GLU CB C -0.545 -8.330 -0.862 1.00 . A A . 454 GLU CB 1 1 5 2238 1 1 22 GLU CD C -2.024 -9.001 1.047 1.00 . A A . 454 GLU CD 1 1 5 2239 1 1 22 GLU CG C -1.945 -8.287 -0.283 1.00 . A A . 454 GLU CG 1 1 5 2240 1 1 22 GLU H H 1.692 -7.618 -1.849 1.00 . A A . 454 GLU H 1 1 5 2241 1 1 22 GLU HA H -0.938 -8.157 -2.970 1.00 . A A . 454 GLU HA 1 1 5 2242 1 1 22 GLU HB2 H -0.267 -9.365 -0.982 1.00 . A A . 454 GLU HB2 1 1 5 2243 1 1 22 GLU HB3 H 0.128 -7.870 -0.152 1.00 . A A . 454 GLU HB3 1 1 5 2244 1 1 22 GLU HG2 H -2.235 -7.257 -0.142 1.00 . A A . 454 GLU HG2 1 1 5 2245 1 1 22 GLU HG3 H -2.621 -8.763 -0.972 1.00 . A A . 454 GLU HG3 1 1 5 2246 1 1 22 GLU N N 1.028 -7.654 -2.568 1.00 . A A . 454 GLU N 1 1 5 2247 1 1 22 GLU O O -0.202 -5.333 -1.561 1.00 . A A . 454 GLU O 1 1 5 2248 1 1 22 GLU OE1 O -1.514 -8.460 2.046 1.00 . A A . 454 GLU OE1 1 1 5 2249 1 1 22 GLU OE2 O -2.576 -10.120 1.092 1.00 . A A . 454 GLU OE2 1 1 5 2250 1 1 23 SER C C -3.571 -4.375 -1.598 1.00 . A A . 455 SER C 1 1 5 2251 1 1 23 SER CA C -2.541 -4.546 -2.718 1.00 . A A . 455 SER CA 1 1 5 2252 1 1 23 SER CB C -3.152 -4.217 -4.088 1.00 . A A . 455 SER CB 1 1 5 2253 1 1 23 SER H H -2.549 -6.620 -3.129 1.00 . A A . 455 SER H 1 1 5 2254 1 1 23 SER HA H -1.713 -3.878 -2.534 1.00 . A A . 455 SER HA 1 1 5 2255 1 1 23 SER HB2 H -2.557 -4.677 -4.864 1.00 . A A . 455 SER HB2 1 1 5 2256 1 1 23 SER HB3 H -4.158 -4.605 -4.132 1.00 . A A . 455 SER HB3 1 1 5 2257 1 1 23 SER HG H -2.395 -2.550 -4.792 1.00 . A A . 455 SER HG 1 1 5 2258 1 1 23 SER N N -2.025 -5.902 -2.714 1.00 . A A . 455 SER N 1 1 5 2259 1 1 23 SER O O -4.672 -4.922 -1.663 1.00 . A A . 455 SER O 1 1 5 2260 1 1 23 SER OG O -3.192 -2.817 -4.318 1.00 . A A . 455 SER OG 1 1 5 2261 1 1 24 THR C C -4.614 -2.025 0.630 1.00 . A A . 456 THR C 1 1 5 2262 1 1 24 THR CA C -4.041 -3.445 0.603 1.00 . A A . 456 THR CA 1 1 5 2263 1 1 24 THR CB C -3.239 -3.703 1.895 1.00 . A A . 456 THR CB 1 1 5 2264 1 1 24 THR CG2 C -4.153 -3.749 3.107 1.00 . A A . 456 THR CG2 1 1 5 2265 1 1 24 THR H H -2.308 -3.209 -0.576 1.00 . A A . 456 THR H 1 1 5 2266 1 1 24 THR HA H -4.851 -4.154 0.554 1.00 . A A . 456 THR HA 1 1 5 2267 1 1 24 THR HB H -2.528 -2.899 2.027 1.00 . A A . 456 THR HB 1 1 5 2268 1 1 24 THR HG1 H -2.916 -5.589 2.395 1.00 . A A . 456 THR HG1 1 1 5 2269 1 1 24 THR HG21 H -4.671 -2.806 3.204 1.00 . A A . 456 THR HG21 1 1 5 2270 1 1 24 THR HG22 H -3.564 -3.928 3.994 1.00 . A A . 456 THR HG22 1 1 5 2271 1 1 24 THR HG23 H -4.874 -4.545 2.986 1.00 . A A . 456 THR HG23 1 1 5 2272 1 1 24 THR N N -3.192 -3.638 -0.563 1.00 . A A . 456 THR N 1 1 5 2273 1 1 24 THR O O -3.874 -1.043 0.647 1.00 . A A . 456 THR O 1 1 5 2274 1 1 24 THR OG1 O -2.532 -4.944 1.784 1.00 . A A . 456 THR OG1 1 1 5 2275 1 1 25 TRP C C -7.381 -0.343 1.851 1.00 . A A . 457 TRP C 1 1 5 2276 1 1 25 TRP CA C -6.576 -0.602 0.584 1.00 . A A . 457 TRP CA 1 1 5 2277 1 1 25 TRP CB C -7.431 -0.479 -0.681 1.00 . A A . 457 TRP CB 1 1 5 2278 1 1 25 TRP CD1 C -5.876 -1.567 -2.390 1.00 . A A . 457 TRP CD1 1 1 5 2279 1 1 25 TRP CD2 C -6.297 0.592 -2.796 1.00 . A A . 457 TRP CD2 1 1 5 2280 1 1 25 TRP CE2 C -5.404 0.111 -3.773 1.00 . A A . 457 TRP CE2 1 1 5 2281 1 1 25 TRP CE3 C -6.708 1.926 -2.857 1.00 . A A . 457 TRP CE3 1 1 5 2282 1 1 25 TRP CG C -6.575 -0.500 -1.911 1.00 . A A . 457 TRP CG 1 1 5 2283 1 1 25 TRP CH2 C -5.330 2.218 -4.831 1.00 . A A . 457 TRP CH2 1 1 5 2284 1 1 25 TRP CZ2 C -4.912 0.915 -4.795 1.00 . A A . 457 TRP CZ2 1 1 5 2285 1 1 25 TRP CZ3 C -6.224 2.725 -3.878 1.00 . A A . 457 TRP CZ3 1 1 5 2286 1 1 25 TRP H H -6.486 -2.720 0.613 1.00 . A A . 457 TRP H 1 1 5 2287 1 1 25 TRP HA H -5.787 0.136 0.535 1.00 . A A . 457 TRP HA 1 1 5 2288 1 1 25 TRP HB2 H -8.123 -1.309 -0.730 1.00 . A A . 457 TRP HB2 1 1 5 2289 1 1 25 TRP HB3 H -7.978 0.452 -0.661 1.00 . A A . 457 TRP HB3 1 1 5 2290 1 1 25 TRP HD1 H -5.877 -2.548 -1.938 1.00 . A A . 457 TRP HD1 1 1 5 2291 1 1 25 TRP HE1 H -4.567 -1.799 -4.016 1.00 . A A . 457 TRP HE1 1 1 5 2292 1 1 25 TRP HE3 H -7.396 2.332 -2.131 1.00 . A A . 457 TRP HE3 1 1 5 2293 1 1 25 TRP HH2 H -4.977 2.879 -5.611 1.00 . A A . 457 TRP HH2 1 1 5 2294 1 1 25 TRP HZ2 H -4.208 0.542 -5.523 1.00 . A A . 457 TRP HZ2 1 1 5 2295 1 1 25 TRP HZ3 H -6.531 3.757 -3.941 1.00 . A A . 457 TRP HZ3 1 1 5 2296 1 1 25 TRP N N -5.935 -1.912 0.620 1.00 . A A . 457 TRP N 1 1 5 2297 1 1 25 TRP NE1 N -5.161 -1.204 -3.498 1.00 . A A . 457 TRP NE1 1 1 5 2298 1 1 25 TRP O O -8.053 0.680 1.984 1.00 . A A . 457 TRP O 1 1 5 2299 1 1 26 GLU C C -6.706 -1.219 5.117 1.00 . A A . 458 GLU C 1 1 5 2300 1 1 26 GLU CA C -7.840 -1.081 4.114 1.00 . A A . 458 GLU CA 1 1 5 2301 1 1 26 GLU CB C -8.944 -2.096 4.408 1.00 . A A . 458 GLU CB 1 1 5 2302 1 1 26 GLU CD C -10.286 -0.413 5.708 1.00 . A A . 458 GLU CD 1 1 5 2303 1 1 26 GLU CG C -9.698 -1.808 5.694 1.00 . A A . 458 GLU CG 1 1 5 2304 1 1 26 GLU H H -6.853 -2.121 2.573 1.00 . A A . 458 GLU H 1 1 5 2305 1 1 26 GLU HA H -8.242 -0.081 4.171 1.00 . A A . 458 GLU HA 1 1 5 2306 1 1 26 GLU HB2 H -9.651 -2.090 3.590 1.00 . A A . 458 GLU HB2 1 1 5 2307 1 1 26 GLU HB3 H -8.504 -3.080 4.486 1.00 . A A . 458 GLU HB3 1 1 5 2308 1 1 26 GLU HG2 H -10.502 -2.522 5.796 1.00 . A A . 458 GLU HG2 1 1 5 2309 1 1 26 GLU HG3 H -9.018 -1.906 6.528 1.00 . A A . 458 GLU HG3 1 1 5 2310 1 1 26 GLU N N -7.303 -1.279 2.780 1.00 . A A . 458 GLU N 1 1 5 2311 1 1 26 GLU O O -6.028 -2.244 5.136 1.00 . A A . 458 GLU O 1 1 5 2312 1 1 26 GLU OE1 O -11.352 -0.206 5.093 1.00 . A A . 458 GLU OE1 1 1 5 2313 1 1 26 GLU OE2 O -9.683 0.488 6.327 1.00 . A A . 458 GLU OE2 1 1 5 2314 1 1 27 LYS C C -5.528 -1.362 7.869 1.00 . A A . 459 LYS C 1 1 5 2315 1 1 27 LYS CA C -5.372 -0.216 6.878 1.00 . A A . 459 LYS CA 1 1 5 2316 1 1 27 LYS CB C -5.255 1.108 7.640 1.00 . A A . 459 LYS CB 1 1 5 2317 1 1 27 LYS CD C -4.389 3.461 7.371 1.00 . A A . 459 LYS CD 1 1 5 2318 1 1 27 LYS CE C -2.904 3.124 7.414 1.00 . A A . 459 LYS CE 1 1 5 2319 1 1 27 LYS CG C -5.193 2.330 6.742 1.00 . A A . 459 LYS CG 1 1 5 2320 1 1 27 LYS H H -7.089 0.577 5.914 1.00 . A A . 459 LYS H 1 1 5 2321 1 1 27 LYS HA H -4.466 -0.372 6.310 1.00 . A A . 459 LYS HA 1 1 5 2322 1 1 27 LYS HB2 H -6.110 1.209 8.292 1.00 . A A . 459 LYS HB2 1 1 5 2323 1 1 27 LYS HB3 H -4.359 1.083 8.241 1.00 . A A . 459 LYS HB3 1 1 5 2324 1 1 27 LYS HD2 H -4.524 4.355 6.781 1.00 . A A . 459 LYS HD2 1 1 5 2325 1 1 27 LYS HD3 H -4.744 3.632 8.376 1.00 . A A . 459 LYS HD3 1 1 5 2326 1 1 27 LYS HE2 H -2.762 2.276 8.068 1.00 . A A . 459 LYS HE2 1 1 5 2327 1 1 27 LYS HE3 H -2.581 2.867 6.418 1.00 . A A . 459 LYS HE3 1 1 5 2328 1 1 27 LYS HG2 H -4.728 2.053 5.809 1.00 . A A . 459 LYS HG2 1 1 5 2329 1 1 27 LYS HG3 H -6.198 2.678 6.556 1.00 . A A . 459 LYS HG3 1 1 5 2330 1 1 27 LYS HZ1 H -2.199 4.366 8.945 1.00 . A A . 459 LYS HZ1 1 1 5 2331 1 1 27 LYS HZ2 H -2.366 5.146 7.445 1.00 . A A . 459 LYS HZ2 1 1 5 2332 1 1 27 LYS HZ3 H -1.068 4.082 7.704 1.00 . A A . 459 LYS HZ3 1 1 5 2333 1 1 27 LYS N N -6.486 -0.197 5.936 1.00 . A A . 459 LYS N 1 1 5 2334 1 1 27 LYS NZ N -2.080 4.257 7.912 1.00 . A A . 459 LYS NZ 1 1 5 2335 1 1 27 LYS O O -6.558 -1.478 8.535 1.00 . A A . 459 LYS O 1 1 5 2336 1 1 28 PRO C C -4.423 -2.846 10.357 1.00 . A A . 460 PRO C 1 1 5 2337 1 1 28 PRO CA C -4.520 -3.342 8.916 1.00 . A A . 460 PRO CA 1 1 5 2338 1 1 28 PRO CB C -3.282 -4.158 8.533 1.00 . A A . 460 PRO CB 1 1 5 2339 1 1 28 PRO CD C -3.290 -2.206 7.147 1.00 . A A . 460 PRO CD 1 1 5 2340 1 1 28 PRO CG C -2.388 -3.200 7.824 1.00 . A A . 460 PRO CG 1 1 5 2341 1 1 28 PRO HA H -5.407 -3.950 8.807 1.00 . A A . 460 PRO HA 1 1 5 2342 1 1 28 PRO HB2 H -2.813 -4.545 9.426 1.00 . A A . 460 PRO HB2 1 1 5 2343 1 1 28 PRO HB3 H -3.573 -4.976 7.890 1.00 . A A . 460 PRO HB3 1 1 5 2344 1 1 28 PRO HD2 H -2.841 -1.224 7.158 1.00 . A A . 460 PRO HD2 1 1 5 2345 1 1 28 PRO HD3 H -3.497 -2.516 6.132 1.00 . A A . 460 PRO HD3 1 1 5 2346 1 1 28 PRO HG2 H -1.748 -2.700 8.536 1.00 . A A . 460 PRO HG2 1 1 5 2347 1 1 28 PRO HG3 H -1.796 -3.727 7.092 1.00 . A A . 460 PRO HG3 1 1 5 2348 1 1 28 PRO N N -4.515 -2.232 7.965 1.00 . A A . 460 PRO N 1 1 5 2349 1 1 28 PRO O O -3.298 -2.611 10.837 1.00 . A A . 460 PRO O 1 1 5 2350 1 1 28 PRO OXT O -5.476 -2.674 11.003 1.00 . A A . 460 PRO OXT 1 1 6 2351 1 1 1 SER C C 8.243 -2.801 4.732 1.00 . A A . 433 SER C 1 1 6 2352 1 1 1 SER CA C 9.164 -1.648 5.164 1.00 . A A . 433 SER CA 1 1 6 2353 1 1 1 SER CB C 8.612 -0.878 6.370 1.00 . A A . 433 SER CB 1 1 6 2354 1 1 1 SER H1 H 8.462 -0.222 3.820 1.00 . A A . 433 SER H1 1 1 6 2355 1 1 1 SER H2 H 9.667 -1.227 3.188 1.00 . A A . 433 SER H2 1 1 6 2356 1 1 1 SER H3 H 10.076 0.001 4.284 1.00 . A A . 433 SER H3 1 1 6 2357 1 1 1 SER HA H 10.131 -2.061 5.420 1.00 . A A . 433 SER HA 1 1 6 2358 1 1 1 SER HB2 H 7.623 -0.508 6.143 1.00 . A A . 433 SER HB2 1 1 6 2359 1 1 1 SER HB3 H 8.570 -1.533 7.229 1.00 . A A . 433 SER HB3 1 1 6 2360 1 1 1 SER HG H 9.517 0.319 7.650 1.00 . A A . 433 SER HG 1 1 6 2361 1 1 1 SER N N 9.354 -0.709 4.039 1.00 . A A . 433 SER N 1 1 6 2362 1 1 1 SER O O 8.545 -3.486 3.754 1.00 . A A . 433 SER O 1 1 6 2363 1 1 1 SER OG O 9.443 0.231 6.684 1.00 . A A . 433 SER OG 1 1 6 2364 1 1 2 GLU C C 5.102 -3.523 4.196 1.00 . A A . 434 GLU C 1 1 6 2365 1 1 2 GLU CA C 6.218 -4.092 5.054 1.00 . A A . 434 GLU CA 1 1 6 2366 1 1 2 GLU CB C 5.620 -4.791 6.281 1.00 . A A . 434 GLU CB 1 1 6 2367 1 1 2 GLU CD C 7.733 -4.838 7.677 1.00 . A A . 434 GLU CD 1 1 6 2368 1 1 2 GLU CG C 6.609 -5.646 7.067 1.00 . A A . 434 GLU CG 1 1 6 2369 1 1 2 GLU H H 6.936 -2.494 6.228 1.00 . A A . 434 GLU H 1 1 6 2370 1 1 2 GLU HA H 6.772 -4.816 4.471 1.00 . A A . 434 GLU HA 1 1 6 2371 1 1 2 GLU HB2 H 5.223 -4.038 6.948 1.00 . A A . 434 GLU HB2 1 1 6 2372 1 1 2 GLU HB3 H 4.810 -5.427 5.954 1.00 . A A . 434 GLU HB3 1 1 6 2373 1 1 2 GLU HG2 H 6.077 -6.147 7.862 1.00 . A A . 434 GLU HG2 1 1 6 2374 1 1 2 GLU HG3 H 7.034 -6.382 6.401 1.00 . A A . 434 GLU HG3 1 1 6 2375 1 1 2 GLU N N 7.139 -3.035 5.439 1.00 . A A . 434 GLU N 1 1 6 2376 1 1 2 GLU O O 4.639 -4.163 3.251 1.00 . A A . 434 GLU O 1 1 6 2377 1 1 2 GLU OE1 O 7.490 -4.141 8.681 1.00 . A A . 434 GLU OE1 1 1 6 2378 1 1 2 GLU OE2 O 8.863 -4.891 7.147 1.00 . A A . 434 GLU OE2 1 1 6 2379 1 1 3 TRP C C 4.113 -0.375 3.202 1.00 . A A . 435 TRP C 1 1 6 2380 1 1 3 TRP CA C 3.594 -1.658 3.838 1.00 . A A . 435 TRP CA 1 1 6 2381 1 1 3 TRP CB C 2.451 -1.320 4.806 1.00 . A A . 435 TRP CB 1 1 6 2382 1 1 3 TRP CD1 C 1.912 -2.540 7.000 1.00 . A A . 435 TRP CD1 1 1 6 2383 1 1 3 TRP CD2 C 1.563 -3.762 5.160 1.00 . A A . 435 TRP CD2 1 1 6 2384 1 1 3 TRP CE2 C 1.231 -4.541 6.286 1.00 . A A . 435 TRP CE2 1 1 6 2385 1 1 3 TRP CE3 C 1.424 -4.323 3.892 1.00 . A A . 435 TRP CE3 1 1 6 2386 1 1 3 TRP CG C 1.991 -2.485 5.638 1.00 . A A . 435 TRP CG 1 1 6 2387 1 1 3 TRP CH2 C 0.647 -6.373 4.919 1.00 . A A . 435 TRP CH2 1 1 6 2388 1 1 3 TRP CZ2 C 0.768 -5.849 6.175 1.00 . A A . 435 TRP CZ2 1 1 6 2389 1 1 3 TRP CZ3 C 0.971 -5.620 3.785 1.00 . A A . 435 TRP CZ3 1 1 6 2390 1 1 3 TRP H H 5.094 -1.860 5.306 1.00 . A A . 435 TRP H 1 1 6 2391 1 1 3 TRP HA H 3.229 -2.326 3.072 1.00 . A A . 435 TRP HA 1 1 6 2392 1 1 3 TRP HB2 H 2.779 -0.542 5.478 1.00 . A A . 435 TRP HB2 1 1 6 2393 1 1 3 TRP HB3 H 1.604 -0.963 4.238 1.00 . A A . 435 TRP HB3 1 1 6 2394 1 1 3 TRP HD1 H 2.170 -1.725 7.658 1.00 . A A . 435 TRP HD1 1 1 6 2395 1 1 3 TRP HE1 H 1.299 -4.058 8.331 1.00 . A A . 435 TRP HE1 1 1 6 2396 1 1 3 TRP HE3 H 1.668 -3.761 3.002 1.00 . A A . 435 TRP HE3 1 1 6 2397 1 1 3 TRP HH2 H 0.297 -7.385 4.781 1.00 . A A . 435 TRP HH2 1 1 6 2398 1 1 3 TRP HZ2 H 0.514 -6.441 7.044 1.00 . A A . 435 TRP HZ2 1 1 6 2399 1 1 3 TRP HZ3 H 0.867 -6.073 2.808 1.00 . A A . 435 TRP HZ3 1 1 6 2400 1 1 3 TRP N N 4.670 -2.322 4.545 1.00 . A A . 435 TRP N 1 1 6 2401 1 1 3 TRP NE1 N 1.448 -3.772 7.396 1.00 . A A . 435 TRP NE1 1 1 6 2402 1 1 3 TRP O O 4.847 0.382 3.836 1.00 . A A . 435 TRP O 1 1 6 2403 1 1 4 THR C C 2.854 2.049 1.390 1.00 . A A . 436 THR C 1 1 6 2404 1 1 4 THR CA C 4.060 1.125 1.315 1.00 . A A . 436 THR CA 1 1 6 2405 1 1 4 THR CB C 4.473 0.927 -0.160 1.00 . A A . 436 THR CB 1 1 6 2406 1 1 4 THR CG2 C 4.692 2.269 -0.857 1.00 . A A . 436 THR CG2 1 1 6 2407 1 1 4 THR H H 3.265 -0.822 1.449 1.00 . A A . 436 THR H 1 1 6 2408 1 1 4 THR HA H 4.886 1.578 1.845 1.00 . A A . 436 THR HA 1 1 6 2409 1 1 4 THR HB H 3.678 0.400 -0.671 1.00 . A A . 436 THR HB 1 1 6 2410 1 1 4 THR HG1 H 5.533 -0.695 0.239 1.00 . A A . 436 THR HG1 1 1 6 2411 1 1 4 THR HG21 H 5.015 2.101 -1.875 1.00 . A A . 436 THR HG21 1 1 6 2412 1 1 4 THR HG22 H 5.446 2.834 -0.331 1.00 . A A . 436 THR HG22 1 1 6 2413 1 1 4 THR HG23 H 3.764 2.829 -0.864 1.00 . A A . 436 THR HG23 1 1 6 2414 1 1 4 THR N N 3.752 -0.136 1.955 1.00 . A A . 436 THR N 1 1 6 2415 1 1 4 THR O O 1.900 1.893 0.625 1.00 . A A . 436 THR O 1 1 6 2416 1 1 4 THR OG1 O 5.672 0.138 -0.230 1.00 . A A . 436 THR OG1 1 1 6 2417 1 1 5 GLU C C 2.154 5.156 1.555 1.00 . A A . 437 GLU C 1 1 6 2418 1 1 5 GLU CA C 1.813 3.965 2.427 1.00 . A A . 437 GLU CA 1 1 6 2419 1 1 5 GLU CB C 1.597 4.424 3.876 1.00 . A A . 437 GLU CB 1 1 6 2420 1 1 5 GLU CD C 2.812 2.832 5.431 1.00 . A A . 437 GLU CD 1 1 6 2421 1 1 5 GLU CG C 1.472 3.289 4.884 1.00 . A A . 437 GLU CG 1 1 6 2422 1 1 5 GLU H H 3.627 3.024 2.964 1.00 . A A . 437 GLU H 1 1 6 2423 1 1 5 GLU HA H 0.908 3.508 2.057 1.00 . A A . 437 GLU HA 1 1 6 2424 1 1 5 GLU HB2 H 2.431 5.043 4.169 1.00 . A A . 437 GLU HB2 1 1 6 2425 1 1 5 GLU HB3 H 0.693 5.015 3.920 1.00 . A A . 437 GLU HB3 1 1 6 2426 1 1 5 GLU HG2 H 0.863 3.626 5.710 1.00 . A A . 437 GLU HG2 1 1 6 2427 1 1 5 GLU HG3 H 0.991 2.449 4.404 1.00 . A A . 437 GLU HG3 1 1 6 2428 1 1 5 GLU N N 2.882 2.992 2.321 1.00 . A A . 437 GLU N 1 1 6 2429 1 1 5 GLU O O 2.922 6.038 1.947 1.00 . A A . 437 GLU O 1 1 6 2430 1 1 5 GLU OE1 O 3.858 3.248 4.886 1.00 . A A . 437 GLU OE1 1 1 6 2431 1 1 5 GLU OE2 O 2.823 2.071 6.423 1.00 . A A . 437 GLU OE2 1 1 6 2432 1 1 6 ARG C C 0.697 6.768 -1.218 1.00 . A A . 438 ARG C 1 1 6 2433 1 1 6 ARG CA C 1.969 6.143 -0.639 1.00 . A A . 438 ARG CA 1 1 6 2434 1 1 6 ARG CB C 2.804 5.483 -1.741 1.00 . A A . 438 ARG CB 1 1 6 2435 1 1 6 ARG CD C 4.324 5.832 -3.704 1.00 . A A . 438 ARG CD 1 1 6 2436 1 1 6 ARG CG C 3.178 6.407 -2.888 1.00 . A A . 438 ARG CG 1 1 6 2437 1 1 6 ARG CZ C 6.480 4.818 -3.024 1.00 . A A . 438 ARG CZ 1 1 6 2438 1 1 6 ARG H H 0.965 4.449 0.119 1.00 . A A . 438 ARG H 1 1 6 2439 1 1 6 ARG HA H 2.565 6.891 -0.141 1.00 . A A . 438 ARG HA 1 1 6 2440 1 1 6 ARG HB2 H 3.717 5.106 -1.304 1.00 . A A . 438 ARG HB2 1 1 6 2441 1 1 6 ARG HB3 H 2.245 4.652 -2.147 1.00 . A A . 438 ARG HB3 1 1 6 2442 1 1 6 ARG HD2 H 4.065 4.829 -4.013 1.00 . A A . 438 ARG HD2 1 1 6 2443 1 1 6 ARG HD3 H 4.477 6.450 -4.574 1.00 . A A . 438 ARG HD3 1 1 6 2444 1 1 6 ARG HE H 5.727 6.536 -2.298 1.00 . A A . 438 ARG HE 1 1 6 2445 1 1 6 ARG HG2 H 2.320 6.536 -3.532 1.00 . A A . 438 ARG HG2 1 1 6 2446 1 1 6 ARG HG3 H 3.477 7.363 -2.485 1.00 . A A . 438 ARG HG3 1 1 6 2447 1 1 6 ARG HH11 H 5.423 3.700 -4.355 1.00 . A A . 438 ARG HH11 1 1 6 2448 1 1 6 ARG HH12 H 6.964 3.044 -3.890 1.00 . A A . 438 ARG HH12 1 1 6 2449 1 1 6 ARG HH21 H 7.743 5.656 -1.670 1.00 . A A . 438 ARG HH21 1 1 6 2450 1 1 6 ARG HH22 H 8.285 4.155 -2.370 1.00 . A A . 438 ARG HH22 1 1 6 2451 1 1 6 ARG N N 1.622 5.147 0.349 1.00 . A A . 438 ARG N 1 1 6 2452 1 1 6 ARG NE N 5.565 5.786 -2.926 1.00 . A A . 438 ARG NE 1 1 6 2453 1 1 6 ARG NH1 N 6.275 3.774 -3.819 1.00 . A A . 438 ARG NH1 1 1 6 2454 1 1 6 ARG NH2 N 7.589 4.880 -2.299 1.00 . A A . 438 ARG NH2 1 1 6 2455 1 1 6 ARG O O -0.314 6.081 -1.366 1.00 . A A . 438 ARG O 1 1 6 2456 1 1 7 LYS C C -0.350 8.791 -3.610 1.00 . A A . 439 LYS C 1 1 6 2457 1 1 7 LYS CA C -0.436 8.714 -2.095 1.00 . A A . 439 LYS CA 1 1 6 2458 1 1 7 LYS CB C -0.586 10.115 -1.494 1.00 . A A . 439 LYS CB 1 1 6 2459 1 1 7 LYS CD C -0.974 11.521 0.556 1.00 . A A . 439 LYS CD 1 1 6 2460 1 1 7 LYS CE C -1.271 11.516 2.048 1.00 . A A . 439 LYS CE 1 1 6 2461 1 1 7 LYS CG C -0.879 10.108 -0.002 1.00 . A A . 439 LYS CG 1 1 6 2462 1 1 7 LYS H H 1.575 8.564 -1.498 1.00 . A A . 439 LYS H 1 1 6 2463 1 1 7 LYS HA H -1.298 8.122 -1.826 1.00 . A A . 439 LYS HA 1 1 6 2464 1 1 7 LYS HB2 H 0.331 10.664 -1.655 1.00 . A A . 439 LYS HB2 1 1 6 2465 1 1 7 LYS HB3 H -1.393 10.626 -1.995 1.00 . A A . 439 LYS HB3 1 1 6 2466 1 1 7 LYS HD2 H -0.036 12.026 0.389 1.00 . A A . 439 LYS HD2 1 1 6 2467 1 1 7 LYS HD3 H -1.765 12.049 0.044 1.00 . A A . 439 LYS HD3 1 1 6 2468 1 1 7 LYS HE2 H -0.518 10.925 2.547 1.00 . A A . 439 LYS HE2 1 1 6 2469 1 1 7 LYS HE3 H -1.227 12.533 2.411 1.00 . A A . 439 LYS HE3 1 1 6 2470 1 1 7 LYS HG2 H -1.817 9.600 0.169 1.00 . A A . 439 LYS HG2 1 1 6 2471 1 1 7 LYS HG3 H -0.084 9.582 0.506 1.00 . A A . 439 LYS HG3 1 1 6 2472 1 1 7 LYS HZ1 H -3.364 11.580 1.990 1.00 . A A . 439 LYS HZ1 1 1 6 2473 1 1 7 LYS HZ2 H -2.735 10.830 3.379 1.00 . A A . 439 LYS HZ2 1 1 6 2474 1 1 7 LYS HZ3 H -2.722 10.016 1.896 1.00 . A A . 439 LYS HZ3 1 1 6 2475 1 1 7 LYS N N 0.736 8.053 -1.565 1.00 . A A . 439 LYS N 1 1 6 2476 1 1 7 LYS NZ N -2.614 10.949 2.351 1.00 . A A . 439 LYS NZ 1 1 6 2477 1 1 7 LYS O O 0.623 9.304 -4.168 1.00 . A A . 439 LYS O 1 1 6 2478 1 1 8 THR C C -2.193 9.620 -6.109 1.00 . A A . 440 THR C 1 1 6 2479 1 1 8 THR CA C -1.459 8.345 -5.710 1.00 . A A . 440 THR CA 1 1 6 2480 1 1 8 THR CB C -2.168 7.111 -6.312 1.00 . A A . 440 THR CB 1 1 6 2481 1 1 8 THR CG2 C -3.604 6.996 -5.823 1.00 . A A . 440 THR CG2 1 1 6 2482 1 1 8 THR H H -2.065 7.800 -3.759 1.00 . A A . 440 THR H 1 1 6 2483 1 1 8 THR HA H -0.452 8.385 -6.104 1.00 . A A . 440 THR HA 1 1 6 2484 1 1 8 THR HB H -1.631 6.226 -6.006 1.00 . A A . 440 THR HB 1 1 6 2485 1 1 8 THR HG1 H -2.274 6.297 -8.106 1.00 . A A . 440 THR HG1 1 1 6 2486 1 1 8 THR HG21 H -4.070 6.132 -6.275 1.00 . A A . 440 THR HG21 1 1 6 2487 1 1 8 THR HG22 H -4.151 7.885 -6.102 1.00 . A A . 440 THR HG22 1 1 6 2488 1 1 8 THR HG23 H -3.612 6.890 -4.749 1.00 . A A . 440 THR HG23 1 1 6 2489 1 1 8 THR N N -1.365 8.270 -4.265 1.00 . A A . 440 THR N 1 1 6 2490 1 1 8 THR O O -3.035 10.118 -5.356 1.00 . A A . 440 THR O 1 1 6 2491 1 1 8 THR OG1 O -2.161 7.187 -7.742 1.00 . A A . 440 THR OG1 1 1 6 2492 1 1 9 ALA C C -3.838 11.564 -7.809 1.00 . A A . 441 ALA C 1 1 6 2493 1 1 9 ALA CA C -2.316 11.467 -7.720 1.00 . A A . 441 ALA CA 1 1 6 2494 1 1 9 ALA CB C -1.694 11.810 -9.062 1.00 . A A . 441 ALA CB 1 1 6 2495 1 1 9 ALA H H -1.270 9.631 -7.875 1.00 . A A . 441 ALA H 1 1 6 2496 1 1 9 ALA HA H -1.966 12.193 -7.000 1.00 . A A . 441 ALA HA 1 1 6 2497 1 1 9 ALA HB1 H -0.618 11.747 -8.989 1.00 . A A . 441 ALA HB1 1 1 6 2498 1 1 9 ALA HB2 H -1.978 12.813 -9.344 1.00 . A A . 441 ALA HB2 1 1 6 2499 1 1 9 ALA HB3 H -2.045 11.114 -9.810 1.00 . A A . 441 ALA HB3 1 1 6 2500 1 1 9 ALA N N -1.853 10.148 -7.280 1.00 . A A . 441 ALA N 1 1 6 2501 1 1 9 ALA O O -4.393 12.659 -7.884 1.00 . A A . 441 ALA O 1 1 6 2502 1 1 10 ASP C C -6.543 10.847 -6.463 1.00 . A A . 442 ASP C 1 1 6 2503 1 1 10 ASP CA C -5.974 10.421 -7.819 1.00 . A A . 442 ASP CA 1 1 6 2504 1 1 10 ASP CB C -6.507 9.041 -8.210 1.00 . A A . 442 ASP CB 1 1 6 2505 1 1 10 ASP CG C -8.015 9.025 -8.359 1.00 . A A . 442 ASP CG 1 1 6 2506 1 1 10 ASP H H -4.030 9.578 -7.754 1.00 . A A . 442 ASP H 1 1 6 2507 1 1 10 ASP HA H -6.288 11.139 -8.564 1.00 . A A . 442 ASP HA 1 1 6 2508 1 1 10 ASP HB2 H -6.067 8.745 -9.151 1.00 . A A . 442 ASP HB2 1 1 6 2509 1 1 10 ASP HB3 H -6.230 8.326 -7.447 1.00 . A A . 442 ASP HB3 1 1 6 2510 1 1 10 ASP N N -4.517 10.427 -7.790 1.00 . A A . 442 ASP N 1 1 6 2511 1 1 10 ASP O O -7.746 11.057 -6.314 1.00 . A A . 442 ASP O 1 1 6 2512 1 1 10 ASP OD1 O -8.539 9.738 -9.242 1.00 . A A . 442 ASP OD1 1 1 6 2513 1 1 10 ASP OD2 O -8.686 8.296 -7.603 1.00 . A A . 442 ASP OD2 1 1 6 2514 1 1 11 GLY C C -6.414 10.218 -3.272 1.00 . A A . 443 GLY C 1 1 6 2515 1 1 11 GLY CA C -6.082 11.399 -4.155 1.00 . A A . 443 GLY CA 1 1 6 2516 1 1 11 GLY H H -4.709 10.830 -5.662 1.00 . A A . 443 GLY H 1 1 6 2517 1 1 11 GLY HA2 H -5.287 11.968 -3.694 1.00 . A A . 443 GLY HA2 1 1 6 2518 1 1 11 GLY HA3 H -6.955 12.028 -4.242 1.00 . A A . 443 GLY HA3 1 1 6 2519 1 1 11 GLY N N -5.661 10.994 -5.481 1.00 . A A . 443 GLY N 1 1 6 2520 1 1 11 GLY O O -7.316 10.287 -2.440 1.00 . A A . 443 GLY O 1 1 6 2521 1 1 12 LYS C C -4.584 7.530 -1.976 1.00 . A A . 444 LYS C 1 1 6 2522 1 1 12 LYS CA C -5.885 7.941 -2.646 1.00 . A A . 444 LYS CA 1 1 6 2523 1 1 12 LYS CB C -6.399 6.775 -3.495 1.00 . A A . 444 LYS CB 1 1 6 2524 1 1 12 LYS CD C -8.369 5.627 -4.525 1.00 . A A . 444 LYS CD 1 1 6 2525 1 1 12 LYS CE C -9.792 5.757 -5.044 1.00 . A A . 444 LYS CE 1 1 6 2526 1 1 12 LYS CG C -7.803 6.958 -4.048 1.00 . A A . 444 LYS CG 1 1 6 2527 1 1 12 LYS H H -4.986 9.135 -4.138 1.00 . A A . 444 LYS H 1 1 6 2528 1 1 12 LYS HA H -6.612 8.175 -1.884 1.00 . A A . 444 LYS HA 1 1 6 2529 1 1 12 LYS HB2 H -5.729 6.637 -4.330 1.00 . A A . 444 LYS HB2 1 1 6 2530 1 1 12 LYS HB3 H -6.389 5.880 -2.890 1.00 . A A . 444 LYS HB3 1 1 6 2531 1 1 12 LYS HD2 H -7.743 5.248 -5.320 1.00 . A A . 444 LYS HD2 1 1 6 2532 1 1 12 LYS HD3 H -8.361 4.930 -3.700 1.00 . A A . 444 LYS HD3 1 1 6 2533 1 1 12 LYS HE2 H -10.256 4.781 -5.037 1.00 . A A . 444 LYS HE2 1 1 6 2534 1 1 12 LYS HE3 H -10.341 6.418 -4.389 1.00 . A A . 444 LYS HE3 1 1 6 2535 1 1 12 LYS HG2 H -8.441 7.354 -3.272 1.00 . A A . 444 LYS HG2 1 1 6 2536 1 1 12 LYS HG3 H -7.767 7.645 -4.880 1.00 . A A . 444 LYS HG3 1 1 6 2537 1 1 12 LYS HZ1 H -10.829 6.348 -6.755 1.00 . A A . 444 LYS HZ1 1 1 6 2538 1 1 12 LYS HZ2 H -9.306 5.683 -7.074 1.00 . A A . 444 LYS HZ2 1 1 6 2539 1 1 12 LYS HZ3 H -9.428 7.258 -6.461 1.00 . A A . 444 LYS HZ3 1 1 6 2540 1 1 12 LYS N N -5.685 9.133 -3.453 1.00 . A A . 444 LYS N 1 1 6 2541 1 1 12 LYS NZ N -9.842 6.299 -6.426 1.00 . A A . 444 LYS NZ 1 1 6 2542 1 1 12 LYS O O -3.545 7.417 -2.633 1.00 . A A . 444 LYS O 1 1 6 2543 1 1 13 THR C C -3.542 5.265 0.033 1.00 . A A . 445 THR C 1 1 6 2544 1 1 13 THR CA C -3.498 6.784 0.051 1.00 . A A . 445 THR CA 1 1 6 2545 1 1 13 THR CB C -3.491 7.270 1.512 1.00 . A A . 445 THR CB 1 1 6 2546 1 1 13 THR CG2 C -2.124 7.053 2.145 1.00 . A A . 445 THR CG2 1 1 6 2547 1 1 13 THR H H -5.479 7.463 -0.198 1.00 . A A . 445 THR H 1 1 6 2548 1 1 13 THR HA H -2.595 7.126 -0.437 1.00 . A A . 445 THR HA 1 1 6 2549 1 1 13 THR HB H -4.224 6.707 2.069 1.00 . A A . 445 THR HB 1 1 6 2550 1 1 13 THR HG1 H -4.611 8.779 2.121 1.00 . A A . 445 THR HG1 1 1 6 2551 1 1 13 THR HG21 H -1.378 7.594 1.583 1.00 . A A . 445 THR HG21 1 1 6 2552 1 1 13 THR HG22 H -1.887 6.000 2.137 1.00 . A A . 445 THR HG22 1 1 6 2553 1 1 13 THR HG23 H -2.138 7.411 3.164 1.00 . A A . 445 THR HG23 1 1 6 2554 1 1 13 THR N N -4.643 7.294 -0.676 1.00 . A A . 445 THR N 1 1 6 2555 1 1 13 THR O O -4.264 4.649 0.815 1.00 . A A . 445 THR O 1 1 6 2556 1 1 13 THR OG1 O -3.824 8.662 1.564 1.00 . A A . 445 THR OG1 1 1 6 2557 1 1 14 TYR C C -1.660 2.558 -0.432 1.00 . A A . 446 TYR C 1 1 6 2558 1 1 14 TYR CA C -2.868 3.225 -1.056 1.00 . A A . 446 TYR CA 1 1 6 2559 1 1 14 TYR CB C -2.991 2.853 -2.537 1.00 . A A . 446 TYR CB 1 1 6 2560 1 1 14 TYR CD1 C -1.275 4.258 -3.763 1.00 . A A . 446 TYR CD1 1 1 6 2561 1 1 14 TYR CD2 C -1.033 1.887 -3.799 1.00 . A A . 446 TYR CD2 1 1 6 2562 1 1 14 TYR CE1 C -0.149 4.386 -4.557 1.00 . A A . 446 TYR CE1 1 1 6 2563 1 1 14 TYR CE2 C 0.094 2.005 -4.584 1.00 . A A . 446 TYR CE2 1 1 6 2564 1 1 14 TYR CG C -1.735 3.008 -3.371 1.00 . A A . 446 TYR CG 1 1 6 2565 1 1 14 TYR CZ C 0.532 3.257 -4.963 1.00 . A A . 446 TYR CZ 1 1 6 2566 1 1 14 TYR H H -2.186 5.191 -1.435 1.00 . A A . 446 TYR H 1 1 6 2567 1 1 14 TYR HA H -3.749 2.878 -0.539 1.00 . A A . 446 TYR HA 1 1 6 2568 1 1 14 TYR HB2 H -3.293 1.818 -2.606 1.00 . A A . 446 TYR HB2 1 1 6 2569 1 1 14 TYR HB3 H -3.760 3.467 -2.983 1.00 . A A . 446 TYR HB3 1 1 6 2570 1 1 14 TYR HD1 H -1.808 5.138 -3.441 1.00 . A A . 446 TYR HD1 1 1 6 2571 1 1 14 TYR HD2 H -1.379 0.906 -3.501 1.00 . A A . 446 TYR HD2 1 1 6 2572 1 1 14 TYR HE1 H 0.194 5.366 -4.851 1.00 . A A . 446 TYR HE1 1 1 6 2573 1 1 14 TYR HE2 H 0.626 1.118 -4.901 1.00 . A A . 446 TYR HE2 1 1 6 2574 1 1 14 TYR HH H 1.505 2.880 -6.581 1.00 . A A . 446 TYR HH 1 1 6 2575 1 1 14 TYR N N -2.803 4.663 -0.883 1.00 . A A . 446 TYR N 1 1 6 2576 1 1 14 TYR O O -0.557 3.112 -0.428 1.00 . A A . 446 TYR O 1 1 6 2577 1 1 14 TYR OH O 1.646 3.376 -5.764 1.00 . A A . 446 TYR OH 1 1 6 2578 1 1 15 TYR C C -0.431 -0.577 -0.027 1.00 . A A . 447 TYR C 1 1 6 2579 1 1 15 TYR CA C -0.837 0.650 0.783 1.00 . A A . 447 TYR CA 1 1 6 2580 1 1 15 TYR CB C -1.328 0.264 2.185 1.00 . A A . 447 TYR CB 1 1 6 2581 1 1 15 TYR CD1 C -1.580 2.457 3.434 1.00 . A A . 447 TYR CD1 1 1 6 2582 1 1 15 TYR CD2 C -3.558 1.303 2.774 1.00 . A A . 447 TYR CD2 1 1 6 2583 1 1 15 TYR CE1 C -2.346 3.470 3.976 1.00 . A A . 447 TYR CE1 1 1 6 2584 1 1 15 TYR CE2 C -4.330 2.309 3.321 1.00 . A A . 447 TYR CE2 1 1 6 2585 1 1 15 TYR CG C -2.169 1.356 2.822 1.00 . A A . 447 TYR CG 1 1 6 2586 1 1 15 TYR CZ C -3.718 3.392 3.918 1.00 . A A . 447 TYR CZ 1 1 6 2587 1 1 15 TYR H H -2.757 0.948 -0.016 1.00 . A A . 447 TYR H 1 1 6 2588 1 1 15 TYR HA H 0.012 1.308 0.878 1.00 . A A . 447 TYR HA 1 1 6 2589 1 1 15 TYR HB2 H -1.931 -0.631 2.120 1.00 . A A . 447 TYR HB2 1 1 6 2590 1 1 15 TYR HB3 H -0.478 0.079 2.825 1.00 . A A . 447 TYR HB3 1 1 6 2591 1 1 15 TYR HD1 H -0.507 2.516 3.486 1.00 . A A . 447 TYR HD1 1 1 6 2592 1 1 15 TYR HD2 H -4.034 0.454 2.307 1.00 . A A . 447 TYR HD2 1 1 6 2593 1 1 15 TYR HE1 H -1.867 4.315 4.446 1.00 . A A . 447 TYR HE1 1 1 6 2594 1 1 15 TYR HE2 H -5.406 2.243 3.280 1.00 . A A . 447 TYR HE2 1 1 6 2595 1 1 15 TYR HH H -5.287 4.037 4.827 1.00 . A A . 447 TYR HH 1 1 6 2596 1 1 15 TYR N N -1.876 1.366 0.085 1.00 . A A . 447 TYR N 1 1 6 2597 1 1 15 TYR O O -1.129 -1.584 -0.055 1.00 . A A . 447 TYR O 1 1 6 2598 1 1 15 TYR OH O -4.485 4.408 4.448 1.00 . A A . 447 TYR OH 1 1 6 2599 1 1 16 TYR C C 2.061 -2.492 -0.723 1.00 . A A . 448 TYR C 1 1 6 2600 1 1 16 TYR CA C 1.153 -1.578 -1.542 1.00 . A A . 448 TYR CA 1 1 6 2601 1 1 16 TYR CB C 1.898 -1.042 -2.766 1.00 . A A . 448 TYR CB 1 1 6 2602 1 1 16 TYR CD1 C 1.649 -3.015 -4.326 1.00 . A A . 448 TYR CD1 1 1 6 2603 1 1 16 TYR CD2 C 3.850 -2.247 -3.827 1.00 . A A . 448 TYR CD2 1 1 6 2604 1 1 16 TYR CE1 C 2.173 -3.999 -5.143 1.00 . A A . 448 TYR CE1 1 1 6 2605 1 1 16 TYR CE2 C 4.381 -3.229 -4.642 1.00 . A A . 448 TYR CE2 1 1 6 2606 1 1 16 TYR CG C 2.477 -2.123 -3.655 1.00 . A A . 448 TYR CG 1 1 6 2607 1 1 16 TYR CZ C 3.539 -4.101 -5.297 1.00 . A A . 448 TYR CZ 1 1 6 2608 1 1 16 TYR H H 1.157 0.379 -0.755 1.00 . A A . 448 TYR H 1 1 6 2609 1 1 16 TYR HA H 0.289 -2.136 -1.873 1.00 . A A . 448 TYR HA 1 1 6 2610 1 1 16 TYR HB2 H 1.219 -0.453 -3.364 1.00 . A A . 448 TYR HB2 1 1 6 2611 1 1 16 TYR HB3 H 2.713 -0.416 -2.433 1.00 . A A . 448 TYR HB3 1 1 6 2612 1 1 16 TYR HD1 H 0.579 -2.931 -4.205 1.00 . A A . 448 TYR HD1 1 1 6 2613 1 1 16 TYR HD2 H 4.507 -1.564 -3.313 1.00 . A A . 448 TYR HD2 1 1 6 2614 1 1 16 TYR HE1 H 1.512 -4.682 -5.656 1.00 . A A . 448 TYR HE1 1 1 6 2615 1 1 16 TYR HE2 H 5.451 -3.311 -4.762 1.00 . A A . 448 TYR HE2 1 1 6 2616 1 1 16 TYR HH H 4.836 -5.460 -5.692 1.00 . A A . 448 TYR HH 1 1 6 2617 1 1 16 TYR N N 0.680 -0.474 -0.731 1.00 . A A . 448 TYR N 1 1 6 2618 1 1 16 TYR O O 3.002 -2.040 -0.069 1.00 . A A . 448 TYR O 1 1 6 2619 1 1 16 TYR OH O 4.063 -5.076 -6.111 1.00 . A A . 448 TYR OH 1 1 6 2620 1 1 17 ASN C C 3.657 -5.324 -0.792 1.00 . A A . 449 ASN C 1 1 6 2621 1 1 17 ASN CA C 2.459 -4.799 -0.008 1.00 . A A . 449 ASN CA 1 1 6 2622 1 1 17 ASN CB C 1.475 -5.946 0.294 1.00 . A A . 449 ASN CB 1 1 6 2623 1 1 17 ASN CG C 2.056 -7.078 1.129 1.00 . A A . 449 ASN CG 1 1 6 2624 1 1 17 ASN H H 1.046 -4.075 -1.389 1.00 . A A . 449 ASN H 1 1 6 2625 1 1 17 ASN HA H 2.795 -4.357 0.917 1.00 . A A . 449 ASN HA 1 1 6 2626 1 1 17 ASN HB2 H 0.629 -5.542 0.825 1.00 . A A . 449 ASN HB2 1 1 6 2627 1 1 17 ASN HB3 H 1.132 -6.360 -0.645 1.00 . A A . 449 ASN HB3 1 1 6 2628 1 1 17 ASN HD21 H 0.230 -7.654 1.669 1.00 . A A . 449 ASN HD21 1 1 6 2629 1 1 17 ASN HD22 H 1.536 -8.584 2.321 1.00 . A A . 449 ASN HD22 1 1 6 2630 1 1 17 ASN N N 1.766 -3.785 -0.786 1.00 . A A . 449 ASN N 1 1 6 2631 1 1 17 ASN ND2 N 1.189 -7.851 1.768 1.00 . A A . 449 ASN ND2 1 1 6 2632 1 1 17 ASN O O 3.500 -5.927 -1.855 1.00 . A A . 449 ASN O 1 1 6 2633 1 1 17 ASN OD1 O 3.261 -7.280 1.181 1.00 . A A . 449 ASN OD1 1 1 6 2634 1 1 18 ASN C C 6.597 -6.803 -0.276 1.00 . A A . 450 ASN C 1 1 6 2635 1 1 18 ASN CA C 6.080 -5.521 -0.920 1.00 . A A . 450 ASN CA 1 1 6 2636 1 1 18 ASN CB C 7.149 -4.419 -0.856 1.00 . A A . 450 ASN CB 1 1 6 2637 1 1 18 ASN CG C 7.450 -3.967 0.562 1.00 . A A . 450 ASN CG 1 1 6 2638 1 1 18 ASN H H 4.908 -4.602 0.588 1.00 . A A . 450 ASN H 1 1 6 2639 1 1 18 ASN HA H 5.848 -5.722 -1.955 1.00 . A A . 450 ASN HA 1 1 6 2640 1 1 18 ASN HB2 H 8.062 -4.789 -1.294 1.00 . A A . 450 ASN HB2 1 1 6 2641 1 1 18 ASN HB3 H 6.806 -3.565 -1.423 1.00 . A A . 450 ASN HB3 1 1 6 2642 1 1 18 ASN HD21 H 8.972 -5.250 0.691 1.00 . A A . 450 ASN HD21 1 1 6 2643 1 1 18 ASN HD22 H 8.674 -4.274 2.097 1.00 . A A . 450 ASN HD22 1 1 6 2644 1 1 18 ASN N N 4.851 -5.083 -0.266 1.00 . A A . 450 ASN N 1 1 6 2645 1 1 18 ASN ND2 N 8.465 -4.556 1.178 1.00 . A A . 450 ASN ND2 1 1 6 2646 1 1 18 ASN O O 7.636 -7.335 -0.663 1.00 . A A . 450 ASN O 1 1 6 2647 1 1 18 ASN OD1 O 6.789 -3.076 1.092 1.00 . A A . 450 ASN OD1 1 1 6 2648 1 1 19 ARG C C 5.588 -9.743 0.734 1.00 . A A . 451 ARG C 1 1 6 2649 1 1 19 ARG CA C 6.215 -8.520 1.400 1.00 . A A . 451 ARG CA 1 1 6 2650 1 1 19 ARG CB C 5.781 -8.458 2.867 1.00 . A A . 451 ARG CB 1 1 6 2651 1 1 19 ARG CD C 8.026 -7.745 3.721 1.00 . A A . 451 ARG CD 1 1 6 2652 1 1 19 ARG CG C 6.541 -7.435 3.691 1.00 . A A . 451 ARG CG 1 1 6 2653 1 1 19 ARG CZ C 10.089 -6.757 4.624 1.00 . A A . 451 ARG CZ 1 1 6 2654 1 1 19 ARG H H 5.028 -6.824 0.959 1.00 . A A . 451 ARG H 1 1 6 2655 1 1 19 ARG HA H 7.284 -8.613 1.361 1.00 . A A . 451 ARG HA 1 1 6 2656 1 1 19 ARG HB2 H 4.731 -8.211 2.909 1.00 . A A . 451 ARG HB2 1 1 6 2657 1 1 19 ARG HB3 H 5.930 -9.429 3.313 1.00 . A A . 451 ARG HB3 1 1 6 2658 1 1 19 ARG HD2 H 8.162 -8.755 4.076 1.00 . A A . 451 ARG HD2 1 1 6 2659 1 1 19 ARG HD3 H 8.417 -7.661 2.717 1.00 . A A . 451 ARG HD3 1 1 6 2660 1 1 19 ARG HE H 8.240 -6.261 5.193 1.00 . A A . 451 ARG HE 1 1 6 2661 1 1 19 ARG HG2 H 6.396 -6.457 3.257 1.00 . A A . 451 ARG HG2 1 1 6 2662 1 1 19 ARG HG3 H 6.159 -7.443 4.701 1.00 . A A . 451 ARG HG3 1 1 6 2663 1 1 19 ARG HH11 H 10.378 -8.177 3.203 1.00 . A A . 451 ARG HH11 1 1 6 2664 1 1 19 ARG HH12 H 11.828 -7.475 3.850 1.00 . A A . 451 ARG HH12 1 1 6 2665 1 1 19 ARG HH21 H 10.114 -5.334 6.074 1.00 . A A . 451 ARG HH21 1 1 6 2666 1 1 19 ARG HH22 H 11.680 -5.855 5.503 1.00 . A A . 451 ARG HH22 1 1 6 2667 1 1 19 ARG N N 5.853 -7.295 0.702 1.00 . A A . 451 ARG N 1 1 6 2668 1 1 19 ARG NE N 8.764 -6.837 4.591 1.00 . A A . 451 ARG NE 1 1 6 2669 1 1 19 ARG NH1 N 10.823 -7.531 3.829 1.00 . A A . 451 ARG NH1 1 1 6 2670 1 1 19 ARG NH2 N 10.677 -5.914 5.462 1.00 . A A . 451 ARG NH2 1 1 6 2671 1 1 19 ARG O O 6.235 -10.774 0.570 1.00 . A A . 451 ARG O 1 1 6 2672 1 1 20 THR C C 3.129 -10.422 -1.627 1.00 . A A . 452 THR C 1 1 6 2673 1 1 20 THR CA C 3.577 -10.739 -0.200 1.00 . A A . 452 THR CA 1 1 6 2674 1 1 20 THR CB C 2.341 -11.056 0.665 1.00 . A A . 452 THR CB 1 1 6 2675 1 1 20 THR CG2 C 1.845 -12.474 0.427 1.00 . A A . 452 THR CG2 1 1 6 2676 1 1 20 THR H H 3.862 -8.769 0.517 1.00 . A A . 452 THR H 1 1 6 2677 1 1 20 THR HA H 4.220 -11.607 -0.213 1.00 . A A . 452 THR HA 1 1 6 2678 1 1 20 THR HB H 1.552 -10.364 0.409 1.00 . A A . 452 THR HB 1 1 6 2679 1 1 20 THR HG1 H 3.546 -11.261 2.213 1.00 . A A . 452 THR HG1 1 1 6 2680 1 1 20 THR HG21 H 1.583 -12.592 -0.614 1.00 . A A . 452 THR HG21 1 1 6 2681 1 1 20 THR HG22 H 0.976 -12.659 1.039 1.00 . A A . 452 THR HG22 1 1 6 2682 1 1 20 THR HG23 H 2.624 -13.177 0.684 1.00 . A A . 452 THR HG23 1 1 6 2683 1 1 20 THR N N 4.323 -9.626 0.373 1.00 . A A . 452 THR N 1 1 6 2684 1 1 20 THR O O 2.483 -11.243 -2.280 1.00 . A A . 452 THR O 1 1 6 2685 1 1 20 THR OG1 O 2.672 -10.899 2.050 1.00 . A A . 452 THR OG1 1 1 6 2686 1 1 21 LEU C C 1.516 -8.665 -3.450 1.00 . A A . 453 LEU C 1 1 6 2687 1 1 21 LEU CA C 3.038 -8.740 -3.408 1.00 . A A . 453 LEU CA 1 1 6 2688 1 1 21 LEU CB C 3.568 -9.615 -4.550 1.00 . A A . 453 LEU CB 1 1 6 2689 1 1 21 LEU CD1 C 5.498 -10.641 -5.779 1.00 . A A . 453 LEU CD1 1 1 6 2690 1 1 21 LEU CD2 C 5.719 -8.349 -4.804 1.00 . A A . 453 LEU CD2 1 1 6 2691 1 1 21 LEU CG C 5.092 -9.726 -4.632 1.00 . A A . 453 LEU CG 1 1 6 2692 1 1 21 LEU H H 4.056 -8.653 -1.554 1.00 . A A . 453 LEU H 1 1 6 2693 1 1 21 LEU HA H 3.430 -7.738 -3.528 1.00 . A A . 453 LEU HA 1 1 6 2694 1 1 21 LEU HB2 H 3.160 -10.610 -4.430 1.00 . A A . 453 LEU HB2 1 1 6 2695 1 1 21 LEU HB3 H 3.208 -9.209 -5.484 1.00 . A A . 453 LEU HB3 1 1 6 2696 1 1 21 LEU HD11 H 5.157 -10.219 -6.713 1.00 . A A . 453 LEU HD11 1 1 6 2697 1 1 21 LEU HD12 H 5.051 -11.614 -5.640 1.00 . A A . 453 LEU HD12 1 1 6 2698 1 1 21 LEU HD13 H 6.573 -10.738 -5.799 1.00 . A A . 453 LEU HD13 1 1 6 2699 1 1 21 LEU HD21 H 5.357 -7.901 -5.718 1.00 . A A . 453 LEU HD21 1 1 6 2700 1 1 21 LEU HD22 H 6.793 -8.448 -4.853 1.00 . A A . 453 LEU HD22 1 1 6 2701 1 1 21 LEU HD23 H 5.453 -7.723 -3.967 1.00 . A A . 453 LEU HD23 1 1 6 2702 1 1 21 LEU HG H 5.463 -10.154 -3.713 1.00 . A A . 453 LEU HG 1 1 6 2703 1 1 21 LEU N N 3.480 -9.223 -2.100 1.00 . A A . 453 LEU N 1 1 6 2704 1 1 21 LEU O O 0.844 -9.528 -4.017 1.00 . A A . 453 LEU O 1 1 6 2705 1 1 22 GLU C C -0.875 -6.072 -2.694 1.00 . A A . 454 GLU C 1 1 6 2706 1 1 22 GLU CA C -0.454 -7.533 -2.597 1.00 . A A . 454 GLU CA 1 1 6 2707 1 1 22 GLU CB C -0.825 -8.096 -1.221 1.00 . A A . 454 GLU CB 1 1 6 2708 1 1 22 GLU CD C -2.603 -8.485 0.519 1.00 . A A . 454 GLU CD 1 1 6 2709 1 1 22 GLU CG C -2.306 -8.019 -0.889 1.00 . A A . 454 GLU CG 1 1 6 2710 1 1 22 GLU H H 1.570 -6.956 -2.428 1.00 . A A . 454 GLU H 1 1 6 2711 1 1 22 GLU HA H -0.950 -8.104 -3.365 1.00 . A A . 454 GLU HA 1 1 6 2712 1 1 22 GLU HB2 H -0.524 -9.132 -1.178 1.00 . A A . 454 GLU HB2 1 1 6 2713 1 1 22 GLU HB3 H -0.283 -7.546 -0.467 1.00 . A A . 454 GLU HB3 1 1 6 2714 1 1 22 GLU HG2 H -2.633 -6.995 -0.989 1.00 . A A . 454 GLU HG2 1 1 6 2715 1 1 22 GLU HG3 H -2.850 -8.642 -1.581 1.00 . A A . 454 GLU HG3 1 1 6 2716 1 1 22 GLU N N 0.982 -7.656 -2.789 1.00 . A A . 454 GLU N 1 1 6 2717 1 1 22 GLU O O -0.145 -5.182 -2.265 1.00 . A A . 454 GLU O 1 1 6 2718 1 1 22 GLU OE1 O -2.624 -9.712 0.748 1.00 . A A . 454 GLU OE1 1 1 6 2719 1 1 22 GLU OE2 O -2.819 -7.629 1.400 1.00 . A A . 454 GLU OE2 1 1 6 2720 1 1 23 SER C C -3.543 -4.307 -2.108 1.00 . A A . 455 SER C 1 1 6 2721 1 1 23 SER CA C -2.588 -4.488 -3.292 1.00 . A A . 455 SER CA 1 1 6 2722 1 1 23 SER CB C -3.294 -4.259 -4.634 1.00 . A A . 455 SER CB 1 1 6 2723 1 1 23 SER H H -2.562 -6.569 -3.635 1.00 . A A . 455 SER H 1 1 6 2724 1 1 23 SER HA H -1.768 -3.792 -3.193 1.00 . A A . 455 SER HA 1 1 6 2725 1 1 23 SER HB2 H -2.667 -4.634 -5.428 1.00 . A A . 455 SER HB2 1 1 6 2726 1 1 23 SER HB3 H -4.232 -4.792 -4.639 1.00 . A A . 455 SER HB3 1 1 6 2727 1 1 23 SER HG H -4.358 -2.807 -5.413 1.00 . A A . 455 SER HG 1 1 6 2728 1 1 23 SER N N -2.045 -5.827 -3.249 1.00 . A A . 455 SER N 1 1 6 2729 1 1 23 SER O O -4.681 -4.783 -2.131 1.00 . A A . 455 SER O 1 1 6 2730 1 1 23 SER OG O -3.549 -2.887 -4.876 1.00 . A A . 455 SER OG 1 1 6 2731 1 1 24 THR C C -4.327 -2.170 0.429 1.00 . A A . 456 THR C 1 1 6 2732 1 1 24 THR CA C -3.781 -3.581 0.205 1.00 . A A . 456 THR CA 1 1 6 2733 1 1 24 THR CB C -2.870 -3.974 1.385 1.00 . A A . 456 THR CB 1 1 6 2734 1 1 24 THR CG2 C -3.690 -4.317 2.617 1.00 . A A . 456 THR CG2 1 1 6 2735 1 1 24 THR H H -2.170 -3.240 -1.114 1.00 . A A . 456 THR H 1 1 6 2736 1 1 24 THR HA H -4.607 -4.278 0.164 1.00 . A A . 456 THR HA 1 1 6 2737 1 1 24 THR HB H -2.226 -3.138 1.618 1.00 . A A . 456 THR HB 1 1 6 2738 1 1 24 THR HG1 H -2.527 -5.928 1.232 1.00 . A A . 456 THR HG1 1 1 6 2739 1 1 24 THR HG21 H -4.281 -3.459 2.906 1.00 . A A . 456 THR HG21 1 1 6 2740 1 1 24 THR HG22 H -3.026 -4.588 3.425 1.00 . A A . 456 THR HG22 1 1 6 2741 1 1 24 THR HG23 H -4.345 -5.146 2.395 1.00 . A A . 456 THR HG23 1 1 6 2742 1 1 24 THR N N -3.051 -3.669 -1.050 1.00 . A A . 456 THR N 1 1 6 2743 1 1 24 THR O O -3.599 -1.258 0.803 1.00 . A A . 456 THR O 1 1 6 2744 1 1 24 THR OG1 O -2.058 -5.104 1.021 1.00 . A A . 456 THR OG1 1 1 6 2745 1 1 25 TRP C C -7.020 -0.570 1.596 1.00 . A A . 457 TRP C 1 1 6 2746 1 1 25 TRP CA C -6.212 -0.666 0.314 1.00 . A A . 457 TRP CA 1 1 6 2747 1 1 25 TRP CB C -7.043 -0.360 -0.937 1.00 . A A . 457 TRP CB 1 1 6 2748 1 1 25 TRP CD1 C -5.340 -1.236 -2.626 1.00 . A A . 457 TRP CD1 1 1 6 2749 1 1 25 TRP CD2 C -5.995 0.865 -3.024 1.00 . A A . 457 TRP CD2 1 1 6 2750 1 1 25 TRP CE2 C -5.032 0.496 -3.983 1.00 . A A . 457 TRP CE2 1 1 6 2751 1 1 25 TRP CE3 C -6.552 2.146 -3.091 1.00 . A A . 457 TRP CE3 1 1 6 2752 1 1 25 TRP CG C -6.165 -0.261 -2.150 1.00 . A A . 457 TRP CG 1 1 6 2753 1 1 25 TRP CH2 C -5.168 2.600 -5.034 1.00 . A A . 457 TRP CH2 1 1 6 2754 1 1 25 TRP CZ2 C -4.608 1.352 -4.989 1.00 . A A . 457 TRP CZ2 1 1 6 2755 1 1 25 TRP CZ3 C -6.135 2.999 -4.100 1.00 . A A . 457 TRP CZ3 1 1 6 2756 1 1 25 TRP H H -6.171 -2.756 -0.063 1.00 . A A . 457 TRP H 1 1 6 2757 1 1 25 TRP HA H -5.403 0.049 0.372 1.00 . A A . 457 TRP HA 1 1 6 2758 1 1 25 TRP HB2 H -7.763 -1.151 -1.096 1.00 . A A . 457 TRP HB2 1 1 6 2759 1 1 25 TRP HB3 H -7.557 0.581 -0.811 1.00 . A A . 457 TRP HB3 1 1 6 2760 1 1 25 TRP HD1 H -5.240 -2.214 -2.182 1.00 . A A . 457 TRP HD1 1 1 6 2761 1 1 25 TRP HE1 H -3.980 -1.303 -4.216 1.00 . A A . 457 TRP HE1 1 1 6 2762 1 1 25 TRP HE3 H -7.297 2.471 -2.380 1.00 . A A . 457 TRP HE3 1 1 6 2763 1 1 25 TRP HH2 H -4.872 3.297 -5.804 1.00 . A A . 457 TRP HH2 1 1 6 2764 1 1 25 TRP HZ2 H -3.849 1.060 -5.700 1.00 . A A . 457 TRP HZ2 1 1 6 2765 1 1 25 TRP HZ3 H -6.554 3.993 -4.170 1.00 . A A . 457 TRP HZ3 1 1 6 2766 1 1 25 TRP N N -5.611 -1.987 0.196 1.00 . A A . 457 TRP N 1 1 6 2767 1 1 25 TRP NE1 N -4.645 -0.781 -3.709 1.00 . A A . 457 TRP NE1 1 1 6 2768 1 1 25 TRP O O -7.700 0.420 1.858 1.00 . A A . 457 TRP O 1 1 6 2769 1 1 26 GLU C C -6.336 -1.514 4.765 1.00 . A A . 458 GLU C 1 1 6 2770 1 1 26 GLU CA C -7.460 -1.621 3.746 1.00 . A A . 458 GLU CA 1 1 6 2771 1 1 26 GLU CB C -8.247 -2.910 3.966 1.00 . A A . 458 GLU CB 1 1 6 2772 1 1 26 GLU CD C -10.531 -1.928 3.609 1.00 . A A . 458 GLU CD 1 1 6 2773 1 1 26 GLU CG C -9.533 -2.975 3.164 1.00 . A A . 458 GLU CG 1 1 6 2774 1 1 26 GLU H H -6.395 -2.388 2.101 1.00 . A A . 458 GLU H 1 1 6 2775 1 1 26 GLU HA H -8.119 -0.772 3.849 1.00 . A A . 458 GLU HA 1 1 6 2776 1 1 26 GLU HB2 H -7.628 -3.750 3.685 1.00 . A A . 458 GLU HB2 1 1 6 2777 1 1 26 GLU HB3 H -8.496 -2.993 5.013 1.00 . A A . 458 GLU HB3 1 1 6 2778 1 1 26 GLU HG2 H -9.303 -2.814 2.121 1.00 . A A . 458 GLU HG2 1 1 6 2779 1 1 26 GLU HG3 H -9.975 -3.952 3.290 1.00 . A A . 458 GLU HG3 1 1 6 2780 1 1 26 GLU N N -6.896 -1.606 2.410 1.00 . A A . 458 GLU N 1 1 6 2781 1 1 26 GLU O O -5.347 -2.241 4.675 1.00 . A A . 458 GLU O 1 1 6 2782 1 1 26 GLU OE1 O -11.031 -2.033 4.749 1.00 . A A . 458 GLU OE1 1 1 6 2783 1 1 26 GLU OE2 O -10.807 -0.989 2.833 1.00 . A A . 458 GLU OE2 1 1 6 2784 1 1 27 LYS C C -5.376 -1.530 7.732 1.00 . A A . 459 LYS C 1 1 6 2785 1 1 27 LYS CA C -5.432 -0.400 6.713 1.00 . A A . 459 LYS CA 1 1 6 2786 1 1 27 LYS CB C -5.620 0.931 7.433 1.00 . A A . 459 LYS CB 1 1 6 2787 1 1 27 LYS CD C -4.951 3.367 7.529 1.00 . A A . 459 LYS CD 1 1 6 2788 1 1 27 LYS CE C -4.147 3.151 8.808 1.00 . A A . 459 LYS CE 1 1 6 2789 1 1 27 LYS CG C -5.035 2.106 6.679 1.00 . A A . 459 LYS CG 1 1 6 2790 1 1 27 LYS H H -7.313 -0.099 5.780 1.00 . A A . 459 LYS H 1 1 6 2791 1 1 27 LYS HA H -4.493 -0.369 6.178 1.00 . A A . 459 LYS HA 1 1 6 2792 1 1 27 LYS HB2 H -6.676 1.108 7.575 1.00 . A A . 459 LYS HB2 1 1 6 2793 1 1 27 LYS HB3 H -5.139 0.877 8.399 1.00 . A A . 459 LYS HB3 1 1 6 2794 1 1 27 LYS HD2 H -4.472 4.140 6.946 1.00 . A A . 459 LYS HD2 1 1 6 2795 1 1 27 LYS HD3 H -5.951 3.680 7.789 1.00 . A A . 459 LYS HD3 1 1 6 2796 1 1 27 LYS HE2 H -3.349 2.455 8.603 1.00 . A A . 459 LYS HE2 1 1 6 2797 1 1 27 LYS HE3 H -3.727 4.098 9.114 1.00 . A A . 459 LYS HE3 1 1 6 2798 1 1 27 LYS HG2 H -4.040 1.845 6.351 1.00 . A A . 459 LYS HG2 1 1 6 2799 1 1 27 LYS HG3 H -5.654 2.307 5.816 1.00 . A A . 459 LYS HG3 1 1 6 2800 1 1 27 LYS HZ1 H -5.549 3.376 10.346 1.00 . A A . 459 LYS HZ1 1 1 6 2801 1 1 27 LYS HZ2 H -4.375 2.190 10.653 1.00 . A A . 459 LYS HZ2 1 1 6 2802 1 1 27 LYS HZ3 H -5.631 1.878 9.565 1.00 . A A . 459 LYS HZ3 1 1 6 2803 1 1 27 LYS N N -6.480 -0.616 5.726 1.00 . A A . 459 LYS N 1 1 6 2804 1 1 27 LYS NZ N -4.982 2.611 9.919 1.00 . A A . 459 LYS NZ 1 1 6 2805 1 1 27 LYS O O -6.382 -1.866 8.355 1.00 . A A . 459 LYS O 1 1 6 2806 1 1 28 PRO C C -3.919 -2.590 10.329 1.00 . A A . 460 PRO C 1 1 6 2807 1 1 28 PRO CA C -3.967 -3.163 8.913 1.00 . A A . 460 PRO CA 1 1 6 2808 1 1 28 PRO CB C -2.612 -3.757 8.518 1.00 . A A . 460 PRO CB 1 1 6 2809 1 1 28 PRO CD C -2.966 -1.827 7.137 1.00 . A A . 460 PRO CD 1 1 6 2810 1 1 28 PRO CG C -1.903 -2.659 7.801 1.00 . A A . 460 PRO CG 1 1 6 2811 1 1 28 PRO HA H -4.727 -3.931 8.863 1.00 . A A . 460 PRO HA 1 1 6 2812 1 1 28 PRO HB2 H -2.076 -4.058 9.406 1.00 . A A . 460 PRO HB2 1 1 6 2813 1 1 28 PRO HB3 H -2.764 -4.611 7.876 1.00 . A A . 460 PRO HB3 1 1 6 2814 1 1 28 PRO HD2 H -2.714 -0.778 7.203 1.00 . A A . 460 PRO HD2 1 1 6 2815 1 1 28 PRO HD3 H -3.084 -2.121 6.104 1.00 . A A . 460 PRO HD3 1 1 6 2816 1 1 28 PRO HG2 H -1.349 -2.060 8.507 1.00 . A A . 460 PRO HG2 1 1 6 2817 1 1 28 PRO HG3 H -1.238 -3.075 7.060 1.00 . A A . 460 PRO HG3 1 1 6 2818 1 1 28 PRO N N -4.189 -2.123 7.910 1.00 . A A . 460 PRO N 1 1 6 2819 1 1 28 PRO O O -4.907 -2.751 11.073 1.00 . A A . 460 PRO O 1 1 6 2820 1 1 28 PRO OXT O -2.900 -1.963 10.691 1.00 . A A . 460 PRO OXT 1 1 7 2821 1 1 1 SER C C 8.025 -0.686 5.716 1.00 . A A . 433 SER C 1 1 7 2822 1 1 1 SER CA C 8.067 0.684 6.389 1.00 . A A . 433 SER CA 1 1 7 2823 1 1 1 SER CB C 9.115 0.690 7.509 1.00 . A A . 433 SER CB 1 1 7 2824 1 1 1 SER H1 H 6.411 0.313 7.611 1.00 . A A . 433 SER H1 1 1 7 2825 1 1 1 SER H2 H 6.037 1.123 6.168 1.00 . A A . 433 SER H2 1 1 7 2826 1 1 1 SER H3 H 6.788 1.958 7.433 1.00 . A A . 433 SER H3 1 1 7 2827 1 1 1 SER HA H 8.337 1.426 5.650 1.00 . A A . 433 SER HA 1 1 7 2828 1 1 1 SER HB2 H 9.128 1.660 7.982 1.00 . A A . 433 SER HB2 1 1 7 2829 1 1 1 SER HB3 H 8.857 -0.062 8.241 1.00 . A A . 433 SER HB3 1 1 7 2830 1 1 1 SER HG H 10.816 1.233 6.691 1.00 . A A . 433 SER HG 1 1 7 2831 1 1 1 SER N N 6.735 1.040 6.937 1.00 . A A . 433 SER N 1 1 7 2832 1 1 1 SER O O 8.656 -0.909 4.681 1.00 . A A . 433 SER O 1 1 7 2833 1 1 1 SER OG O 10.411 0.409 7.007 1.00 . A A . 433 SER OG 1 1 7 2834 1 1 2 GLU C C 5.968 -2.899 4.758 1.00 . A A . 434 GLU C 1 1 7 2835 1 1 2 GLU CA C 7.086 -2.937 5.788 1.00 . A A . 434 GLU CA 1 1 7 2836 1 1 2 GLU CB C 6.740 -3.924 6.916 1.00 . A A . 434 GLU CB 1 1 7 2837 1 1 2 GLU CD C 5.687 -2.359 8.641 1.00 . A A . 434 GLU CD 1 1 7 2838 1 1 2 GLU CG C 5.490 -3.554 7.720 1.00 . A A . 434 GLU CG 1 1 7 2839 1 1 2 GLU H H 6.852 -1.374 7.183 1.00 . A A . 434 GLU H 1 1 7 2840 1 1 2 GLU HA H 8.002 -3.250 5.305 1.00 . A A . 434 GLU HA 1 1 7 2841 1 1 2 GLU HB2 H 6.583 -4.901 6.484 1.00 . A A . 434 GLU HB2 1 1 7 2842 1 1 2 GLU HB3 H 7.576 -3.975 7.598 1.00 . A A . 434 GLU HB3 1 1 7 2843 1 1 2 GLU HG2 H 4.692 -3.324 7.030 1.00 . A A . 434 GLU HG2 1 1 7 2844 1 1 2 GLU HG3 H 5.205 -4.407 8.320 1.00 . A A . 434 GLU HG3 1 1 7 2845 1 1 2 GLU N N 7.289 -1.603 6.328 1.00 . A A . 434 GLU N 1 1 7 2846 1 1 2 GLU O O 5.750 -3.845 4.003 1.00 . A A . 434 GLU O 1 1 7 2847 1 1 2 GLU OE1 O 5.552 -1.200 8.172 1.00 . A A . 434 GLU OE1 1 1 7 2848 1 1 2 GLU OE2 O 5.989 -2.568 9.834 1.00 . A A . 434 GLU OE2 1 1 7 2849 1 1 3 TRP C C 4.560 -0.370 2.940 1.00 . A A . 435 TRP C 1 1 7 2850 1 1 3 TRP CA C 4.179 -1.533 3.838 1.00 . A A . 435 TRP CA 1 1 7 2851 1 1 3 TRP CB C 2.884 -1.214 4.596 1.00 . A A . 435 TRP CB 1 1 7 2852 1 1 3 TRP CD1 C 2.221 -2.271 6.844 1.00 . A A . 435 TRP CD1 1 1 7 2853 1 1 3 TRP CD2 C 2.170 -3.670 5.101 1.00 . A A . 435 TRP CD2 1 1 7 2854 1 1 3 TRP CE2 C 1.790 -4.380 6.253 1.00 . A A . 435 TRP CE2 1 1 7 2855 1 1 3 TRP CE3 C 2.213 -4.342 3.880 1.00 . A A . 435 TRP CE3 1 1 7 2856 1 1 3 TRP CG C 2.438 -2.326 5.495 1.00 . A A . 435 TRP CG 1 1 7 2857 1 1 3 TRP CH2 C 1.511 -6.364 5.003 1.00 . A A . 435 TRP CH2 1 1 7 2858 1 1 3 TRP CZ2 C 1.459 -5.733 6.217 1.00 . A A . 435 TRP CZ2 1 1 7 2859 1 1 3 TRP CZ3 C 1.883 -5.679 3.846 1.00 . A A . 435 TRP CZ3 1 1 7 2860 1 1 3 TRP H H 5.463 -1.109 5.437 1.00 . A A . 435 TRP H 1 1 7 2861 1 1 3 TRP HA H 4.033 -2.418 3.235 1.00 . A A . 435 TRP HA 1 1 7 2862 1 1 3 TRP HB2 H 3.036 -0.333 5.204 1.00 . A A . 435 TRP HB2 1 1 7 2863 1 1 3 TRP HB3 H 2.096 -1.022 3.884 1.00 . A A . 435 TRP HB3 1 1 7 2864 1 1 3 TRP HD1 H 2.340 -1.381 7.445 1.00 . A A . 435 TRP HD1 1 1 7 2865 1 1 3 TRP HE1 H 1.612 -3.723 8.239 1.00 . A A . 435 TRP HE1 1 1 7 2866 1 1 3 TRP HE3 H 2.498 -3.831 2.971 1.00 . A A . 435 TRP HE3 1 1 7 2867 1 1 3 TRP HH2 H 1.267 -7.414 4.920 1.00 . A A . 435 TRP HH2 1 1 7 2868 1 1 3 TRP HZ2 H 1.169 -6.274 7.105 1.00 . A A . 435 TRP HZ2 1 1 7 2869 1 1 3 TRP HZ3 H 1.913 -6.213 2.908 1.00 . A A . 435 TRP HZ3 1 1 7 2870 1 1 3 TRP N N 5.254 -1.788 4.770 1.00 . A A . 435 TRP N 1 1 7 2871 1 1 3 TRP NE1 N 1.828 -3.504 7.308 1.00 . A A . 435 TRP NE1 1 1 7 2872 1 1 3 TRP O O 5.286 0.532 3.368 1.00 . A A . 435 TRP O 1 1 7 2873 1 1 4 THR C C 3.245 1.790 1.020 1.00 . A A . 436 THR C 1 1 7 2874 1 1 4 THR CA C 4.319 0.742 0.818 1.00 . A A . 436 THR CA 1 1 7 2875 1 1 4 THR CB C 4.334 0.303 -0.661 1.00 . A A . 436 THR CB 1 1 7 2876 1 1 4 THR CG2 C 4.583 1.490 -1.591 1.00 . A A . 436 THR CG2 1 1 7 2877 1 1 4 THR H H 3.510 -1.120 1.410 1.00 . A A . 436 THR H 1 1 7 2878 1 1 4 THR HA H 5.282 1.164 1.068 1.00 . A A . 436 THR HA 1 1 7 2879 1 1 4 THR HB H 3.370 -0.123 -0.900 1.00 . A A . 436 THR HB 1 1 7 2880 1 1 4 THR HG1 H 5.101 -1.493 -0.370 1.00 . A A . 436 THR HG1 1 1 7 2881 1 1 4 THR HG21 H 5.529 1.949 -1.347 1.00 . A A . 436 THR HG21 1 1 7 2882 1 1 4 THR HG22 H 3.790 2.217 -1.469 1.00 . A A . 436 THR HG22 1 1 7 2883 1 1 4 THR HG23 H 4.600 1.150 -2.617 1.00 . A A . 436 THR HG23 1 1 7 2884 1 1 4 THR N N 4.058 -0.364 1.717 1.00 . A A . 436 THR N 1 1 7 2885 1 1 4 THR O O 2.177 1.741 0.413 1.00 . A A . 436 THR O 1 1 7 2886 1 1 4 THR OG1 O 5.340 -0.698 -0.863 1.00 . A A . 436 THR OG1 1 1 7 2887 1 1 5 GLU C C 2.827 4.952 1.388 1.00 . A A . 437 GLU C 1 1 7 2888 1 1 5 GLU CA C 2.608 3.750 2.291 1.00 . A A . 437 GLU CA 1 1 7 2889 1 1 5 GLU CB C 2.812 4.114 3.764 1.00 . A A . 437 GLU CB 1 1 7 2890 1 1 5 GLU CD C 3.473 3.027 5.960 1.00 . A A . 437 GLU CD 1 1 7 2891 1 1 5 GLU CG C 2.635 2.925 4.700 1.00 . A A . 437 GLU CG 1 1 7 2892 1 1 5 GLU H H 4.412 2.676 2.364 1.00 . A A . 437 GLU H 1 1 7 2893 1 1 5 GLU HA H 1.606 3.377 2.148 1.00 . A A . 437 GLU HA 1 1 7 2894 1 1 5 GLU HB2 H 3.811 4.506 3.893 1.00 . A A . 437 GLU HB2 1 1 7 2895 1 1 5 GLU HB3 H 2.097 4.874 4.040 1.00 . A A . 437 GLU HB3 1 1 7 2896 1 1 5 GLU HG2 H 1.596 2.865 4.986 1.00 . A A . 437 GLU HG2 1 1 7 2897 1 1 5 GLU HG3 H 2.912 2.025 4.172 1.00 . A A . 437 GLU HG3 1 1 7 2898 1 1 5 GLU N N 3.536 2.706 1.923 1.00 . A A . 437 GLU N 1 1 7 2899 1 1 5 GLU O O 3.658 5.820 1.666 1.00 . A A . 437 GLU O 1 1 7 2900 1 1 5 GLU OE1 O 3.305 4.006 6.717 1.00 . A A . 437 GLU OE1 1 1 7 2901 1 1 5 GLU OE2 O 4.295 2.112 6.210 1.00 . A A . 437 GLU OE2 1 1 7 2902 1 1 6 ARG C C 0.961 6.517 -1.203 1.00 . A A . 438 ARG C 1 1 7 2903 1 1 6 ARG CA C 2.317 5.964 -0.749 1.00 . A A . 438 ARG CA 1 1 7 2904 1 1 6 ARG CB C 3.059 5.322 -1.928 1.00 . A A . 438 ARG CB 1 1 7 2905 1 1 6 ARG CD C 4.285 5.606 -4.104 1.00 . A A . 438 ARG CD 1 1 7 2906 1 1 6 ARG CG C 3.464 6.298 -3.023 1.00 . A A . 438 ARG CG 1 1 7 2907 1 1 6 ARG CZ C 6.379 4.299 -4.282 1.00 . A A . 438 ARG CZ 1 1 7 2908 1 1 6 ARG H H 1.420 4.275 0.144 1.00 . A A . 438 ARG H 1 1 7 2909 1 1 6 ARG HA H 2.925 6.747 -0.325 1.00 . A A . 438 ARG HA 1 1 7 2910 1 1 6 ARG HB2 H 3.954 4.846 -1.556 1.00 . A A . 438 ARG HB2 1 1 7 2911 1 1 6 ARG HB3 H 2.422 4.569 -2.369 1.00 . A A . 438 ARG HB3 1 1 7 2912 1 1 6 ARG HD2 H 3.702 4.795 -4.512 1.00 . A A . 438 ARG HD2 1 1 7 2913 1 1 6 ARG HD3 H 4.501 6.321 -4.886 1.00 . A A . 438 ARG HD3 1 1 7 2914 1 1 6 ARG HE H 5.793 5.315 -2.655 1.00 . A A . 438 ARG HE 1 1 7 2915 1 1 6 ARG HG2 H 2.574 6.713 -3.470 1.00 . A A . 438 ARG HG2 1 1 7 2916 1 1 6 ARG HG3 H 4.055 7.089 -2.587 1.00 . A A . 438 ARG HG3 1 1 7 2917 1 1 6 ARG HH11 H 5.214 4.232 -5.937 1.00 . A A . 438 ARG HH11 1 1 7 2918 1 1 6 ARG HH12 H 6.707 3.356 -6.052 1.00 . A A . 438 ARG HH12 1 1 7 2919 1 1 6 ARG HH21 H 7.756 4.155 -2.795 1.00 . A A . 438 ARG HH21 1 1 7 2920 1 1 6 ARG HH22 H 8.153 3.305 -4.263 1.00 . A A . 438 ARG HH22 1 1 7 2921 1 1 6 ARG N N 2.113 4.963 0.278 1.00 . A A . 438 ARG N 1 1 7 2922 1 1 6 ARG NE N 5.546 5.072 -3.585 1.00 . A A . 438 ARG NE 1 1 7 2923 1 1 6 ARG NH1 N 6.073 3.932 -5.522 1.00 . A A . 438 ARG NH1 1 1 7 2924 1 1 6 ARG NH2 N 7.518 3.886 -3.735 1.00 . A A . 438 ARG NH2 1 1 7 2925 1 1 6 ARG O O -0.020 5.775 -1.242 1.00 . A A . 438 ARG O 1 1 7 2926 1 1 7 LYS C C -0.274 8.836 -3.433 1.00 . A A . 439 LYS C 1 1 7 2927 1 1 7 LYS CA C -0.371 8.366 -1.994 1.00 . A A . 439 LYS CA 1 1 7 2928 1 1 7 LYS CB C -0.795 9.511 -1.070 1.00 . A A . 439 LYS CB 1 1 7 2929 1 1 7 LYS CD C -2.661 11.049 -0.362 1.00 . A A . 439 LYS CD 1 1 7 2930 1 1 7 LYS CE C -1.691 12.159 0.008 1.00 . A A . 439 LYS CE 1 1 7 2931 1 1 7 LYS CG C -2.115 10.157 -1.464 1.00 . A A . 439 LYS CG 1 1 7 2932 1 1 7 LYS H H 1.684 8.372 -1.535 1.00 . A A . 439 LYS H 1 1 7 2933 1 1 7 LYS HA H -1.111 7.587 -1.944 1.00 . A A . 439 LYS HA 1 1 7 2934 1 1 7 LYS HB2 H -0.894 9.130 -0.064 1.00 . A A . 439 LYS HB2 1 1 7 2935 1 1 7 LYS HB3 H -0.030 10.273 -1.083 1.00 . A A . 439 LYS HB3 1 1 7 2936 1 1 7 LYS HD2 H -3.585 11.494 -0.702 1.00 . A A . 439 LYS HD2 1 1 7 2937 1 1 7 LYS HD3 H -2.855 10.444 0.513 1.00 . A A . 439 LYS HD3 1 1 7 2938 1 1 7 LYS HE2 H -0.749 11.717 0.297 1.00 . A A . 439 LYS HE2 1 1 7 2939 1 1 7 LYS HE3 H -1.542 12.792 -0.854 1.00 . A A . 439 LYS HE3 1 1 7 2940 1 1 7 LYS HG2 H -1.959 10.754 -2.351 1.00 . A A . 439 LYS HG2 1 1 7 2941 1 1 7 LYS HG3 H -2.835 9.380 -1.675 1.00 . A A . 439 LYS HG3 1 1 7 2942 1 1 7 LYS HZ1 H -1.456 13.625 1.475 1.00 . A A . 439 LYS HZ1 1 1 7 2943 1 1 7 LYS HZ2 H -2.509 12.373 1.916 1.00 . A A . 439 LYS HZ2 1 1 7 2944 1 1 7 LYS HZ3 H -3.017 13.558 0.818 1.00 . A A . 439 LYS HZ3 1 1 7 2945 1 1 7 LYS N N 0.886 7.798 -1.558 1.00 . A A . 439 LYS N 1 1 7 2946 1 1 7 LYS NZ N -2.204 12.984 1.131 1.00 . A A . 439 LYS NZ 1 1 7 2947 1 1 7 LYS O O 0.593 9.637 -3.784 1.00 . A A . 439 LYS O 1 1 7 2948 1 1 8 THR C C -2.140 9.937 -5.826 1.00 . A A . 440 THR C 1 1 7 2949 1 1 8 THR CA C -1.233 8.716 -5.652 1.00 . A A . 440 THR CA 1 1 7 2950 1 1 8 THR CB C -1.736 7.540 -6.527 1.00 . A A . 440 THR CB 1 1 7 2951 1 1 8 THR CG2 C -3.138 7.110 -6.124 1.00 . A A . 440 THR CG2 1 1 7 2952 1 1 8 THR H H -1.819 7.677 -3.908 1.00 . A A . 440 THR H 1 1 7 2953 1 1 8 THR HA H -0.232 8.974 -5.968 1.00 . A A . 440 THR HA 1 1 7 2954 1 1 8 THR HB H -1.070 6.702 -6.382 1.00 . A A . 440 THR HB 1 1 7 2955 1 1 8 THR HG1 H -1.764 7.090 -8.454 1.00 . A A . 440 THR HG1 1 1 7 2956 1 1 8 THR HG21 H -3.455 6.287 -6.749 1.00 . A A . 440 THR HG21 1 1 7 2957 1 1 8 THR HG22 H -3.819 7.938 -6.248 1.00 . A A . 440 THR HG22 1 1 7 2958 1 1 8 THR HG23 H -3.137 6.797 -5.089 1.00 . A A . 440 THR HG23 1 1 7 2959 1 1 8 THR N N -1.178 8.339 -4.253 1.00 . A A . 440 THR N 1 1 7 2960 1 1 8 THR O O -3.083 10.138 -5.049 1.00 . A A . 440 THR O 1 1 7 2961 1 1 8 THR OG1 O -1.725 7.900 -7.913 1.00 . A A . 440 THR OG1 1 1 7 2962 1 1 9 ALA C C -4.007 11.827 -7.403 1.00 . A A . 441 ALA C 1 1 7 2963 1 1 9 ALA CA C -2.534 12.025 -7.056 1.00 . A A . 441 ALA CA 1 1 7 2964 1 1 9 ALA CB C -1.836 12.818 -8.150 1.00 . A A . 441 ALA CB 1 1 7 2965 1 1 9 ALA H H -1.127 10.492 -7.463 1.00 . A A . 441 ALA H 1 1 7 2966 1 1 9 ALA HA H -2.470 12.597 -6.140 1.00 . A A . 441 ALA HA 1 1 7 2967 1 1 9 ALA HB1 H -0.800 12.963 -7.883 1.00 . A A . 441 ALA HB1 1 1 7 2968 1 1 9 ALA HB2 H -2.317 13.779 -8.262 1.00 . A A . 441 ALA HB2 1 1 7 2969 1 1 9 ALA HB3 H -1.894 12.275 -9.082 1.00 . A A . 441 ALA HB3 1 1 7 2970 1 1 9 ALA N N -1.840 10.755 -6.836 1.00 . A A . 441 ALA N 1 1 7 2971 1 1 9 ALA O O -4.749 12.795 -7.575 1.00 . A A . 441 ALA O 1 1 7 2972 1 1 10 ASP C C -6.627 10.499 -6.439 1.00 . A A . 442 ASP C 1 1 7 2973 1 1 10 ASP CA C -5.828 10.244 -7.720 1.00 . A A . 442 ASP CA 1 1 7 2974 1 1 10 ASP CB C -5.958 8.779 -8.158 1.00 . A A . 442 ASP CB 1 1 7 2975 1 1 10 ASP CG C -7.211 8.509 -8.967 1.00 . A A . 442 ASP CG 1 1 7 2976 1 1 10 ASP H H -3.774 9.846 -7.418 1.00 . A A . 442 ASP H 1 1 7 2977 1 1 10 ASP HA H -6.203 10.886 -8.504 1.00 . A A . 442 ASP HA 1 1 7 2978 1 1 10 ASP HB2 H -5.104 8.517 -8.764 1.00 . A A . 442 ASP HB2 1 1 7 2979 1 1 10 ASP HB3 H -5.976 8.152 -7.280 1.00 . A A . 442 ASP HB3 1 1 7 2980 1 1 10 ASP N N -4.427 10.572 -7.497 1.00 . A A . 442 ASP N 1 1 7 2981 1 1 10 ASP O O -7.853 10.379 -6.416 1.00 . A A . 442 ASP O 1 1 7 2982 1 1 10 ASP OD1 O -7.321 9.046 -10.090 1.00 . A A . 442 ASP OD1 1 1 7 2983 1 1 10 ASP OD2 O -8.072 7.731 -8.507 1.00 . A A . 442 ASP OD2 1 1 7 2984 1 1 11 GLY C C -6.746 10.009 -3.207 1.00 . A A . 443 GLY C 1 1 7 2985 1 1 11 GLY CA C -6.539 11.204 -4.112 1.00 . A A . 443 GLY CA 1 1 7 2986 1 1 11 GLY H H -4.928 10.858 -5.440 1.00 . A A . 443 GLY H 1 1 7 2987 1 1 11 GLY HA2 H -5.916 11.925 -3.602 1.00 . A A . 443 GLY HA2 1 1 7 2988 1 1 11 GLY HA3 H -7.498 11.656 -4.318 1.00 . A A . 443 GLY HA3 1 1 7 2989 1 1 11 GLY N N -5.907 10.846 -5.370 1.00 . A A . 443 GLY N 1 1 7 2990 1 1 11 GLY O O -7.717 9.949 -2.453 1.00 . A A . 443 GLY O 1 1 7 2991 1 1 12 LYS C C -4.638 7.350 -1.980 1.00 . A A . 444 LYS C 1 1 7 2992 1 1 12 LYS CA C -5.974 7.812 -2.538 1.00 . A A . 444 LYS CA 1 1 7 2993 1 1 12 LYS CB C -6.560 6.745 -3.467 1.00 . A A . 444 LYS CB 1 1 7 2994 1 1 12 LYS CD C -8.317 6.402 -5.238 1.00 . A A . 444 LYS CD 1 1 7 2995 1 1 12 LYS CE C -9.676 6.866 -5.737 1.00 . A A . 444 LYS CE 1 1 7 2996 1 1 12 LYS CG C -7.975 7.065 -3.920 1.00 . A A . 444 LYS CG 1 1 7 2997 1 1 12 LYS H H -5.026 9.203 -3.816 1.00 . A A . 444 LYS H 1 1 7 2998 1 1 12 LYS HA H -6.657 7.982 -1.720 1.00 . A A . 444 LYS HA 1 1 7 2999 1 1 12 LYS HB2 H -5.932 6.661 -4.342 1.00 . A A . 444 LYS HB2 1 1 7 3000 1 1 12 LYS HB3 H -6.576 5.797 -2.950 1.00 . A A . 444 LYS HB3 1 1 7 3001 1 1 12 LYS HD2 H -7.565 6.662 -5.968 1.00 . A A . 444 LYS HD2 1 1 7 3002 1 1 12 LYS HD3 H -8.337 5.330 -5.101 1.00 . A A . 444 LYS HD3 1 1 7 3003 1 1 12 LYS HE2 H -10.440 6.455 -5.093 1.00 . A A . 444 LYS HE2 1 1 7 3004 1 1 12 LYS HE3 H -9.710 7.946 -5.691 1.00 . A A . 444 LYS HE3 1 1 7 3005 1 1 12 LYS HG2 H -8.668 6.720 -3.170 1.00 . A A . 444 LYS HG2 1 1 7 3006 1 1 12 LYS HG3 H -8.069 8.135 -4.034 1.00 . A A . 444 LYS HG3 1 1 7 3007 1 1 12 LYS HZ1 H -9.197 6.801 -7.767 1.00 . A A . 444 LYS HZ1 1 1 7 3008 1 1 12 LYS HZ2 H -10.862 6.797 -7.451 1.00 . A A . 444 LYS HZ2 1 1 7 3009 1 1 12 LYS HZ3 H -9.948 5.390 -7.191 1.00 . A A . 444 LYS HZ3 1 1 7 3010 1 1 12 LYS N N -5.827 9.060 -3.270 1.00 . A A . 444 LYS N 1 1 7 3011 1 1 12 LYS NZ N -9.941 6.432 -7.131 1.00 . A A . 444 LYS NZ 1 1 7 3012 1 1 12 LYS O O -3.646 7.264 -2.708 1.00 . A A . 444 LYS O 1 1 7 3013 1 1 13 THR C C -3.506 4.981 -0.127 1.00 . A A . 445 THR C 1 1 7 3014 1 1 13 THR CA C -3.442 6.503 -0.050 1.00 . A A . 445 THR CA 1 1 7 3015 1 1 13 THR CB C -3.338 6.930 1.430 1.00 . A A . 445 THR CB 1 1 7 3016 1 1 13 THR CG2 C -2.012 6.477 2.021 1.00 . A A . 445 THR CG2 1 1 7 3017 1 1 13 THR H H -5.423 7.217 -0.149 1.00 . A A . 445 THR H 1 1 7 3018 1 1 13 THR HA H -2.571 6.858 -0.573 1.00 . A A . 445 THR HA 1 1 7 3019 1 1 13 THR HB H -4.141 6.463 1.983 1.00 . A A . 445 THR HB 1 1 7 3020 1 1 13 THR HG1 H -3.630 8.588 2.477 1.00 . A A . 445 THR HG1 1 1 7 3021 1 1 13 THR HG21 H -1.989 6.708 3.075 1.00 . A A . 445 THR HG21 1 1 7 3022 1 1 13 THR HG22 H -1.204 6.991 1.523 1.00 . A A . 445 THR HG22 1 1 7 3023 1 1 13 THR HG23 H -1.903 5.412 1.879 1.00 . A A . 445 THR HG23 1 1 7 3024 1 1 13 THR N N -4.619 7.060 -0.688 1.00 . A A . 445 THR N 1 1 7 3025 1 1 13 THR O O -4.426 4.368 0.420 1.00 . A A . 445 THR O 1 1 7 3026 1 1 13 THR OG1 O -3.453 8.358 1.551 1.00 . A A . 445 THR OG1 1 1 7 3027 1 1 14 TYR C C -1.387 2.289 -0.326 1.00 . A A . 446 TYR C 1 1 7 3028 1 1 14 TYR CA C -2.585 2.928 -1.000 1.00 . A A . 446 TYR CA 1 1 7 3029 1 1 14 TYR CB C -2.628 2.564 -2.486 1.00 . A A . 446 TYR CB 1 1 7 3030 1 1 14 TYR CD1 C -0.890 4.003 -3.637 1.00 . A A . 446 TYR CD1 1 1 7 3031 1 1 14 TYR CD2 C -0.561 1.643 -3.596 1.00 . A A . 446 TYR CD2 1 1 7 3032 1 1 14 TYR CE1 C 0.282 4.157 -4.354 1.00 . A A . 446 TYR CE1 1 1 7 3033 1 1 14 TYR CE2 C 0.614 1.787 -4.308 1.00 . A A . 446 TYR CE2 1 1 7 3034 1 1 14 TYR CG C -1.330 2.745 -3.245 1.00 . A A . 446 TYR CG 1 1 7 3035 1 1 14 TYR CZ C 1.031 3.047 -4.687 1.00 . A A . 446 TYR CZ 1 1 7 3036 1 1 14 TYR H H -1.810 4.883 -1.197 1.00 . A A . 446 TYR H 1 1 7 3037 1 1 14 TYR HA H -3.483 2.558 -0.525 1.00 . A A . 446 TYR HA 1 1 7 3038 1 1 14 TYR HB2 H -2.912 1.529 -2.578 1.00 . A A . 446 TYR HB2 1 1 7 3039 1 1 14 TYR HB3 H -3.378 3.176 -2.968 1.00 . A A . 446 TYR HB3 1 1 7 3040 1 1 14 TYR HD1 H -1.477 4.871 -3.372 1.00 . A A . 446 TYR HD1 1 1 7 3041 1 1 14 TYR HD2 H -0.892 0.658 -3.299 1.00 . A A . 446 TYR HD2 1 1 7 3042 1 1 14 TYR HE1 H 0.606 5.142 -4.649 1.00 . A A . 446 TYR HE1 1 1 7 3043 1 1 14 TYR HE2 H 1.195 0.914 -4.567 1.00 . A A . 446 TYR HE2 1 1 7 3044 1 1 14 TYR HH H 2.153 2.642 -6.202 1.00 . A A . 446 TYR HH 1 1 7 3045 1 1 14 TYR N N -2.556 4.367 -0.820 1.00 . A A . 446 TYR N 1 1 7 3046 1 1 14 TYR O O -0.318 2.896 -0.232 1.00 . A A . 446 TYR O 1 1 7 3047 1 1 14 TYR OH O 2.196 3.198 -5.407 1.00 . A A . 446 TYR OH 1 1 7 3048 1 1 15 TYR C C -0.193 -0.924 0.068 1.00 . A A . 447 TYR C 1 1 7 3049 1 1 15 TYR CA C -0.532 0.345 0.836 1.00 . A A . 447 TYR CA 1 1 7 3050 1 1 15 TYR CB C -0.992 0.018 2.265 1.00 . A A . 447 TYR CB 1 1 7 3051 1 1 15 TYR CD1 C -1.068 2.171 3.594 1.00 . A A . 447 TYR CD1 1 1 7 3052 1 1 15 TYR CD2 C -3.121 1.266 2.791 1.00 . A A . 447 TYR CD2 1 1 7 3053 1 1 15 TYR CE1 C -1.748 3.243 4.136 1.00 . A A . 447 TYR CE1 1 1 7 3054 1 1 15 TYR CE2 C -3.808 2.331 3.338 1.00 . A A . 447 TYR CE2 1 1 7 3055 1 1 15 TYR CG C -1.740 1.167 2.910 1.00 . A A . 447 TYR CG 1 1 7 3056 1 1 15 TYR CZ C -3.117 3.319 4.006 1.00 . A A . 447 TYR CZ 1 1 7 3057 1 1 15 TYR H H -2.444 0.625 -0.002 1.00 . A A . 447 TYR H 1 1 7 3058 1 1 15 TYR HA H 0.343 0.979 0.880 1.00 . A A . 447 TYR HA 1 1 7 3059 1 1 15 TYR HB2 H -1.650 -0.839 2.242 1.00 . A A . 447 TYR HB2 1 1 7 3060 1 1 15 TYR HB3 H -0.131 -0.206 2.878 1.00 . A A . 447 TYR HB3 1 1 7 3061 1 1 15 TYR HD1 H 0.000 2.109 3.699 1.00 . A A . 447 TYR HD1 1 1 7 3062 1 1 15 TYR HD2 H -3.660 0.485 2.271 1.00 . A A . 447 TYR HD2 1 1 7 3063 1 1 15 TYR HE1 H -1.205 4.012 4.667 1.00 . A A . 447 TYR HE1 1 1 7 3064 1 1 15 TYR HE2 H -4.882 2.389 3.236 1.00 . A A . 447 TYR HE2 1 1 7 3065 1 1 15 TYR HH H -4.659 4.109 4.844 1.00 . A A . 447 TYR HH 1 1 7 3066 1 1 15 TYR N N -1.573 1.065 0.135 1.00 . A A . 447 TYR N 1 1 7 3067 1 1 15 TYR O O -0.927 -1.903 0.109 1.00 . A A . 447 TYR O 1 1 7 3068 1 1 15 TYR OH O -3.794 4.396 4.533 1.00 . A A . 447 TYR OH 1 1 7 3069 1 1 16 TYR C C 2.194 -2.984 -0.646 1.00 . A A . 448 TYR C 1 1 7 3070 1 1 16 TYR CA C 1.289 -2.048 -1.458 1.00 . A A . 448 TYR CA 1 1 7 3071 1 1 16 TYR CB C 2.008 -1.599 -2.735 1.00 . A A . 448 TYR CB 1 1 7 3072 1 1 16 TYR CD1 C 1.553 -3.455 -4.385 1.00 . A A . 448 TYR CD1 1 1 7 3073 1 1 16 TYR CD2 C 3.800 -3.126 -3.659 1.00 . A A . 448 TYR CD2 1 1 7 3074 1 1 16 TYR CE1 C 1.961 -4.507 -5.182 1.00 . A A . 448 TYR CE1 1 1 7 3075 1 1 16 TYR CE2 C 4.215 -4.176 -4.456 1.00 . A A . 448 TYR CE2 1 1 7 3076 1 1 16 TYR CG C 2.462 -2.747 -3.612 1.00 . A A . 448 TYR CG 1 1 7 3077 1 1 16 TYR CZ C 3.292 -4.864 -5.214 1.00 . A A . 448 TYR CZ 1 1 7 3078 1 1 16 TYR H H 1.400 -0.060 -0.752 1.00 . A A . 448 TYR H 1 1 7 3079 1 1 16 TYR HA H 0.389 -2.574 -1.734 1.00 . A A . 448 TYR HA 1 1 7 3080 1 1 16 TYR HB2 H 1.340 -0.983 -3.319 1.00 . A A . 448 TYR HB2 1 1 7 3081 1 1 16 TYR HB3 H 2.880 -1.021 -2.466 1.00 . A A . 448 TYR HB3 1 1 7 3082 1 1 16 TYR HD1 H 0.512 -3.172 -4.359 1.00 . A A . 448 TYR HD1 1 1 7 3083 1 1 16 TYR HD2 H 4.522 -2.586 -3.063 1.00 . A A . 448 TYR HD2 1 1 7 3084 1 1 16 TYR HE1 H 1.237 -5.046 -5.775 1.00 . A A . 448 TYR HE1 1 1 7 3085 1 1 16 TYR HE2 H 5.258 -4.456 -4.481 1.00 . A A . 448 TYR HE2 1 1 7 3086 1 1 16 TYR HH H 3.286 -5.839 -6.877 1.00 . A A . 448 TYR HH 1 1 7 3087 1 1 16 TYR N N 0.895 -0.893 -0.675 1.00 . A A . 448 TYR N 1 1 7 3088 1 1 16 TYR O O 3.196 -2.561 -0.064 1.00 . A A . 448 TYR O 1 1 7 3089 1 1 16 TYR OH O 3.702 -5.911 -6.005 1.00 . A A . 448 TYR OH 1 1 7 3090 1 1 17 ASN C C 3.574 -5.902 -0.923 1.00 . A A . 449 ASN C 1 1 7 3091 1 1 17 ASN CA C 2.562 -5.308 0.047 1.00 . A A . 449 ASN CA 1 1 7 3092 1 1 17 ASN CB C 1.577 -6.391 0.519 1.00 . A A . 449 ASN CB 1 1 7 3093 1 1 17 ASN CG C 2.222 -7.570 1.235 1.00 . A A . 449 ASN CG 1 1 7 3094 1 1 17 ASN H H 1.000 -4.516 -1.108 1.00 . A A . 449 ASN H 1 1 7 3095 1 1 17 ASN HA H 3.074 -4.883 0.898 1.00 . A A . 449 ASN HA 1 1 7 3096 1 1 17 ASN HB2 H 0.868 -5.943 1.196 1.00 . A A . 449 ASN HB2 1 1 7 3097 1 1 17 ASN HB3 H 1.043 -6.770 -0.342 1.00 . A A . 449 ASN HB3 1 1 7 3098 1 1 17 ASN HD21 H 0.479 -8.027 2.080 1.00 . A A . 449 ASN HD21 1 1 7 3099 1 1 17 ASN HD22 H 1.815 -9.050 2.491 1.00 . A A . 449 ASN HD22 1 1 7 3100 1 1 17 ASN N N 1.820 -4.257 -0.627 1.00 . A A . 449 ASN N 1 1 7 3101 1 1 17 ASN ND2 N 1.429 -8.288 2.012 1.00 . A A . 449 ASN ND2 1 1 7 3102 1 1 17 ASN O O 3.199 -6.564 -1.890 1.00 . A A . 449 ASN O 1 1 7 3103 1 1 17 ASN OD1 O 3.404 -7.859 1.066 1.00 . A A . 449 ASN OD1 1 1 7 3104 1 1 18 ASN C C 6.418 -7.479 -1.153 1.00 . A A . 450 ASN C 1 1 7 3105 1 1 18 ASN CA C 5.895 -6.118 -1.582 1.00 . A A . 450 ASN CA 1 1 7 3106 1 1 18 ASN CB C 7.040 -5.097 -1.643 1.00 . A A . 450 ASN CB 1 1 7 3107 1 1 18 ASN CG C 7.785 -4.949 -0.325 1.00 . A A . 450 ASN CG 1 1 7 3108 1 1 18 ASN H H 5.102 -5.206 0.158 1.00 . A A . 450 ASN H 1 1 7 3109 1 1 18 ASN HA H 5.454 -6.211 -2.564 1.00 . A A . 450 ASN HA 1 1 7 3110 1 1 18 ASN HB2 H 7.748 -5.411 -2.396 1.00 . A A . 450 ASN HB2 1 1 7 3111 1 1 18 ASN HB3 H 6.638 -4.134 -1.917 1.00 . A A . 450 ASN HB3 1 1 7 3112 1 1 18 ASN HD21 H 9.429 -4.401 -1.300 1.00 . A A . 450 ASN HD21 1 1 7 3113 1 1 18 ASN HD22 H 9.558 -4.467 0.425 1.00 . A A . 450 ASN HD22 1 1 7 3114 1 1 18 ASN N N 4.849 -5.669 -0.670 1.00 . A A . 450 ASN N 1 1 7 3115 1 1 18 ASN ND2 N 9.051 -4.566 -0.407 1.00 . A A . 450 ASN ND2 1 1 7 3116 1 1 18 ASN O O 7.275 -8.072 -1.810 1.00 . A A . 450 ASN O 1 1 7 3117 1 1 18 ASN OD1 O 7.224 -5.159 0.751 1.00 . A A . 450 ASN OD1 1 1 7 3118 1 1 19 ARG C C 5.501 -10.385 -0.212 1.00 . A A . 451 ARG C 1 1 7 3119 1 1 19 ARG CA C 6.277 -9.269 0.479 1.00 . A A . 451 ARG CA 1 1 7 3120 1 1 19 ARG CB C 6.045 -9.340 1.993 1.00 . A A . 451 ARG CB 1 1 7 3121 1 1 19 ARG CD C 6.447 -8.312 4.258 1.00 . A A . 451 ARG CD 1 1 7 3122 1 1 19 ARG CG C 6.562 -8.127 2.752 1.00 . A A . 451 ARG CG 1 1 7 3123 1 1 19 ARG CZ C 4.531 -8.327 5.817 1.00 . A A . 451 ARG CZ 1 1 7 3124 1 1 19 ARG H H 5.200 -7.446 0.425 1.00 . A A . 451 ARG H 1 1 7 3125 1 1 19 ARG HA H 7.325 -9.399 0.281 1.00 . A A . 451 ARG HA 1 1 7 3126 1 1 19 ARG HB2 H 4.984 -9.428 2.180 1.00 . A A . 451 ARG HB2 1 1 7 3127 1 1 19 ARG HB3 H 6.542 -10.218 2.380 1.00 . A A . 451 ARG HB3 1 1 7 3128 1 1 19 ARG HD2 H 7.146 -9.076 4.566 1.00 . A A . 451 ARG HD2 1 1 7 3129 1 1 19 ARG HD3 H 6.701 -7.379 4.742 1.00 . A A . 451 ARG HD3 1 1 7 3130 1 1 19 ARG HE H 4.606 -9.315 4.080 1.00 . A A . 451 ARG HE 1 1 7 3131 1 1 19 ARG HG2 H 7.599 -7.973 2.498 1.00 . A A . 451 ARG HG2 1 1 7 3132 1 1 19 ARG HG3 H 5.985 -7.261 2.460 1.00 . A A . 451 ARG HG3 1 1 7 3133 1 1 19 ARG HH11 H 6.062 -7.135 6.392 1.00 . A A . 451 ARG HH11 1 1 7 3134 1 1 19 ARG HH12 H 4.713 -7.184 7.489 1.00 . A A . 451 ARG HH12 1 1 7 3135 1 1 19 ARG HH21 H 2.854 -9.428 5.517 1.00 . A A . 451 ARG HH21 1 1 7 3136 1 1 19 ARG HH22 H 2.884 -8.513 6.997 1.00 . A A . 451 ARG HH22 1 1 7 3137 1 1 19 ARG N N 5.882 -7.973 -0.049 1.00 . A A . 451 ARG N 1 1 7 3138 1 1 19 ARG NE N 5.101 -8.710 4.675 1.00 . A A . 451 ARG NE 1 1 7 3139 1 1 19 ARG NH1 N 5.156 -7.485 6.629 1.00 . A A . 451 ARG NH1 1 1 7 3140 1 1 19 ARG NH2 N 3.328 -8.790 6.135 1.00 . A A . 451 ARG NH2 1 1 7 3141 1 1 19 ARG O O 6.045 -11.451 -0.494 1.00 . A A . 451 ARG O 1 1 7 3142 1 1 20 THR C C 2.753 -10.654 -2.383 1.00 . A A . 452 THR C 1 1 7 3143 1 1 20 THR CA C 3.345 -11.146 -1.054 1.00 . A A . 452 THR CA 1 1 7 3144 1 1 20 THR CB C 2.210 -11.524 -0.077 1.00 . A A . 452 THR CB 1 1 7 3145 1 1 20 THR CG2 C 1.513 -12.808 -0.507 1.00 . A A . 452 THR CG2 1 1 7 3146 1 1 20 THR H H 3.842 -9.272 -0.204 1.00 . A A . 452 THR H 1 1 7 3147 1 1 20 THR HA H 3.937 -12.030 -1.242 1.00 . A A . 452 THR HA 1 1 7 3148 1 1 20 THR HB H 1.485 -10.723 -0.055 1.00 . A A . 452 THR HB 1 1 7 3149 1 1 20 THR HG1 H 3.566 -12.229 1.179 1.00 . A A . 452 THR HG1 1 1 7 3150 1 1 20 THR HG21 H 0.725 -13.042 0.192 1.00 . A A . 452 THR HG21 1 1 7 3151 1 1 20 THR HG22 H 2.228 -13.614 -0.528 1.00 . A A . 452 THR HG22 1 1 7 3152 1 1 20 THR HG23 H 1.091 -12.674 -1.493 1.00 . A A . 452 THR HG23 1 1 7 3153 1 1 20 THR N N 4.218 -10.142 -0.454 1.00 . A A . 452 THR N 1 1 7 3154 1 1 20 THR O O 1.984 -11.367 -3.035 1.00 . A A . 452 THR O 1 1 7 3155 1 1 20 THR OG1 O 2.752 -11.707 1.239 1.00 . A A . 452 THR OG1 1 1 7 3156 1 1 21 LEU C C 1.106 -8.504 -3.847 1.00 . A A . 453 LEU C 1 1 7 3157 1 1 21 LEU CA C 2.597 -8.803 -3.998 1.00 . A A . 453 LEU CA 1 1 7 3158 1 1 21 LEU CB C 2.841 -9.699 -5.220 1.00 . A A . 453 LEU CB 1 1 7 3159 1 1 21 LEU CD1 C 4.422 -10.907 -6.739 1.00 . A A . 453 LEU CD1 1 1 7 3160 1 1 21 LEU CD2 C 5.156 -8.801 -5.616 1.00 . A A . 453 LEU CD2 1 1 7 3161 1 1 21 LEU CG C 4.306 -10.056 -5.487 1.00 . A A . 453 LEU CG 1 1 7 3162 1 1 21 LEU H H 3.759 -8.931 -2.228 1.00 . A A . 453 LEU H 1 1 7 3163 1 1 21 LEU HA H 3.124 -7.870 -4.137 1.00 . A A . 453 LEU HA 1 1 7 3164 1 1 21 LEU HB2 H 2.289 -10.617 -5.082 1.00 . A A . 453 LEU HB2 1 1 7 3165 1 1 21 LEU HB3 H 2.454 -9.195 -6.093 1.00 . A A . 453 LEU HB3 1 1 7 3166 1 1 21 LEU HD11 H 5.460 -11.146 -6.915 1.00 . A A . 453 LEU HD11 1 1 7 3167 1 1 21 LEU HD12 H 4.030 -10.361 -7.584 1.00 . A A . 453 LEU HD12 1 1 7 3168 1 1 21 LEU HD13 H 3.860 -11.820 -6.608 1.00 . A A . 453 LEU HD13 1 1 7 3169 1 1 21 LEU HD21 H 4.799 -8.211 -6.445 1.00 . A A . 453 LEU HD21 1 1 7 3170 1 1 21 LEU HD22 H 6.185 -9.079 -5.787 1.00 . A A . 453 LEU HD22 1 1 7 3171 1 1 21 LEU HD23 H 5.085 -8.224 -4.706 1.00 . A A . 453 LEU HD23 1 1 7 3172 1 1 21 LEU HG H 4.686 -10.634 -4.656 1.00 . A A . 453 LEU HG 1 1 7 3173 1 1 21 LEU N N 3.116 -9.429 -2.774 1.00 . A A . 453 LEU N 1 1 7 3174 1 1 21 LEU O O 0.351 -8.496 -4.818 1.00 . A A . 453 LEU O 1 1 7 3175 1 1 22 GLU C C -0.906 -6.387 -2.462 1.00 . A A . 454 GLU C 1 1 7 3176 1 1 22 GLU CA C -0.672 -7.885 -2.297 1.00 . A A . 454 GLU CA 1 1 7 3177 1 1 22 GLU CB C -0.947 -8.291 -0.844 1.00 . A A . 454 GLU CB 1 1 7 3178 1 1 22 GLU CD C -2.435 -7.910 1.163 1.00 . A A . 454 GLU CD 1 1 7 3179 1 1 22 GLU CG C -2.339 -7.931 -0.348 1.00 . A A . 454 GLU CG 1 1 7 3180 1 1 22 GLU H H 1.384 -8.155 -1.914 1.00 . A A . 454 GLU H 1 1 7 3181 1 1 22 GLU HA H -1.320 -8.436 -2.961 1.00 . A A . 454 GLU HA 1 1 7 3182 1 1 22 GLU HB2 H -0.826 -9.361 -0.752 1.00 . A A . 454 GLU HB2 1 1 7 3183 1 1 22 GLU HB3 H -0.224 -7.803 -0.206 1.00 . A A . 454 GLU HB3 1 1 7 3184 1 1 22 GLU HG2 H -2.599 -6.953 -0.723 1.00 . A A . 454 GLU HG2 1 1 7 3185 1 1 22 GLU HG3 H -3.039 -8.659 -0.728 1.00 . A A . 454 GLU HG3 1 1 7 3186 1 1 22 GLU N N 0.713 -8.194 -2.624 1.00 . A A . 454 GLU N 1 1 7 3187 1 1 22 GLU O O 0.000 -5.595 -2.250 1.00 . A A . 454 GLU O 1 1 7 3188 1 1 22 GLU OE1 O -1.611 -8.574 1.828 1.00 . A A . 454 GLU OE1 1 1 7 3189 1 1 22 GLU OE2 O -3.335 -7.219 1.692 1.00 . A A . 454 GLU OE2 1 1 7 3190 1 1 23 SER C C -3.445 -4.232 -1.832 1.00 . A A . 455 SER C 1 1 7 3191 1 1 23 SER CA C -2.422 -4.579 -2.915 1.00 . A A . 455 SER CA 1 1 7 3192 1 1 23 SER CB C -2.928 -4.212 -4.317 1.00 . A A . 455 SER CB 1 1 7 3193 1 1 23 SER H H -2.789 -6.658 -3.070 1.00 . A A . 455 SER H 1 1 7 3194 1 1 23 SER HA H -1.511 -4.029 -2.717 1.00 . A A . 455 SER HA 1 1 7 3195 1 1 23 SER HB2 H -2.322 -4.716 -5.054 1.00 . A A . 455 SER HB2 1 1 7 3196 1 1 23 SER HB3 H -3.957 -4.525 -4.420 1.00 . A A . 455 SER HB3 1 1 7 3197 1 1 23 SER HG H -2.129 -2.642 -5.169 1.00 . A A . 455 SER HG 1 1 7 3198 1 1 23 SER N N -2.105 -5.993 -2.842 1.00 . A A . 455 SER N 1 1 7 3199 1 1 23 SER O O -4.629 -4.554 -1.952 1.00 . A A . 455 SER O 1 1 7 3200 1 1 23 SER OG O -2.846 -2.816 -4.550 1.00 . A A . 455 SER OG 1 1 7 3201 1 1 24 THR C C -4.346 -1.898 0.334 1.00 . A A . 456 THR C 1 1 7 3202 1 1 24 THR CA C -3.787 -3.319 0.408 1.00 . A A . 456 THR CA 1 1 7 3203 1 1 24 THR CB C -2.954 -3.454 1.696 1.00 . A A . 456 THR CB 1 1 7 3204 1 1 24 THR CG2 C -3.831 -3.339 2.931 1.00 . A A . 456 THR CG2 1 1 7 3205 1 1 24 THR H H -2.018 -3.355 -0.738 1.00 . A A . 456 THR H 1 1 7 3206 1 1 24 THR HA H -4.601 -4.027 0.445 1.00 . A A . 456 THR HA 1 1 7 3207 1 1 24 THR HB H -2.226 -2.655 1.719 1.00 . A A . 456 THR HB 1 1 7 3208 1 1 24 THR HG1 H -2.900 -5.438 1.719 1.00 . A A . 456 THR HG1 1 1 7 3209 1 1 24 THR HG21 H -3.211 -3.192 3.800 1.00 . A A . 456 THR HG21 1 1 7 3210 1 1 24 THR HG22 H -4.408 -4.244 3.049 1.00 . A A . 456 THR HG22 1 1 7 3211 1 1 24 THR HG23 H -4.498 -2.500 2.820 1.00 . A A . 456 THR HG23 1 1 7 3212 1 1 24 THR N N -2.964 -3.619 -0.756 1.00 . A A . 456 THR N 1 1 7 3213 1 1 24 THR O O -3.595 -0.923 0.318 1.00 . A A . 456 THR O 1 1 7 3214 1 1 24 THR OG1 O -2.260 -4.710 1.708 1.00 . A A . 456 THR OG1 1 1 7 3215 1 1 25 TRP C C -7.154 -0.215 1.459 1.00 . A A . 457 TRP C 1 1 7 3216 1 1 25 TRP CA C -6.286 -0.455 0.228 1.00 . A A . 457 TRP CA 1 1 7 3217 1 1 25 TRP CB C -7.072 -0.291 -1.078 1.00 . A A . 457 TRP CB 1 1 7 3218 1 1 25 TRP CD1 C -5.457 -1.385 -2.725 1.00 . A A . 457 TRP CD1 1 1 7 3219 1 1 25 TRP CD2 C -5.808 0.792 -3.112 1.00 . A A . 457 TRP CD2 1 1 7 3220 1 1 25 TRP CE2 C -4.872 0.307 -4.047 1.00 . A A . 457 TRP CE2 1 1 7 3221 1 1 25 TRP CE3 C -6.184 2.137 -3.174 1.00 . A A . 457 TRP CE3 1 1 7 3222 1 1 25 TRP CG C -6.154 -0.309 -2.261 1.00 . A A . 457 TRP CG 1 1 7 3223 1 1 25 TRP CH2 C -4.695 2.428 -5.068 1.00 . A A . 457 TRP CH2 1 1 7 3224 1 1 25 TRP CZ2 C -4.306 1.115 -5.026 1.00 . A A . 457 TRP CZ2 1 1 7 3225 1 1 25 TRP CZ3 C -5.629 2.939 -4.157 1.00 . A A . 457 TRP CZ3 1 1 7 3226 1 1 25 TRP H H -6.221 -2.577 0.214 1.00 . A A . 457 TRP H 1 1 7 3227 1 1 25 TRP HA H -5.486 0.271 0.238 1.00 . A A . 457 TRP HA 1 1 7 3228 1 1 25 TRP HB2 H -7.779 -1.103 -1.181 1.00 . A A . 457 TRP HB2 1 1 7 3229 1 1 25 TRP HB3 H -7.596 0.652 -1.070 1.00 . A A . 457 TRP HB3 1 1 7 3230 1 1 25 TRP HD1 H -5.507 -2.373 -2.292 1.00 . A A . 457 TRP HD1 1 1 7 3231 1 1 25 TRP HE1 H -4.065 -1.621 -4.276 1.00 . A A . 457 TRP HE1 1 1 7 3232 1 1 25 TRP HE3 H -6.902 2.549 -2.481 1.00 . A A . 457 TRP HE3 1 1 7 3233 1 1 25 TRP HH2 H -4.287 3.089 -5.819 1.00 . A A . 457 TRP HH2 1 1 7 3234 1 1 25 TRP HZ2 H -3.569 0.733 -5.719 1.00 . A A . 457 TRP HZ2 1 1 7 3235 1 1 25 TRP HZ3 H -5.910 3.981 -4.223 1.00 . A A . 457 TRP HZ3 1 1 7 3236 1 1 25 TRP N N -5.662 -1.773 0.270 1.00 . A A . 457 TRP N 1 1 7 3237 1 1 25 TRP NE1 N -4.671 -1.019 -3.781 1.00 . A A . 457 TRP NE1 1 1 7 3238 1 1 25 TRP O O -7.774 0.839 1.603 1.00 . A A . 457 TRP O 1 1 7 3239 1 1 26 GLU C C -6.792 -1.240 4.757 1.00 . A A . 458 GLU C 1 1 7 3240 1 1 26 GLU CA C -7.823 -1.057 3.647 1.00 . A A . 458 GLU CA 1 1 7 3241 1 1 26 GLU CB C -8.937 -2.096 3.796 1.00 . A A . 458 GLU CB 1 1 7 3242 1 1 26 GLU CD C -10.754 -0.601 2.870 1.00 . A A . 458 GLU CD 1 1 7 3243 1 1 26 GLU CG C -10.061 -1.946 2.780 1.00 . A A . 458 GLU CG 1 1 7 3244 1 1 26 GLU H H -6.705 -2.029 2.158 1.00 . A A . 458 GLU H 1 1 7 3245 1 1 26 GLU HA H -8.246 -0.065 3.712 1.00 . A A . 458 GLU HA 1 1 7 3246 1 1 26 GLU HB2 H -8.508 -3.081 3.684 1.00 . A A . 458 GLU HB2 1 1 7 3247 1 1 26 GLU HB3 H -9.359 -2.009 4.785 1.00 . A A . 458 GLU HB3 1 1 7 3248 1 1 26 GLU HG2 H -9.649 -2.055 1.787 1.00 . A A . 458 GLU HG2 1 1 7 3249 1 1 26 GLU HG3 H -10.792 -2.723 2.952 1.00 . A A . 458 GLU HG3 1 1 7 3250 1 1 26 GLU N N -7.164 -1.192 2.359 1.00 . A A . 458 GLU N 1 1 7 3251 1 1 26 GLU O O -6.187 -2.304 4.870 1.00 . A A . 458 GLU O 1 1 7 3252 1 1 26 GLU OE1 O -11.309 -0.283 3.943 1.00 . A A . 458 GLU OE1 1 1 7 3253 1 1 26 GLU OE2 O -10.766 0.140 1.864 1.00 . A A . 458 GLU OE2 1 1 7 3254 1 1 27 LYS C C -5.804 -1.329 7.614 1.00 . A A . 459 LYS C 1 1 7 3255 1 1 27 LYS CA C -5.561 -0.215 6.602 1.00 . A A . 459 LYS CA 1 1 7 3256 1 1 27 LYS CB C -5.526 1.105 7.370 1.00 . A A . 459 LYS CB 1 1 7 3257 1 1 27 LYS CD C -4.658 3.477 7.354 1.00 . A A . 459 LYS CD 1 1 7 3258 1 1 27 LYS CE C -5.506 3.777 8.586 1.00 . A A . 459 LYS CE 1 1 7 3259 1 1 27 LYS CG C -5.226 2.326 6.523 1.00 . A A . 459 LYS CG 1 1 7 3260 1 1 27 LYS H H -7.136 0.610 5.437 1.00 . A A . 459 LYS H 1 1 7 3261 1 1 27 LYS HA H -4.604 -0.362 6.129 1.00 . A A . 459 LYS HA 1 1 7 3262 1 1 27 LYS HB2 H -6.488 1.253 7.840 1.00 . A A . 459 LYS HB2 1 1 7 3263 1 1 27 LYS HB3 H -4.770 1.035 8.139 1.00 . A A . 459 LYS HB3 1 1 7 3264 1 1 27 LYS HD2 H -3.657 3.214 7.669 1.00 . A A . 459 LYS HD2 1 1 7 3265 1 1 27 LYS HD3 H -4.614 4.362 6.735 1.00 . A A . 459 LYS HD3 1 1 7 3266 1 1 27 LYS HE2 H -5.374 4.815 8.854 1.00 . A A . 459 LYS HE2 1 1 7 3267 1 1 27 LYS HE3 H -6.542 3.598 8.342 1.00 . A A . 459 LYS HE3 1 1 7 3268 1 1 27 LYS HG2 H -4.504 2.056 5.765 1.00 . A A . 459 LYS HG2 1 1 7 3269 1 1 27 LYS HG3 H -6.140 2.656 6.047 1.00 . A A . 459 LYS HG3 1 1 7 3270 1 1 27 LYS HZ1 H -4.743 2.015 9.427 1.00 . A A . 459 LYS HZ1 1 1 7 3271 1 1 27 LYS HZ2 H -5.964 2.737 10.343 1.00 . A A . 459 LYS HZ2 1 1 7 3272 1 1 27 LYS HZ3 H -4.408 3.410 10.333 1.00 . A A . 459 LYS HZ3 1 1 7 3273 1 1 27 LYS N N -6.586 -0.197 5.556 1.00 . A A . 459 LYS N 1 1 7 3274 1 1 27 LYS NZ N -5.128 2.928 9.752 1.00 . A A . 459 LYS NZ 1 1 7 3275 1 1 27 LYS O O -6.870 -1.383 8.224 1.00 . A A . 459 LYS O 1 1 7 3276 1 1 28 PRO C C -4.937 -2.455 10.267 1.00 . A A . 460 PRO C 1 1 7 3277 1 1 28 PRO CA C -4.860 -3.179 8.923 1.00 . A A . 460 PRO CA 1 1 7 3278 1 1 28 PRO CB C -3.532 -3.931 8.806 1.00 . A A . 460 PRO CB 1 1 7 3279 1 1 28 PRO CD C -3.653 -2.436 6.941 1.00 . A A . 460 PRO CD 1 1 7 3280 1 1 28 PRO CG C -3.112 -3.764 7.388 1.00 . A A . 460 PRO CG 1 1 7 3281 1 1 28 PRO HA H -5.684 -3.871 8.835 1.00 . A A . 460 PRO HA 1 1 7 3282 1 1 28 PRO HB2 H -2.812 -3.496 9.484 1.00 . A A . 460 PRO HB2 1 1 7 3283 1 1 28 PRO HB3 H -3.682 -4.971 9.052 1.00 . A A . 460 PRO HB3 1 1 7 3284 1 1 28 PRO HD2 H -2.919 -1.657 7.092 1.00 . A A . 460 PRO HD2 1 1 7 3285 1 1 28 PRO HD3 H -3.944 -2.489 5.902 1.00 . A A . 460 PRO HD3 1 1 7 3286 1 1 28 PRO HG2 H -2.035 -3.769 7.323 1.00 . A A . 460 PRO HG2 1 1 7 3287 1 1 28 PRO HG3 H -3.529 -4.558 6.787 1.00 . A A . 460 PRO HG3 1 1 7 3288 1 1 28 PRO N N -4.829 -2.233 7.807 1.00 . A A . 460 PRO N 1 1 7 3289 1 1 28 PRO O O -3.907 -1.885 10.692 1.00 . A A . 460 PRO O 1 1 7 3290 1 1 28 PRO OXT O -6.017 -2.445 10.887 1.00 . A A . 460 PRO OXT 1 1 8 3291 1 1 1 SER C C 7.788 -0.968 5.149 1.00 . A A . 433 SER C 1 1 8 3292 1 1 1 SER CA C 7.731 0.131 6.213 1.00 . A A . 433 SER CA 1 1 8 3293 1 1 1 SER CB C 6.409 0.088 6.994 1.00 . A A . 433 SER CB 1 1 8 3294 1 1 1 SER H1 H 7.113 1.561 4.842 1.00 . A A . 433 SER H1 1 1 8 3295 1 1 1 SER H2 H 8.791 1.521 5.087 1.00 . A A . 433 SER H2 1 1 8 3296 1 1 1 SER H3 H 7.775 2.213 6.257 1.00 . A A . 433 SER H3 1 1 8 3297 1 1 1 SER HA H 8.558 0.004 6.897 1.00 . A A . 433 SER HA 1 1 8 3298 1 1 1 SER HB2 H 6.352 -0.822 7.570 1.00 . A A . 433 SER HB2 1 1 8 3299 1 1 1 SER HB3 H 6.367 0.933 7.664 1.00 . A A . 433 SER HB3 1 1 8 3300 1 1 1 SER HG H 4.977 1.069 6.054 1.00 . A A . 433 SER HG 1 1 8 3301 1 1 1 SER N N 7.862 1.447 5.556 1.00 . A A . 433 SER N 1 1 8 3302 1 1 1 SER O O 8.232 -0.713 4.029 1.00 . A A . 433 SER O 1 1 8 3303 1 1 1 SER OG O 5.295 0.150 6.121 1.00 . A A . 433 SER OG 1 1 8 3304 1 1 2 GLU C C 6.012 -2.981 3.633 1.00 . A A . 434 GLU C 1 1 8 3305 1 1 2 GLU CA C 7.242 -3.244 4.493 1.00 . A A . 434 GLU CA 1 1 8 3306 1 1 2 GLU CB C 7.155 -4.632 5.141 1.00 . A A . 434 GLU CB 1 1 8 3307 1 1 2 GLU CD C 6.702 -4.187 7.587 1.00 . A A . 434 GLU CD 1 1 8 3308 1 1 2 GLU CG C 6.152 -4.732 6.285 1.00 . A A . 434 GLU CG 1 1 8 3309 1 1 2 GLU H H 7.160 -2.390 6.428 1.00 . A A . 434 GLU H 1 1 8 3310 1 1 2 GLU HA H 8.119 -3.206 3.860 1.00 . A A . 434 GLU HA 1 1 8 3311 1 1 2 GLU HB2 H 6.873 -5.350 4.384 1.00 . A A . 434 GLU HB2 1 1 8 3312 1 1 2 GLU HB3 H 8.130 -4.896 5.524 1.00 . A A . 434 GLU HB3 1 1 8 3313 1 1 2 GLU HG2 H 5.269 -4.169 6.022 1.00 . A A . 434 GLU HG2 1 1 8 3314 1 1 2 GLU HG3 H 5.889 -5.770 6.428 1.00 . A A . 434 GLU HG3 1 1 8 3315 1 1 2 GLU N N 7.376 -2.190 5.490 1.00 . A A . 434 GLU N 1 1 8 3316 1 1 2 GLU O O 5.818 -3.598 2.580 1.00 . A A . 434 GLU O 1 1 8 3317 1 1 2 GLU OE1 O 7.447 -4.918 8.272 1.00 . A A . 434 GLU OE1 1 1 8 3318 1 1 2 GLU OE2 O 6.410 -3.022 7.920 1.00 . A A . 434 GLU OE2 1 1 8 3319 1 1 3 TRP C C 4.464 -0.360 2.577 1.00 . A A . 435 TRP C 1 1 8 3320 1 1 3 TRP CA C 4.041 -1.594 3.353 1.00 . A A . 435 TRP CA 1 1 8 3321 1 1 3 TRP CB C 2.885 -1.222 4.285 1.00 . A A . 435 TRP CB 1 1 8 3322 1 1 3 TRP CD1 C 2.601 -2.228 6.619 1.00 . A A . 435 TRP CD1 1 1 8 3323 1 1 3 TRP CD2 C 1.985 -3.590 4.957 1.00 . A A . 435 TRP CD2 1 1 8 3324 1 1 3 TRP CE2 C 1.774 -4.255 6.181 1.00 . A A . 435 TRP CE2 1 1 8 3325 1 1 3 TRP CE3 C 1.670 -4.251 3.770 1.00 . A A . 435 TRP CE3 1 1 8 3326 1 1 3 TRP CG C 2.509 -2.295 5.260 1.00 . A A . 435 TRP CG 1 1 8 3327 1 1 3 TRP CH2 C 0.965 -6.173 5.062 1.00 . A A . 435 TRP CH2 1 1 8 3328 1 1 3 TRP CZ2 C 1.262 -5.551 6.246 1.00 . A A . 435 TRP CZ2 1 1 8 3329 1 1 3 TRP CZ3 C 1.166 -5.531 3.837 1.00 . A A . 435 TRP CZ3 1 1 8 3330 1 1 3 TRP H H 5.339 -1.696 5.002 1.00 . A A . 435 TRP H 1 1 8 3331 1 1 3 TRP HA H 3.727 -2.368 2.668 1.00 . A A . 435 TRP HA 1 1 8 3332 1 1 3 TRP HB2 H 3.161 -0.347 4.853 1.00 . A A . 435 TRP HB2 1 1 8 3333 1 1 3 TRP HB3 H 2.013 -0.995 3.689 1.00 . A A . 435 TRP HB3 1 1 8 3334 1 1 3 TRP HD1 H 2.963 -1.369 7.161 1.00 . A A . 435 TRP HD1 1 1 8 3335 1 1 3 TRP HE1 H 2.118 -3.590 8.144 1.00 . A A . 435 TRP HE1 1 1 8 3336 1 1 3 TRP HE3 H 1.816 -3.776 2.811 1.00 . A A . 435 TRP HE3 1 1 8 3337 1 1 3 TRP HH2 H 0.565 -7.176 5.056 1.00 . A A . 435 TRP HH2 1 1 8 3338 1 1 3 TRP HZ2 H 1.103 -6.057 7.186 1.00 . A A . 435 TRP HZ2 1 1 8 3339 1 1 3 TRP HZ3 H 0.926 -6.060 2.925 1.00 . A A . 435 TRP HZ3 1 1 8 3340 1 1 3 TRP N N 5.177 -2.072 4.109 1.00 . A A . 435 TRP N 1 1 8 3341 1 1 3 TRP NE1 N 2.154 -3.400 7.181 1.00 . A A . 435 TRP NE1 1 1 8 3342 1 1 3 TRP O O 5.169 0.497 3.107 1.00 . A A . 435 TRP O 1 1 8 3343 1 1 4 THR C C 3.162 1.928 0.753 1.00 . A A . 436 THR C 1 1 8 3344 1 1 4 THR CA C 4.304 0.938 0.566 1.00 . A A . 436 THR CA 1 1 8 3345 1 1 4 THR CB C 4.498 0.624 -0.932 1.00 . A A . 436 THR CB 1 1 8 3346 1 1 4 THR CG2 C 4.684 1.901 -1.746 1.00 . A A . 436 THR CG2 1 1 8 3347 1 1 4 THR H H 3.549 -1.006 0.924 1.00 . A A . 436 THR H 1 1 8 3348 1 1 4 THR HA H 5.213 1.382 0.942 1.00 . A A . 436 THR HA 1 1 8 3349 1 1 4 THR HB H 3.621 0.108 -1.294 1.00 . A A . 436 THR HB 1 1 8 3350 1 1 4 THR HG1 H 6.312 0.016 -0.446 1.00 . A A . 436 THR HG1 1 1 8 3351 1 1 4 THR HG21 H 3.806 2.527 -1.647 1.00 . A A . 436 THR HG21 1 1 8 3352 1 1 4 THR HG22 H 4.827 1.648 -2.787 1.00 . A A . 436 THR HG22 1 1 8 3353 1 1 4 THR HG23 H 5.548 2.437 -1.385 1.00 . A A . 436 THR HG23 1 1 8 3354 1 1 4 THR N N 4.045 -0.260 1.334 1.00 . A A . 436 THR N 1 1 8 3355 1 1 4 THR O O 2.098 1.786 0.150 1.00 . A A . 436 THR O 1 1 8 3356 1 1 4 THR OG1 O 5.643 -0.225 -1.098 1.00 . A A . 436 THR OG1 1 1 8 3357 1 1 5 GLU C C 2.670 5.082 0.869 1.00 . A A . 437 GLU C 1 1 8 3358 1 1 5 GLU CA C 2.395 3.949 1.844 1.00 . A A . 437 GLU CA 1 1 8 3359 1 1 5 GLU CB C 2.443 4.471 3.288 1.00 . A A . 437 GLU CB 1 1 8 3360 1 1 5 GLU CD C 4.120 3.131 4.647 1.00 . A A . 437 GLU CD 1 1 8 3361 1 1 5 GLU CG C 2.650 3.388 4.340 1.00 . A A . 437 GLU CG 1 1 8 3362 1 1 5 GLU H H 4.219 2.926 2.132 1.00 . A A . 437 GLU H 1 1 8 3363 1 1 5 GLU HA H 1.416 3.538 1.642 1.00 . A A . 437 GLU HA 1 1 8 3364 1 1 5 GLU HB2 H 3.251 5.182 3.373 1.00 . A A . 437 GLU HB2 1 1 8 3365 1 1 5 GLU HB3 H 1.512 4.976 3.503 1.00 . A A . 437 GLU HB3 1 1 8 3366 1 1 5 GLU HG2 H 2.159 3.694 5.252 1.00 . A A . 437 GLU HG2 1 1 8 3367 1 1 5 GLU HG3 H 2.207 2.471 3.985 1.00 . A A . 437 GLU HG3 1 1 8 3368 1 1 5 GLU N N 3.377 2.907 1.621 1.00 . A A . 437 GLU N 1 1 8 3369 1 1 5 GLU O O 3.541 5.924 1.100 1.00 . A A . 437 GLU O 1 1 8 3370 1 1 5 GLU OE1 O 4.982 3.467 3.804 1.00 . A A . 437 GLU OE1 1 1 8 3371 1 1 5 GLU OE2 O 4.419 2.623 5.746 1.00 . A A . 437 GLU OE2 1 1 8 3372 1 1 6 ARG C C 0.994 6.806 -1.676 1.00 . A A . 438 ARG C 1 1 8 3373 1 1 6 ARG CA C 2.251 5.976 -1.338 1.00 . A A . 438 ARG CA 1 1 8 3374 1 1 6 ARG CB C 2.694 5.155 -2.547 1.00 . A A . 438 ARG CB 1 1 8 3375 1 1 6 ARG CD C 3.811 5.062 -4.778 1.00 . A A . 438 ARG CD 1 1 8 3376 1 1 6 ARG CG C 3.213 5.973 -3.716 1.00 . A A . 438 ARG CG 1 1 8 3377 1 1 6 ARG CZ C 4.806 5.216 -7.023 1.00 . A A . 438 ARG CZ 1 1 8 3378 1 1 6 ARG H H 1.229 4.417 -0.341 1.00 . A A . 438 ARG H 1 1 8 3379 1 1 6 ARG HA H 3.071 6.606 -1.029 1.00 . A A . 438 ARG HA 1 1 8 3380 1 1 6 ARG HB2 H 3.479 4.482 -2.238 1.00 . A A . 438 ARG HB2 1 1 8 3381 1 1 6 ARG HB3 H 1.853 4.572 -2.893 1.00 . A A . 438 ARG HB3 1 1 8 3382 1 1 6 ARG HD2 H 4.661 4.548 -4.354 1.00 . A A . 438 ARG HD2 1 1 8 3383 1 1 6 ARG HD3 H 3.063 4.336 -5.069 1.00 . A A . 438 ARG HD3 1 1 8 3384 1 1 6 ARG HE H 4.092 6.773 -5.973 1.00 . A A . 438 ARG HE 1 1 8 3385 1 1 6 ARG HG2 H 2.395 6.531 -4.146 1.00 . A A . 438 ARG HG2 1 1 8 3386 1 1 6 ARG HG3 H 3.975 6.653 -3.363 1.00 . A A . 438 ARG HG3 1 1 8 3387 1 1 6 ARG HH11 H 4.844 3.358 -6.208 1.00 . A A . 438 ARG HH11 1 1 8 3388 1 1 6 ARG HH12 H 5.502 3.477 -7.811 1.00 . A A . 438 ARG HH12 1 1 8 3389 1 1 6 ARG HH21 H 4.919 6.929 -8.102 1.00 . A A . 438 ARG HH21 1 1 8 3390 1 1 6 ARG HH22 H 5.528 5.506 -8.897 1.00 . A A . 438 ARG HH22 1 1 8 3391 1 1 6 ARG N N 1.966 5.064 -0.247 1.00 . A A . 438 ARG N 1 1 8 3392 1 1 6 ARG NE N 4.246 5.792 -5.962 1.00 . A A . 438 ARG NE 1 1 8 3393 1 1 6 ARG NH1 N 5.070 3.914 -7.014 1.00 . A A . 438 ARG NH1 1 1 8 3394 1 1 6 ARG NH2 N 5.113 5.942 -8.090 1.00 . A A . 438 ARG NH2 1 1 8 3395 1 1 6 ARG O O -0.015 6.227 -2.089 1.00 . A A . 438 ARG O 1 1 8 3396 1 1 7 LYS C C -0.135 9.424 -3.214 1.00 . A A . 439 LYS C 1 1 8 3397 1 1 7 LYS CA C -0.161 8.942 -1.773 1.00 . A A . 439 LYS CA 1 1 8 3398 1 1 7 LYS CB C -0.251 10.124 -0.804 1.00 . A A . 439 LYS CB 1 1 8 3399 1 1 7 LYS CD C -1.674 11.945 0.196 1.00 . A A . 439 LYS CD 1 1 8 3400 1 1 7 LYS CE C -1.662 11.310 1.580 1.00 . A A . 439 LYS CE 1 1 8 3401 1 1 7 LYS CG C -1.557 10.899 -0.904 1.00 . A A . 439 LYS CG 1 1 8 3402 1 1 7 LYS H H 1.809 8.589 -1.140 1.00 . A A . 439 LYS H 1 1 8 3403 1 1 7 LYS HA H -1.026 8.320 -1.641 1.00 . A A . 439 LYS HA 1 1 8 3404 1 1 7 LYS HB2 H -0.152 9.756 0.207 1.00 . A A . 439 LYS HB2 1 1 8 3405 1 1 7 LYS HB3 H 0.561 10.804 -1.011 1.00 . A A . 439 LYS HB3 1 1 8 3406 1 1 7 LYS HD2 H -0.844 12.629 0.119 1.00 . A A . 439 LYS HD2 1 1 8 3407 1 1 7 LYS HD3 H -2.601 12.487 0.066 1.00 . A A . 439 LYS HD3 1 1 8 3408 1 1 7 LYS HE2 H -2.468 10.593 1.643 1.00 . A A . 439 LYS HE2 1 1 8 3409 1 1 7 LYS HE3 H -0.719 10.804 1.722 1.00 . A A . 439 LYS HE3 1 1 8 3410 1 1 7 LYS HG2 H -1.596 11.394 -1.863 1.00 . A A . 439 LYS HG2 1 1 8 3411 1 1 7 LYS HG3 H -2.383 10.206 -0.821 1.00 . A A . 439 LYS HG3 1 1 8 3412 1 1 7 LYS HZ1 H -1.074 13.031 2.609 1.00 . A A . 439 LYS HZ1 1 1 8 3413 1 1 7 LYS HZ2 H -1.803 11.858 3.594 1.00 . A A . 439 LYS HZ2 1 1 8 3414 1 1 7 LYS HZ3 H -2.756 12.803 2.555 1.00 . A A . 439 LYS HZ3 1 1 8 3415 1 1 7 LYS N N 1.012 8.136 -1.484 1.00 . A A . 439 LYS N 1 1 8 3416 1 1 7 LYS NZ N -1.835 12.320 2.657 1.00 . A A . 439 LYS NZ 1 1 8 3417 1 1 7 LYS O O 0.718 10.226 -3.600 1.00 . A A . 439 LYS O 1 1 8 3418 1 1 8 THR C C -2.102 10.483 -5.573 1.00 . A A . 440 THR C 1 1 8 3419 1 1 8 THR CA C -1.167 9.286 -5.408 1.00 . A A . 440 THR CA 1 1 8 3420 1 1 8 THR CB C -1.659 8.104 -6.282 1.00 . A A . 440 THR CB 1 1 8 3421 1 1 8 THR CG2 C -2.983 7.551 -5.776 1.00 . A A . 440 THR CG2 1 1 8 3422 1 1 8 THR H H -1.691 8.253 -3.642 1.00 . A A . 440 THR H 1 1 8 3423 1 1 8 THR HA H -0.182 9.570 -5.748 1.00 . A A . 440 THR HA 1 1 8 3424 1 1 8 THR HB H -0.921 7.316 -6.235 1.00 . A A . 440 THR HB 1 1 8 3425 1 1 8 THR HG1 H -1.378 7.865 -8.225 1.00 . A A . 440 THR HG1 1 1 8 3426 1 1 8 THR HG21 H -3.303 6.745 -6.417 1.00 . A A . 440 THR HG21 1 1 8 3427 1 1 8 THR HG22 H -3.725 8.336 -5.784 1.00 . A A . 440 THR HG22 1 1 8 3428 1 1 8 THR HG23 H -2.858 7.184 -4.767 1.00 . A A . 440 THR HG23 1 1 8 3429 1 1 8 THR N N -1.058 8.909 -4.010 1.00 . A A . 440 THR N 1 1 8 3430 1 1 8 THR O O -3.045 10.662 -4.788 1.00 . A A . 440 THR O 1 1 8 3431 1 1 8 THR OG1 O -1.804 8.515 -7.646 1.00 . A A . 440 THR OG1 1 1 8 3432 1 1 9 ALA C C -4.026 12.169 -7.299 1.00 . A A . 441 ALA C 1 1 8 3433 1 1 9 ALA CA C -2.605 12.502 -6.870 1.00 . A A . 441 ALA CA 1 1 8 3434 1 1 9 ALA CB C -1.921 13.348 -7.929 1.00 . A A . 441 ALA CB 1 1 8 3435 1 1 9 ALA H H -1.094 11.056 -7.205 1.00 . A A . 441 ALA H 1 1 8 3436 1 1 9 ALA HA H -2.645 13.078 -5.956 1.00 . A A . 441 ALA HA 1 1 8 3437 1 1 9 ALA HB1 H -1.898 12.806 -8.863 1.00 . A A . 441 ALA HB1 1 1 8 3438 1 1 9 ALA HB2 H -0.913 13.572 -7.617 1.00 . A A . 441 ALA HB2 1 1 8 3439 1 1 9 ALA HB3 H -2.470 14.269 -8.063 1.00 . A A . 441 ALA HB3 1 1 8 3440 1 1 9 ALA N N -1.833 11.291 -6.600 1.00 . A A . 441 ALA N 1 1 8 3441 1 1 9 ALA O O -4.838 13.061 -7.546 1.00 . A A . 441 ALA O 1 1 8 3442 1 1 10 ASP C C -6.534 10.743 -6.395 1.00 . A A . 442 ASP C 1 1 8 3443 1 1 10 ASP CA C -5.676 10.405 -7.612 1.00 . A A . 442 ASP CA 1 1 8 3444 1 1 10 ASP CB C -5.672 8.894 -7.857 1.00 . A A . 442 ASP CB 1 1 8 3445 1 1 10 ASP CG C -7.039 8.336 -8.196 1.00 . A A . 442 ASP CG 1 1 8 3446 1 1 10 ASP H H -3.585 10.224 -7.339 1.00 . A A . 442 ASP H 1 1 8 3447 1 1 10 ASP HA H -6.078 10.909 -8.480 1.00 . A A . 442 ASP HA 1 1 8 3448 1 1 10 ASP HB2 H -5.007 8.674 -8.677 1.00 . A A . 442 ASP HB2 1 1 8 3449 1 1 10 ASP HB3 H -5.313 8.396 -6.967 1.00 . A A . 442 ASP HB3 1 1 8 3450 1 1 10 ASP N N -4.316 10.879 -7.401 1.00 . A A . 442 ASP N 1 1 8 3451 1 1 10 ASP O O -7.763 10.673 -6.438 1.00 . A A . 442 ASP O 1 1 8 3452 1 1 10 ASP OD1 O -7.800 7.991 -7.273 1.00 . A A . 442 ASP OD1 1 1 8 3453 1 1 10 ASP OD2 O -7.354 8.217 -9.398 1.00 . A A . 442 ASP OD2 1 1 8 3454 1 1 11 GLY C C -6.723 10.259 -3.187 1.00 . A A . 443 GLY C 1 1 8 3455 1 1 11 GLY CA C -6.542 11.463 -4.084 1.00 . A A . 443 GLY CA 1 1 8 3456 1 1 11 GLY H H -4.882 11.174 -5.353 1.00 . A A . 443 GLY H 1 1 8 3457 1 1 11 GLY HA2 H -5.969 12.213 -3.559 1.00 . A A . 443 GLY HA2 1 1 8 3458 1 1 11 GLY HA3 H -7.515 11.868 -4.322 1.00 . A A . 443 GLY HA3 1 1 8 3459 1 1 11 GLY N N -5.862 11.125 -5.312 1.00 . A A . 443 GLY N 1 1 8 3460 1 1 11 GLY O O -7.669 10.196 -2.405 1.00 . A A . 443 GLY O 1 1 8 3461 1 1 12 LYS C C -4.501 7.649 -2.023 1.00 . A A . 444 LYS C 1 1 8 3462 1 1 12 LYS CA C -5.884 8.081 -2.492 1.00 . A A . 444 LYS CA 1 1 8 3463 1 1 12 LYS CB C -6.521 6.935 -3.294 1.00 . A A . 444 LYS CB 1 1 8 3464 1 1 12 LYS CD C -8.690 5.982 -4.133 1.00 . A A . 444 LYS CD 1 1 8 3465 1 1 12 LYS CE C -9.941 6.261 -4.953 1.00 . A A . 444 LYS CE 1 1 8 3466 1 1 12 LYS CG C -7.897 7.252 -3.863 1.00 . A A . 444 LYS CG 1 1 8 3467 1 1 12 LYS H H -5.043 9.429 -3.900 1.00 . A A . 444 LYS H 1 1 8 3468 1 1 12 LYS HA H -6.498 8.288 -1.628 1.00 . A A . 444 LYS HA 1 1 8 3469 1 1 12 LYS HB2 H -5.868 6.686 -4.116 1.00 . A A . 444 LYS HB2 1 1 8 3470 1 1 12 LYS HB3 H -6.613 6.074 -2.649 1.00 . A A . 444 LYS HB3 1 1 8 3471 1 1 12 LYS HD2 H -8.065 5.290 -4.676 1.00 . A A . 444 LYS HD2 1 1 8 3472 1 1 12 LYS HD3 H -8.979 5.543 -3.189 1.00 . A A . 444 LYS HD3 1 1 8 3473 1 1 12 LYS HE2 H -10.643 5.454 -4.805 1.00 . A A . 444 LYS HE2 1 1 8 3474 1 1 12 LYS HE3 H -10.380 7.188 -4.614 1.00 . A A . 444 LYS HE3 1 1 8 3475 1 1 12 LYS HG2 H -8.438 7.858 -3.154 1.00 . A A . 444 LYS HG2 1 1 8 3476 1 1 12 LYS HG3 H -7.779 7.796 -4.790 1.00 . A A . 444 LYS HG3 1 1 8 3477 1 1 12 LYS HZ1 H -9.239 5.475 -6.755 1.00 . A A . 444 LYS HZ1 1 1 8 3478 1 1 12 LYS HZ2 H -8.926 7.132 -6.570 1.00 . A A . 444 LYS HZ2 1 1 8 3479 1 1 12 LYS HZ3 H -10.495 6.598 -6.947 1.00 . A A . 444 LYS HZ3 1 1 8 3480 1 1 12 LYS N N -5.804 9.302 -3.287 1.00 . A A . 444 LYS N 1 1 8 3481 1 1 12 LYS NZ N -9.631 6.374 -6.405 1.00 . A A . 444 LYS NZ 1 1 8 3482 1 1 12 LYS O O -3.520 7.748 -2.763 1.00 . A A . 444 LYS O 1 1 8 3483 1 1 13 THR C C -3.345 5.051 -0.313 1.00 . A A . 445 THR C 1 1 8 3484 1 1 13 THR CA C -3.214 6.569 -0.289 1.00 . A A . 445 THR CA 1 1 8 3485 1 1 13 THR CB C -2.916 7.046 1.146 1.00 . A A . 445 THR CB 1 1 8 3486 1 1 13 THR CG2 C -1.591 6.490 1.649 1.00 . A A . 445 THR CG2 1 1 8 3487 1 1 13 THR H H -5.226 7.189 -0.224 1.00 . A A . 445 THR H 1 1 8 3488 1 1 13 THR HA H -2.402 6.865 -0.926 1.00 . A A . 445 THR HA 1 1 8 3489 1 1 13 THR HB H -3.707 6.701 1.796 1.00 . A A . 445 THR HB 1 1 8 3490 1 1 13 THR HG1 H -3.760 8.834 1.015 1.00 . A A . 445 THR HG1 1 1 8 3491 1 1 13 THR HG21 H -1.623 5.410 1.631 1.00 . A A . 445 THR HG21 1 1 8 3492 1 1 13 THR HG22 H -1.422 6.828 2.660 1.00 . A A . 445 THR HG22 1 1 8 3493 1 1 13 THR HG23 H -0.790 6.838 1.013 1.00 . A A . 445 THR HG23 1 1 8 3494 1 1 13 THR N N -4.430 7.159 -0.801 1.00 . A A . 445 THR N 1 1 8 3495 1 1 13 THR O O -4.103 4.477 0.471 1.00 . A A . 445 THR O 1 1 8 3496 1 1 13 THR OG1 O -2.873 8.479 1.181 1.00 . A A . 445 THR OG1 1 1 8 3497 1 1 14 TYR C C -1.601 2.270 -0.672 1.00 . A A . 446 TYR C 1 1 8 3498 1 1 14 TYR CA C -2.755 2.960 -1.367 1.00 . A A . 446 TYR CA 1 1 8 3499 1 1 14 TYR CB C -2.819 2.556 -2.842 1.00 . A A . 446 TYR CB 1 1 8 3500 1 1 14 TYR CD1 C -0.910 3.756 -4.002 1.00 . A A . 446 TYR CD1 1 1 8 3501 1 1 14 TYR CD2 C -0.870 1.373 -3.920 1.00 . A A . 446 TYR CD2 1 1 8 3502 1 1 14 TYR CE1 C 0.278 3.750 -4.711 1.00 . A A . 446 TYR CE1 1 1 8 3503 1 1 14 TYR CE2 C 0.317 1.361 -4.624 1.00 . A A . 446 TYR CE2 1 1 8 3504 1 1 14 TYR CG C -1.503 2.568 -3.593 1.00 . A A . 446 TYR CG 1 1 8 3505 1 1 14 TYR CZ C 0.887 2.549 -5.018 1.00 . A A . 446 TYR CZ 1 1 8 3506 1 1 14 TYR H H -2.016 4.887 -1.810 1.00 . A A . 446 TYR H 1 1 8 3507 1 1 14 TYR HA H -3.674 2.661 -0.886 1.00 . A A . 446 TYR HA 1 1 8 3508 1 1 14 TYR HB2 H -3.214 1.553 -2.905 1.00 . A A . 446 TYR HB2 1 1 8 3509 1 1 14 TYR HB3 H -3.496 3.225 -3.353 1.00 . A A . 446 TYR HB3 1 1 8 3510 1 1 14 TYR HD1 H -1.385 4.694 -3.755 1.00 . A A . 446 TYR HD1 1 1 8 3511 1 1 14 TYR HD2 H -1.319 0.441 -3.610 1.00 . A A . 446 TYR HD2 1 1 8 3512 1 1 14 TYR HE1 H 0.726 4.684 -5.019 1.00 . A A . 446 TYR HE1 1 1 8 3513 1 1 14 TYR HE2 H 0.792 0.422 -4.867 1.00 . A A . 446 TYR HE2 1 1 8 3514 1 1 14 TYR HH H 2.008 1.893 -6.437 1.00 . A A . 446 TYR HH 1 1 8 3515 1 1 14 TYR N N -2.638 4.398 -1.229 1.00 . A A . 446 TYR N 1 1 8 3516 1 1 14 TYR O O -0.475 2.773 -0.666 1.00 . A A . 446 TYR O 1 1 8 3517 1 1 14 TYR OH O 2.068 2.539 -5.725 1.00 . A A . 446 TYR OH 1 1 8 3518 1 1 15 TYR C C -0.513 -0.892 -0.108 1.00 . A A . 447 TYR C 1 1 8 3519 1 1 15 TYR CA C -0.885 0.380 0.645 1.00 . A A . 447 TYR CA 1 1 8 3520 1 1 15 TYR CB C -1.419 0.045 2.044 1.00 . A A . 447 TYR CB 1 1 8 3521 1 1 15 TYR CD1 C -1.782 2.290 3.168 1.00 . A A . 447 TYR CD1 1 1 8 3522 1 1 15 TYR CD2 C -3.698 1.006 2.562 1.00 . A A . 447 TYR CD2 1 1 8 3523 1 1 15 TYR CE1 C -2.603 3.289 3.654 1.00 . A A . 447 TYR CE1 1 1 8 3524 1 1 15 TYR CE2 C -4.523 1.998 3.052 1.00 . A A . 447 TYR CE2 1 1 8 3525 1 1 15 TYR CG C -2.314 1.131 2.612 1.00 . A A . 447 TYR CG 1 1 8 3526 1 1 15 TYR CZ C -3.972 3.138 3.594 1.00 . A A . 447 TYR CZ 1 1 8 3527 1 1 15 TYR H H -2.783 0.735 -0.192 1.00 . A A . 447 TYR H 1 1 8 3528 1 1 15 TYR HA H -0.010 1.006 0.740 1.00 . A A . 447 TYR HA 1 1 8 3529 1 1 15 TYR HB2 H -1.993 -0.868 1.994 1.00 . A A . 447 TYR HB2 1 1 8 3530 1 1 15 TYR HB3 H -0.587 -0.091 2.719 1.00 . A A . 447 TYR HB3 1 1 8 3531 1 1 15 TYR HD1 H -0.712 2.406 3.219 1.00 . A A . 447 TYR HD1 1 1 8 3532 1 1 15 TYR HD2 H -4.127 0.111 2.139 1.00 . A A . 447 TYR HD2 1 1 8 3533 1 1 15 TYR HE1 H -2.170 4.181 4.083 1.00 . A A . 447 TYR HE1 1 1 8 3534 1 1 15 TYR HE2 H -5.595 1.877 3.009 1.00 . A A . 447 TYR HE2 1 1 8 3535 1 1 15 TYR HH H -5.547 3.743 4.520 1.00 . A A . 447 TYR HH 1 1 8 3536 1 1 15 TYR N N -1.882 1.114 -0.102 1.00 . A A . 447 TYR N 1 1 8 3537 1 1 15 TYR O O -1.275 -1.848 -0.154 1.00 . A A . 447 TYR O 1 1 8 3538 1 1 15 TYR OH O -4.792 4.135 4.071 1.00 . A A . 447 TYR OH 1 1 8 3539 1 1 16 TYR C C 1.923 -2.967 -0.507 1.00 . A A . 448 TYR C 1 1 8 3540 1 1 16 TYR CA C 1.104 -2.070 -1.439 1.00 . A A . 448 TYR CA 1 1 8 3541 1 1 16 TYR CB C 1.951 -1.664 -2.648 1.00 . A A . 448 TYR CB 1 1 8 3542 1 1 16 TYR CD1 C 1.604 -3.418 -4.428 1.00 . A A . 448 TYR CD1 1 1 8 3543 1 1 16 TYR CD2 C 3.702 -3.361 -3.300 1.00 . A A . 448 TYR CD2 1 1 8 3544 1 1 16 TYR CE1 C 2.035 -4.493 -5.182 1.00 . A A . 448 TYR CE1 1 1 8 3545 1 1 16 TYR CE2 C 4.142 -4.435 -4.050 1.00 . A A . 448 TYR CE2 1 1 8 3546 1 1 16 TYR CG C 2.429 -2.835 -3.475 1.00 . A A . 448 TYR CG 1 1 8 3547 1 1 16 TYR CZ C 3.303 -4.999 -4.990 1.00 . A A . 448 TYR CZ 1 1 8 3548 1 1 16 TYR H H 1.143 -0.055 -0.810 1.00 . A A . 448 TYR H 1 1 8 3549 1 1 16 TYR HA H 0.240 -2.615 -1.784 1.00 . A A . 448 TYR HA 1 1 8 3550 1 1 16 TYR HB2 H 1.365 -1.024 -3.287 1.00 . A A . 448 TYR HB2 1 1 8 3551 1 1 16 TYR HB3 H 2.821 -1.122 -2.301 1.00 . A A . 448 TYR HB3 1 1 8 3552 1 1 16 TYR HD1 H 0.612 -3.021 -4.576 1.00 . A A . 448 TYR HD1 1 1 8 3553 1 1 16 TYR HD2 H 4.356 -2.918 -2.563 1.00 . A A . 448 TYR HD2 1 1 8 3554 1 1 16 TYR HE1 H 1.377 -4.932 -5.919 1.00 . A A . 448 TYR HE1 1 1 8 3555 1 1 16 TYR HE2 H 5.136 -4.830 -3.893 1.00 . A A . 448 TYR HE2 1 1 8 3556 1 1 16 TYR HH H 4.308 -6.626 -5.217 1.00 . A A . 448 TYR HH 1 1 8 3557 1 1 16 TYR N N 0.639 -0.887 -0.741 1.00 . A A . 448 TYR N 1 1 8 3558 1 1 16 TYR O O 2.827 -2.508 0.194 1.00 . A A . 448 TYR O 1 1 8 3559 1 1 16 TYR OH O 3.732 -6.067 -5.747 1.00 . A A . 448 TYR OH 1 1 8 3560 1 1 17 ASN C C 3.461 -5.816 -0.451 1.00 . A A . 449 ASN C 1 1 8 3561 1 1 17 ASN CA C 2.254 -5.258 0.291 1.00 . A A . 449 ASN CA 1 1 8 3562 1 1 17 ASN CB C 1.248 -6.385 0.582 1.00 . A A . 449 ASN CB 1 1 8 3563 1 1 17 ASN CG C 1.790 -7.514 1.448 1.00 . A A . 449 ASN CG 1 1 8 3564 1 1 17 ASN H H 0.893 -4.550 -1.152 1.00 . A A . 449 ASN H 1 1 8 3565 1 1 17 ASN HA H 2.568 -4.799 1.214 1.00 . A A . 449 ASN HA 1 1 8 3566 1 1 17 ASN HB2 H 0.394 -5.962 1.087 1.00 . A A . 449 ASN HB2 1 1 8 3567 1 1 17 ASN HB3 H 0.922 -6.808 -0.358 1.00 . A A . 449 ASN HB3 1 1 8 3568 1 1 17 ASN HD21 H -0.069 -8.079 1.914 1.00 . A A . 449 ASN HD21 1 1 8 3569 1 1 17 ASN HD22 H 1.211 -9.014 2.615 1.00 . A A . 449 ASN HD22 1 1 8 3570 1 1 17 ASN N N 1.604 -4.255 -0.539 1.00 . A A . 449 ASN N 1 1 8 3571 1 1 17 ASN ND2 N 0.890 -8.278 2.054 1.00 . A A . 449 ASN ND2 1 1 8 3572 1 1 17 ASN O O 3.319 -6.387 -1.529 1.00 . A A . 449 ASN O 1 1 8 3573 1 1 17 ASN OD1 O 2.995 -7.726 1.544 1.00 . A A . 449 ASN OD1 1 1 8 3574 1 1 18 ASN C C 6.319 -7.437 0.010 1.00 . A A . 450 ASN C 1 1 8 3575 1 1 18 ASN CA C 5.870 -6.090 -0.534 1.00 . A A . 450 ASN CA 1 1 8 3576 1 1 18 ASN CB C 6.988 -5.058 -0.362 1.00 . A A . 450 ASN CB 1 1 8 3577 1 1 18 ASN CG C 6.654 -3.726 -0.998 1.00 . A A . 450 ASN CG 1 1 8 3578 1 1 18 ASN H H 4.697 -5.207 0.997 1.00 . A A . 450 ASN H 1 1 8 3579 1 1 18 ASN HA H 5.655 -6.197 -1.586 1.00 . A A . 450 ASN HA 1 1 8 3580 1 1 18 ASN HB2 H 7.157 -4.898 0.688 1.00 . A A . 450 ASN HB2 1 1 8 3581 1 1 18 ASN HB3 H 7.893 -5.436 -0.815 1.00 . A A . 450 ASN HB3 1 1 8 3582 1 1 18 ASN HD21 H 5.892 -3.080 0.720 1.00 . A A . 450 ASN HD21 1 1 8 3583 1 1 18 ASN HD22 H 5.835 -1.959 -0.602 1.00 . A A . 450 ASN HD22 1 1 8 3584 1 1 18 ASN N N 4.645 -5.643 0.120 1.00 . A A . 450 ASN N 1 1 8 3585 1 1 18 ASN ND2 N 6.069 -2.832 -0.215 1.00 . A A . 450 ASN ND2 1 1 8 3586 1 1 18 ASN O O 7.271 -8.029 -0.491 1.00 . A A . 450 ASN O 1 1 8 3587 1 1 18 ASN OD1 O 6.925 -3.501 -2.177 1.00 . A A . 450 ASN OD1 1 1 8 3588 1 1 19 ARG C C 5.308 -10.350 0.854 1.00 . A A . 451 ARG C 1 1 8 3589 1 1 19 ARG CA C 5.957 -9.209 1.627 1.00 . A A . 451 ARG CA 1 1 8 3590 1 1 19 ARG CB C 5.524 -9.263 3.096 1.00 . A A . 451 ARG CB 1 1 8 3591 1 1 19 ARG CD C 7.818 -8.793 3.990 1.00 . A A . 451 ARG CD 1 1 8 3592 1 1 19 ARG CG C 6.354 -8.384 4.013 1.00 . A A . 451 ARG CG 1 1 8 3593 1 1 19 ARG CZ C 9.853 -7.541 4.607 1.00 . A A . 451 ARG CZ 1 1 8 3594 1 1 19 ARG H H 4.860 -7.416 1.378 1.00 . A A . 451 ARG H 1 1 8 3595 1 1 19 ARG HA H 7.026 -9.323 1.576 1.00 . A A . 451 ARG HA 1 1 8 3596 1 1 19 ARG HB2 H 4.494 -8.949 3.168 1.00 . A A . 451 ARG HB2 1 1 8 3597 1 1 19 ARG HB3 H 5.604 -10.284 3.445 1.00 . A A . 451 ARG HB3 1 1 8 3598 1 1 19 ARG HD2 H 7.893 -9.830 4.284 1.00 . A A . 451 ARG HD2 1 1 8 3599 1 1 19 ARG HD3 H 8.196 -8.677 2.984 1.00 . A A . 451 ARG HD3 1 1 8 3600 1 1 19 ARG HE H 8.238 -7.768 5.785 1.00 . A A . 451 ARG HE 1 1 8 3601 1 1 19 ARG HG2 H 6.271 -7.357 3.686 1.00 . A A . 451 ARG HG2 1 1 8 3602 1 1 19 ARG HG3 H 5.979 -8.475 5.020 1.00 . A A . 451 ARG HG3 1 1 8 3603 1 1 19 ARG HH11 H 9.893 -8.358 2.746 1.00 . A A . 451 ARG HH11 1 1 8 3604 1 1 19 ARG HH12 H 11.319 -7.472 3.206 1.00 . A A . 451 ARG HH12 1 1 8 3605 1 1 19 ARG HH21 H 10.128 -6.606 6.388 1.00 . A A . 451 ARG HH21 1 1 8 3606 1 1 19 ARG HH22 H 11.462 -6.507 5.279 1.00 . A A . 451 ARG HH22 1 1 8 3607 1 1 19 ARG N N 5.624 -7.923 1.029 1.00 . A A . 451 ARG N 1 1 8 3608 1 1 19 ARG NE N 8.630 -7.985 4.898 1.00 . A A . 451 ARG NE 1 1 8 3609 1 1 19 ARG NH1 N 10.399 -7.814 3.429 1.00 . A A . 451 ARG NH1 1 1 8 3610 1 1 19 ARG NH2 N 10.533 -6.826 5.493 1.00 . A A . 451 ARG NH2 1 1 8 3611 1 1 19 ARG O O 5.924 -11.394 0.636 1.00 . A A . 451 ARG O 1 1 8 3612 1 1 20 THR C C 3.007 -10.689 -1.682 1.00 . A A . 452 THR C 1 1 8 3613 1 1 20 THR CA C 3.326 -11.173 -0.269 1.00 . A A . 452 THR CA 1 1 8 3614 1 1 20 THR CB C 2.014 -11.516 0.465 1.00 . A A . 452 THR CB 1 1 8 3615 1 1 20 THR CG2 C 1.480 -12.878 0.032 1.00 . A A . 452 THR CG2 1 1 8 3616 1 1 20 THR H H 3.610 -9.313 0.696 1.00 . A A . 452 THR H 1 1 8 3617 1 1 20 THR HA H 3.935 -12.062 -0.324 1.00 . A A . 452 THR HA 1 1 8 3618 1 1 20 THR HB H 1.277 -10.764 0.224 1.00 . A A . 452 THR HB 1 1 8 3619 1 1 20 THR HG1 H 2.070 -12.401 2.237 1.00 . A A . 452 THR HG1 1 1 8 3620 1 1 20 THR HG21 H 0.559 -13.086 0.554 1.00 . A A . 452 THR HG21 1 1 8 3621 1 1 20 THR HG22 H 2.208 -13.642 0.266 1.00 . A A . 452 THR HG22 1 1 8 3622 1 1 20 THR HG23 H 1.296 -12.870 -1.032 1.00 . A A . 452 THR HG23 1 1 8 3623 1 1 20 THR N N 4.061 -10.155 0.464 1.00 . A A . 452 THR N 1 1 8 3624 1 1 20 THR O O 2.426 -11.416 -2.484 1.00 . A A . 452 THR O 1 1 8 3625 1 1 20 THR OG1 O 2.239 -11.517 1.881 1.00 . A A . 452 THR OG1 1 1 8 3626 1 1 21 LEU C C 1.561 -8.709 -3.373 1.00 . A A . 453 LEU C 1 1 8 3627 1 1 21 LEU CA C 3.078 -8.789 -3.230 1.00 . A A . 453 LEU CA 1 1 8 3628 1 1 21 LEU CB C 3.712 -9.481 -4.446 1.00 . A A . 453 LEU CB 1 1 8 3629 1 1 21 LEU CD1 C 5.756 -10.243 -5.681 1.00 . A A . 453 LEU CD1 1 1 8 3630 1 1 21 LEU CD2 C 5.851 -8.181 -4.275 1.00 . A A . 453 LEU CD2 1 1 8 3631 1 1 21 LEU CG C 5.241 -9.565 -4.423 1.00 . A A . 453 LEU CG 1 1 8 3632 1 1 21 LEU H H 3.993 -8.986 -1.332 1.00 . A A . 453 LEU H 1 1 8 3633 1 1 21 LEU HA H 3.462 -7.779 -3.170 1.00 . A A . 453 LEU HA 1 1 8 3634 1 1 21 LEU HB2 H 3.317 -10.486 -4.507 1.00 . A A . 453 LEU HB2 1 1 8 3635 1 1 21 LEU HB3 H 3.418 -8.943 -5.333 1.00 . A A . 453 LEU HB3 1 1 8 3636 1 1 21 LEU HD11 H 5.465 -9.665 -6.546 1.00 . A A . 453 LEU HD11 1 1 8 3637 1 1 21 LEU HD12 H 5.335 -11.235 -5.753 1.00 . A A . 453 LEU HD12 1 1 8 3638 1 1 21 LEU HD13 H 6.833 -10.311 -5.638 1.00 . A A . 453 LEU HD13 1 1 8 3639 1 1 21 LEU HD21 H 5.548 -7.563 -5.107 1.00 . A A . 453 LEU HD21 1 1 8 3640 1 1 21 LEU HD22 H 6.927 -8.264 -4.260 1.00 . A A . 453 LEU HD22 1 1 8 3641 1 1 21 LEU HD23 H 5.511 -7.736 -3.352 1.00 . A A . 453 LEU HD23 1 1 8 3642 1 1 21 LEU HG H 5.548 -10.159 -3.575 1.00 . A A . 453 LEU HG 1 1 8 3643 1 1 21 LEU N N 3.427 -9.458 -1.978 1.00 . A A . 453 LEU N 1 1 8 3644 1 1 21 LEU O O 0.941 -9.469 -4.121 1.00 . A A . 453 LEU O 1 1 8 3645 1 1 22 GLU C C -0.964 -6.307 -2.630 1.00 . A A . 454 GLU C 1 1 8 3646 1 1 22 GLU CA C -0.473 -7.742 -2.451 1.00 . A A . 454 GLU CA 1 1 8 3647 1 1 22 GLU CB C -0.829 -8.238 -1.047 1.00 . A A . 454 GLU CB 1 1 8 3648 1 1 22 GLU CD C -2.629 -8.094 0.701 1.00 . A A . 454 GLU CD 1 1 8 3649 1 1 22 GLU CG C -2.312 -8.322 -0.761 1.00 . A A . 454 GLU CG 1 1 8 3650 1 1 22 GLU H H 1.531 -7.150 -2.141 1.00 . A A . 454 GLU H 1 1 8 3651 1 1 22 GLU HA H -0.933 -8.380 -3.189 1.00 . A A . 454 GLU HA 1 1 8 3652 1 1 22 GLU HB2 H -0.407 -9.222 -0.911 1.00 . A A . 454 GLU HB2 1 1 8 3653 1 1 22 GLU HB3 H -0.385 -7.569 -0.323 1.00 . A A . 454 GLU HB3 1 1 8 3654 1 1 22 GLU HG2 H -2.824 -7.573 -1.348 1.00 . A A . 454 GLU HG2 1 1 8 3655 1 1 22 GLU HG3 H -2.662 -9.303 -1.038 1.00 . A A . 454 GLU HG3 1 1 8 3656 1 1 22 GLU N N 0.974 -7.807 -2.612 1.00 . A A . 454 GLU N 1 1 8 3657 1 1 22 GLU O O -0.250 -5.358 -2.314 1.00 . A A . 454 GLU O 1 1 8 3658 1 1 22 GLU OE1 O -1.984 -8.729 1.562 1.00 . A A . 454 GLU OE1 1 1 8 3659 1 1 22 GLU OE2 O -3.512 -7.262 0.989 1.00 . A A . 454 GLU OE2 1 1 8 3660 1 1 23 SER C C -3.708 -4.605 -2.024 1.00 . A A . 455 SER C 1 1 8 3661 1 1 23 SER CA C -2.793 -4.841 -3.231 1.00 . A A . 455 SER CA 1 1 8 3662 1 1 23 SER CB C -3.567 -4.742 -4.553 1.00 . A A . 455 SER CB 1 1 8 3663 1 1 23 SER H H -2.683 -6.939 -3.413 1.00 . A A . 455 SER H 1 1 8 3664 1 1 23 SER HA H -2.003 -4.104 -3.224 1.00 . A A . 455 SER HA 1 1 8 3665 1 1 23 SER HB2 H -2.929 -5.064 -5.361 1.00 . A A . 455 SER HB2 1 1 8 3666 1 1 23 SER HB3 H -4.434 -5.384 -4.506 1.00 . A A . 455 SER HB3 1 1 8 3667 1 1 23 SER HG H -4.813 -3.446 -5.336 1.00 . A A . 455 SER HG 1 1 8 3668 1 1 23 SER N N -2.181 -6.153 -3.121 1.00 . A A . 455 SER N 1 1 8 3669 1 1 23 SER O O -4.832 -5.111 -1.973 1.00 . A A . 455 SER O 1 1 8 3670 1 1 23 SER OG O -3.993 -3.419 -4.818 1.00 . A A . 455 SER OG 1 1 8 3671 1 1 24 THR C C -4.531 -2.287 0.288 1.00 . A A . 456 THR C 1 1 8 3672 1 1 24 THR CA C -3.911 -3.683 0.223 1.00 . A A . 456 THR CA 1 1 8 3673 1 1 24 THR CB C -2.953 -3.872 1.418 1.00 . A A . 456 THR CB 1 1 8 3674 1 1 24 THR CG2 C -3.724 -4.033 2.720 1.00 . A A . 456 THR CG2 1 1 8 3675 1 1 24 THR H H -2.323 -3.456 -1.150 1.00 . A A . 456 THR H 1 1 8 3676 1 1 24 THR HA H -4.695 -4.422 0.288 1.00 . A A . 456 THR HA 1 1 8 3677 1 1 24 THR HB H -2.321 -2.997 1.496 1.00 . A A . 456 THR HB 1 1 8 3678 1 1 24 THR HG1 H -2.691 -5.818 1.147 1.00 . A A . 456 THR HG1 1 1 8 3679 1 1 24 THR HG21 H -4.319 -3.149 2.898 1.00 . A A . 456 THR HG21 1 1 8 3680 1 1 24 THR HG22 H -3.030 -4.170 3.536 1.00 . A A . 456 THR HG22 1 1 8 3681 1 1 24 THR HG23 H -4.372 -4.894 2.652 1.00 . A A . 456 THR HG23 1 1 8 3682 1 1 24 THR N N -3.201 -3.877 -1.035 1.00 . A A . 456 THR N 1 1 8 3683 1 1 24 THR O O -3.826 -1.280 0.308 1.00 . A A . 456 THR O 1 1 8 3684 1 1 24 THR OG1 O -2.130 -5.027 1.204 1.00 . A A . 456 THR OG1 1 1 8 3685 1 1 25 TRP C C -7.359 -0.741 1.573 1.00 . A A . 457 TRP C 1 1 8 3686 1 1 25 TRP CA C -6.535 -0.925 0.308 1.00 . A A . 457 TRP CA 1 1 8 3687 1 1 25 TRP CB C -7.364 -0.774 -0.972 1.00 . A A . 457 TRP CB 1 1 8 3688 1 1 25 TRP CD1 C -5.687 -1.671 -2.672 1.00 . A A . 457 TRP CD1 1 1 8 3689 1 1 25 TRP CD2 C -6.223 0.475 -2.989 1.00 . A A . 457 TRP CD2 1 1 8 3690 1 1 25 TRP CE2 C -5.261 0.097 -3.945 1.00 . A A . 457 TRP CE2 1 1 8 3691 1 1 25 TRP CE3 C -6.709 1.785 -3.008 1.00 . A A . 457 TRP CE3 1 1 8 3692 1 1 25 TRP CG C -6.467 -0.676 -2.170 1.00 . A A . 457 TRP CG 1 1 8 3693 1 1 25 TRP CH2 C -5.266 2.249 -4.902 1.00 . A A . 457 TRP CH2 1 1 8 3694 1 1 25 TRP CZ2 C -4.774 0.972 -4.902 1.00 . A A . 457 TRP CZ2 1 1 8 3695 1 1 25 TRP CZ3 C -6.232 2.657 -3.968 1.00 . A A . 457 TRP CZ3 1 1 8 3696 1 1 25 TRP H H -6.380 -3.044 0.297 1.00 . A A . 457 TRP H 1 1 8 3697 1 1 25 TRP HA H -5.765 -0.166 0.305 1.00 . A A . 457 TRP HA 1 1 8 3698 1 1 25 TRP HB2 H -8.007 -1.635 -1.093 1.00 . A A . 457 TRP HB2 1 1 8 3699 1 1 25 TRP HB3 H -7.960 0.125 -0.917 1.00 . A A . 457 TRP HB3 1 1 8 3700 1 1 25 TRP HD1 H -5.648 -2.674 -2.271 1.00 . A A . 457 TRP HD1 1 1 8 3701 1 1 25 TRP HE1 H -4.304 -1.744 -4.245 1.00 . A A . 457 TRP HE1 1 1 8 3702 1 1 25 TRP HE3 H -7.452 2.115 -2.298 1.00 . A A . 457 TRP HE3 1 1 8 3703 1 1 25 TRP HH2 H -4.920 2.962 -5.634 1.00 . A A . 457 TRP HH2 1 1 8 3704 1 1 25 TRP HZ2 H -4.010 0.672 -5.606 1.00 . A A . 457 TRP HZ2 1 1 8 3705 1 1 25 TRP HZ3 H -6.595 3.673 -4.000 1.00 . A A . 457 TRP HZ3 1 1 8 3706 1 1 25 TRP N N -5.853 -2.217 0.304 1.00 . A A . 457 TRP N 1 1 8 3707 1 1 25 TRP NE1 N -4.949 -1.209 -3.723 1.00 . A A . 457 TRP NE1 1 1 8 3708 1 1 25 TRP O O -8.117 0.221 1.712 1.00 . A A . 457 TRP O 1 1 8 3709 1 1 26 GLU C C -6.509 -1.563 4.815 1.00 . A A . 458 GLU C 1 1 8 3710 1 1 26 GLU CA C -7.688 -1.521 3.855 1.00 . A A . 458 GLU CA 1 1 8 3711 1 1 26 GLU CB C -8.681 -2.631 4.190 1.00 . A A . 458 GLU CB 1 1 8 3712 1 1 26 GLU CD C -10.927 -3.666 3.730 1.00 . A A . 458 GLU CD 1 1 8 3713 1 1 26 GLU CG C -9.885 -2.672 3.269 1.00 . A A . 458 GLU CG 1 1 8 3714 1 1 26 GLU H H -6.675 -2.475 2.278 1.00 . A A . 458 GLU H 1 1 8 3715 1 1 26 GLU HA H -8.177 -0.559 3.933 1.00 . A A . 458 GLU HA 1 1 8 3716 1 1 26 GLU HB2 H -8.173 -3.583 4.124 1.00 . A A . 458 GLU HB2 1 1 8 3717 1 1 26 GLU HB3 H -9.033 -2.492 5.202 1.00 . A A . 458 GLU HB3 1 1 8 3718 1 1 26 GLU HG2 H -10.334 -1.689 3.239 1.00 . A A . 458 GLU HG2 1 1 8 3719 1 1 26 GLU HG3 H -9.558 -2.947 2.277 1.00 . A A . 458 GLU HG3 1 1 8 3720 1 1 26 GLU N N -7.181 -1.668 2.503 1.00 . A A . 458 GLU N 1 1 8 3721 1 1 26 GLU O O -5.696 -2.483 4.747 1.00 . A A . 458 GLU O 1 1 8 3722 1 1 26 GLU OE1 O -10.734 -4.882 3.514 1.00 . A A . 458 GLU OE1 1 1 8 3723 1 1 26 GLU OE2 O -11.945 -3.237 4.311 1.00 . A A . 458 GLU OE2 1 1 8 3724 1 1 27 LYS C C -5.221 -1.658 7.570 1.00 . A A . 459 LYS C 1 1 8 3725 1 1 27 LYS CA C -5.266 -0.482 6.599 1.00 . A A . 459 LYS CA 1 1 8 3726 1 1 27 LYS CB C -5.292 0.830 7.383 1.00 . A A . 459 LYS CB 1 1 8 3727 1 1 27 LYS CD C -4.772 3.291 7.339 1.00 . A A . 459 LYS CD 1 1 8 3728 1 1 27 LYS CE C -3.492 3.117 8.143 1.00 . A A . 459 LYS CE 1 1 8 3729 1 1 27 LYS CG C -5.085 2.055 6.514 1.00 . A A . 459 LYS CG 1 1 8 3730 1 1 27 LYS H H -7.125 0.096 5.751 1.00 . A A . 459 LYS H 1 1 8 3731 1 1 27 LYS HA H -4.373 -0.504 5.991 1.00 . A A . 459 LYS HA 1 1 8 3732 1 1 27 LYS HB2 H -6.248 0.922 7.877 1.00 . A A . 459 LYS HB2 1 1 8 3733 1 1 27 LYS HB3 H -4.510 0.806 8.128 1.00 . A A . 459 LYS HB3 1 1 8 3734 1 1 27 LYS HD2 H -4.647 4.129 6.668 1.00 . A A . 459 LYS HD2 1 1 8 3735 1 1 27 LYS HD3 H -5.592 3.483 8.015 1.00 . A A . 459 LYS HD3 1 1 8 3736 1 1 27 LYS HE2 H -3.601 2.254 8.783 1.00 . A A . 459 LYS HE2 1 1 8 3737 1 1 27 LYS HE3 H -2.673 2.953 7.457 1.00 . A A . 459 LYS HE3 1 1 8 3738 1 1 27 LYS HG2 H -4.263 1.869 5.840 1.00 . A A . 459 LYS HG2 1 1 8 3739 1 1 27 LYS HG3 H -5.985 2.234 5.944 1.00 . A A . 459 LYS HG3 1 1 8 3740 1 1 27 LYS HZ1 H -3.179 5.173 8.400 1.00 . A A . 459 LYS HZ1 1 1 8 3741 1 1 27 LYS HZ2 H -2.257 4.197 9.436 1.00 . A A . 459 LYS HZ2 1 1 8 3742 1 1 27 LYS HZ3 H -3.912 4.415 9.732 1.00 . A A . 459 LYS HZ3 1 1 8 3743 1 1 27 LYS N N -6.408 -0.577 5.697 1.00 . A A . 459 LYS N 1 1 8 3744 1 1 27 LYS NZ N -3.191 4.307 8.983 1.00 . A A . 459 LYS NZ 1 1 8 3745 1 1 27 LYS O O -6.178 -1.893 8.312 1.00 . A A . 459 LYS O 1 1 8 3746 1 1 28 PRO C C -3.890 -3.083 9.947 1.00 . A A . 460 PRO C 1 1 8 3747 1 1 28 PRO CA C -3.906 -3.531 8.488 1.00 . A A . 460 PRO CA 1 1 8 3748 1 1 28 PRO CB C -2.541 -4.101 8.083 1.00 . A A . 460 PRO CB 1 1 8 3749 1 1 28 PRO CD C -2.957 -2.214 6.677 1.00 . A A . 460 PRO CD 1 1 8 3750 1 1 28 PRO CG C -1.864 -3.000 7.343 1.00 . A A . 460 PRO CG 1 1 8 3751 1 1 28 PRO HA H -4.668 -4.286 8.357 1.00 . A A . 460 PRO HA 1 1 8 3752 1 1 28 PRO HB2 H -1.989 -4.379 8.967 1.00 . A A . 460 PRO HB2 1 1 8 3753 1 1 28 PRO HB3 H -2.682 -4.968 7.453 1.00 . A A . 460 PRO HB3 1 1 8 3754 1 1 28 PRO HD2 H -2.687 -1.171 6.613 1.00 . A A . 460 PRO HD2 1 1 8 3755 1 1 28 PRO HD3 H -3.165 -2.613 5.694 1.00 . A A . 460 PRO HD3 1 1 8 3756 1 1 28 PRO HG2 H -1.321 -2.374 8.035 1.00 . A A . 460 PRO HG2 1 1 8 3757 1 1 28 PRO HG3 H -1.194 -3.413 6.603 1.00 . A A . 460 PRO HG3 1 1 8 3758 1 1 28 PRO N N -4.108 -2.407 7.572 1.00 . A A . 460 PRO N 1 1 8 3759 1 1 28 PRO O O -4.858 -3.396 10.671 1.00 . A A . 460 PRO O 1 1 8 3760 1 1 28 PRO OXT O -2.921 -2.402 10.357 1.00 . A A . 460 PRO OXT 1 1 9 3761 1 1 1 SER C C 8.299 -2.317 4.668 1.00 . A A . 433 SER C 1 1 9 3762 1 1 1 SER CA C 9.058 -0.996 4.640 1.00 . A A . 433 SER CA 1 1 9 3763 1 1 1 SER CB C 8.949 -0.359 3.255 1.00 . A A . 433 SER CB 1 1 9 3764 1 1 1 SER H1 H 10.912 -1.873 4.316 1.00 . A A . 433 SER H1 1 1 9 3765 1 1 1 SER H2 H 10.548 -1.601 5.953 1.00 . A A . 433 SER H2 1 1 9 3766 1 1 1 SER H3 H 10.993 -0.306 4.954 1.00 . A A . 433 SER H3 1 1 9 3767 1 1 1 SER HA H 8.623 -0.330 5.372 1.00 . A A . 433 SER HA 1 1 9 3768 1 1 1 SER HB2 H 9.413 -1.008 2.526 1.00 . A A . 433 SER HB2 1 1 9 3769 1 1 1 SER HB3 H 7.907 -0.223 3.003 1.00 . A A . 433 SER HB3 1 1 9 3770 1 1 1 SER HG H 8.981 1.565 2.865 1.00 . A A . 433 SER HG 1 1 9 3771 1 1 1 SER N N 10.476 -1.208 4.989 1.00 . A A . 433 SER N 1 1 9 3772 1 1 1 SER O O 8.601 -3.236 3.908 1.00 . A A . 433 SER O 1 1 9 3773 1 1 1 SER OG O 9.596 0.902 3.222 1.00 . A A . 433 SER OG 1 1 9 3774 1 1 2 GLU C C 5.210 -3.307 4.823 1.00 . A A . 434 GLU C 1 1 9 3775 1 1 2 GLU CA C 6.469 -3.577 5.642 1.00 . A A . 434 GLU CA 1 1 9 3776 1 1 2 GLU CB C 6.100 -3.875 7.100 1.00 . A A . 434 GLU CB 1 1 9 3777 1 1 2 GLU CD C 6.730 -6.313 7.320 1.00 . A A . 434 GLU CD 1 1 9 3778 1 1 2 GLU CG C 5.607 -5.293 7.341 1.00 . A A . 434 GLU CG 1 1 9 3779 1 1 2 GLU H H 7.193 -1.670 6.203 1.00 . A A . 434 GLU H 1 1 9 3780 1 1 2 GLU HA H 6.995 -4.422 5.220 1.00 . A A . 434 GLU HA 1 1 9 3781 1 1 2 GLU HB2 H 6.971 -3.711 7.717 1.00 . A A . 434 GLU HB2 1 1 9 3782 1 1 2 GLU HB3 H 5.322 -3.191 7.405 1.00 . A A . 434 GLU HB3 1 1 9 3783 1 1 2 GLU HG2 H 5.121 -5.336 8.305 1.00 . A A . 434 GLU HG2 1 1 9 3784 1 1 2 GLU HG3 H 4.897 -5.547 6.569 1.00 . A A . 434 GLU HG3 1 1 9 3785 1 1 2 GLU N N 7.332 -2.412 5.567 1.00 . A A . 434 GLU N 1 1 9 3786 1 1 2 GLU O O 4.706 -4.179 4.112 1.00 . A A . 434 GLU O 1 1 9 3787 1 1 2 GLU OE1 O 7.039 -6.851 6.239 1.00 . A A . 434 GLU OE1 1 1 9 3788 1 1 2 GLU OE2 O 7.308 -6.592 8.394 1.00 . A A . 434 GLU OE2 1 1 9 3789 1 1 3 TRP C C 3.872 -0.284 3.528 1.00 . A A . 435 TRP C 1 1 9 3790 1 1 3 TRP CA C 3.553 -1.626 4.185 1.00 . A A . 435 TRP CA 1 1 9 3791 1 1 3 TRP CB C 2.329 -1.456 5.102 1.00 . A A . 435 TRP CB 1 1 9 3792 1 1 3 TRP CD1 C 2.019 -2.678 7.333 1.00 . A A . 435 TRP CD1 1 1 9 3793 1 1 3 TRP CD2 C 1.712 -3.972 5.535 1.00 . A A . 435 TRP CD2 1 1 9 3794 1 1 3 TRP CE2 C 1.517 -4.753 6.687 1.00 . A A . 435 TRP CE2 1 1 9 3795 1 1 3 TRP CE3 C 1.573 -4.573 4.284 1.00 . A A . 435 TRP CE3 1 1 9 3796 1 1 3 TRP CG C 2.031 -2.645 5.969 1.00 . A A . 435 TRP CG 1 1 9 3797 1 1 3 TRP CH2 C 1.065 -6.668 5.382 1.00 . A A . 435 TRP CH2 1 1 9 3798 1 1 3 TRP CZ2 C 1.191 -6.106 6.622 1.00 . A A . 435 TRP CZ2 1 1 9 3799 1 1 3 TRP CZ3 C 1.253 -5.915 4.223 1.00 . A A . 435 TRP CZ3 1 1 9 3800 1 1 3 TRP H H 5.146 -1.450 5.559 1.00 . A A . 435 TRP H 1 1 9 3801 1 1 3 TRP HA H 3.335 -2.360 3.424 1.00 . A A . 435 TRP HA 1 1 9 3802 1 1 3 TRP HB2 H 2.496 -0.610 5.752 1.00 . A A . 435 TRP HB2 1 1 9 3803 1 1 3 TRP HB3 H 1.459 -1.263 4.492 1.00 . A A . 435 TRP HB3 1 1 9 3804 1 1 3 TRP HD1 H 2.221 -1.825 7.963 1.00 . A A . 435 TRP HD1 1 1 9 3805 1 1 3 TRP HE1 H 1.633 -4.216 8.711 1.00 . A A . 435 TRP HE1 1 1 9 3806 1 1 3 TRP HE3 H 1.713 -4.010 3.373 1.00 . A A . 435 TRP HE3 1 1 9 3807 1 1 3 TRP HH2 H 0.822 -7.716 5.281 1.00 . A A . 435 TRP HH2 1 1 9 3808 1 1 3 TRP HZ2 H 1.043 -6.702 7.511 1.00 . A A . 435 TRP HZ2 1 1 9 3809 1 1 3 TRP HZ3 H 1.156 -6.400 3.261 1.00 . A A . 435 TRP HZ3 1 1 9 3810 1 1 3 TRP N N 4.712 -2.077 4.941 1.00 . A A . 435 TRP N 1 1 9 3811 1 1 3 TRP NE1 N 1.706 -3.941 7.774 1.00 . A A . 435 TRP NE1 1 1 9 3812 1 1 3 TRP O O 4.232 0.670 4.219 1.00 . A A . 435 TRP O 1 1 9 3813 1 1 4 THR C C 2.776 1.903 1.407 1.00 . A A . 436 THR C 1 1 9 3814 1 1 4 THR CA C 4.026 1.046 1.511 1.00 . A A . 436 THR CA 1 1 9 3815 1 1 4 THR CB C 4.579 0.795 0.091 1.00 . A A . 436 THR CB 1 1 9 3816 1 1 4 THR CG2 C 4.763 2.108 -0.672 1.00 . A A . 436 THR CG2 1 1 9 3817 1 1 4 THR H H 3.455 -0.983 1.696 1.00 . A A . 436 THR H 1 1 9 3818 1 1 4 THR HA H 4.775 1.584 2.075 1.00 . A A . 436 THR HA 1 1 9 3819 1 1 4 THR HB H 3.869 0.184 -0.447 1.00 . A A . 436 THR HB 1 1 9 3820 1 1 4 THR HG1 H 5.680 -0.839 -0.014 1.00 . A A . 436 THR HG1 1 1 9 3821 1 1 4 THR HG21 H 5.451 2.745 -0.136 1.00 . A A . 436 THR HG21 1 1 9 3822 1 1 4 THR HG22 H 3.807 2.612 -0.765 1.00 . A A . 436 THR HG22 1 1 9 3823 1 1 4 THR HG23 H 5.154 1.903 -1.657 1.00 . A A . 436 THR HG23 1 1 9 3824 1 1 4 THR N N 3.746 -0.200 2.212 1.00 . A A . 436 THR N 1 1 9 3825 1 1 4 THR O O 1.875 1.611 0.619 1.00 . A A . 436 THR O 1 1 9 3826 1 1 4 THR OG1 O 5.827 0.094 0.170 1.00 . A A . 436 THR OG1 1 1 9 3827 1 1 5 GLU C C 2.080 5.007 1.116 1.00 . A A . 437 GLU C 1 1 9 3828 1 1 5 GLU CA C 1.642 3.924 2.085 1.00 . A A . 437 GLU CA 1 1 9 3829 1 1 5 GLU CB C 1.262 4.543 3.438 1.00 . A A . 437 GLU CB 1 1 9 3830 1 1 5 GLU CD C 0.230 4.173 5.713 1.00 . A A . 437 GLU CD 1 1 9 3831 1 1 5 GLU CG C 0.894 3.528 4.512 1.00 . A A . 437 GLU CG 1 1 9 3832 1 1 5 GLU H H 3.398 3.079 2.898 1.00 . A A . 437 GLU H 1 1 9 3833 1 1 5 GLU HA H 0.785 3.417 1.671 1.00 . A A . 437 GLU HA 1 1 9 3834 1 1 5 GLU HB2 H 2.099 5.122 3.799 1.00 . A A . 437 GLU HB2 1 1 9 3835 1 1 5 GLU HB3 H 0.418 5.202 3.294 1.00 . A A . 437 GLU HB3 1 1 9 3836 1 1 5 GLU HG2 H 0.216 2.801 4.089 1.00 . A A . 437 GLU HG2 1 1 9 3837 1 1 5 GLU HG3 H 1.794 3.032 4.841 1.00 . A A . 437 GLU HG3 1 1 9 3838 1 1 5 GLU N N 2.712 2.953 2.212 1.00 . A A . 437 GLU N 1 1 9 3839 1 1 5 GLU O O 2.750 5.968 1.498 1.00 . A A . 437 GLU O 1 1 9 3840 1 1 5 GLU OE1 O 0.924 4.880 6.479 1.00 . A A . 437 GLU OE1 1 1 9 3841 1 1 5 GLU OE2 O -0.994 3.986 5.894 1.00 . A A . 437 GLU OE2 1 1 9 3842 1 1 6 ARG C C 1.013 6.611 -1.632 1.00 . A A . 438 ARG C 1 1 9 3843 1 1 6 ARG CA C 2.193 5.735 -1.182 1.00 . A A . 438 ARG CA 1 1 9 3844 1 1 6 ARG CB C 2.754 4.954 -2.372 1.00 . A A . 438 ARG CB 1 1 9 3845 1 1 6 ARG CD C 3.873 5.020 -4.620 1.00 . A A . 438 ARG CD 1 1 9 3846 1 1 6 ARG CG C 3.245 5.839 -3.507 1.00 . A A . 438 ARG CG 1 1 9 3847 1 1 6 ARG CZ C 5.666 3.329 -4.801 1.00 . A A . 438 ARG CZ 1 1 9 3848 1 1 6 ARG H H 1.192 4.047 -0.395 1.00 . A A . 438 ARG H 1 1 9 3849 1 1 6 ARG HA H 2.981 6.335 -0.754 1.00 . A A . 438 ARG HA 1 1 9 3850 1 1 6 ARG HB2 H 3.581 4.348 -2.032 1.00 . A A . 438 ARG HB2 1 1 9 3851 1 1 6 ARG HB3 H 1.982 4.306 -2.759 1.00 . A A . 438 ARG HB3 1 1 9 3852 1 1 6 ARG HD2 H 3.182 4.240 -4.906 1.00 . A A . 438 ARG HD2 1 1 9 3853 1 1 6 ARG HD3 H 4.053 5.665 -5.466 1.00 . A A . 438 ARG HD3 1 1 9 3854 1 1 6 ARG HE H 5.640 4.838 -3.485 1.00 . A A . 438 ARG HE 1 1 9 3855 1 1 6 ARG HG2 H 2.409 6.391 -3.909 1.00 . A A . 438 ARG HG2 1 1 9 3856 1 1 6 ARG HG3 H 3.981 6.528 -3.119 1.00 . A A . 438 ARG HG3 1 1 9 3857 1 1 6 ARG HH11 H 4.076 3.001 -6.020 1.00 . A A . 438 ARG HH11 1 1 9 3858 1 1 6 ARG HH12 H 5.389 1.872 -6.186 1.00 . A A . 438 ARG HH12 1 1 9 3859 1 1 6 ARG HH21 H 7.368 3.380 -3.700 1.00 . A A . 438 ARG HH21 1 1 9 3860 1 1 6 ARG HH22 H 7.283 2.099 -4.877 1.00 . A A . 438 ARG HH22 1 1 9 3861 1 1 6 ARG N N 1.755 4.817 -0.150 1.00 . A A . 438 ARG N 1 1 9 3862 1 1 6 ARG NE N 5.137 4.403 -4.214 1.00 . A A . 438 ARG NE 1 1 9 3863 1 1 6 ARG NH1 N 4.991 2.682 -5.744 1.00 . A A . 438 ARG NH1 1 1 9 3864 1 1 6 ARG NH2 N 6.864 2.897 -4.426 1.00 . A A . 438 ARG NH2 1 1 9 3865 1 1 6 ARG O O -0.064 6.080 -1.912 1.00 . A A . 438 ARG O 1 1 9 3866 1 1 7 LYS C C 0.015 8.967 -3.594 1.00 . A A . 439 LYS C 1 1 9 3867 1 1 7 LYS CA C 0.084 8.797 -2.085 1.00 . A A . 439 LYS CA 1 1 9 3868 1 1 7 LYS CB C 0.218 10.160 -1.395 1.00 . A A . 439 LYS CB 1 1 9 3869 1 1 7 LYS CD C -0.817 12.401 -0.899 1.00 . A A . 439 LYS CD 1 1 9 3870 1 1 7 LYS CE C 0.458 13.188 -1.169 1.00 . A A . 439 LYS CE 1 1 9 3871 1 1 7 LYS CG C -0.901 11.132 -1.735 1.00 . A A . 439 LYS CG 1 1 9 3872 1 1 7 LYS H H 2.074 8.345 -1.590 1.00 . A A . 439 LYS H 1 1 9 3873 1 1 7 LYS HA H -0.825 8.322 -1.748 1.00 . A A . 439 LYS HA 1 1 9 3874 1 1 7 LYS HB2 H 0.221 10.010 -0.325 1.00 . A A . 439 LYS HB2 1 1 9 3875 1 1 7 LYS HB3 H 1.155 10.609 -1.688 1.00 . A A . 439 LYS HB3 1 1 9 3876 1 1 7 LYS HD2 H -1.665 13.026 -1.130 1.00 . A A . 439 LYS HD2 1 1 9 3877 1 1 7 LYS HD3 H -0.845 12.129 0.146 1.00 . A A . 439 LYS HD3 1 1 9 3878 1 1 7 LYS HE2 H 0.504 14.018 -0.482 1.00 . A A . 439 LYS HE2 1 1 9 3879 1 1 7 LYS HE3 H 1.306 12.539 -1.003 1.00 . A A . 439 LYS HE3 1 1 9 3880 1 1 7 LYS HG2 H -0.828 11.397 -2.780 1.00 . A A . 439 LYS HG2 1 1 9 3881 1 1 7 LYS HG3 H -1.851 10.652 -1.549 1.00 . A A . 439 LYS HG3 1 1 9 3882 1 1 7 LYS HZ1 H 0.805 12.954 -3.220 1.00 . A A . 439 LYS HZ1 1 1 9 3883 1 1 7 LYS HZ2 H 1.209 14.489 -2.621 1.00 . A A . 439 LYS HZ2 1 1 9 3884 1 1 7 LYS HZ3 H -0.418 14.072 -2.851 1.00 . A A . 439 LYS HZ3 1 1 9 3885 1 1 7 LYS N N 1.188 7.937 -1.727 1.00 . A A . 439 LYS N 1 1 9 3886 1 1 7 LYS NZ N 0.518 13.711 -2.560 1.00 . A A . 439 LYS NZ 1 1 9 3887 1 1 7 LYS O O 0.932 9.503 -4.216 1.00 . A A . 439 LYS O 1 1 9 3888 1 1 8 THR C C -2.080 9.973 -5.829 1.00 . A A . 440 THR C 1 1 9 3889 1 1 8 THR CA C -1.312 8.672 -5.592 1.00 . A A . 440 THR CA 1 1 9 3890 1 1 8 THR CB C -2.120 7.483 -6.149 1.00 . A A . 440 THR CB 1 1 9 3891 1 1 8 THR CG2 C -1.469 6.921 -7.400 1.00 . A A . 440 THR CG2 1 1 9 3892 1 1 8 THR H H -1.700 7.969 -3.640 1.00 . A A . 440 THR H 1 1 9 3893 1 1 8 THR HA H -0.361 8.716 -6.103 1.00 . A A . 440 THR HA 1 1 9 3894 1 1 8 THR HB H -3.114 7.821 -6.393 1.00 . A A . 440 THR HB 1 1 9 3895 1 1 8 THR HG1 H -2.874 6.697 -4.500 1.00 . A A . 440 THR HG1 1 1 9 3896 1 1 8 THR HG21 H -0.412 6.787 -7.225 1.00 . A A . 440 THR HG21 1 1 9 3897 1 1 8 THR HG22 H -1.617 7.607 -8.222 1.00 . A A . 440 THR HG22 1 1 9 3898 1 1 8 THR HG23 H -1.917 5.968 -7.639 1.00 . A A . 440 THR HG23 1 1 9 3899 1 1 8 THR N N -1.067 8.494 -4.173 1.00 . A A . 440 THR N 1 1 9 3900 1 1 8 THR O O -2.984 10.314 -5.059 1.00 . A A . 440 THR O 1 1 9 3901 1 1 8 THR OG1 O -2.209 6.453 -5.158 1.00 . A A . 440 THR OG1 1 1 9 3902 1 1 9 ALA C C -3.761 12.011 -7.424 1.00 . A A . 441 ALA C 1 1 9 3903 1 1 9 ALA CA C -2.257 12.033 -7.165 1.00 . A A . 441 ALA CA 1 1 9 3904 1 1 9 ALA CB C -1.531 12.668 -8.342 1.00 . A A . 441 ALA CB 1 1 9 3905 1 1 9 ALA H H -1.068 10.309 -7.530 1.00 . A A . 441 ALA H 1 1 9 3906 1 1 9 ALA HA H -2.066 12.643 -6.294 1.00 . A A . 441 ALA HA 1 1 9 3907 1 1 9 ALA HB1 H -1.716 12.087 -9.234 1.00 . A A . 441 ALA HB1 1 1 9 3908 1 1 9 ALA HB2 H -0.469 12.689 -8.141 1.00 . A A . 441 ALA HB2 1 1 9 3909 1 1 9 ALA HB3 H -1.890 13.675 -8.488 1.00 . A A . 441 ALA HB3 1 1 9 3910 1 1 9 ALA N N -1.718 10.693 -6.896 1.00 . A A . 441 ALA N 1 1 9 3911 1 1 9 ALA O O -4.409 13.060 -7.471 1.00 . A A . 441 ALA O 1 1 9 3912 1 1 10 ASP C C -6.485 11.017 -6.443 1.00 . A A . 442 ASP C 1 1 9 3913 1 1 10 ASP CA C -5.752 10.640 -7.736 1.00 . A A . 442 ASP CA 1 1 9 3914 1 1 10 ASP CB C -6.058 9.189 -8.115 1.00 . A A . 442 ASP CB 1 1 9 3915 1 1 10 ASP CG C -7.533 8.938 -8.350 1.00 . A A . 442 ASP CG 1 1 9 3916 1 1 10 ASP H H -3.726 10.029 -7.621 1.00 . A A . 442 ASP H 1 1 9 3917 1 1 10 ASP HA H -6.086 11.290 -8.530 1.00 . A A . 442 ASP HA 1 1 9 3918 1 1 10 ASP HB2 H -5.522 8.941 -9.017 1.00 . A A . 442 ASP HB2 1 1 9 3919 1 1 10 ASP HB3 H -5.726 8.541 -7.316 1.00 . A A . 442 ASP HB3 1 1 9 3920 1 1 10 ASP N N -4.311 10.816 -7.585 1.00 . A A . 442 ASP N 1 1 9 3921 1 1 10 ASP O O -7.713 11.104 -6.409 1.00 . A A . 442 ASP O 1 1 9 3922 1 1 10 ASP OD1 O -8.026 9.236 -9.457 1.00 . A A . 442 ASP OD1 1 1 9 3923 1 1 10 ASP OD2 O -8.201 8.412 -7.437 1.00 . A A . 442 ASP OD2 1 1 9 3924 1 1 11 GLY C C -6.595 10.399 -3.259 1.00 . A A . 443 GLY C 1 1 9 3925 1 1 11 GLY CA C -6.298 11.610 -4.108 1.00 . A A . 443 GLY CA 1 1 9 3926 1 1 11 GLY H H -4.744 11.170 -5.473 1.00 . A A . 443 GLY H 1 1 9 3927 1 1 11 GLY HA2 H -5.606 12.248 -3.579 1.00 . A A . 443 GLY HA2 1 1 9 3928 1 1 11 GLY HA3 H -7.216 12.151 -4.279 1.00 . A A . 443 GLY HA3 1 1 9 3929 1 1 11 GLY N N -5.719 11.248 -5.385 1.00 . A A . 443 GLY N 1 1 9 3930 1 1 11 GLY O O -7.497 10.416 -2.424 1.00 . A A . 443 GLY O 1 1 9 3931 1 1 12 LYS C C -4.618 7.511 -2.408 1.00 . A A . 444 LYS C 1 1 9 3932 1 1 12 LYS CA C -5.978 8.119 -2.708 1.00 . A A . 444 LYS CA 1 1 9 3933 1 1 12 LYS CB C -6.859 7.104 -3.449 1.00 . A A . 444 LYS CB 1 1 9 3934 1 1 12 LYS CD C -6.979 5.485 -5.362 1.00 . A A . 444 LYS CD 1 1 9 3935 1 1 12 LYS CE C -6.710 5.244 -6.838 1.00 . A A . 444 LYS CE 1 1 9 3936 1 1 12 LYS CG C -6.440 6.827 -4.887 1.00 . A A . 444 LYS CG 1 1 9 3937 1 1 12 LYS H H -5.129 9.393 -4.160 1.00 . A A . 444 LYS H 1 1 9 3938 1 1 12 LYS HA H -6.456 8.377 -1.772 1.00 . A A . 444 LYS HA 1 1 9 3939 1 1 12 LYS HB2 H -6.832 6.170 -2.910 1.00 . A A . 444 LYS HB2 1 1 9 3940 1 1 12 LYS HB3 H -7.874 7.471 -3.459 1.00 . A A . 444 LYS HB3 1 1 9 3941 1 1 12 LYS HD2 H -6.504 4.703 -4.793 1.00 . A A . 444 LYS HD2 1 1 9 3942 1 1 12 LYS HD3 H -8.046 5.457 -5.191 1.00 . A A . 444 LYS HD3 1 1 9 3943 1 1 12 LYS HE2 H -5.757 5.687 -7.095 1.00 . A A . 444 LYS HE2 1 1 9 3944 1 1 12 LYS HE3 H -6.667 4.177 -7.013 1.00 . A A . 444 LYS HE3 1 1 9 3945 1 1 12 LYS HG2 H -6.826 7.608 -5.524 1.00 . A A . 444 LYS HG2 1 1 9 3946 1 1 12 LYS HG3 H -5.361 6.811 -4.942 1.00 . A A . 444 LYS HG3 1 1 9 3947 1 1 12 LYS HZ1 H -8.672 5.350 -7.536 1.00 . A A . 444 LYS HZ1 1 1 9 3948 1 1 12 LYS HZ2 H -7.511 5.738 -8.707 1.00 . A A . 444 LYS HZ2 1 1 9 3949 1 1 12 LYS HZ3 H -7.885 6.851 -7.482 1.00 . A A . 444 LYS HZ3 1 1 9 3950 1 1 12 LYS N N -5.827 9.344 -3.473 1.00 . A A . 444 LYS N 1 1 9 3951 1 1 12 LYS NZ N -7.763 5.835 -7.701 1.00 . A A . 444 LYS NZ 1 1 9 3952 1 1 12 LYS O O -3.786 7.351 -3.300 1.00 . A A . 444 LYS O 1 1 9 3953 1 1 13 THR C C -3.337 5.015 -0.814 1.00 . A A . 445 THR C 1 1 9 3954 1 1 13 THR CA C -3.168 6.531 -0.737 1.00 . A A . 445 THR CA 1 1 9 3955 1 1 13 THR CB C -2.806 6.937 0.707 1.00 . A A . 445 THR CB 1 1 9 3956 1 1 13 THR CG2 C -1.439 6.402 1.106 1.00 . A A . 445 THR CG2 1 1 9 3957 1 1 13 THR H H -5.077 7.380 -0.478 1.00 . A A . 445 THR H 1 1 9 3958 1 1 13 THR HA H -2.374 6.845 -1.398 1.00 . A A . 445 THR HA 1 1 9 3959 1 1 13 THR HB H -3.547 6.521 1.375 1.00 . A A . 445 THR HB 1 1 9 3960 1 1 13 THR HG1 H -2.795 8.603 1.764 1.00 . A A . 445 THR HG1 1 1 9 3961 1 1 13 THR HG21 H -1.437 5.324 1.028 1.00 . A A . 445 THR HG21 1 1 9 3962 1 1 13 THR HG22 H -1.225 6.689 2.124 1.00 . A A . 445 THR HG22 1 1 9 3963 1 1 13 THR HG23 H -0.685 6.811 0.449 1.00 . A A . 445 THR HG23 1 1 9 3964 1 1 13 THR N N -4.395 7.182 -1.151 1.00 . A A . 445 THR N 1 1 9 3965 1 1 13 THR O O -4.192 4.453 -0.130 1.00 . A A . 445 THR O 1 1 9 3966 1 1 13 THR OG1 O -2.818 8.366 0.832 1.00 . A A . 445 THR OG1 1 1 9 3967 1 1 14 TYR C C -1.576 2.202 -1.038 1.00 . A A . 446 TYR C 1 1 9 3968 1 1 14 TYR CA C -2.680 2.916 -1.801 1.00 . A A . 446 TYR CA 1 1 9 3969 1 1 14 TYR CB C -2.680 2.503 -3.282 1.00 . A A . 446 TYR CB 1 1 9 3970 1 1 14 TYR CD1 C -0.932 3.852 -4.536 1.00 . A A . 446 TYR CD1 1 1 9 3971 1 1 14 TYR CD2 C -0.561 1.517 -4.235 1.00 . A A . 446 TYR CD2 1 1 9 3972 1 1 14 TYR CE1 C 0.256 3.951 -5.238 1.00 . A A . 446 TYR CE1 1 1 9 3973 1 1 14 TYR CE2 C 0.628 1.612 -4.931 1.00 . A A . 446 TYR CE2 1 1 9 3974 1 1 14 TYR CG C -1.360 2.634 -4.021 1.00 . A A . 446 TYR CG 1 1 9 3975 1 1 14 TYR CZ C 1.031 2.828 -5.431 1.00 . A A . 446 TYR CZ 1 1 9 3976 1 1 14 TYR H H -1.847 4.833 -2.146 1.00 . A A . 446 TYR H 1 1 9 3977 1 1 14 TYR HA H -3.631 2.640 -1.369 1.00 . A A . 446 TYR HA 1 1 9 3978 1 1 14 TYR HB2 H -2.980 1.469 -3.348 1.00 . A A . 446 TYR HB2 1 1 9 3979 1 1 14 TYR HB3 H -3.409 3.106 -3.802 1.00 . A A . 446 TYR HB3 1 1 9 3980 1 1 14 TYR HD1 H -1.542 4.734 -4.384 1.00 . A A . 446 TYR HD1 1 1 9 3981 1 1 14 TYR HD2 H -0.879 0.562 -3.842 1.00 . A A . 446 TYR HD2 1 1 9 3982 1 1 14 TYR HE1 H 0.573 4.907 -5.630 1.00 . A A . 446 TYR HE1 1 1 9 3983 1 1 14 TYR HE2 H 1.235 0.734 -5.085 1.00 . A A . 446 TYR HE2 1 1 9 3984 1 1 14 TYR HH H 2.191 2.287 -6.871 1.00 . A A . 446 TYR HH 1 1 9 3985 1 1 14 TYR N N -2.546 4.354 -1.648 1.00 . A A . 446 TYR N 1 1 9 3986 1 1 14 TYR O O -0.411 2.610 -1.090 1.00 . A A . 446 TYR O 1 1 9 3987 1 1 14 TYR OH O 2.210 2.918 -6.135 1.00 . A A . 446 TYR OH 1 1 9 3988 1 1 15 TYR C C -0.476 -0.803 -0.256 1.00 . A A . 447 TYR C 1 1 9 3989 1 1 15 TYR CA C -0.970 0.430 0.485 1.00 . A A . 447 TYR CA 1 1 9 3990 1 1 15 TYR CB C -1.576 0.047 1.842 1.00 . A A . 447 TYR CB 1 1 9 3991 1 1 15 TYR CD1 C -2.205 2.377 2.604 1.00 . A A . 447 TYR CD1 1 1 9 3992 1 1 15 TYR CD2 C -3.896 0.701 2.601 1.00 . A A . 447 TYR CD2 1 1 9 3993 1 1 15 TYR CE1 C -3.118 3.306 3.062 1.00 . A A . 447 TYR CE1 1 1 9 3994 1 1 15 TYR CE2 C -4.816 1.621 3.062 1.00 . A A . 447 TYR CE2 1 1 9 3995 1 1 15 TYR CG C -2.576 1.061 2.362 1.00 . A A . 447 TYR CG 1 1 9 3996 1 1 15 TYR CZ C -4.423 2.923 3.289 1.00 . A A . 447 TYR CZ 1 1 9 3997 1 1 15 TYR H H -2.856 0.809 -0.375 1.00 . A A . 447 TYR H 1 1 9 3998 1 1 15 TYR HA H -0.131 1.090 0.650 1.00 . A A . 447 TYR HA 1 1 9 3999 1 1 15 TYR HB2 H -2.085 -0.902 1.746 1.00 . A A . 447 TYR HB2 1 1 9 4000 1 1 15 TYR HB3 H -0.783 -0.046 2.571 1.00 . A A . 447 TYR HB3 1 1 9 4001 1 1 15 TYR HD1 H -1.188 2.674 2.420 1.00 . A A . 447 TYR HD1 1 1 9 4002 1 1 15 TYR HD2 H -4.200 -0.322 2.425 1.00 . A A . 447 TYR HD2 1 1 9 4003 1 1 15 TYR HE1 H -2.808 4.324 3.244 1.00 . A A . 447 TYR HE1 1 1 9 4004 1 1 15 TYR HE2 H -5.837 1.317 3.243 1.00 . A A . 447 TYR HE2 1 1 9 4005 1 1 15 TYR HH H -5.924 3.436 4.383 1.00 . A A . 447 TYR HH 1 1 9 4006 1 1 15 TYR N N -1.932 1.136 -0.332 1.00 . A A . 447 TYR N 1 1 9 4007 1 1 15 TYR O O -1.088 -1.864 -0.206 1.00 . A A . 447 TYR O 1 1 9 4008 1 1 15 TYR OH O -5.338 3.848 3.743 1.00 . A A . 447 TYR OH 1 1 9 4009 1 1 16 TYR C C 2.227 -2.463 -0.863 1.00 . A A . 448 TYR C 1 1 9 4010 1 1 16 TYR CA C 1.200 -1.736 -1.726 1.00 . A A . 448 TYR CA 1 1 9 4011 1 1 16 TYR CB C 1.847 -1.204 -3.010 1.00 . A A . 448 TYR CB 1 1 9 4012 1 1 16 TYR CD1 C 2.455 -3.264 -4.360 1.00 . A A . 448 TYR CD1 1 1 9 4013 1 1 16 TYR CD2 C 4.218 -1.878 -3.548 1.00 . A A . 448 TYR CD2 1 1 9 4014 1 1 16 TYR CE1 C 3.386 -4.104 -4.949 1.00 . A A . 448 TYR CE1 1 1 9 4015 1 1 16 TYR CE2 C 5.151 -2.713 -4.130 1.00 . A A . 448 TYR CE2 1 1 9 4016 1 1 16 TYR CG C 2.856 -2.136 -3.651 1.00 . A A . 448 TYR CG 1 1 9 4017 1 1 16 TYR CZ C 4.732 -3.824 -4.828 1.00 . A A . 448 TYR CZ 1 1 9 4018 1 1 16 TYR H H 0.991 0.261 -1.064 1.00 . A A . 448 TYR H 1 1 9 4019 1 1 16 TYR HA H 0.409 -2.420 -1.991 1.00 . A A . 448 TYR HA 1 1 9 4020 1 1 16 TYR HB2 H 1.071 -1.020 -3.736 1.00 . A A . 448 TYR HB2 1 1 9 4021 1 1 16 TYR HB3 H 2.349 -0.273 -2.789 1.00 . A A . 448 TYR HB3 1 1 9 4022 1 1 16 TYR HD1 H 1.401 -3.481 -4.452 1.00 . A A . 448 TYR HD1 1 1 9 4023 1 1 16 TYR HD2 H 4.546 -1.006 -3.001 1.00 . A A . 448 TYR HD2 1 1 9 4024 1 1 16 TYR HE1 H 3.056 -4.976 -5.496 1.00 . A A . 448 TYR HE1 1 1 9 4025 1 1 16 TYR HE2 H 6.204 -2.493 -4.036 1.00 . A A . 448 TYR HE2 1 1 9 4026 1 1 16 TYR HH H 5.403 -4.838 -6.324 1.00 . A A . 448 TYR HH 1 1 9 4027 1 1 16 TYR N N 0.604 -0.636 -0.989 1.00 . A A . 448 TYR N 1 1 9 4028 1 1 16 TYR O O 3.190 -1.867 -0.377 1.00 . A A . 448 TYR O 1 1 9 4029 1 1 16 TYR OH O 5.663 -4.652 -5.412 1.00 . A A . 448 TYR OH 1 1 9 4030 1 1 17 ASN C C 3.909 -5.279 -0.780 1.00 . A A . 449 ASN C 1 1 9 4031 1 1 17 ASN CA C 2.903 -4.577 0.120 1.00 . A A . 449 ASN CA 1 1 9 4032 1 1 17 ASN CB C 2.108 -5.603 0.923 1.00 . A A . 449 ASN CB 1 1 9 4033 1 1 17 ASN CG C 2.980 -6.723 1.452 1.00 . A A . 449 ASN CG 1 1 9 4034 1 1 17 ASN H H 1.201 -4.167 -1.054 1.00 . A A . 449 ASN H 1 1 9 4035 1 1 17 ASN HA H 3.437 -3.934 0.803 1.00 . A A . 449 ASN HA 1 1 9 4036 1 1 17 ASN HB2 H 1.639 -5.110 1.761 1.00 . A A . 449 ASN HB2 1 1 9 4037 1 1 17 ASN HB3 H 1.345 -6.033 0.290 1.00 . A A . 449 ASN HB3 1 1 9 4038 1 1 17 ASN HD21 H 3.559 -5.594 2.987 1.00 . A A . 449 ASN HD21 1 1 9 4039 1 1 17 ASN HD22 H 4.200 -7.200 2.942 1.00 . A A . 449 ASN HD22 1 1 9 4040 1 1 17 ASN N N 2.004 -3.752 -0.662 1.00 . A A . 449 ASN N 1 1 9 4041 1 1 17 ASN ND2 N 3.653 -6.481 2.566 1.00 . A A . 449 ASN ND2 1 1 9 4042 1 1 17 ASN O O 3.536 -5.917 -1.762 1.00 . A A . 449 ASN O 1 1 9 4043 1 1 17 ASN OD1 O 3.077 -7.787 0.844 1.00 . A A . 449 ASN OD1 1 1 9 4044 1 1 18 ASN C C 6.597 -7.161 -0.728 1.00 . A A . 450 ASN C 1 1 9 4045 1 1 18 ASN CA C 6.256 -5.757 -1.206 1.00 . A A . 450 ASN CA 1 1 9 4046 1 1 18 ASN CB C 7.498 -4.862 -1.130 1.00 . A A . 450 ASN CB 1 1 9 4047 1 1 18 ASN CG C 7.921 -4.577 0.303 1.00 . A A . 450 ASN CG 1 1 9 4048 1 1 18 ASN H H 5.396 -4.740 0.432 1.00 . A A . 450 ASN H 1 1 9 4049 1 1 18 ASN HA H 5.923 -5.809 -2.232 1.00 . A A . 450 ASN HA 1 1 9 4050 1 1 18 ASN HB2 H 8.319 -5.350 -1.636 1.00 . A A . 450 ASN HB2 1 1 9 4051 1 1 18 ASN HB3 H 7.287 -3.922 -1.618 1.00 . A A . 450 ASN HB3 1 1 9 4052 1 1 18 ASN HD21 H 9.176 -6.126 0.296 1.00 . A A . 450 ASN HD21 1 1 9 4053 1 1 18 ASN HD22 H 9.102 -5.214 1.765 1.00 . A A . 450 ASN HD22 1 1 9 4054 1 1 18 ASN N N 5.176 -5.190 -0.410 1.00 . A A . 450 ASN N 1 1 9 4055 1 1 18 ASN ND2 N 8.823 -5.385 0.841 1.00 . A A . 450 ASN ND2 1 1 9 4056 1 1 18 ASN O O 7.407 -7.856 -1.338 1.00 . A A . 450 ASN O 1 1 9 4057 1 1 18 ASN OD1 O 7.436 -3.631 0.921 1.00 . A A . 450 ASN OD1 1 1 9 4058 1 1 19 ARG C C 5.653 -9.996 0.070 1.00 . A A . 451 ARG C 1 1 9 4059 1 1 19 ARG CA C 6.234 -8.891 0.946 1.00 . A A . 451 ARG CA 1 1 9 4060 1 1 19 ARG CB C 5.690 -8.992 2.373 1.00 . A A . 451 ARG CB 1 1 9 4061 1 1 19 ARG CD C 7.954 -8.553 3.345 1.00 . A A . 451 ARG CD 1 1 9 4062 1 1 19 ARG CG C 6.485 -8.167 3.372 1.00 . A A . 451 ARG CG 1 1 9 4063 1 1 19 ARG CZ C 10.013 -7.372 3.983 1.00 . A A . 451 ARG CZ 1 1 9 4064 1 1 19 ARG H H 5.331 -6.971 0.807 1.00 . A A . 451 ARG H 1 1 9 4065 1 1 19 ARG HA H 7.299 -9.015 0.984 1.00 . A A . 451 ARG HA 1 1 9 4066 1 1 19 ARG HB2 H 4.667 -8.645 2.384 1.00 . A A . 451 ARG HB2 1 1 9 4067 1 1 19 ARG HB3 H 5.715 -10.025 2.688 1.00 . A A . 451 ARG HB3 1 1 9 4068 1 1 19 ARG HD2 H 8.045 -9.589 3.634 1.00 . A A . 451 ARG HD2 1 1 9 4069 1 1 19 ARG HD3 H 8.327 -8.429 2.339 1.00 . A A . 451 ARG HD3 1 1 9 4070 1 1 19 ARG HE H 8.355 -7.486 5.117 1.00 . A A . 451 ARG HE 1 1 9 4071 1 1 19 ARG HG2 H 6.392 -7.123 3.118 1.00 . A A . 451 ARG HG2 1 1 9 4072 1 1 19 ARG HG3 H 6.092 -8.339 4.364 1.00 . A A . 451 ARG HG3 1 1 9 4073 1 1 19 ARG HH11 H 10.004 -8.099 2.088 1.00 . A A . 451 ARG HH11 1 1 9 4074 1 1 19 ARG HH12 H 11.485 -7.338 2.585 1.00 . A A . 451 ARG HH12 1 1 9 4075 1 1 19 ARG HH21 H 10.325 -6.517 5.791 1.00 . A A . 451 ARG HH21 1 1 9 4076 1 1 19 ARG HH22 H 11.678 -6.466 4.698 1.00 . A A . 451 ARG HH22 1 1 9 4077 1 1 19 ARG N N 5.977 -7.571 0.373 1.00 . A A . 451 ARG N 1 1 9 4078 1 1 19 ARG NE N 8.762 -7.742 4.249 1.00 . A A . 451 ARG NE 1 1 9 4079 1 1 19 ARG NH1 N 10.543 -7.626 2.794 1.00 . A A . 451 ARG NH1 1 1 9 4080 1 1 19 ARG NH2 N 10.727 -6.729 4.894 1.00 . A A . 451 ARG NH2 1 1 9 4081 1 1 19 ARG O O 6.389 -10.760 -0.547 1.00 . A A . 451 ARG O 1 1 9 4082 1 1 20 THR C C 3.202 -10.402 -2.128 1.00 . A A . 452 THR C 1 1 9 4083 1 1 20 THR CA C 3.669 -11.049 -0.828 1.00 . A A . 452 THR CA 1 1 9 4084 1 1 20 THR CB C 2.476 -11.708 -0.096 1.00 . A A . 452 THR CB 1 1 9 4085 1 1 20 THR CG2 C 1.407 -10.683 0.250 1.00 . A A . 452 THR CG2 1 1 9 4086 1 1 20 THR H H 3.794 -9.431 0.527 1.00 . A A . 452 THR H 1 1 9 4087 1 1 20 THR HA H 4.388 -11.820 -1.064 1.00 . A A . 452 THR HA 1 1 9 4088 1 1 20 THR HB H 2.839 -12.148 0.822 1.00 . A A . 452 THR HB 1 1 9 4089 1 1 20 THR HG1 H 1.905 -12.453 -1.833 1.00 . A A . 452 THR HG1 1 1 9 4090 1 1 20 THR HG21 H 0.593 -11.170 0.764 1.00 . A A . 452 THR HG21 1 1 9 4091 1 1 20 THR HG22 H 1.039 -10.227 -0.658 1.00 . A A . 452 THR HG22 1 1 9 4092 1 1 20 THR HG23 H 1.833 -9.922 0.888 1.00 . A A . 452 THR HG23 1 1 9 4093 1 1 20 THR N N 4.337 -10.063 0.004 1.00 . A A . 452 THR N 1 1 9 4094 1 1 20 THR O O 2.586 -11.055 -2.976 1.00 . A A . 452 THR O 1 1 9 4095 1 1 20 THR OG1 O 1.906 -12.741 -0.911 1.00 . A A . 452 THR OG1 1 1 9 4096 1 1 21 LEU C C 1.581 -8.097 -3.399 1.00 . A A . 453 LEU C 1 1 9 4097 1 1 21 LEU CA C 3.090 -8.304 -3.415 1.00 . A A . 453 LEU CA 1 1 9 4098 1 1 21 LEU CB C 3.544 -8.970 -4.722 1.00 . A A . 453 LEU CB 1 1 9 4099 1 1 21 LEU CD1 C 5.388 -9.906 -6.144 1.00 . A A . 453 LEU CD1 1 1 9 4100 1 1 21 LEU CD2 C 5.812 -7.890 -4.730 1.00 . A A . 453 LEU CD2 1 1 9 4101 1 1 21 LEU CG C 5.053 -9.205 -4.838 1.00 . A A . 453 LEU CG 1 1 9 4102 1 1 21 LEU H H 3.995 -8.661 -1.540 1.00 . A A . 453 LEU H 1 1 9 4103 1 1 21 LEU HA H 3.571 -7.339 -3.330 1.00 . A A . 453 LEU HA 1 1 9 4104 1 1 21 LEU HB2 H 3.045 -9.924 -4.809 1.00 . A A . 453 LEU HB2 1 1 9 4105 1 1 21 LEU HB3 H 3.236 -8.345 -5.548 1.00 . A A . 453 LEU HB3 1 1 9 4106 1 1 21 LEU HD11 H 4.902 -10.870 -6.169 1.00 . A A . 453 LEU HD11 1 1 9 4107 1 1 21 LEU HD12 H 6.457 -10.040 -6.217 1.00 . A A . 453 LEU HD12 1 1 9 4108 1 1 21 LEU HD13 H 5.042 -9.307 -6.974 1.00 . A A . 453 LEU HD13 1 1 9 4109 1 1 21 LEU HD21 H 6.871 -8.077 -4.823 1.00 . A A . 453 LEU HD21 1 1 9 4110 1 1 21 LEU HD22 H 5.608 -7.436 -3.772 1.00 . A A . 453 LEU HD22 1 1 9 4111 1 1 21 LEU HD23 H 5.493 -7.225 -5.520 1.00 . A A . 453 LEU HD23 1 1 9 4112 1 1 21 LEU HG H 5.374 -9.841 -4.027 1.00 . A A . 453 LEU HG 1 1 9 4113 1 1 21 LEU N N 3.491 -9.100 -2.256 1.00 . A A . 453 LEU N 1 1 9 4114 1 1 21 LEU O O 0.906 -8.199 -4.425 1.00 . A A . 453 LEU O 1 1 9 4115 1 1 22 GLU C C -0.782 -6.159 -2.208 1.00 . A A . 454 GLU C 1 1 9 4116 1 1 22 GLU CA C -0.360 -7.610 -2.006 1.00 . A A . 454 GLU CA 1 1 9 4117 1 1 22 GLU CB C -0.725 -8.053 -0.584 1.00 . A A . 454 GLU CB 1 1 9 4118 1 1 22 GLU CD C -2.532 -8.295 1.162 1.00 . A A . 454 GLU CD 1 1 9 4119 1 1 22 GLU CG C -2.211 -7.969 -0.280 1.00 . A A . 454 GLU CG 1 1 9 4120 1 1 22 GLU H H 1.684 -7.582 -1.476 1.00 . A A . 454 GLU H 1 1 9 4121 1 1 22 GLU HA H -0.875 -8.238 -2.717 1.00 . A A . 454 GLU HA 1 1 9 4122 1 1 22 GLU HB2 H -0.410 -9.077 -0.446 1.00 . A A . 454 GLU HB2 1 1 9 4123 1 1 22 GLU HB3 H -0.200 -7.426 0.122 1.00 . A A . 454 GLU HB3 1 1 9 4124 1 1 22 GLU HG2 H -2.553 -6.967 -0.491 1.00 . A A . 454 GLU HG2 1 1 9 4125 1 1 22 GLU HG3 H -2.733 -8.668 -0.916 1.00 . A A . 454 GLU HG3 1 1 9 4126 1 1 22 GLU N N 1.072 -7.761 -2.221 1.00 . A A . 454 GLU N 1 1 9 4127 1 1 22 GLU O O -0.091 -5.239 -1.768 1.00 . A A . 454 GLU O 1 1 9 4128 1 1 22 GLU OE1 O -2.561 -9.494 1.512 1.00 . A A . 454 GLU OE1 1 1 9 4129 1 1 22 GLU OE2 O -2.756 -7.356 1.955 1.00 . A A . 454 GLU OE2 1 1 9 4130 1 1 23 SER C C -3.492 -4.457 -1.817 1.00 . A A . 455 SER C 1 1 9 4131 1 1 23 SER CA C -2.496 -4.630 -2.962 1.00 . A A . 455 SER CA 1 1 9 4132 1 1 23 SER CB C -3.176 -4.435 -4.324 1.00 . A A . 455 SER CB 1 1 9 4133 1 1 23 SER H H -2.382 -6.712 -3.283 1.00 . A A . 455 SER H 1 1 9 4134 1 1 23 SER HA H -1.701 -3.906 -2.850 1.00 . A A . 455 SER HA 1 1 9 4135 1 1 23 SER HB2 H -2.510 -4.771 -5.105 1.00 . A A . 455 SER HB2 1 1 9 4136 1 1 23 SER HB3 H -4.086 -5.015 -4.356 1.00 . A A . 455 SER HB3 1 1 9 4137 1 1 23 SER HG H -2.676 -2.594 -4.793 1.00 . A A . 455 SER HG 1 1 9 4138 1 1 23 SER N N -1.915 -5.953 -2.866 1.00 . A A . 455 SER N 1 1 9 4139 1 1 23 SER O O -4.597 -5.004 -1.850 1.00 . A A . 455 SER O 1 1 9 4140 1 1 23 SER OG O -3.493 -3.074 -4.560 1.00 . A A . 455 SER OG 1 1 9 4141 1 1 24 THR C C -4.565 -2.257 0.441 1.00 . A A . 456 THR C 1 1 9 4142 1 1 24 THR CA C -3.850 -3.603 0.428 1.00 . A A . 456 THR CA 1 1 9 4143 1 1 24 THR CB C -2.936 -3.706 1.669 1.00 . A A . 456 THR CB 1 1 9 4144 1 1 24 THR CG2 C -3.755 -3.872 2.939 1.00 . A A . 456 THR CG2 1 1 9 4145 1 1 24 THR H H -2.203 -3.283 -0.847 1.00 . A A . 456 THR H 1 1 9 4146 1 1 24 THR HA H -4.578 -4.399 0.465 1.00 . A A . 456 THR HA 1 1 9 4147 1 1 24 THR HB H -2.358 -2.796 1.747 1.00 . A A . 456 THR HB 1 1 9 4148 1 1 24 THR HG1 H -2.520 -5.650 1.671 1.00 . A A . 456 THR HG1 1 1 9 4149 1 1 24 THR HG21 H -3.093 -3.916 3.792 1.00 . A A . 456 THR HG21 1 1 9 4150 1 1 24 THR HG22 H -4.329 -4.785 2.880 1.00 . A A . 456 THR HG22 1 1 9 4151 1 1 24 THR HG23 H -4.425 -3.032 3.048 1.00 . A A . 456 THR HG23 1 1 9 4152 1 1 24 THR N N -3.071 -3.745 -0.788 1.00 . A A . 456 THR N 1 1 9 4153 1 1 24 THR O O -3.939 -1.215 0.270 1.00 . A A . 456 THR O 1 1 9 4154 1 1 24 THR OG1 O -2.039 -4.818 1.527 1.00 . A A . 456 THR OG1 1 1 9 4155 1 1 25 TRP C C -7.452 -0.921 1.947 1.00 . A A . 457 TRP C 1 1 9 4156 1 1 25 TRP CA C -6.649 -1.035 0.652 1.00 . A A . 457 TRP CA 1 1 9 4157 1 1 25 TRP CB C -7.545 -0.926 -0.583 1.00 . A A . 457 TRP CB 1 1 9 4158 1 1 25 TRP CD1 C -6.029 -1.818 -2.444 1.00 . A A . 457 TRP CD1 1 1 9 4159 1 1 25 TRP CD2 C -6.513 0.356 -2.617 1.00 . A A . 457 TRP CD2 1 1 9 4160 1 1 25 TRP CE2 C -5.653 0.000 -3.674 1.00 . A A . 457 TRP CE2 1 1 9 4161 1 1 25 TRP CE3 C -6.957 1.675 -2.524 1.00 . A A . 457 TRP CE3 1 1 9 4162 1 1 25 TRP CG C -6.732 -0.819 -1.837 1.00 . A A . 457 TRP CG 1 1 9 4163 1 1 25 TRP CH2 C -5.677 2.202 -4.513 1.00 . A A . 457 TRP CH2 1 1 9 4164 1 1 25 TRP CZ2 C -5.226 0.915 -4.626 1.00 . A A . 457 TRP CZ2 1 1 9 4165 1 1 25 TRP CZ3 C -6.538 2.583 -3.473 1.00 . A A . 457 TRP CZ3 1 1 9 4166 1 1 25 TRP H H -6.351 -3.138 0.622 1.00 . A A . 457 TRP H 1 1 9 4167 1 1 25 TRP HA H -5.938 -0.222 0.629 1.00 . A A . 457 TRP HA 1 1 9 4168 1 1 25 TRP HB2 H -8.171 -1.804 -0.654 1.00 . A A . 457 TRP HB2 1 1 9 4169 1 1 25 TRP HB3 H -8.162 -0.044 -0.503 1.00 . A A . 457 TRP HB3 1 1 9 4170 1 1 25 TRP HD1 H -5.991 -2.838 -2.090 1.00 . A A . 457 TRP HD1 1 1 9 4171 1 1 25 TRP HE1 H -4.780 -1.857 -4.133 1.00 . A A . 457 TRP HE1 1 1 9 4172 1 1 25 TRP HE3 H -7.619 1.987 -1.731 1.00 . A A . 457 TRP HE3 1 1 9 4173 1 1 25 TRP HH2 H -5.375 2.948 -5.232 1.00 . A A . 457 TRP HH2 1 1 9 4174 1 1 25 TRP HZ2 H -4.552 0.637 -5.424 1.00 . A A . 457 TRP HZ2 1 1 9 4175 1 1 25 TRP HZ3 H -6.871 3.609 -3.417 1.00 . A A . 457 TRP HZ3 1 1 9 4176 1 1 25 TRP N N -5.883 -2.278 0.595 1.00 . A A . 457 TRP N 1 1 9 4177 1 1 25 TRP NE1 N -5.365 -1.330 -3.538 1.00 . A A . 457 TRP NE1 1 1 9 4178 1 1 25 TRP O O -8.197 0.038 2.150 1.00 . A A . 457 TRP O 1 1 9 4179 1 1 26 GLU C C -6.763 -1.758 5.192 1.00 . A A . 458 GLU C 1 1 9 4180 1 1 26 GLU CA C -7.875 -1.847 4.153 1.00 . A A . 458 GLU CA 1 1 9 4181 1 1 26 GLU CB C -8.727 -3.100 4.408 1.00 . A A . 458 GLU CB 1 1 9 4182 1 1 26 GLU CD C -9.503 -3.804 2.089 1.00 . A A . 458 GLU CD 1 1 9 4183 1 1 26 GLU CG C -9.905 -3.277 3.454 1.00 . A A . 458 GLU CG 1 1 9 4184 1 1 26 GLU H H -6.712 -2.647 2.601 1.00 . A A . 458 GLU H 1 1 9 4185 1 1 26 GLU HA H -8.498 -0.966 4.218 1.00 . A A . 458 GLU HA 1 1 9 4186 1 1 26 GLU HB2 H -8.093 -3.970 4.320 1.00 . A A . 458 GLU HB2 1 1 9 4187 1 1 26 GLU HB3 H -9.115 -3.054 5.415 1.00 . A A . 458 GLU HB3 1 1 9 4188 1 1 26 GLU HG2 H -10.605 -3.969 3.895 1.00 . A A . 458 GLU HG2 1 1 9 4189 1 1 26 GLU HG3 H -10.387 -2.319 3.323 1.00 . A A . 458 GLU HG3 1 1 9 4190 1 1 26 GLU N N -7.273 -1.887 2.832 1.00 . A A . 458 GLU N 1 1 9 4191 1 1 26 GLU O O -5.897 -2.629 5.243 1.00 . A A . 458 GLU O 1 1 9 4192 1 1 26 GLU OE1 O -9.095 -4.981 1.995 1.00 . A A . 458 GLU OE1 1 1 9 4193 1 1 26 GLU OE2 O -9.614 -3.053 1.097 1.00 . A A . 458 GLU OE2 1 1 9 4194 1 1 27 LYS C C -5.895 -1.453 8.178 1.00 . A A . 459 LYS C 1 1 9 4195 1 1 27 LYS CA C -5.714 -0.510 6.991 1.00 . A A . 459 LYS CA 1 1 9 4196 1 1 27 LYS CB C -5.672 0.942 7.474 1.00 . A A . 459 LYS CB 1 1 9 4197 1 1 27 LYS CD C -4.985 3.321 6.980 1.00 . A A . 459 LYS CD 1 1 9 4198 1 1 27 LYS CE C -4.018 3.454 8.147 1.00 . A A . 459 LYS CE 1 1 9 4199 1 1 27 LYS CG C -5.064 1.894 6.457 1.00 . A A . 459 LYS CG 1 1 9 4200 1 1 27 LYS H H -7.505 -0.053 5.940 1.00 . A A . 459 LYS H 1 1 9 4201 1 1 27 LYS HA H -4.775 -0.739 6.509 1.00 . A A . 459 LYS HA 1 1 9 4202 1 1 27 LYS HB2 H -6.679 1.269 7.686 1.00 . A A . 459 LYS HB2 1 1 9 4203 1 1 27 LYS HB3 H -5.086 0.993 8.380 1.00 . A A . 459 LYS HB3 1 1 9 4204 1 1 27 LYS HD2 H -4.652 3.965 6.181 1.00 . A A . 459 LYS HD2 1 1 9 4205 1 1 27 LYS HD3 H -5.969 3.629 7.305 1.00 . A A . 459 LYS HD3 1 1 9 4206 1 1 27 LYS HE2 H -4.033 4.476 8.493 1.00 . A A . 459 LYS HE2 1 1 9 4207 1 1 27 LYS HE3 H -4.350 2.804 8.943 1.00 . A A . 459 LYS HE3 1 1 9 4208 1 1 27 LYS HG2 H -4.067 1.557 6.218 1.00 . A A . 459 LYS HG2 1 1 9 4209 1 1 27 LYS HG3 H -5.671 1.883 5.564 1.00 . A A . 459 LYS HG3 1 1 9 4210 1 1 27 LYS HZ1 H -1.969 3.382 8.544 1.00 . A A . 459 LYS HZ1 1 1 9 4211 1 1 27 LYS HZ2 H -2.330 3.572 6.898 1.00 . A A . 459 LYS HZ2 1 1 9 4212 1 1 27 LYS HZ3 H -2.535 2.062 7.648 1.00 . A A . 459 LYS HZ3 1 1 9 4213 1 1 27 LYS N N -6.769 -0.705 6.000 1.00 . A A . 459 LYS N 1 1 9 4214 1 1 27 LYS NZ N -2.619 3.093 7.780 1.00 . A A . 459 LYS NZ 1 1 9 4215 1 1 27 LYS O O -6.913 -1.402 8.868 1.00 . A A . 459 LYS O 1 1 9 4216 1 1 28 PRO C C -4.598 -2.596 10.862 1.00 . A A . 460 PRO C 1 1 9 4217 1 1 28 PRO CA C -4.927 -3.274 9.535 1.00 . A A . 460 PRO CA 1 1 9 4218 1 1 28 PRO CB C -3.846 -4.287 9.163 1.00 . A A . 460 PRO CB 1 1 9 4219 1 1 28 PRO CD C -3.688 -2.479 7.594 1.00 . A A . 460 PRO CD 1 1 9 4220 1 1 28 PRO CG C -2.881 -3.523 8.322 1.00 . A A . 460 PRO CG 1 1 9 4221 1 1 28 PRO HA H -5.882 -3.772 9.615 1.00 . A A . 460 PRO HA 1 1 9 4222 1 1 28 PRO HB2 H -3.376 -4.662 10.062 1.00 . A A . 460 PRO HB2 1 1 9 4223 1 1 28 PRO HB3 H -4.286 -5.104 8.612 1.00 . A A . 460 PRO HB3 1 1 9 4224 1 1 28 PRO HD2 H -3.143 -1.546 7.546 1.00 . A A . 460 PRO HD2 1 1 9 4225 1 1 28 PRO HD3 H -3.935 -2.823 6.600 1.00 . A A . 460 PRO HD3 1 1 9 4226 1 1 28 PRO HG2 H -2.141 -3.051 8.950 1.00 . A A . 460 PRO HG2 1 1 9 4227 1 1 28 PRO HG3 H -2.406 -4.187 7.615 1.00 . A A . 460 PRO HG3 1 1 9 4228 1 1 28 PRO N N -4.907 -2.331 8.414 1.00 . A A . 460 PRO N 1 1 9 4229 1 1 28 PRO O O -5.399 -2.714 11.811 1.00 . A A . 460 PRO O 1 1 9 4230 1 1 28 PRO OXT O -3.544 -1.930 10.950 1.00 . A A . 460 PRO OXT 1 1 10 4231 1 1 1 SER C C 8.079 -1.728 4.687 1.00 . A A . 433 SER C 1 1 10 4232 1 1 1 SER CA C 8.793 -0.433 5.059 1.00 . A A . 433 SER CA 1 1 10 4233 1 1 1 SER CB C 8.160 0.743 4.315 1.00 . A A . 433 SER CB 1 1 10 4234 1 1 1 SER H1 H 10.654 -1.345 5.208 1.00 . A A . 433 SER H1 1 1 10 4235 1 1 1 SER H2 H 10.724 0.338 5.011 1.00 . A A . 433 SER H2 1 1 10 4236 1 1 1 SER H3 H 10.344 -0.652 3.692 1.00 . A A . 433 SER H3 1 1 10 4237 1 1 1 SER HA H 8.703 -0.272 6.123 1.00 . A A . 433 SER HA 1 1 10 4238 1 1 1 SER HB2 H 8.260 0.590 3.251 1.00 . A A . 433 SER HB2 1 1 10 4239 1 1 1 SER HB3 H 7.113 0.806 4.573 1.00 . A A . 433 SER HB3 1 1 10 4240 1 1 1 SER HG H 8.169 2.503 5.189 1.00 . A A . 433 SER HG 1 1 10 4241 1 1 1 SER N N 10.227 -0.528 4.720 1.00 . A A . 433 SER N 1 1 10 4242 1 1 1 SER O O 8.150 -2.175 3.541 1.00 . A A . 433 SER O 1 1 10 4243 1 1 1 SER OG O 8.790 1.966 4.661 1.00 . A A . 433 SER OG 1 1 10 4244 1 1 2 GLU C C 5.444 -3.243 4.545 1.00 . A A . 434 GLU C 1 1 10 4245 1 1 2 GLU CA C 6.654 -3.555 5.419 1.00 . A A . 434 GLU CA 1 1 10 4246 1 1 2 GLU CB C 6.212 -4.187 6.745 1.00 . A A . 434 GLU CB 1 1 10 4247 1 1 2 GLU CD C 6.776 -6.603 6.229 1.00 . A A . 434 GLU CD 1 1 10 4248 1 1 2 GLU CG C 5.689 -5.608 6.597 1.00 . A A . 434 GLU CG 1 1 10 4249 1 1 2 GLU H H 7.408 -1.937 6.560 1.00 . A A . 434 GLU H 1 1 10 4250 1 1 2 GLU HA H 7.298 -4.245 4.895 1.00 . A A . 434 GLU HA 1 1 10 4251 1 1 2 GLU HB2 H 7.054 -4.206 7.420 1.00 . A A . 434 GLU HB2 1 1 10 4252 1 1 2 GLU HB3 H 5.430 -3.582 7.177 1.00 . A A . 434 GLU HB3 1 1 10 4253 1 1 2 GLU HG2 H 5.249 -5.913 7.533 1.00 . A A . 434 GLU HG2 1 1 10 4254 1 1 2 GLU HG3 H 4.934 -5.620 5.825 1.00 . A A . 434 GLU HG3 1 1 10 4255 1 1 2 GLU N N 7.405 -2.331 5.660 1.00 . A A . 434 GLU N 1 1 10 4256 1 1 2 GLU O O 5.207 -3.894 3.525 1.00 . A A . 434 GLU O 1 1 10 4257 1 1 2 GLU OE1 O 7.456 -6.401 5.202 1.00 . A A . 434 GLU OE1 1 1 10 4258 1 1 2 GLU OE2 O 6.940 -7.604 6.955 1.00 . A A . 434 GLU OE2 1 1 10 4259 1 1 3 TRP C C 3.957 -0.350 3.640 1.00 . A A . 435 TRP C 1 1 10 4260 1 1 3 TRP CA C 3.585 -1.732 4.166 1.00 . A A . 435 TRP CA 1 1 10 4261 1 1 3 TRP CB C 2.311 -1.636 5.012 1.00 . A A . 435 TRP CB 1 1 10 4262 1 1 3 TRP CD1 C 1.956 -2.971 7.173 1.00 . A A . 435 TRP CD1 1 1 10 4263 1 1 3 TRP CD2 C 1.737 -4.186 5.306 1.00 . A A . 435 TRP CD2 1 1 10 4264 1 1 3 TRP CE2 C 1.517 -5.024 6.417 1.00 . A A . 435 TRP CE2 1 1 10 4265 1 1 3 TRP CE3 C 1.652 -4.734 4.027 1.00 . A A . 435 TRP CE3 1 1 10 4266 1 1 3 TRP CG C 2.013 -2.873 5.812 1.00 . A A . 435 TRP CG 1 1 10 4267 1 1 3 TRP CH2 C 1.142 -6.886 5.015 1.00 . A A . 435 TRP CH2 1 1 10 4268 1 1 3 TRP CZ2 C 1.218 -6.379 6.282 1.00 . A A . 435 TRP CZ2 1 1 10 4269 1 1 3 TRP CZ3 C 1.358 -6.077 3.897 1.00 . A A . 435 TRP CZ3 1 1 10 4270 1 1 3 TRP H H 4.882 -1.821 5.826 1.00 . A A . 435 TRP H 1 1 10 4271 1 1 3 TRP HA H 3.422 -2.405 3.338 1.00 . A A . 435 TRP HA 1 1 10 4272 1 1 3 TRP HB2 H 2.409 -0.811 5.701 1.00 . A A . 435 TRP HB2 1 1 10 4273 1 1 3 TRP HB3 H 1.472 -1.452 4.357 1.00 . A A . 435 TRP HB3 1 1 10 4274 1 1 3 TRP HD1 H 2.122 -2.145 7.850 1.00 . A A . 435 TRP HD1 1 1 10 4275 1 1 3 TRP HE1 H 1.560 -4.580 8.466 1.00 . A A . 435 TRP HE1 1 1 10 4276 1 1 3 TRP HE3 H 1.814 -4.128 3.147 1.00 . A A . 435 TRP HE3 1 1 10 4277 1 1 3 TRP HH2 H 0.911 -7.930 4.858 1.00 . A A . 435 TRP HH2 1 1 10 4278 1 1 3 TRP HZ2 H 1.049 -7.015 7.137 1.00 . A A . 435 TRP HZ2 1 1 10 4279 1 1 3 TRP HZ3 H 1.299 -6.522 2.910 1.00 . A A . 435 TRP HZ3 1 1 10 4280 1 1 3 TRP N N 4.689 -2.238 4.958 1.00 . A A . 435 TRP N 1 1 10 4281 1 1 3 TRP NE1 N 1.655 -4.259 7.542 1.00 . A A . 435 TRP NE1 1 1 10 4282 1 1 3 TRP O O 4.376 0.513 4.410 1.00 . A A . 435 TRP O 1 1 10 4283 1 1 4 THR C C 2.998 2.110 1.775 1.00 . A A . 436 THR C 1 1 10 4284 1 1 4 THR CA C 4.173 1.142 1.752 1.00 . A A . 436 THR CA 1 1 10 4285 1 1 4 THR CB C 4.666 0.965 0.298 1.00 . A A . 436 THR CB 1 1 10 4286 1 1 4 THR CG2 C 4.999 2.313 -0.340 1.00 . A A . 436 THR CG2 1 1 10 4287 1 1 4 THR H H 3.434 -0.840 1.772 1.00 . A A . 436 THR H 1 1 10 4288 1 1 4 THR HA H 4.981 1.560 2.337 1.00 . A A . 436 THR HA 1 1 10 4289 1 1 4 THR HB H 3.875 0.500 -0.277 1.00 . A A . 436 THR HB 1 1 10 4290 1 1 4 THR HG1 H 5.611 -0.723 0.703 1.00 . A A . 436 THR HG1 1 1 10 4291 1 1 4 THR HG21 H 4.100 2.913 -0.411 1.00 . A A . 436 THR HG21 1 1 10 4292 1 1 4 THR HG22 H 5.403 2.155 -1.329 1.00 . A A . 436 THR HG22 1 1 10 4293 1 1 4 THR HG23 H 5.725 2.829 0.268 1.00 . A A . 436 THR HG23 1 1 10 4294 1 1 4 THR N N 3.805 -0.133 2.344 1.00 . A A . 436 THR N 1 1 10 4295 1 1 4 THR O O 2.056 1.973 0.992 1.00 . A A . 436 THR O 1 1 10 4296 1 1 4 THR OG1 O 5.822 0.113 0.270 1.00 . A A . 436 THR OG1 1 1 10 4297 1 1 5 GLU C C 2.409 5.265 1.881 1.00 . A A . 437 GLU C 1 1 10 4298 1 1 5 GLU CA C 2.017 4.096 2.766 1.00 . A A . 437 GLU CA 1 1 10 4299 1 1 5 GLU CB C 1.819 4.597 4.202 1.00 . A A . 437 GLU CB 1 1 10 4300 1 1 5 GLU CD C 3.550 3.647 5.764 1.00 . A A . 437 GLU CD 1 1 10 4301 1 1 5 GLU CG C 2.117 3.563 5.274 1.00 . A A . 437 GLU CG 1 1 10 4302 1 1 5 GLU H H 3.793 3.089 3.336 1.00 . A A . 437 GLU H 1 1 10 4303 1 1 5 GLU HA H 1.093 3.671 2.402 1.00 . A A . 437 GLU HA 1 1 10 4304 1 1 5 GLU HB2 H 2.467 5.446 4.367 1.00 . A A . 437 GLU HB2 1 1 10 4305 1 1 5 GLU HB3 H 0.795 4.916 4.320 1.00 . A A . 437 GLU HB3 1 1 10 4306 1 1 5 GLU HG2 H 1.453 3.725 6.110 1.00 . A A . 437 GLU HG2 1 1 10 4307 1 1 5 GLU HG3 H 1.948 2.577 4.864 1.00 . A A . 437 GLU HG3 1 1 10 4308 1 1 5 GLU N N 3.047 3.072 2.686 1.00 . A A . 437 GLU N 1 1 10 4309 1 1 5 GLU O O 3.289 6.057 2.233 1.00 . A A . 437 GLU O 1 1 10 4310 1 1 5 GLU OE1 O 4.476 3.694 4.924 1.00 . A A . 437 GLU OE1 1 1 10 4311 1 1 5 GLU OE2 O 3.754 3.693 6.996 1.00 . A A . 437 GLU OE2 1 1 10 4312 1 1 6 ARG C C 0.841 6.845 -0.939 1.00 . A A . 438 ARG C 1 1 10 4313 1 1 6 ARG CA C 2.119 6.394 -0.233 1.00 . A A . 438 ARG CA 1 1 10 4314 1 1 6 ARG CB C 3.134 5.848 -1.241 1.00 . A A . 438 ARG CB 1 1 10 4315 1 1 6 ARG CD C 4.845 6.343 -2.994 1.00 . A A . 438 ARG CD 1 1 10 4316 1 1 6 ARG CG C 3.635 6.871 -2.242 1.00 . A A . 438 ARG CG 1 1 10 4317 1 1 6 ARG CZ C 6.929 5.181 -2.338 1.00 . A A . 438 ARG CZ 1 1 10 4318 1 1 6 ARG H H 1.094 4.697 0.495 1.00 . A A . 438 ARG H 1 1 10 4319 1 1 6 ARG HA H 2.559 7.212 0.316 1.00 . A A . 438 ARG HA 1 1 10 4320 1 1 6 ARG HB2 H 3.987 5.462 -0.702 1.00 . A A . 438 ARG HB2 1 1 10 4321 1 1 6 ARG HB3 H 2.674 5.038 -1.789 1.00 . A A . 438 ARG HB3 1 1 10 4322 1 1 6 ARG HD2 H 4.565 5.439 -3.517 1.00 . A A . 438 ARG HD2 1 1 10 4323 1 1 6 ARG HD3 H 5.165 7.089 -3.705 1.00 . A A . 438 ARG HD3 1 1 10 4324 1 1 6 ARG HE H 5.957 6.521 -1.212 1.00 . A A . 438 ARG HE 1 1 10 4325 1 1 6 ARG HG2 H 2.847 7.090 -2.948 1.00 . A A . 438 ARG HG2 1 1 10 4326 1 1 6 ARG HG3 H 3.912 7.770 -1.714 1.00 . A A . 438 ARG HG3 1 1 10 4327 1 1 6 ARG HH11 H 6.239 4.634 -4.165 1.00 . A A . 438 ARG HH11 1 1 10 4328 1 1 6 ARG HH12 H 7.709 3.856 -3.658 1.00 . A A . 438 ARG HH12 1 1 10 4329 1 1 6 ARG HH21 H 7.865 5.476 -0.567 1.00 . A A . 438 ARG HH21 1 1 10 4330 1 1 6 ARG HH22 H 8.617 4.319 -1.628 1.00 . A A . 438 ARG HH22 1 1 10 4331 1 1 6 ARG N N 1.792 5.354 0.721 1.00 . A A . 438 ARG N 1 1 10 4332 1 1 6 ARG NE N 5.951 6.046 -2.084 1.00 . A A . 438 ARG NE 1 1 10 4333 1 1 6 ARG NH1 N 6.960 4.506 -3.480 1.00 . A A . 438 ARG NH1 1 1 10 4334 1 1 6 ARG NH2 N 7.881 4.980 -1.440 1.00 . A A . 438 ARG NH2 1 1 10 4335 1 1 6 ARG O O -0.016 6.011 -1.232 1.00 . A A . 438 ARG O 1 1 10 4336 1 1 7 LYS C C -0.308 8.836 -3.345 1.00 . A A . 439 LYS C 1 1 10 4337 1 1 7 LYS CA C -0.527 8.589 -1.867 1.00 . A A . 439 LYS CA 1 1 10 4338 1 1 7 LYS CB C -1.117 9.821 -1.169 1.00 . A A . 439 LYS CB 1 1 10 4339 1 1 7 LYS CD C -0.861 12.206 -0.397 1.00 . A A . 439 LYS CD 1 1 10 4340 1 1 7 LYS CE C -1.060 12.039 1.110 1.00 . A A . 439 LYS CE 1 1 10 4341 1 1 7 LYS CG C -0.173 11.003 -1.037 1.00 . A A . 439 LYS CG 1 1 10 4342 1 1 7 LYS H H 1.412 8.783 -1.053 1.00 . A A . 439 LYS H 1 1 10 4343 1 1 7 LYS HA H -1.238 7.784 -1.785 1.00 . A A . 439 LYS HA 1 1 10 4344 1 1 7 LYS HB2 H -1.982 10.147 -1.726 1.00 . A A . 439 LYS HB2 1 1 10 4345 1 1 7 LYS HB3 H -1.433 9.533 -0.177 1.00 . A A . 439 LYS HB3 1 1 10 4346 1 1 7 LYS HD2 H -0.257 13.086 -0.570 1.00 . A A . 439 LYS HD2 1 1 10 4347 1 1 7 LYS HD3 H -1.826 12.340 -0.863 1.00 . A A . 439 LYS HD3 1 1 10 4348 1 1 7 LYS HE2 H -0.110 11.791 1.557 1.00 . A A . 439 LYS HE2 1 1 10 4349 1 1 7 LYS HE3 H -1.408 12.978 1.515 1.00 . A A . 439 LYS HE3 1 1 10 4350 1 1 7 LYS HG2 H 0.665 10.712 -0.422 1.00 . A A . 439 LYS HG2 1 1 10 4351 1 1 7 LYS HG3 H 0.180 11.281 -2.020 1.00 . A A . 439 LYS HG3 1 1 10 4352 1 1 7 LYS HZ1 H -2.122 10.886 2.495 1.00 . A A . 439 LYS HZ1 1 1 10 4353 1 1 7 LYS HZ2 H -1.735 10.059 1.076 1.00 . A A . 439 LYS HZ2 1 1 10 4354 1 1 7 LYS HZ3 H -2.985 11.200 1.069 1.00 . A A . 439 LYS HZ3 1 1 10 4355 1 1 7 LYS N N 0.690 8.137 -1.231 1.00 . A A . 439 LYS N 1 1 10 4356 1 1 7 LYS NZ N -2.042 10.972 1.459 1.00 . A A . 439 LYS NZ 1 1 10 4357 1 1 7 LYS O O 0.558 9.613 -3.754 1.00 . A A . 439 LYS O 1 1 10 4358 1 1 8 THR C C -2.007 9.349 -6.045 1.00 . A A . 440 THR C 1 1 10 4359 1 1 8 THR CA C -1.071 8.243 -5.574 1.00 . A A . 440 THR CA 1 1 10 4360 1 1 8 THR CB C -1.463 6.901 -6.230 1.00 . A A . 440 THR CB 1 1 10 4361 1 1 8 THR CG2 C -2.837 6.445 -5.763 1.00 . A A . 440 THR CG2 1 1 10 4362 1 1 8 THR H H -1.762 7.542 -3.715 1.00 . A A . 440 THR H 1 1 10 4363 1 1 8 THR HA H -0.059 8.487 -5.865 1.00 . A A . 440 THR HA 1 1 10 4364 1 1 8 THR HB H -0.739 6.153 -5.936 1.00 . A A . 440 THR HB 1 1 10 4365 1 1 8 THR HG1 H -0.947 6.271 -8.029 1.00 . A A . 440 THR HG1 1 1 10 4366 1 1 8 THR HG21 H -3.092 5.516 -6.251 1.00 . A A . 440 THR HG21 1 1 10 4367 1 1 8 THR HG22 H -3.569 7.198 -6.016 1.00 . A A . 440 THR HG22 1 1 10 4368 1 1 8 THR HG23 H -2.825 6.298 -4.693 1.00 . A A . 440 THR HG23 1 1 10 4369 1 1 8 THR N N -1.110 8.150 -4.130 1.00 . A A . 440 THR N 1 1 10 4370 1 1 8 THR O O -3.001 9.655 -5.376 1.00 . A A . 440 THR O 1 1 10 4371 1 1 8 THR OG1 O -1.453 7.012 -7.656 1.00 . A A . 440 THR OG1 1 1 10 4372 1 1 9 ALA C C -3.879 10.709 -8.037 1.00 . A A . 441 ALA C 1 1 10 4373 1 1 9 ALA CA C -2.430 11.089 -7.727 1.00 . A A . 441 ALA CA 1 1 10 4374 1 1 9 ALA CB C -1.749 11.619 -8.979 1.00 . A A . 441 ALA CB 1 1 10 4375 1 1 9 ALA H H -0.870 9.655 -7.661 1.00 . A A . 441 ALA H 1 1 10 4376 1 1 9 ALA HA H -2.428 11.880 -6.989 1.00 . A A . 441 ALA HA 1 1 10 4377 1 1 9 ALA HB1 H -0.729 11.884 -8.747 1.00 . A A . 441 ALA HB1 1 1 10 4378 1 1 9 ALA HB2 H -2.277 12.494 -9.331 1.00 . A A . 441 ALA HB2 1 1 10 4379 1 1 9 ALA HB3 H -1.760 10.858 -9.744 1.00 . A A . 441 ALA HB3 1 1 10 4380 1 1 9 ALA N N -1.666 9.966 -7.178 1.00 . A A . 441 ALA N 1 1 10 4381 1 1 9 ALA O O -4.678 11.556 -8.438 1.00 . A A . 441 ALA O 1 1 10 4382 1 1 10 ASP C C -6.415 9.552 -6.779 1.00 . A A . 442 ASP C 1 1 10 4383 1 1 10 ASP CA C -5.594 8.972 -7.934 1.00 . A A . 442 ASP CA 1 1 10 4384 1 1 10 ASP CB C -5.632 7.442 -7.897 1.00 . A A . 442 ASP CB 1 1 10 4385 1 1 10 ASP CG C -7.009 6.873 -8.171 1.00 . A A . 442 ASP CG 1 1 10 4386 1 1 10 ASP H H -3.504 8.788 -7.648 1.00 . A A . 442 ASP H 1 1 10 4387 1 1 10 ASP HA H -6.009 9.315 -8.868 1.00 . A A . 442 ASP HA 1 1 10 4388 1 1 10 ASP HB2 H -4.953 7.056 -8.643 1.00 . A A . 442 ASP HB2 1 1 10 4389 1 1 10 ASP HB3 H -5.313 7.106 -6.921 1.00 . A A . 442 ASP HB3 1 1 10 4390 1 1 10 ASP N N -4.213 9.436 -7.847 1.00 . A A . 442 ASP N 1 1 10 4391 1 1 10 ASP O O -7.645 9.501 -6.776 1.00 . A A . 442 ASP O 1 1 10 4392 1 1 10 ASP OD1 O -7.380 6.763 -9.359 1.00 . A A . 442 ASP OD1 1 1 10 4393 1 1 10 ASP OD2 O -7.718 6.524 -7.209 1.00 . A A . 442 ASP OD2 1 1 10 4394 1 1 11 GLY C C -6.580 9.738 -3.526 1.00 . A A . 443 GLY C 1 1 10 4395 1 1 11 GLY CA C -6.360 10.721 -4.655 1.00 . A A . 443 GLY CA 1 1 10 4396 1 1 11 GLY H H -4.731 10.110 -5.857 1.00 . A A . 443 GLY H 1 1 10 4397 1 1 11 GLY HA2 H -5.743 11.531 -4.297 1.00 . A A . 443 GLY HA2 1 1 10 4398 1 1 11 GLY HA3 H -7.316 11.118 -4.963 1.00 . A A . 443 GLY HA3 1 1 10 4399 1 1 11 GLY N N -5.712 10.110 -5.798 1.00 . A A . 443 GLY N 1 1 10 4400 1 1 11 GLY O O -7.541 9.857 -2.768 1.00 . A A . 443 GLY O 1 1 10 4401 1 1 12 LYS C C -4.488 7.351 -1.783 1.00 . A A . 444 LYS C 1 1 10 4402 1 1 12 LYS CA C -5.827 7.709 -2.417 1.00 . A A . 444 LYS CA 1 1 10 4403 1 1 12 LYS CB C -6.417 6.458 -3.070 1.00 . A A . 444 LYS CB 1 1 10 4404 1 1 12 LYS CD C -8.347 5.335 -4.201 1.00 . A A . 444 LYS CD 1 1 10 4405 1 1 12 LYS CE C -9.767 5.477 -4.719 1.00 . A A . 444 LYS CE 1 1 10 4406 1 1 12 LYS CG C -7.849 6.616 -3.557 1.00 . A A . 444 LYS CG 1 1 10 4407 1 1 12 LYS H H -4.896 8.771 -3.998 1.00 . A A . 444 LYS H 1 1 10 4408 1 1 12 LYS HA H -6.500 8.057 -1.649 1.00 . A A . 444 LYS HA 1 1 10 4409 1 1 12 LYS HB2 H -5.804 6.190 -3.917 1.00 . A A . 444 LYS HB2 1 1 10 4410 1 1 12 LYS HB3 H -6.394 5.651 -2.352 1.00 . A A . 444 LYS HB3 1 1 10 4411 1 1 12 LYS HD2 H -7.698 5.083 -5.026 1.00 . A A . 444 LYS HD2 1 1 10 4412 1 1 12 LYS HD3 H -8.320 4.544 -3.467 1.00 . A A . 444 LYS HD3 1 1 10 4413 1 1 12 LYS HE2 H -10.058 4.549 -5.190 1.00 . A A . 444 LYS HE2 1 1 10 4414 1 1 12 LYS HE3 H -10.419 5.677 -3.883 1.00 . A A . 444 LYS HE3 1 1 10 4415 1 1 12 LYS HG2 H -8.482 6.858 -2.717 1.00 . A A . 444 LYS HG2 1 1 10 4416 1 1 12 LYS HG3 H -7.887 7.415 -4.284 1.00 . A A . 444 LYS HG3 1 1 10 4417 1 1 12 LYS HZ1 H -9.900 7.501 -5.216 1.00 . A A . 444 LYS HZ1 1 1 10 4418 1 1 12 LYS HZ2 H -10.769 6.475 -6.251 1.00 . A A . 444 LYS HZ2 1 1 10 4419 1 1 12 LYS HZ3 H -9.079 6.559 -6.369 1.00 . A A . 444 LYS HZ3 1 1 10 4420 1 1 12 LYS N N -5.681 8.769 -3.409 1.00 . A A . 444 LYS N 1 1 10 4421 1 1 12 LYS NZ N -9.888 6.578 -5.706 1.00 . A A . 444 LYS NZ 1 1 10 4422 1 1 12 LYS O O -3.458 7.297 -2.461 1.00 . A A . 444 LYS O 1 1 10 4423 1 1 13 THR C C -3.383 5.029 0.145 1.00 . A A . 445 THR C 1 1 10 4424 1 1 13 THR CA C -3.353 6.552 0.204 1.00 . A A . 445 THR CA 1 1 10 4425 1 1 13 THR CB C -3.315 7.013 1.672 1.00 . A A . 445 THR CB 1 1 10 4426 1 1 13 THR CG2 C -2.007 6.610 2.339 1.00 . A A . 445 THR CG2 1 1 10 4427 1 1 13 THR H H -5.340 7.236 0.018 1.00 . A A . 445 THR H 1 1 10 4428 1 1 13 THR HA H -2.474 6.913 -0.293 1.00 . A A . 445 THR HA 1 1 10 4429 1 1 13 THR HB H -4.132 6.550 2.202 1.00 . A A . 445 THR HB 1 1 10 4430 1 1 13 THR HG1 H -3.948 8.667 2.547 1.00 . A A . 445 THR HG1 1 1 10 4431 1 1 13 THR HG21 H -1.903 5.535 2.312 1.00 . A A . 445 THR HG21 1 1 10 4432 1 1 13 THR HG22 H -2.011 6.945 3.365 1.00 . A A . 445 THR HG22 1 1 10 4433 1 1 13 THR HG23 H -1.177 7.066 1.816 1.00 . A A . 445 THR HG23 1 1 10 4434 1 1 13 THR N N -4.517 7.076 -0.487 1.00 . A A . 445 THR N 1 1 10 4435 1 1 13 THR O O -4.126 4.383 0.886 1.00 . A A . 445 THR O 1 1 10 4436 1 1 13 THR OG1 O -3.461 8.438 1.737 1.00 . A A . 445 THR OG1 1 1 10 4437 1 1 14 TYR C C -1.436 2.360 -0.343 1.00 . A A . 446 TYR C 1 1 10 4438 1 1 14 TYR CA C -2.643 3.022 -0.978 1.00 . A A . 446 TYR CA 1 1 10 4439 1 1 14 TYR CB C -2.720 2.697 -2.473 1.00 . A A . 446 TYR CB 1 1 10 4440 1 1 14 TYR CD1 C -0.853 4.071 -3.510 1.00 . A A . 446 TYR CD1 1 1 10 4441 1 1 14 TYR CD2 C -0.797 1.702 -3.768 1.00 . A A . 446 TYR CD2 1 1 10 4442 1 1 14 TYR CE1 C 0.312 4.180 -4.249 1.00 . A A . 446 TYR CE1 1 1 10 4443 1 1 14 TYR CE2 C 0.366 1.803 -4.502 1.00 . A A . 446 TYR CE2 1 1 10 4444 1 1 14 TYR CG C -1.427 2.831 -3.256 1.00 . A A . 446 TYR CG 1 1 10 4445 1 1 14 TYR CZ C 0.917 3.041 -4.741 1.00 . A A . 446 TYR CZ 1 1 10 4446 1 1 14 TYR H H -1.990 5.005 -1.297 1.00 . A A . 446 TYR H 1 1 10 4447 1 1 14 TYR HA H -3.534 2.648 -0.497 1.00 . A A . 446 TYR HA 1 1 10 4448 1 1 14 TYR HB2 H -3.059 1.678 -2.586 1.00 . A A . 446 TYR HB2 1 1 10 4449 1 1 14 TYR HB3 H -3.447 3.355 -2.927 1.00 . A A . 446 TYR HB3 1 1 10 4450 1 1 14 TYR HD1 H -1.327 4.960 -3.119 1.00 . A A . 446 TYR HD1 1 1 10 4451 1 1 14 TYR HD2 H -1.231 0.732 -3.581 1.00 . A A . 446 TYR HD2 1 1 10 4452 1 1 14 TYR HE1 H 0.745 5.151 -4.437 1.00 . A A . 446 TYR HE1 1 1 10 4453 1 1 14 TYR HE2 H 0.838 0.911 -4.889 1.00 . A A . 446 TYR HE2 1 1 10 4454 1 1 14 TYR HH H 2.728 3.652 -4.990 1.00 . A A . 446 TYR HH 1 1 10 4455 1 1 14 TYR N N -2.608 4.456 -0.768 1.00 . A A . 446 TYR N 1 1 10 4456 1 1 14 TYR O O -0.331 2.903 -0.372 1.00 . A A . 446 TYR O 1 1 10 4457 1 1 14 TYR OH O 2.075 3.141 -5.481 1.00 . A A . 446 TYR OH 1 1 10 4458 1 1 15 TYR C C -0.168 -0.735 0.080 1.00 . A A . 447 TYR C 1 1 10 4459 1 1 15 TYR CA C -0.587 0.478 0.901 1.00 . A A . 447 TYR CA 1 1 10 4460 1 1 15 TYR CB C -1.048 0.072 2.305 1.00 . A A . 447 TYR CB 1 1 10 4461 1 1 15 TYR CD1 C -0.992 2.196 3.675 1.00 . A A . 447 TYR CD1 1 1 10 4462 1 1 15 TYR CD2 C -3.116 1.315 3.049 1.00 . A A . 447 TYR CD2 1 1 10 4463 1 1 15 TYR CE1 C -1.613 3.256 4.304 1.00 . A A . 447 TYR CE1 1 1 10 4464 1 1 15 TYR CE2 C -3.744 2.369 3.683 1.00 . A A . 447 TYR CE2 1 1 10 4465 1 1 15 TYR CG C -1.731 1.209 3.036 1.00 . A A . 447 TYR CG 1 1 10 4466 1 1 15 TYR CZ C -2.988 3.338 4.306 1.00 . A A . 447 TYR CZ 1 1 10 4467 1 1 15 TYR H H -2.539 0.773 0.176 1.00 . A A . 447 TYR H 1 1 10 4468 1 1 15 TYR HA H 0.253 1.150 0.990 1.00 . A A . 447 TYR HA 1 1 10 4469 1 1 15 TYR HB2 H -1.749 -0.746 2.227 1.00 . A A . 447 TYR HB2 1 1 10 4470 1 1 15 TYR HB3 H -0.193 -0.239 2.887 1.00 . A A . 447 TYR HB3 1 1 10 4471 1 1 15 TYR HD1 H 0.084 2.128 3.678 1.00 . A A . 447 TYR HD1 1 1 10 4472 1 1 15 TYR HD2 H -3.706 0.552 2.560 1.00 . A A . 447 TYR HD2 1 1 10 4473 1 1 15 TYR HE1 H -1.021 4.013 4.796 1.00 . A A . 447 TYR HE1 1 1 10 4474 1 1 15 TYR HE2 H -4.821 2.429 3.688 1.00 . A A . 447 TYR HE2 1 1 10 4475 1 1 15 TYR HH H -4.435 4.102 5.318 1.00 . A A . 447 TYR HH 1 1 10 4476 1 1 15 TYR N N -1.647 1.184 0.222 1.00 . A A . 447 TYR N 1 1 10 4477 1 1 15 TYR O O -0.843 -1.764 0.076 1.00 . A A . 447 TYR O 1 1 10 4478 1 1 15 TYR OH O -3.610 4.401 4.921 1.00 . A A . 447 TYR OH 1 1 10 4479 1 1 16 TYR C C 2.415 -2.530 -0.684 1.00 . A A . 448 TYR C 1 1 10 4480 1 1 16 TYR CA C 1.423 -1.678 -1.479 1.00 . A A . 448 TYR CA 1 1 10 4481 1 1 16 TYR CB C 2.106 -1.120 -2.731 1.00 . A A . 448 TYR CB 1 1 10 4482 1 1 16 TYR CD1 C 1.551 -2.626 -4.673 1.00 . A A . 448 TYR CD1 1 1 10 4483 1 1 16 TYR CD2 C 3.755 -2.729 -3.770 1.00 . A A . 448 TYR CD2 1 1 10 4484 1 1 16 TYR CE1 C 1.882 -3.595 -5.599 1.00 . A A . 448 TYR CE1 1 1 10 4485 1 1 16 TYR CE2 C 4.093 -3.697 -4.695 1.00 . A A . 448 TYR CE2 1 1 10 4486 1 1 16 TYR CG C 2.479 -2.177 -3.744 1.00 . A A . 448 TYR CG 1 1 10 4487 1 1 16 TYR CZ C 3.155 -4.127 -5.606 1.00 . A A . 448 TYR CZ 1 1 10 4488 1 1 16 TYR H H 1.346 0.287 -0.715 1.00 . A A . 448 TYR H 1 1 10 4489 1 1 16 TYR HA H 0.583 -2.286 -1.777 1.00 . A A . 448 TYR HA 1 1 10 4490 1 1 16 TYR HB2 H 1.442 -0.420 -3.213 1.00 . A A . 448 TYR HB2 1 1 10 4491 1 1 16 TYR HB3 H 3.011 -0.608 -2.438 1.00 . A A . 448 TYR HB3 1 1 10 4492 1 1 16 TYR HD1 H 0.554 -2.207 -4.666 1.00 . A A . 448 TYR HD1 1 1 10 4493 1 1 16 TYR HD2 H 4.488 -2.390 -3.054 1.00 . A A . 448 TYR HD2 1 1 10 4494 1 1 16 TYR HE1 H 1.147 -3.930 -6.317 1.00 . A A . 448 TYR HE1 1 1 10 4495 1 1 16 TYR HE2 H 5.088 -4.113 -4.699 1.00 . A A . 448 TYR HE2 1 1 10 4496 1 1 16 TYR HH H 3.198 -4.822 -7.400 1.00 . A A . 448 TYR HH 1 1 10 4497 1 1 16 TYR N N 0.916 -0.590 -0.663 1.00 . A A . 448 TYR N 1 1 10 4498 1 1 16 TYR O O 3.362 -2.018 -0.083 1.00 . A A . 448 TYR O 1 1 10 4499 1 1 16 TYR OH O 3.488 -5.096 -6.525 1.00 . A A . 448 TYR OH 1 1 10 4500 1 1 17 ASN C C 3.928 -5.517 -0.943 1.00 . A A . 449 ASN C 1 1 10 4501 1 1 17 ASN CA C 2.987 -4.803 0.020 1.00 . A A . 449 ASN CA 1 1 10 4502 1 1 17 ASN CB C 2.060 -5.816 0.700 1.00 . A A . 449 ASN CB 1 1 10 4503 1 1 17 ASN CG C 2.783 -7.020 1.273 1.00 . A A . 449 ASN CG 1 1 10 4504 1 1 17 ASN H H 1.409 -4.170 -1.213 1.00 . A A . 449 ASN H 1 1 10 4505 1 1 17 ASN HA H 3.565 -4.283 0.770 1.00 . A A . 449 ASN HA 1 1 10 4506 1 1 17 ASN HB2 H 1.536 -5.325 1.506 1.00 . A A . 449 ASN HB2 1 1 10 4507 1 1 17 ASN HB3 H 1.339 -6.168 -0.025 1.00 . A A . 449 ASN HB3 1 1 10 4508 1 1 17 ASN HD21 H 1.125 -8.114 1.124 1.00 . A A . 449 ASN HD21 1 1 10 4509 1 1 17 ASN HD22 H 2.506 -8.921 1.784 1.00 . A A . 449 ASN HD22 1 1 10 4510 1 1 17 ASN N N 2.175 -3.833 -0.696 1.00 . A A . 449 ASN N 1 1 10 4511 1 1 17 ASN ND2 N 2.071 -8.131 1.401 1.00 . A A . 449 ASN ND2 1 1 10 4512 1 1 17 ASN O O 3.486 -6.087 -1.938 1.00 . A A . 449 ASN O 1 1 10 4513 1 1 17 ASN OD1 O 3.959 -6.947 1.619 1.00 . A A . 449 ASN OD1 1 1 10 4514 1 1 18 ASN C C 6.418 -7.575 -1.185 1.00 . A A . 450 ASN C 1 1 10 4515 1 1 18 ASN CA C 6.213 -6.101 -1.521 1.00 . A A . 450 ASN CA 1 1 10 4516 1 1 18 ASN CB C 7.542 -5.341 -1.421 1.00 . A A . 450 ASN CB 1 1 10 4517 1 1 18 ASN CG C 8.534 -5.729 -2.508 1.00 . A A . 450 ASN CG 1 1 10 4518 1 1 18 ASN H H 5.506 -5.108 0.215 1.00 . A A . 450 ASN H 1 1 10 4519 1 1 18 ASN HA H 5.839 -6.024 -2.530 1.00 . A A . 450 ASN HA 1 1 10 4520 1 1 18 ASN HB2 H 7.348 -4.282 -1.498 1.00 . A A . 450 ASN HB2 1 1 10 4521 1 1 18 ASN HB3 H 7.990 -5.548 -0.460 1.00 . A A . 450 ASN HB3 1 1 10 4522 1 1 18 ASN HD21 H 9.395 -7.068 -1.315 1.00 . A A . 450 ASN HD21 1 1 10 4523 1 1 18 ASN HD22 H 10.067 -6.930 -2.901 1.00 . A A . 450 ASN HD22 1 1 10 4524 1 1 18 ASN N N 5.218 -5.509 -0.633 1.00 . A A . 450 ASN N 1 1 10 4525 1 1 18 ASN ND2 N 9.419 -6.669 -2.210 1.00 . A A . 450 ASN ND2 1 1 10 4526 1 1 18 ASN O O 7.012 -8.326 -1.957 1.00 . A A . 450 ASN O 1 1 10 4527 1 1 18 ASN OD1 O 8.515 -5.171 -3.603 1.00 . A A . 450 ASN OD1 1 1 10 4528 1 1 19 ARG C C 5.246 -10.302 -0.478 1.00 . A A . 451 ARG C 1 1 10 4529 1 1 19 ARG CA C 6.053 -9.369 0.415 1.00 . A A . 451 ARG CA 1 1 10 4530 1 1 19 ARG CB C 5.596 -9.539 1.866 1.00 . A A . 451 ARG CB 1 1 10 4531 1 1 19 ARG CD C 7.824 -9.225 3.008 1.00 . A A . 451 ARG CD 1 1 10 4532 1 1 19 ARG CG C 6.392 -8.728 2.874 1.00 . A A . 451 ARG CG 1 1 10 4533 1 1 19 ARG CZ C 9.732 -8.855 4.544 1.00 . A A . 451 ARG CZ 1 1 10 4534 1 1 19 ARG H H 5.443 -7.339 0.549 1.00 . A A . 451 ARG H 1 1 10 4535 1 1 19 ARG HA H 7.092 -9.631 0.345 1.00 . A A . 451 ARG HA 1 1 10 4536 1 1 19 ARG HB2 H 4.561 -9.243 1.940 1.00 . A A . 451 ARG HB2 1 1 10 4537 1 1 19 ARG HB3 H 5.679 -10.584 2.132 1.00 . A A . 451 ARG HB3 1 1 10 4538 1 1 19 ARG HD2 H 7.808 -10.286 3.214 1.00 . A A . 451 ARG HD2 1 1 10 4539 1 1 19 ARG HD3 H 8.346 -9.043 2.080 1.00 . A A . 451 ARG HD3 1 1 10 4540 1 1 19 ARG HE H 8.037 -7.781 4.527 1.00 . A A . 451 ARG HE 1 1 10 4541 1 1 19 ARG HG2 H 6.410 -7.696 2.556 1.00 . A A . 451 ARG HG2 1 1 10 4542 1 1 19 ARG HG3 H 5.906 -8.799 3.838 1.00 . A A . 451 ARG HG3 1 1 10 4543 1 1 19 ARG HH11 H 10.043 -10.369 3.223 1.00 . A A . 451 ARG HH11 1 1 10 4544 1 1 19 ARG HH12 H 11.345 -10.080 4.342 1.00 . A A . 451 ARG HH12 1 1 10 4545 1 1 19 ARG HH21 H 9.721 -7.424 5.980 1.00 . A A . 451 ARG HH21 1 1 10 4546 1 1 19 ARG HH22 H 11.161 -8.398 5.916 1.00 . A A . 451 ARG HH22 1 1 10 4547 1 1 19 ARG N N 5.916 -7.984 -0.026 1.00 . A A . 451 ARG N 1 1 10 4548 1 1 19 ARG NE N 8.520 -8.536 4.091 1.00 . A A . 451 ARG NE 1 1 10 4549 1 1 19 ARG NH1 N 10.427 -9.845 3.991 1.00 . A A . 451 ARG NH1 1 1 10 4550 1 1 19 ARG NH2 N 10.248 -8.171 5.560 1.00 . A A . 451 ARG NH2 1 1 10 4551 1 1 19 ARG O O 5.701 -11.391 -0.831 1.00 . A A . 451 ARG O 1 1 10 4552 1 1 20 THR C C 2.775 -10.011 -2.928 1.00 . A A . 452 THR C 1 1 10 4553 1 1 20 THR CA C 3.137 -10.697 -1.611 1.00 . A A . 452 THR CA 1 1 10 4554 1 1 20 THR CB C 1.847 -10.985 -0.813 1.00 . A A . 452 THR CB 1 1 10 4555 1 1 20 THR CG2 C 1.182 -12.268 -1.290 1.00 . A A . 452 THR CG2 1 1 10 4556 1 1 20 THR H H 3.747 -8.991 -0.529 1.00 . A A . 452 THR H 1 1 10 4557 1 1 20 THR HA H 3.626 -11.637 -1.820 1.00 . A A . 452 THR HA 1 1 10 4558 1 1 20 THR HB H 1.160 -10.163 -0.952 1.00 . A A . 452 THR HB 1 1 10 4559 1 1 20 THR HG1 H 1.409 -11.498 1.045 1.00 . A A . 452 THR HG1 1 1 10 4560 1 1 20 THR HG21 H 0.940 -12.181 -2.340 1.00 . A A . 452 THR HG21 1 1 10 4561 1 1 20 THR HG22 H 0.277 -12.439 -0.725 1.00 . A A . 452 THR HG22 1 1 10 4562 1 1 20 THR HG23 H 1.858 -13.098 -1.145 1.00 . A A . 452 THR HG23 1 1 10 4563 1 1 20 THR N N 4.041 -9.876 -0.824 1.00 . A A . 452 THR N 1 1 10 4564 1 1 20 THR O O 2.018 -10.559 -3.729 1.00 . A A . 452 THR O 1 1 10 4565 1 1 20 THR OG1 O 2.159 -11.107 0.584 1.00 . A A . 452 THR OG1 1 1 10 4566 1 1 21 LEU C C 1.456 -7.608 -4.179 1.00 . A A . 453 LEU C 1 1 10 4567 1 1 21 LEU CA C 2.938 -7.966 -4.288 1.00 . A A . 453 LEU CA 1 1 10 4568 1 1 21 LEU CB C 3.233 -8.679 -5.612 1.00 . A A . 453 LEU CB 1 1 10 4569 1 1 21 LEU CD1 C 4.883 -9.744 -7.173 1.00 . A A . 453 LEU CD1 1 1 10 4570 1 1 21 LEU CD2 C 5.568 -7.766 -5.802 1.00 . A A . 453 LEU CD2 1 1 10 4571 1 1 21 LEU CG C 4.708 -9.024 -5.846 1.00 . A A . 453 LEU CG 1 1 10 4572 1 1 21 LEU H H 4.008 -8.479 -2.529 1.00 . A A . 453 LEU H 1 1 10 4573 1 1 21 LEU HA H 3.519 -7.054 -4.239 1.00 . A A . 453 LEU HA 1 1 10 4574 1 1 21 LEU HB2 H 2.659 -9.594 -5.638 1.00 . A A . 453 LEU HB2 1 1 10 4575 1 1 21 LEU HB3 H 2.903 -8.043 -6.420 1.00 . A A . 453 LEU HB3 1 1 10 4576 1 1 21 LEU HD11 H 4.533 -9.110 -7.975 1.00 . A A . 453 LEU HD11 1 1 10 4577 1 1 21 LEU HD12 H 4.311 -10.660 -7.164 1.00 . A A . 453 LEU HD12 1 1 10 4578 1 1 21 LEU HD13 H 5.927 -9.972 -7.324 1.00 . A A . 453 LEU HD13 1 1 10 4579 1 1 21 LEU HD21 H 5.259 -7.091 -6.585 1.00 . A A . 453 LEU HD21 1 1 10 4580 1 1 21 LEU HD22 H 6.605 -8.034 -5.946 1.00 . A A . 453 LEU HD22 1 1 10 4581 1 1 21 LEU HD23 H 5.451 -7.283 -4.843 1.00 . A A . 453 LEU HD23 1 1 10 4582 1 1 21 LEU HG H 5.042 -9.687 -5.061 1.00 . A A . 453 LEU HG 1 1 10 4583 1 1 21 LEU N N 3.322 -8.806 -3.144 1.00 . A A . 453 LEU N 1 1 10 4584 1 1 21 LEU O O 0.792 -7.278 -5.162 1.00 . A A . 453 LEU O 1 1 10 4585 1 1 22 GLU C C -0.731 -5.961 -2.406 1.00 . A A . 454 GLU C 1 1 10 4586 1 1 22 GLU CA C -0.417 -7.436 -2.613 1.00 . A A . 454 GLU CA 1 1 10 4587 1 1 22 GLU CB C -0.717 -8.228 -1.339 1.00 . A A . 454 GLU CB 1 1 10 4588 1 1 22 GLU CD C -2.222 -8.652 0.617 1.00 . A A . 454 GLU CD 1 1 10 4589 1 1 22 GLU CG C -2.010 -7.848 -0.641 1.00 . A A . 454 GLU CG 1 1 10 4590 1 1 22 GLU H H 1.624 -7.735 -2.207 1.00 . A A . 454 GLU H 1 1 10 4591 1 1 22 GLU HA H -1.012 -7.823 -3.427 1.00 . A A . 454 GLU HA 1 1 10 4592 1 1 22 GLU HB2 H -0.770 -9.277 -1.590 1.00 . A A . 454 GLU HB2 1 1 10 4593 1 1 22 GLU HB3 H 0.096 -8.082 -0.641 1.00 . A A . 454 GLU HB3 1 1 10 4594 1 1 22 GLU HG2 H -1.974 -6.800 -0.384 1.00 . A A . 454 GLU HG2 1 1 10 4595 1 1 22 GLU HG3 H -2.834 -8.028 -1.310 1.00 . A A . 454 GLU HG3 1 1 10 4596 1 1 22 GLU N N 0.988 -7.618 -2.941 1.00 . A A . 454 GLU N 1 1 10 4597 1 1 22 GLU O O 0.025 -5.249 -1.760 1.00 . A A . 454 GLU O 1 1 10 4598 1 1 22 GLU OE1 O -1.274 -8.767 1.418 1.00 . A A . 454 GLU OE1 1 1 10 4599 1 1 22 GLU OE2 O -3.334 -9.185 0.807 1.00 . A A . 454 GLU OE2 1 1 10 4600 1 1 23 SER C C -3.353 -4.018 -1.707 1.00 . A A . 455 SER C 1 1 10 4601 1 1 23 SER CA C -2.245 -4.120 -2.757 1.00 . A A . 455 SER CA 1 1 10 4602 1 1 23 SER CB C -2.704 -3.527 -4.085 1.00 . A A . 455 SER CB 1 1 10 4603 1 1 23 SER H H -2.422 -6.105 -3.466 1.00 . A A . 455 SER H 1 1 10 4604 1 1 23 SER HA H -1.382 -3.574 -2.408 1.00 . A A . 455 SER HA 1 1 10 4605 1 1 23 SER HB2 H -3.611 -4.017 -4.404 1.00 . A A . 455 SER HB2 1 1 10 4606 1 1 23 SER HB3 H -2.888 -2.471 -3.958 1.00 . A A . 455 SER HB3 1 1 10 4607 1 1 23 SER HG H -1.098 -4.388 -4.799 1.00 . A A . 455 SER HG 1 1 10 4608 1 1 23 SER N N -1.848 -5.502 -2.944 1.00 . A A . 455 SER N 1 1 10 4609 1 1 23 SER O O -4.481 -4.462 -1.931 1.00 . A A . 455 SER O 1 1 10 4610 1 1 23 SER OG O -1.714 -3.705 -5.082 1.00 . A A . 455 SER OG 1 1 10 4611 1 1 24 THR C C -4.449 -1.851 0.599 1.00 . A A . 456 THR C 1 1 10 4612 1 1 24 THR CA C -3.968 -3.302 0.532 1.00 . A A . 456 THR CA 1 1 10 4613 1 1 24 THR CB C -3.319 -3.701 1.871 1.00 . A A . 456 THR CB 1 1 10 4614 1 1 24 THR CG2 C -4.366 -3.873 2.960 1.00 . A A . 456 THR CG2 1 1 10 4615 1 1 24 THR H H -2.099 -3.130 -0.428 1.00 . A A . 456 THR H 1 1 10 4616 1 1 24 THR HA H -4.810 -3.953 0.345 1.00 . A A . 456 THR HA 1 1 10 4617 1 1 24 THR HB H -2.630 -2.924 2.172 1.00 . A A . 456 THR HB 1 1 10 4618 1 1 24 THR HG1 H -3.068 -5.640 2.159 1.00 . A A . 456 THR HG1 1 1 10 4619 1 1 24 THR HG21 H -4.884 -2.939 3.114 1.00 . A A . 456 THR HG21 1 1 10 4620 1 1 24 THR HG22 H -3.883 -4.173 3.877 1.00 . A A . 456 THR HG22 1 1 10 4621 1 1 24 THR HG23 H -5.073 -4.632 2.660 1.00 . A A . 456 THR HG23 1 1 10 4622 1 1 24 THR N N -3.018 -3.455 -0.556 1.00 . A A . 456 THR N 1 1 10 4623 1 1 24 THR O O -3.645 -0.928 0.716 1.00 . A A . 456 THR O 1 1 10 4624 1 1 24 THR OG1 O -2.601 -4.931 1.707 1.00 . A A . 456 THR OG1 1 1 10 4625 1 1 25 TRP C C -7.123 0.033 1.678 1.00 . A A . 457 TRP C 1 1 10 4626 1 1 25 TRP CA C -6.305 -0.299 0.433 1.00 . A A . 457 TRP CA 1 1 10 4627 1 1 25 TRP CB C -7.117 -0.137 -0.860 1.00 . A A . 457 TRP CB 1 1 10 4628 1 1 25 TRP CD1 C -5.569 -1.321 -2.520 1.00 . A A . 457 TRP CD1 1 1 10 4629 1 1 25 TRP CD2 C -5.884 0.848 -2.963 1.00 . A A . 457 TRP CD2 1 1 10 4630 1 1 25 TRP CE2 C -4.991 0.315 -3.912 1.00 . A A . 457 TRP CE2 1 1 10 4631 1 1 25 TRP CE3 C -6.235 2.197 -3.055 1.00 . A A . 457 TRP CE3 1 1 10 4632 1 1 25 TRP CG C -6.232 -0.216 -2.069 1.00 . A A . 457 TRP CG 1 1 10 4633 1 1 25 TRP CH2 C -4.798 2.396 -4.999 1.00 . A A . 457 TRP CH2 1 1 10 4634 1 1 25 TRP CZ2 C -4.436 1.078 -4.929 1.00 . A A . 457 TRP CZ2 1 1 10 4635 1 1 25 TRP CZ3 C -5.691 2.955 -4.077 1.00 . A A . 457 TRP CZ3 1 1 10 4636 1 1 25 TRP H H -6.358 -2.424 0.451 1.00 . A A . 457 TRP H 1 1 10 4637 1 1 25 TRP HA H -5.468 0.383 0.395 1.00 . A A . 457 TRP HA 1 1 10 4638 1 1 25 TRP HB2 H -7.855 -0.924 -0.925 1.00 . A A . 457 TRP HB2 1 1 10 4639 1 1 25 TRP HB3 H -7.607 0.825 -0.860 1.00 . A A . 457 TRP HB3 1 1 10 4640 1 1 25 TRP HD1 H -5.627 -2.294 -2.057 1.00 . A A . 457 TRP HD1 1 1 10 4641 1 1 25 TRP HE1 H -4.242 -1.626 -4.117 1.00 . A A . 457 TRP HE1 1 1 10 4642 1 1 25 TRP HE3 H -6.921 2.646 -2.351 1.00 . A A . 457 TRP HE3 1 1 10 4643 1 1 25 TRP HH2 H -4.399 3.028 -5.779 1.00 . A A . 457 TRP HH2 1 1 10 4644 1 1 25 TRP HZ2 H -3.728 0.661 -5.630 1.00 . A A . 457 TRP HZ2 1 1 10 4645 1 1 25 TRP HZ3 H -5.952 3.996 -4.168 1.00 . A A . 457 TRP HZ3 1 1 10 4646 1 1 25 TRP N N -5.753 -1.650 0.496 1.00 . A A . 457 TRP N 1 1 10 4647 1 1 25 TRP NE1 N -4.811 -1.004 -3.616 1.00 . A A . 457 TRP NE1 1 1 10 4648 1 1 25 TRP O O -7.665 1.132 1.809 1.00 . A A . 457 TRP O 1 1 10 4649 1 1 26 GLU C C -6.712 -0.934 4.976 1.00 . A A . 458 GLU C 1 1 10 4650 1 1 26 GLU CA C -7.771 -0.721 3.902 1.00 . A A . 458 GLU CA 1 1 10 4651 1 1 26 GLU CB C -8.944 -1.688 4.122 1.00 . A A . 458 GLU CB 1 1 10 4652 1 1 26 GLU CD C -8.691 -3.485 2.352 1.00 . A A . 458 GLU CD 1 1 10 4653 1 1 26 GLU CG C -8.625 -3.151 3.830 1.00 . A A . 458 GLU CG 1 1 10 4654 1 1 26 GLU H H -6.805 -1.802 2.381 1.00 . A A . 458 GLU H 1 1 10 4655 1 1 26 GLU HA H -8.130 0.295 3.958 1.00 . A A . 458 GLU HA 1 1 10 4656 1 1 26 GLU HB2 H -9.262 -1.616 5.152 1.00 . A A . 458 GLU HB2 1 1 10 4657 1 1 26 GLU HB3 H -9.764 -1.389 3.484 1.00 . A A . 458 GLU HB3 1 1 10 4658 1 1 26 GLU HG2 H -7.629 -3.365 4.186 1.00 . A A . 458 GLU HG2 1 1 10 4659 1 1 26 GLU HG3 H -9.335 -3.773 4.356 1.00 . A A . 458 GLU HG3 1 1 10 4660 1 1 26 GLU N N -7.176 -0.920 2.594 1.00 . A A . 458 GLU N 1 1 10 4661 1 1 26 GLU O O -5.975 -1.917 4.936 1.00 . A A . 458 GLU O 1 1 10 4662 1 1 26 GLU OE1 O -9.809 -3.738 1.854 1.00 . A A . 458 GLU OE1 1 1 10 4663 1 1 26 GLU OE2 O -7.635 -3.491 1.681 1.00 . A A . 458 GLU OE2 1 1 10 4664 1 1 27 LYS C C -6.015 -1.227 7.987 1.00 . A A . 459 LYS C 1 1 10 4665 1 1 27 LYS CA C -5.643 -0.130 6.995 1.00 . A A . 459 LYS CA 1 1 10 4666 1 1 27 LYS CB C -5.482 1.194 7.740 1.00 . A A . 459 LYS CB 1 1 10 4667 1 1 27 LYS CD C -4.288 3.413 7.871 1.00 . A A . 459 LYS CD 1 1 10 4668 1 1 27 LYS CE C -3.777 3.100 9.273 1.00 . A A . 459 LYS CE 1 1 10 4669 1 1 27 LYS CG C -4.539 2.156 7.047 1.00 . A A . 459 LYS CG 1 1 10 4670 1 1 27 LYS H H -7.236 0.757 5.910 1.00 . A A . 459 LYS H 1 1 10 4671 1 1 27 LYS HA H -4.699 -0.381 6.539 1.00 . A A . 459 LYS HA 1 1 10 4672 1 1 27 LYS HB2 H -6.449 1.667 7.825 1.00 . A A . 459 LYS HB2 1 1 10 4673 1 1 27 LYS HB3 H -5.097 0.996 8.729 1.00 . A A . 459 LYS HB3 1 1 10 4674 1 1 27 LYS HD2 H -3.549 4.015 7.361 1.00 . A A . 459 LYS HD2 1 1 10 4675 1 1 27 LYS HD3 H -5.212 3.967 7.951 1.00 . A A . 459 LYS HD3 1 1 10 4676 1 1 27 LYS HE2 H -3.584 4.030 9.787 1.00 . A A . 459 LYS HE2 1 1 10 4677 1 1 27 LYS HE3 H -4.538 2.549 9.805 1.00 . A A . 459 LYS HE3 1 1 10 4678 1 1 27 LYS HG2 H -3.596 1.659 6.876 1.00 . A A . 459 LYS HG2 1 1 10 4679 1 1 27 LYS HG3 H -4.971 2.442 6.098 1.00 . A A . 459 LYS HG3 1 1 10 4680 1 1 27 LYS HZ1 H -1.850 2.689 8.560 1.00 . A A . 459 LYS HZ1 1 1 10 4681 1 1 27 LYS HZ2 H -2.737 1.306 8.997 1.00 . A A . 459 LYS HZ2 1 1 10 4682 1 1 27 LYS HZ3 H -2.080 2.308 10.194 1.00 . A A . 459 LYS HZ3 1 1 10 4683 1 1 27 LYS N N -6.627 -0.014 5.926 1.00 . A A . 459 LYS N 1 1 10 4684 1 1 27 LYS NZ N -2.526 2.296 9.252 1.00 . A A . 459 LYS NZ 1 1 10 4685 1 1 27 LYS O O -7.088 -1.184 8.592 1.00 . A A . 459 LYS O 1 1 10 4686 1 1 28 PRO C C -5.407 -2.575 10.571 1.00 . A A . 460 PRO C 1 1 10 4687 1 1 28 PRO CA C -5.261 -3.235 9.204 1.00 . A A . 460 PRO CA 1 1 10 4688 1 1 28 PRO CB C -3.941 -4.004 9.129 1.00 . A A . 460 PRO CB 1 1 10 4689 1 1 28 PRO CD C -3.990 -2.513 7.258 1.00 . A A . 460 PRO CD 1 1 10 4690 1 1 28 PRO CG C -3.494 -3.856 7.718 1.00 . A A . 460 PRO CG 1 1 10 4691 1 1 28 PRO HA H -6.089 -3.909 9.035 1.00 . A A . 460 PRO HA 1 1 10 4692 1 1 28 PRO HB2 H -3.229 -3.571 9.816 1.00 . A A . 460 PRO HB2 1 1 10 4693 1 1 28 PRO HB3 H -4.109 -5.041 9.382 1.00 . A A . 460 PRO HB3 1 1 10 4694 1 1 28 PRO HD2 H -3.222 -1.763 7.386 1.00 . A A . 460 PRO HD2 1 1 10 4695 1 1 28 PRO HD3 H -4.298 -2.567 6.224 1.00 . A A . 460 PRO HD3 1 1 10 4696 1 1 28 PRO HG2 H -2.415 -3.895 7.668 1.00 . A A . 460 PRO HG2 1 1 10 4697 1 1 28 PRO HG3 H -3.925 -4.641 7.113 1.00 . A A . 460 PRO HG3 1 1 10 4698 1 1 28 PRO N N -5.143 -2.240 8.138 1.00 . A A . 460 PRO N 1 1 10 4699 1 1 28 PRO O O -4.464 -1.877 10.999 1.00 . A A . 460 PRO O 1 1 10 4700 1 1 28 PRO OXT O -6.466 -2.753 11.208 1.00 . A A . 460 PRO OXT 1 1 11 4701 1 1 1 SER C C 7.779 -1.120 4.758 1.00 . A A . 433 SER C 1 1 11 4702 1 1 1 SER CA C 8.000 0.231 5.440 1.00 . A A . 433 SER CA 1 1 11 4703 1 1 1 SER CB C 8.038 0.083 6.961 1.00 . A A . 433 SER CB 1 1 11 4704 1 1 1 SER H1 H 7.101 2.105 5.531 1.00 . A A . 433 SER H1 1 1 11 4705 1 1 1 SER H2 H 6.007 0.829 5.357 1.00 . A A . 433 SER H2 1 1 11 4706 1 1 1 SER H3 H 6.929 1.337 4.032 1.00 . A A . 433 SER H3 1 1 11 4707 1 1 1 SER HA H 8.946 0.632 5.105 1.00 . A A . 433 SER HA 1 1 11 4708 1 1 1 SER HB2 H 8.641 -0.773 7.222 1.00 . A A . 433 SER HB2 1 1 11 4709 1 1 1 SER HB3 H 8.469 0.974 7.396 1.00 . A A . 433 SER HB3 1 1 11 4710 1 1 1 SER HG H 6.739 0.143 8.428 1.00 . A A . 433 SER HG 1 1 11 4711 1 1 1 SER N N 6.937 1.190 5.064 1.00 . A A . 433 SER N 1 1 11 4712 1 1 1 SER O O 8.127 -1.292 3.588 1.00 . A A . 433 SER O 1 1 11 4713 1 1 1 SER OG O 6.734 -0.098 7.491 1.00 . A A . 433 SER OG 1 1 11 4714 1 1 2 GLU C C 5.696 -3.135 3.887 1.00 . A A . 434 GLU C 1 1 11 4715 1 1 2 GLU CA C 6.811 -3.351 4.893 1.00 . A A . 434 GLU CA 1 1 11 4716 1 1 2 GLU CB C 6.346 -4.342 5.967 1.00 . A A . 434 GLU CB 1 1 11 4717 1 1 2 GLU CD C 8.017 -3.709 7.768 1.00 . A A . 434 GLU CD 1 1 11 4718 1 1 2 GLU CG C 7.438 -4.816 6.911 1.00 . A A . 434 GLU CG 1 1 11 4719 1 1 2 GLU H H 6.981 -1.893 6.424 1.00 . A A . 434 GLU H 1 1 11 4720 1 1 2 GLU HA H 7.676 -3.750 4.383 1.00 . A A . 434 GLU HA 1 1 11 4721 1 1 2 GLU HB2 H 5.577 -3.871 6.560 1.00 . A A . 434 GLU HB2 1 1 11 4722 1 1 2 GLU HB3 H 5.926 -5.209 5.478 1.00 . A A . 434 GLU HB3 1 1 11 4723 1 1 2 GLU HG2 H 7.027 -5.571 7.564 1.00 . A A . 434 GLU HG2 1 1 11 4724 1 1 2 GLU HG3 H 8.236 -5.249 6.326 1.00 . A A . 434 GLU HG3 1 1 11 4725 1 1 2 GLU N N 7.178 -2.065 5.476 1.00 . A A . 434 GLU N 1 1 11 4726 1 1 2 GLU O O 5.646 -3.761 2.827 1.00 . A A . 434 GLU O 1 1 11 4727 1 1 2 GLU OE1 O 7.343 -3.281 8.726 1.00 . A A . 434 GLU OE1 1 1 11 4728 1 1 2 GLU OE2 O 9.157 -3.277 7.494 1.00 . A A . 434 GLU OE2 1 1 11 4729 1 1 3 TRP C C 4.199 -0.540 2.691 1.00 . A A . 435 TRP C 1 1 11 4730 1 1 3 TRP CA C 3.732 -1.810 3.386 1.00 . A A . 435 TRP CA 1 1 11 4731 1 1 3 TRP CB C 2.462 -1.521 4.201 1.00 . A A . 435 TRP CB 1 1 11 4732 1 1 3 TRP CD1 C 2.214 -2.416 6.598 1.00 . A A . 435 TRP CD1 1 1 11 4733 1 1 3 TRP CD2 C 1.743 -3.917 5.010 1.00 . A A . 435 TRP CD2 1 1 11 4734 1 1 3 TRP CE2 C 1.568 -4.529 6.265 1.00 . A A . 435 TRP CE2 1 1 11 4735 1 1 3 TRP CE3 C 1.500 -4.664 3.864 1.00 . A A . 435 TRP CE3 1 1 11 4736 1 1 3 TRP CG C 2.152 -2.565 5.241 1.00 . A A . 435 TRP CG 1 1 11 4737 1 1 3 TRP CH2 C 0.941 -6.568 5.248 1.00 . A A . 435 TRP CH2 1 1 11 4738 1 1 3 TRP CZ2 C 1.166 -5.860 6.397 1.00 . A A . 435 TRP CZ2 1 1 11 4739 1 1 3 TRP CZ3 C 1.107 -5.981 3.995 1.00 . A A . 435 TRP CZ3 1 1 11 4740 1 1 3 TRP H H 4.837 -1.887 5.167 1.00 . A A . 435 TRP H 1 1 11 4741 1 1 3 TRP HA H 3.536 -2.580 2.652 1.00 . A A . 435 TRP HA 1 1 11 4742 1 1 3 TRP HB2 H 2.579 -0.573 4.708 1.00 . A A . 435 TRP HB2 1 1 11 4743 1 1 3 TRP HB3 H 1.621 -1.458 3.528 1.00 . A A . 435 TRP HB3 1 1 11 4744 1 1 3 TRP HD1 H 2.496 -1.501 7.097 1.00 . A A . 435 TRP HD1 1 1 11 4745 1 1 3 TRP HE1 H 1.829 -3.740 8.196 1.00 . A A . 435 TRP HE1 1 1 11 4746 1 1 3 TRP HE3 H 1.623 -4.232 2.882 1.00 . A A . 435 TRP HE3 1 1 11 4747 1 1 3 TRP HH2 H 0.628 -7.602 5.293 1.00 . A A . 435 TRP HH2 1 1 11 4748 1 1 3 TRP HZ2 H 1.034 -6.326 7.364 1.00 . A A . 435 TRP HZ2 1 1 11 4749 1 1 3 TRP HZ3 H 0.934 -6.579 3.110 1.00 . A A . 435 TRP HZ3 1 1 11 4750 1 1 3 TRP N N 4.789 -2.255 4.263 1.00 . A A . 435 TRP N 1 1 11 4751 1 1 3 TRP NE1 N 1.862 -3.592 7.220 1.00 . A A . 435 TRP NE1 1 1 11 4752 1 1 3 TRP O O 4.904 0.267 3.293 1.00 . A A . 435 TRP O 1 1 11 4753 1 1 4 THR C C 3.064 1.898 0.973 1.00 . A A . 436 THR C 1 1 11 4754 1 1 4 THR CA C 4.152 0.870 0.742 1.00 . A A . 436 THR CA 1 1 11 4755 1 1 4 THR CB C 4.316 0.641 -0.775 1.00 . A A . 436 THR CB 1 1 11 4756 1 1 4 THR CG2 C 4.639 1.944 -1.498 1.00 . A A . 436 THR CG2 1 1 11 4757 1 1 4 THR H H 3.293 -1.045 0.985 1.00 . A A . 436 THR H 1 1 11 4758 1 1 4 THR HA H 5.085 1.244 1.141 1.00 . A A . 436 THR HA 1 1 11 4759 1 1 4 THR HB H 3.383 0.259 -1.162 1.00 . A A . 436 THR HB 1 1 11 4760 1 1 4 THR HG1 H 5.044 -1.190 -0.724 1.00 . A A . 436 THR HG1 1 1 11 4761 1 1 4 THR HG21 H 5.542 2.370 -1.087 1.00 . A A . 436 THR HG21 1 1 11 4762 1 1 4 THR HG22 H 3.821 2.640 -1.371 1.00 . A A . 436 THR HG22 1 1 11 4763 1 1 4 THR HG23 H 4.779 1.745 -2.550 1.00 . A A . 436 THR HG23 1 1 11 4764 1 1 4 THR N N 3.812 -0.352 1.445 1.00 . A A . 436 THR N 1 1 11 4765 1 1 4 THR O O 2.010 1.843 0.344 1.00 . A A . 436 THR O 1 1 11 4766 1 1 4 THR OG1 O 5.348 -0.324 -1.023 1.00 . A A . 436 THR OG1 1 1 11 4767 1 1 5 GLU C C 2.626 5.042 1.266 1.00 . A A . 437 GLU C 1 1 11 4768 1 1 5 GLU CA C 2.346 3.857 2.174 1.00 . A A . 437 GLU CA 1 1 11 4769 1 1 5 GLU CB C 2.403 4.303 3.647 1.00 . A A . 437 GLU CB 1 1 11 4770 1 1 5 GLU CD C 3.940 2.764 4.960 1.00 . A A . 437 GLU CD 1 1 11 4771 1 1 5 GLU CG C 2.504 3.160 4.653 1.00 . A A . 437 GLU CG 1 1 11 4772 1 1 5 GLU H H 4.154 2.792 2.393 1.00 . A A . 437 GLU H 1 1 11 4773 1 1 5 GLU HA H 1.362 3.470 1.952 1.00 . A A . 437 GLU HA 1 1 11 4774 1 1 5 GLU HB2 H 3.262 4.943 3.781 1.00 . A A . 437 GLU HB2 1 1 11 4775 1 1 5 GLU HB3 H 1.510 4.870 3.870 1.00 . A A . 437 GLU HB3 1 1 11 4776 1 1 5 GLU HG2 H 2.030 3.469 5.573 1.00 . A A . 437 GLU HG2 1 1 11 4777 1 1 5 GLU HG3 H 1.985 2.303 4.253 1.00 . A A . 437 GLU HG3 1 1 11 4778 1 1 5 GLU N N 3.310 2.819 1.889 1.00 . A A . 437 GLU N 1 1 11 4779 1 1 5 GLU O O 3.438 5.907 1.587 1.00 . A A . 437 GLU O 1 1 11 4780 1 1 5 GLU OE1 O 4.865 3.272 4.288 1.00 . A A . 437 GLU OE1 1 1 11 4781 1 1 5 GLU OE2 O 4.156 1.952 5.885 1.00 . A A . 437 GLU OE2 1 1 11 4782 1 1 6 ARG C C 0.960 6.886 -1.133 1.00 . A A . 438 ARG C 1 1 11 4783 1 1 6 ARG CA C 2.249 6.086 -0.877 1.00 . A A . 438 ARG CA 1 1 11 4784 1 1 6 ARG CB C 2.739 5.472 -2.192 1.00 . A A . 438 ARG CB 1 1 11 4785 1 1 6 ARG CD C 3.404 5.855 -4.591 1.00 . A A . 438 ARG CD 1 1 11 4786 1 1 6 ARG CG C 2.838 6.480 -3.327 1.00 . A A . 438 ARG CG 1 1 11 4787 1 1 6 ARG CZ C 5.502 4.796 -5.339 1.00 . A A . 438 ARG CZ 1 1 11 4788 1 1 6 ARG H H 1.349 4.333 -0.104 1.00 . A A . 438 ARG H 1 1 11 4789 1 1 6 ARG HA H 3.028 6.714 -0.474 1.00 . A A . 438 ARG HA 1 1 11 4790 1 1 6 ARG HB2 H 3.717 5.041 -2.033 1.00 . A A . 438 ARG HB2 1 1 11 4791 1 1 6 ARG HB3 H 2.054 4.689 -2.490 1.00 . A A . 438 ARG HB3 1 1 11 4792 1 1 6 ARG HD2 H 2.834 4.970 -4.827 1.00 . A A . 438 ARG HD2 1 1 11 4793 1 1 6 ARG HD3 H 3.313 6.566 -5.399 1.00 . A A . 438 ARG HD3 1 1 11 4794 1 1 6 ARG HE H 5.273 5.801 -3.620 1.00 . A A . 438 ARG HE 1 1 11 4795 1 1 6 ARG HG2 H 1.853 6.863 -3.542 1.00 . A A . 438 ARG HG2 1 1 11 4796 1 1 6 ARG HG3 H 3.482 7.290 -3.018 1.00 . A A . 438 ARG HG3 1 1 11 4797 1 1 6 ARG HH11 H 3.929 4.501 -6.583 1.00 . A A . 438 ARG HH11 1 1 11 4798 1 1 6 ARG HH12 H 5.433 3.805 -7.109 1.00 . A A . 438 ARG HH12 1 1 11 4799 1 1 6 ARG HH21 H 7.244 4.897 -4.312 1.00 . A A . 438 ARG HH21 1 1 11 4800 1 1 6 ARG HH22 H 7.319 4.041 -5.820 1.00 . A A . 438 ARG HH22 1 1 11 4801 1 1 6 ARG N N 2.000 5.043 0.101 1.00 . A A . 438 ARG N 1 1 11 4802 1 1 6 ARG NE N 4.810 5.490 -4.439 1.00 . A A . 438 ARG NE 1 1 11 4803 1 1 6 ARG NH1 N 4.906 4.332 -6.428 1.00 . A A . 438 ARG NH1 1 1 11 4804 1 1 6 ARG NH2 N 6.791 4.556 -5.140 1.00 . A A . 438 ARG NH2 1 1 11 4805 1 1 6 ARG O O -0.078 6.281 -1.419 1.00 . A A . 438 ARG O 1 1 11 4806 1 1 7 LYS C C -0.262 9.320 -2.811 1.00 . A A . 439 LYS C 1 1 11 4807 1 1 7 LYS CA C -0.196 8.999 -1.329 1.00 . A A . 439 LYS CA 1 1 11 4808 1 1 7 LYS CB C -0.202 10.282 -0.503 1.00 . A A . 439 LYS CB 1 1 11 4809 1 1 7 LYS CD C -1.524 12.188 0.432 1.00 . A A . 439 LYS CD 1 1 11 4810 1 1 7 LYS CE C -2.922 12.626 0.816 1.00 . A A . 439 LYS CE 1 1 11 4811 1 1 7 LYS CG C -1.560 10.946 -0.435 1.00 . A A . 439 LYS CG 1 1 11 4812 1 1 7 LYS H H 1.831 8.703 -0.859 1.00 . A A . 439 LYS H 1 1 11 4813 1 1 7 LYS HA H -1.051 8.399 -1.063 1.00 . A A . 439 LYS HA 1 1 11 4814 1 1 7 LYS HB2 H 0.113 10.051 0.504 1.00 . A A . 439 LYS HB2 1 1 11 4815 1 1 7 LYS HB3 H 0.496 10.983 -0.940 1.00 . A A . 439 LYS HB3 1 1 11 4816 1 1 7 LYS HD2 H -0.964 11.974 1.332 1.00 . A A . 439 LYS HD2 1 1 11 4817 1 1 7 LYS HD3 H -1.043 12.987 -0.114 1.00 . A A . 439 LYS HD3 1 1 11 4818 1 1 7 LYS HE2 H -2.858 13.543 1.380 1.00 . A A . 439 LYS HE2 1 1 11 4819 1 1 7 LYS HE3 H -3.494 12.793 -0.085 1.00 . A A . 439 LYS HE3 1 1 11 4820 1 1 7 LYS HG2 H -1.866 11.223 -1.433 1.00 . A A . 439 LYS HG2 1 1 11 4821 1 1 7 LYS HG3 H -2.271 10.246 -0.020 1.00 . A A . 439 LYS HG3 1 1 11 4822 1 1 7 LYS HZ1 H -3.101 11.464 2.543 1.00 . A A . 439 LYS HZ1 1 1 11 4823 1 1 7 LYS HZ2 H -3.633 10.689 1.137 1.00 . A A . 439 LYS HZ2 1 1 11 4824 1 1 7 LYS HZ3 H -4.586 11.894 1.846 1.00 . A A . 439 LYS HZ3 1 1 11 4825 1 1 7 LYS N N 0.997 8.225 -1.068 1.00 . A A . 439 LYS N 1 1 11 4826 1 1 7 LYS NZ N -3.607 11.597 1.642 1.00 . A A . 439 LYS NZ 1 1 11 4827 1 1 7 LYS O O 0.578 10.043 -3.338 1.00 . A A . 439 LYS O 1 1 11 4828 1 1 8 THR C C -2.198 10.130 -5.283 1.00 . A A . 440 THR C 1 1 11 4829 1 1 8 THR CA C -1.370 8.901 -4.918 1.00 . A A . 440 THR CA 1 1 11 4830 1 1 8 THR CB C -2.014 7.635 -5.503 1.00 . A A . 440 THR CB 1 1 11 4831 1 1 8 THR CG2 C -1.757 7.506 -6.995 1.00 . A A . 440 THR CG2 1 1 11 4832 1 1 8 THR H H -1.911 8.220 -2.994 1.00 . A A . 440 THR H 1 1 11 4833 1 1 8 THR HA H -0.376 9.004 -5.331 1.00 . A A . 440 THR HA 1 1 11 4834 1 1 8 THR HB H -3.081 7.675 -5.333 1.00 . A A . 440 THR HB 1 1 11 4835 1 1 8 THR HG1 H -0.899 6.790 -4.123 1.00 . A A . 440 THR HG1 1 1 11 4836 1 1 8 THR HG21 H -0.697 7.609 -7.187 1.00 . A A . 440 THR HG21 1 1 11 4837 1 1 8 THR HG22 H -2.298 8.275 -7.524 1.00 . A A . 440 THR HG22 1 1 11 4838 1 1 8 THR HG23 H -2.087 6.531 -7.327 1.00 . A A . 440 THR HG23 1 1 11 4839 1 1 8 THR N N -1.248 8.761 -3.479 1.00 . A A . 440 THR N 1 1 11 4840 1 1 8 THR O O -3.202 10.435 -4.626 1.00 . A A . 440 THR O 1 1 11 4841 1 1 8 THR OG1 O -1.472 6.496 -4.837 1.00 . A A . 440 THR OG1 1 1 11 4842 1 1 9 ALA C C -3.800 11.783 -7.390 1.00 . A A . 441 ALA C 1 1 11 4843 1 1 9 ALA CA C -2.430 12.061 -6.777 1.00 . A A . 441 ALA CA 1 1 11 4844 1 1 9 ALA CB C -1.545 12.802 -7.770 1.00 . A A . 441 ALA CB 1 1 11 4845 1 1 9 ALA H H -0.999 10.498 -6.848 1.00 . A A . 441 ALA H 1 1 11 4846 1 1 9 ALA HA H -2.558 12.693 -5.910 1.00 . A A . 441 ALA HA 1 1 11 4847 1 1 9 ALA HB1 H -0.583 12.998 -7.318 1.00 . A A . 441 ALA HB1 1 1 11 4848 1 1 9 ALA HB2 H -2.010 13.736 -8.043 1.00 . A A . 441 ALA HB2 1 1 11 4849 1 1 9 ALA HB3 H -1.410 12.195 -8.654 1.00 . A A . 441 ALA HB3 1 1 11 4850 1 1 9 ALA N N -1.778 10.827 -6.339 1.00 . A A . 441 ALA N 1 1 11 4851 1 1 9 ALA O O -4.474 12.691 -7.874 1.00 . A A . 441 ALA O 1 1 11 4852 1 1 10 ASP C C -6.511 10.305 -6.609 1.00 . A A . 442 ASP C 1 1 11 4853 1 1 10 ASP CA C -5.544 10.129 -7.782 1.00 . A A . 442 ASP CA 1 1 11 4854 1 1 10 ASP CB C -5.538 8.678 -8.274 1.00 . A A . 442 ASP CB 1 1 11 4855 1 1 10 ASP CG C -6.852 8.266 -8.909 1.00 . A A . 442 ASP CG 1 1 11 4856 1 1 10 ASP H H -3.578 9.831 -7.068 1.00 . A A . 442 ASP H 1 1 11 4857 1 1 10 ASP HA H -5.849 10.779 -8.589 1.00 . A A . 442 ASP HA 1 1 11 4858 1 1 10 ASP HB2 H -4.756 8.557 -9.007 1.00 . A A . 442 ASP HB2 1 1 11 4859 1 1 10 ASP HB3 H -5.344 8.023 -7.435 1.00 . A A . 442 ASP HB3 1 1 11 4860 1 1 10 ASP N N -4.204 10.521 -7.367 1.00 . A A . 442 ASP N 1 1 11 4861 1 1 10 ASP O O -7.681 9.920 -6.666 1.00 . A A . 442 ASP O 1 1 11 4862 1 1 10 ASP OD1 O -7.334 8.982 -9.811 1.00 . A A . 442 ASP OD1 1 1 11 4863 1 1 10 ASP OD2 O -7.397 7.216 -8.523 1.00 . A A . 442 ASP OD2 1 1 11 4864 1 1 11 GLY C C -6.978 10.096 -3.411 1.00 . A A . 443 GLY C 1 1 11 4865 1 1 11 GLY CA C -6.816 11.236 -4.391 1.00 . A A . 443 GLY CA 1 1 11 4866 1 1 11 GLY H H -5.034 11.092 -5.517 1.00 . A A . 443 GLY H 1 1 11 4867 1 1 11 GLY HA2 H -6.362 12.073 -3.880 1.00 . A A . 443 GLY HA2 1 1 11 4868 1 1 11 GLY HA3 H -7.794 11.533 -4.743 1.00 . A A . 443 GLY HA3 1 1 11 4869 1 1 11 GLY N N -5.993 10.889 -5.533 1.00 . A A . 443 GLY N 1 1 11 4870 1 1 11 GLY O O -7.898 10.103 -2.593 1.00 . A A . 443 GLY O 1 1 11 4871 1 1 12 LYS C C -4.789 7.431 -2.252 1.00 . A A . 444 LYS C 1 1 11 4872 1 1 12 LYS CA C -6.175 7.934 -2.637 1.00 . A A . 444 LYS CA 1 1 11 4873 1 1 12 LYS CB C -6.955 6.828 -3.360 1.00 . A A . 444 LYS CB 1 1 11 4874 1 1 12 LYS CD C -9.164 6.031 -4.281 1.00 . A A . 444 LYS CD 1 1 11 4875 1 1 12 LYS CE C -8.698 5.935 -5.723 1.00 . A A . 444 LYS CE 1 1 11 4876 1 1 12 LYS CG C -8.438 7.131 -3.520 1.00 . A A . 444 LYS CG 1 1 11 4877 1 1 12 LYS H H -5.323 9.210 -4.095 1.00 . A A . 444 LYS H 1 1 11 4878 1 1 12 LYS HA H -6.707 8.206 -1.736 1.00 . A A . 444 LYS HA 1 1 11 4879 1 1 12 LYS HB2 H -6.529 6.688 -4.342 1.00 . A A . 444 LYS HB2 1 1 11 4880 1 1 12 LYS HB3 H -6.856 5.909 -2.800 1.00 . A A . 444 LYS HB3 1 1 11 4881 1 1 12 LYS HD2 H -8.981 5.090 -3.792 1.00 . A A . 444 LYS HD2 1 1 11 4882 1 1 12 LYS HD3 H -10.223 6.243 -4.271 1.00 . A A . 444 LYS HD3 1 1 11 4883 1 1 12 LYS HE2 H -7.627 5.791 -5.735 1.00 . A A . 444 LYS HE2 1 1 11 4884 1 1 12 LYS HE3 H -9.178 5.087 -6.187 1.00 . A A . 444 LYS HE3 1 1 11 4885 1 1 12 LYS HG2 H -8.882 7.227 -2.539 1.00 . A A . 444 LYS HG2 1 1 11 4886 1 1 12 LYS HG3 H -8.547 8.064 -4.056 1.00 . A A . 444 LYS HG3 1 1 11 4887 1 1 12 LYS HZ1 H -8.602 7.993 -6.050 1.00 . A A . 444 LYS HZ1 1 1 11 4888 1 1 12 LYS HZ2 H -10.064 7.288 -6.529 1.00 . A A . 444 LYS HZ2 1 1 11 4889 1 1 12 LYS HZ3 H -8.667 7.073 -7.472 1.00 . A A . 444 LYS HZ3 1 1 11 4890 1 1 12 LYS N N -6.081 9.122 -3.477 1.00 . A A . 444 LYS N 1 1 11 4891 1 1 12 LYS NZ N -9.030 7.159 -6.492 1.00 . A A . 444 LYS NZ 1 1 11 4892 1 1 12 LYS O O -3.893 7.344 -3.092 1.00 . A A . 444 LYS O 1 1 11 4893 1 1 13 THR C C -3.443 5.020 -0.514 1.00 . A A . 445 THR C 1 1 11 4894 1 1 13 THR CA C -3.379 6.548 -0.479 1.00 . A A . 445 THR CA 1 1 11 4895 1 1 13 THR CB C -3.119 7.016 0.967 1.00 . A A . 445 THR CB 1 1 11 4896 1 1 13 THR CG2 C -1.728 6.611 1.436 1.00 . A A . 445 THR CG2 1 1 11 4897 1 1 13 THR H H -5.358 7.271 -0.349 1.00 . A A . 445 THR H 1 1 11 4898 1 1 13 THR HA H -2.569 6.890 -1.105 1.00 . A A . 445 THR HA 1 1 11 4899 1 1 13 THR HB H -3.850 6.554 1.615 1.00 . A A . 445 THR HB 1 1 11 4900 1 1 13 THR HG1 H -3.582 8.684 1.928 1.00 . A A . 445 THR HG1 1 1 11 4901 1 1 13 THR HG21 H -1.641 5.536 1.415 1.00 . A A . 445 THR HG21 1 1 11 4902 1 1 13 THR HG22 H -1.569 6.967 2.444 1.00 . A A . 445 THR HG22 1 1 11 4903 1 1 13 THR HG23 H -0.988 7.045 0.782 1.00 . A A . 445 THR HG23 1 1 11 4904 1 1 13 THR N N -4.622 7.114 -0.979 1.00 . A A . 445 THR N 1 1 11 4905 1 1 13 THR O O -4.315 4.420 0.119 1.00 . A A . 445 THR O 1 1 11 4906 1 1 13 THR OG1 O -3.257 8.444 1.048 1.00 . A A . 445 THR OG1 1 1 11 4907 1 1 14 TYR C C -1.425 2.308 -0.601 1.00 . A A . 446 TYR C 1 1 11 4908 1 1 14 TYR CA C -2.570 2.935 -1.372 1.00 . A A . 446 TYR CA 1 1 11 4909 1 1 14 TYR CB C -2.537 2.491 -2.843 1.00 . A A . 446 TYR CB 1 1 11 4910 1 1 14 TYR CD1 C -0.227 1.639 -3.433 1.00 . A A . 446 TYR CD1 1 1 11 4911 1 1 14 TYR CD2 C -0.940 3.700 -4.394 1.00 . A A . 446 TYR CD2 1 1 11 4912 1 1 14 TYR CE1 C 0.975 1.738 -4.102 1.00 . A A . 446 TYR CE1 1 1 11 4913 1 1 14 TYR CE2 C 0.261 3.801 -5.071 1.00 . A A . 446 TYR CE2 1 1 11 4914 1 1 14 TYR CG C -1.205 2.620 -3.562 1.00 . A A . 446 TYR CG 1 1 11 4915 1 1 14 TYR CZ C 1.213 2.819 -4.920 1.00 . A A . 446 TYR CZ 1 1 11 4916 1 1 14 TYR H H -1.827 4.892 -1.697 1.00 . A A . 446 TYR H 1 1 11 4917 1 1 14 TYR HA H -3.500 2.596 -0.932 1.00 . A A . 446 TYR HA 1 1 11 4918 1 1 14 TYR HB2 H -2.827 1.455 -2.897 1.00 . A A . 446 TYR HB2 1 1 11 4919 1 1 14 TYR HB3 H -3.260 3.080 -3.392 1.00 . A A . 446 TYR HB3 1 1 11 4920 1 1 14 TYR HD1 H -0.417 0.792 -2.791 1.00 . A A . 446 TYR HD1 1 1 11 4921 1 1 14 TYR HD2 H -1.687 4.475 -4.512 1.00 . A A . 446 TYR HD2 1 1 11 4922 1 1 14 TYR HE1 H 1.721 0.965 -3.985 1.00 . A A . 446 TYR HE1 1 1 11 4923 1 1 14 TYR HE2 H 0.447 4.647 -5.713 1.00 . A A . 446 TYR HE2 1 1 11 4924 1 1 14 TYR HH H 2.605 2.071 -6.015 1.00 . A A . 446 TYR HH 1 1 11 4925 1 1 14 TYR N N -2.539 4.384 -1.249 1.00 . A A . 446 TYR N 1 1 11 4926 1 1 14 TYR O O -0.357 2.910 -0.464 1.00 . A A . 446 TYR O 1 1 11 4927 1 1 14 TYR OH O 2.407 2.914 -5.597 1.00 . A A . 446 TYR OH 1 1 11 4928 1 1 15 TYR C C -0.259 -0.902 -0.136 1.00 . A A . 447 TYR C 1 1 11 4929 1 1 15 TYR CA C -0.624 0.375 0.620 1.00 . A A . 447 TYR CA 1 1 11 4930 1 1 15 TYR CB C -1.094 0.051 2.045 1.00 . A A . 447 TYR CB 1 1 11 4931 1 1 15 TYR CD1 C -1.206 2.292 3.220 1.00 . A A . 447 TYR CD1 1 1 11 4932 1 1 15 TYR CD2 C -3.250 1.152 2.773 1.00 . A A . 447 TYR CD2 1 1 11 4933 1 1 15 TYR CE1 C -1.910 3.336 3.791 1.00 . A A . 447 TYR CE1 1 1 11 4934 1 1 15 TYR CE2 C -3.959 2.188 3.349 1.00 . A A . 447 TYR CE2 1 1 11 4935 1 1 15 TYR CG C -1.862 1.185 2.700 1.00 . A A . 447 TYR CG 1 1 11 4936 1 1 15 TYR CZ C -3.284 3.278 3.856 1.00 . A A . 447 TYR CZ 1 1 11 4937 1 1 15 TYR H H -2.524 0.675 -0.247 1.00 . A A . 447 TYR H 1 1 11 4938 1 1 15 TYR HA H 0.250 1.010 0.673 1.00 . A A . 447 TYR HA 1 1 11 4939 1 1 15 TYR HB2 H -1.740 -0.813 2.017 1.00 . A A . 447 TYR HB2 1 1 11 4940 1 1 15 TYR HB3 H -0.234 -0.168 2.661 1.00 . A A . 447 TYR HB3 1 1 11 4941 1 1 15 TYR HD1 H -0.133 2.335 3.178 1.00 . A A . 447 TYR HD1 1 1 11 4942 1 1 15 TYR HD2 H -3.778 0.299 2.376 1.00 . A A . 447 TYR HD2 1 1 11 4943 1 1 15 TYR HE1 H -1.380 4.189 4.190 1.00 . A A . 447 TYR HE1 1 1 11 4944 1 1 15 TYR HE2 H -5.036 2.136 3.408 1.00 . A A . 447 TYR HE2 1 1 11 4945 1 1 15 TYR HH H -4.742 3.976 4.913 1.00 . A A . 447 TYR HH 1 1 11 4946 1 1 15 TYR N N -1.648 1.098 -0.110 1.00 . A A . 447 TYR N 1 1 11 4947 1 1 15 TYR O O -0.927 -1.929 -0.019 1.00 . A A . 447 TYR O 1 1 11 4948 1 1 15 TYR OH O -3.988 4.323 4.415 1.00 . A A . 447 TYR OH 1 1 11 4949 1 1 16 TYR C C 2.304 -2.736 -0.973 1.00 . A A . 448 TYR C 1 1 11 4950 1 1 16 TYR CA C 1.247 -1.942 -1.744 1.00 . A A . 448 TYR CA 1 1 11 4951 1 1 16 TYR CB C 1.804 -1.437 -3.081 1.00 . A A . 448 TYR CB 1 1 11 4952 1 1 16 TYR CD1 C 2.362 -3.718 -4.047 1.00 . A A . 448 TYR CD1 1 1 11 4953 1 1 16 TYR CD2 C 3.974 -1.972 -4.248 1.00 . A A . 448 TYR CD2 1 1 11 4954 1 1 16 TYR CE1 C 3.216 -4.583 -4.708 1.00 . A A . 448 TYR CE1 1 1 11 4955 1 1 16 TYR CE2 C 4.829 -2.832 -4.912 1.00 . A A . 448 TYR CE2 1 1 11 4956 1 1 16 TYR CG C 2.726 -2.398 -3.804 1.00 . A A . 448 TYR CG 1 1 11 4957 1 1 16 TYR CZ C 4.446 -4.133 -5.137 1.00 . A A . 448 TYR CZ 1 1 11 4958 1 1 16 TYR H H 1.194 0.068 -1.090 1.00 . A A . 448 TYR H 1 1 11 4959 1 1 16 TYR HA H 0.402 -2.582 -1.940 1.00 . A A . 448 TYR HA 1 1 11 4960 1 1 16 TYR HB2 H 0.978 -1.222 -3.740 1.00 . A A . 448 TYR HB2 1 1 11 4961 1 1 16 TYR HB3 H 2.354 -0.526 -2.902 1.00 . A A . 448 TYR HB3 1 1 11 4962 1 1 16 TYR HD1 H 1.397 -4.068 -3.709 1.00 . A A . 448 TYR HD1 1 1 11 4963 1 1 16 TYR HD2 H 4.273 -0.949 -4.071 1.00 . A A . 448 TYR HD2 1 1 11 4964 1 1 16 TYR HE1 H 2.922 -5.605 -4.882 1.00 . A A . 448 TYR HE1 1 1 11 4965 1 1 16 TYR HE2 H 5.793 -2.481 -5.249 1.00 . A A . 448 TYR HE2 1 1 11 4966 1 1 16 TYR HH H 4.769 -5.572 -6.381 1.00 . A A . 448 TYR HH 1 1 11 4967 1 1 16 TYR N N 0.772 -0.806 -0.962 1.00 . A A . 448 TYR N 1 1 11 4968 1 1 16 TYR O O 3.348 -2.208 -0.600 1.00 . A A . 448 TYR O 1 1 11 4969 1 1 16 TYR OH O 5.291 -4.989 -5.802 1.00 . A A . 448 TYR OH 1 1 11 4970 1 1 17 ASN C C 3.787 -5.685 -0.920 1.00 . A A . 449 ASN C 1 1 11 4971 1 1 17 ASN CA C 2.900 -4.883 0.014 1.00 . A A . 449 ASN CA 1 1 11 4972 1 1 17 ASN CB C 2.080 -5.853 0.861 1.00 . A A . 449 ASN CB 1 1 11 4973 1 1 17 ASN CG C 2.957 -6.802 1.656 1.00 . A A . 449 ASN CG 1 1 11 4974 1 1 17 ASN H H 1.167 -4.375 -1.071 1.00 . A A . 449 ASN H 1 1 11 4975 1 1 17 ASN HA H 3.514 -4.276 0.660 1.00 . A A . 449 ASN HA 1 1 11 4976 1 1 17 ASN HB2 H 1.470 -5.290 1.553 1.00 . A A . 449 ASN HB2 1 1 11 4977 1 1 17 ASN HB3 H 1.442 -6.439 0.217 1.00 . A A . 449 ASN HB3 1 1 11 4978 1 1 17 ASN HD21 H 1.547 -8.204 1.591 1.00 . A A . 449 ASN HD21 1 1 11 4979 1 1 17 ASN HD22 H 2.987 -8.618 2.455 1.00 . A A . 449 ASN HD22 1 1 11 4980 1 1 17 ASN N N 2.013 -4.007 -0.735 1.00 . A A . 449 ASN N 1 1 11 4981 1 1 17 ASN ND2 N 2.452 -7.995 1.922 1.00 . A A . 449 ASN ND2 1 1 11 4982 1 1 17 ASN O O 3.302 -6.324 -1.850 1.00 . A A . 449 ASN O 1 1 11 4983 1 1 17 ASN OD1 O 4.076 -6.466 2.028 1.00 . A A . 449 ASN OD1 1 1 11 4984 1 1 18 ASN C C 6.386 -7.755 -0.710 1.00 . A A . 450 ASN C 1 1 11 4985 1 1 18 ASN CA C 6.031 -6.450 -1.431 1.00 . A A . 450 ASN CA 1 1 11 4986 1 1 18 ASN CB C 7.284 -5.610 -1.708 1.00 . A A . 450 ASN CB 1 1 11 4987 1 1 18 ASN CG C 8.243 -6.249 -2.703 1.00 . A A . 450 ASN CG 1 1 11 4988 1 1 18 ASN H H 5.403 -5.145 0.113 1.00 . A A . 450 ASN H 1 1 11 4989 1 1 18 ASN HA H 5.556 -6.694 -2.370 1.00 . A A . 450 ASN HA 1 1 11 4990 1 1 18 ASN HB2 H 6.978 -4.655 -2.107 1.00 . A A . 450 ASN HB2 1 1 11 4991 1 1 18 ASN HB3 H 7.814 -5.451 -0.780 1.00 . A A . 450 ASN HB3 1 1 11 4992 1 1 18 ASN HD21 H 9.347 -7.006 -1.234 1.00 . A A . 450 ASN HD21 1 1 11 4993 1 1 18 ASN HD22 H 9.891 -7.346 -2.836 1.00 . A A . 450 ASN HD22 1 1 11 4994 1 1 18 ASN N N 5.080 -5.681 -0.642 1.00 . A A . 450 ASN N 1 1 11 4995 1 1 18 ASN ND2 N 9.259 -6.938 -2.208 1.00 . A A . 450 ASN ND2 1 1 11 4996 1 1 18 ASN O O 7.106 -8.597 -1.238 1.00 . A A . 450 ASN O 1 1 11 4997 1 1 18 ASN OD1 O 8.082 -6.098 -3.913 1.00 . A A . 450 ASN OD1 1 1 11 4998 1 1 19 ARG C C 5.389 -10.339 0.682 1.00 . A A . 451 ARG C 1 1 11 4999 1 1 19 ARG CA C 6.111 -9.138 1.283 1.00 . A A . 451 ARG CA 1 1 11 5000 1 1 19 ARG CB C 5.701 -8.958 2.748 1.00 . A A . 451 ARG CB 1 1 11 5001 1 1 19 ARG CD C 8.014 -8.299 3.501 1.00 . A A . 451 ARG CD 1 1 11 5002 1 1 19 ARG CG C 6.537 -7.934 3.501 1.00 . A A . 451 ARG CG 1 1 11 5003 1 1 19 ARG CZ C 9.771 -6.582 3.767 1.00 . A A . 451 ARG CZ 1 1 11 5004 1 1 19 ARG H H 5.281 -7.223 0.883 1.00 . A A . 451 ARG H 1 1 11 5005 1 1 19 ARG HA H 7.165 -9.324 1.247 1.00 . A A . 451 ARG HA 1 1 11 5006 1 1 19 ARG HB2 H 4.670 -8.639 2.782 1.00 . A A . 451 ARG HB2 1 1 11 5007 1 1 19 ARG HB3 H 5.790 -9.908 3.254 1.00 . A A . 451 ARG HB3 1 1 11 5008 1 1 19 ARG HD2 H 8.128 -9.287 3.921 1.00 . A A . 451 ARG HD2 1 1 11 5009 1 1 19 ARG HD3 H 8.372 -8.301 2.481 1.00 . A A . 451 ARG HD3 1 1 11 5010 1 1 19 ARG HE H 8.623 -7.297 5.250 1.00 . A A . 451 ARG HE 1 1 11 5011 1 1 19 ARG HG2 H 6.418 -6.971 3.027 1.00 . A A . 451 ARG HG2 1 1 11 5012 1 1 19 ARG HG3 H 6.187 -7.879 4.522 1.00 . A A . 451 ARG HG3 1 1 11 5013 1 1 19 ARG HH11 H 9.584 -7.293 1.877 1.00 . A A . 451 ARG HH11 1 1 11 5014 1 1 19 ARG HH12 H 10.797 -6.063 2.084 1.00 . A A . 451 ARG HH12 1 1 11 5015 1 1 19 ARG HH21 H 10.233 -5.695 5.536 1.00 . A A . 451 ARG HH21 1 1 11 5016 1 1 19 ARG HH22 H 11.162 -5.155 4.167 1.00 . A A . 451 ARG HH22 1 1 11 5017 1 1 19 ARG N N 5.854 -7.928 0.502 1.00 . A A . 451 ARG N 1 1 11 5018 1 1 19 ARG NE N 8.812 -7.356 4.282 1.00 . A A . 451 ARG NE 1 1 11 5019 1 1 19 ARG NH1 N 10.070 -6.654 2.474 1.00 . A A . 451 ARG NH1 1 1 11 5020 1 1 19 ARG NH2 N 10.441 -5.746 4.552 1.00 . A A . 451 ARG NH2 1 1 11 5021 1 1 19 ARG O O 5.948 -11.426 0.580 1.00 . A A . 451 ARG O 1 1 11 5022 1 1 20 THR C C 2.900 -10.763 -1.707 1.00 . A A . 452 THR C 1 1 11 5023 1 1 20 THR CA C 3.345 -11.190 -0.317 1.00 . A A . 452 THR CA 1 1 11 5024 1 1 20 THR CB C 2.111 -11.549 0.533 1.00 . A A . 452 THR CB 1 1 11 5025 1 1 20 THR CG2 C 2.514 -12.294 1.796 1.00 . A A . 452 THR CG2 1 1 11 5026 1 1 20 THR H H 3.722 -9.266 0.467 1.00 . A A . 452 THR H 1 1 11 5027 1 1 20 THR HA H 3.968 -12.069 -0.403 1.00 . A A . 452 THR HA 1 1 11 5028 1 1 20 THR HB H 1.465 -12.186 -0.052 1.00 . A A . 452 THR HB 1 1 11 5029 1 1 20 THR HG1 H 0.458 -10.565 0.992 1.00 . A A . 452 THR HG1 1 1 11 5030 1 1 20 THR HG21 H 3.027 -13.206 1.526 1.00 . A A . 452 THR HG21 1 1 11 5031 1 1 20 THR HG22 H 1.631 -12.534 2.370 1.00 . A A . 452 THR HG22 1 1 11 5032 1 1 20 THR HG23 H 3.172 -11.673 2.387 1.00 . A A . 452 THR HG23 1 1 11 5033 1 1 20 THR N N 4.136 -10.139 0.307 1.00 . A A . 452 THR N 1 1 11 5034 1 1 20 THR O O 2.206 -11.508 -2.400 1.00 . A A . 452 THR O 1 1 11 5035 1 1 20 THR OG1 O 1.396 -10.356 0.885 1.00 . A A . 452 THR OG1 1 1 11 5036 1 1 21 LEU C C 1.298 -8.760 -3.218 1.00 . A A . 453 LEU C 1 1 11 5037 1 1 21 LEU CA C 2.812 -8.905 -3.304 1.00 . A A . 453 LEU CA 1 1 11 5038 1 1 21 LEU CB C 3.230 -9.664 -4.569 1.00 . A A . 453 LEU CB 1 1 11 5039 1 1 21 LEU CD1 C 5.039 -10.542 -6.069 1.00 . A A . 453 LEU CD1 1 1 11 5040 1 1 21 LEU CD2 C 5.353 -8.358 -4.882 1.00 . A A . 453 LEU CD2 1 1 11 5041 1 1 21 LEU CG C 4.741 -9.751 -4.803 1.00 . A A . 453 LEU CG 1 1 11 5042 1 1 21 LEU H H 3.963 -9.080 -1.543 1.00 . A A . 453 LEU H 1 1 11 5043 1 1 21 LEU HA H 3.243 -7.914 -3.335 1.00 . A A . 453 LEU HA 1 1 11 5044 1 1 21 LEU HB2 H 2.837 -10.668 -4.509 1.00 . A A . 453 LEU HB2 1 1 11 5045 1 1 21 LEU HB3 H 2.786 -9.172 -5.421 1.00 . A A . 453 LEU HB3 1 1 11 5046 1 1 21 LEU HD11 H 4.590 -10.046 -6.918 1.00 . A A . 453 LEU HD11 1 1 11 5047 1 1 21 LEU HD12 H 4.630 -11.537 -5.975 1.00 . A A . 453 LEU HD12 1 1 11 5048 1 1 21 LEU HD13 H 6.107 -10.604 -6.209 1.00 . A A . 453 LEU HD13 1 1 11 5049 1 1 21 LEU HD21 H 6.417 -8.439 -5.055 1.00 . A A . 453 LEU HD21 1 1 11 5050 1 1 21 LEU HD22 H 5.176 -7.835 -3.954 1.00 . A A . 453 LEU HD22 1 1 11 5051 1 1 21 LEU HD23 H 4.898 -7.809 -5.694 1.00 . A A . 453 LEU HD23 1 1 11 5052 1 1 21 LEU HG H 5.196 -10.271 -3.970 1.00 . A A . 453 LEU HG 1 1 11 5053 1 1 21 LEU N N 3.303 -9.551 -2.092 1.00 . A A . 453 LEU N 1 1 11 5054 1 1 21 LEU O O 0.539 -9.469 -3.881 1.00 . A A . 453 LEU O 1 1 11 5055 1 1 22 GLU C C -0.908 -6.222 -2.037 1.00 . A A . 454 GLU C 1 1 11 5056 1 1 22 GLU CA C -0.524 -7.700 -2.010 1.00 . A A . 454 GLU CA 1 1 11 5057 1 1 22 GLU CB C -0.767 -8.287 -0.611 1.00 . A A . 454 GLU CB 1 1 11 5058 1 1 22 GLU CD C -2.433 -9.004 1.149 1.00 . A A . 454 GLU CD 1 1 11 5059 1 1 22 GLU CG C -2.231 -8.337 -0.197 1.00 . A A . 454 GLU CG 1 1 11 5060 1 1 22 GLU H H 1.537 -7.249 -1.941 1.00 . A A . 454 GLU H 1 1 11 5061 1 1 22 GLU HA H -1.106 -8.247 -2.731 1.00 . A A . 454 GLU HA 1 1 11 5062 1 1 22 GLU HB2 H -0.377 -9.294 -0.587 1.00 . A A . 454 GLU HB2 1 1 11 5063 1 1 22 GLU HB3 H -0.231 -7.691 0.112 1.00 . A A . 454 GLU HB3 1 1 11 5064 1 1 22 GLU HG2 H -2.613 -7.330 -0.144 1.00 . A A . 454 GLU HG2 1 1 11 5065 1 1 22 GLU HG3 H -2.779 -8.891 -0.938 1.00 . A A . 454 GLU HG3 1 1 11 5066 1 1 22 GLU N N 0.878 -7.851 -2.352 1.00 . A A . 454 GLU N 1 1 11 5067 1 1 22 GLU O O -0.326 -5.417 -1.314 1.00 . A A . 454 GLU O 1 1 11 5068 1 1 22 GLU OE1 O -1.808 -10.060 1.392 1.00 . A A . 454 GLU OE1 1 1 11 5069 1 1 22 GLU OE2 O -3.229 -8.491 1.962 1.00 . A A . 454 GLU OE2 1 1 11 5070 1 1 23 SER C C -3.423 -4.236 -1.920 1.00 . A A . 455 SER C 1 1 11 5071 1 1 23 SER CA C -2.308 -4.476 -2.933 1.00 . A A . 455 SER CA 1 1 11 5072 1 1 23 SER CB C -2.767 -4.132 -4.355 1.00 . A A . 455 SER CB 1 1 11 5073 1 1 23 SER H H -2.304 -6.527 -3.442 1.00 . A A . 455 SER H 1 1 11 5074 1 1 23 SER HA H -1.462 -3.855 -2.674 1.00 . A A . 455 SER HA 1 1 11 5075 1 1 23 SER HB2 H -2.034 -4.487 -5.063 1.00 . A A . 455 SER HB2 1 1 11 5076 1 1 23 SER HB3 H -3.715 -4.609 -4.551 1.00 . A A . 455 SER HB3 1 1 11 5077 1 1 23 SER HG H -2.341 -2.438 -5.249 1.00 . A A . 455 SER HG 1 1 11 5078 1 1 23 SER N N -1.879 -5.858 -2.859 1.00 . A A . 455 SER N 1 1 11 5079 1 1 23 SER O O -4.573 -4.612 -2.136 1.00 . A A . 455 SER O 1 1 11 5080 1 1 23 SER OG O -2.917 -2.734 -4.529 1.00 . A A . 455 SER OG 1 1 11 5081 1 1 24 THR C C -4.398 -1.989 0.394 1.00 . A A . 456 THR C 1 1 11 5082 1 1 24 THR CA C -3.983 -3.455 0.307 1.00 . A A . 456 THR CA 1 1 11 5083 1 1 24 THR CB C -3.335 -3.893 1.633 1.00 . A A . 456 THR CB 1 1 11 5084 1 1 24 THR CG2 C -4.387 -4.163 2.695 1.00 . A A . 456 THR CG2 1 1 11 5085 1 1 24 THR H H -2.132 -3.333 -0.693 1.00 . A A . 456 THR H 1 1 11 5086 1 1 24 THR HA H -4.856 -4.064 0.131 1.00 . A A . 456 THR HA 1 1 11 5087 1 1 24 THR HB H -2.681 -3.105 1.979 1.00 . A A . 456 THR HB 1 1 11 5088 1 1 24 THR HG1 H -2.467 -5.233 0.473 1.00 . A A . 456 THR HG1 1 1 11 5089 1 1 24 THR HG21 H -4.932 -3.254 2.902 1.00 . A A . 456 THR HG21 1 1 11 5090 1 1 24 THR HG22 H -3.908 -4.506 3.599 1.00 . A A . 456 THR HG22 1 1 11 5091 1 1 24 THR HG23 H -5.074 -4.922 2.341 1.00 . A A . 456 THR HG23 1 1 11 5092 1 1 24 THR N N -3.057 -3.653 -0.791 1.00 . A A . 456 THR N 1 1 11 5093 1 1 24 THR O O -3.568 -1.110 0.599 1.00 . A A . 456 THR O 1 1 11 5094 1 1 24 THR OG1 O -2.567 -5.085 1.418 1.00 . A A . 456 THR OG1 1 1 11 5095 1 1 25 TRP C C -6.919 -0.076 1.522 1.00 . A A . 457 TRP C 1 1 11 5096 1 1 25 TRP CA C -6.170 -0.350 0.228 1.00 . A A . 457 TRP CA 1 1 11 5097 1 1 25 TRP CB C -7.030 -0.089 -1.009 1.00 . A A . 457 TRP CB 1 1 11 5098 1 1 25 TRP CD1 C -5.616 -1.274 -2.782 1.00 . A A . 457 TRP CD1 1 1 11 5099 1 1 25 TRP CD2 C -5.878 0.919 -3.140 1.00 . A A . 457 TRP CD2 1 1 11 5100 1 1 25 TRP CE2 C -5.060 0.388 -4.155 1.00 . A A . 457 TRP CE2 1 1 11 5101 1 1 25 TRP CE3 C -6.186 2.281 -3.167 1.00 . A A . 457 TRP CE3 1 1 11 5102 1 1 25 TRP CG C -6.211 -0.161 -2.261 1.00 . A A . 457 TRP CG 1 1 11 5103 1 1 25 TRP CH2 C -4.860 2.498 -5.187 1.00 . A A . 457 TRP CH2 1 1 11 5104 1 1 25 TRP CZ2 C -4.545 1.168 -5.182 1.00 . A A . 457 TRP CZ2 1 1 11 5105 1 1 25 TRP CZ3 C -5.677 3.058 -4.193 1.00 . A A . 457 TRP CZ3 1 1 11 5106 1 1 25 TRP H H -6.305 -2.455 0.038 1.00 . A A . 457 TRP H 1 1 11 5107 1 1 25 TRP HA H -5.310 0.301 0.194 1.00 . A A . 457 TRP HA 1 1 11 5108 1 1 25 TRP HB2 H -7.814 -0.832 -1.070 1.00 . A A . 457 TRP HB2 1 1 11 5109 1 1 25 TRP HB3 H -7.465 0.895 -0.943 1.00 . A A . 457 TRP HB3 1 1 11 5110 1 1 25 TRP HD1 H -5.682 -2.259 -2.344 1.00 . A A . 457 TRP HD1 1 1 11 5111 1 1 25 TRP HE1 H -4.384 -1.578 -4.453 1.00 . A A . 457 TRP HE1 1 1 11 5112 1 1 25 TRP HE3 H -6.809 2.728 -2.407 1.00 . A A . 457 TRP HE3 1 1 11 5113 1 1 25 TRP HH2 H -4.486 3.140 -5.970 1.00 . A A . 457 TRP HH2 1 1 11 5114 1 1 25 TRP HZ2 H -3.900 0.753 -5.942 1.00 . A A . 457 TRP HZ2 1 1 11 5115 1 1 25 TRP HZ3 H -5.905 4.112 -4.235 1.00 . A A . 457 TRP HZ3 1 1 11 5116 1 1 25 TRP N N -5.678 -1.720 0.206 1.00 . A A . 457 TRP N 1 1 11 5117 1 1 25 TRP NE1 N -4.911 -0.947 -3.906 1.00 . A A . 457 TRP NE1 1 1 11 5118 1 1 25 TRP O O -7.373 1.040 1.775 1.00 . A A . 457 TRP O 1 1 11 5119 1 1 26 GLU C C -6.358 -1.081 4.673 1.00 . A A . 458 GLU C 1 1 11 5120 1 1 26 GLU CA C -7.527 -1.002 3.691 1.00 . A A . 458 GLU CA 1 1 11 5121 1 1 26 GLU CB C -8.521 -2.135 3.946 1.00 . A A . 458 GLU CB 1 1 11 5122 1 1 26 GLU CD C -8.938 -4.628 3.860 1.00 . A A . 458 GLU CD 1 1 11 5123 1 1 26 GLU CG C -7.910 -3.522 3.801 1.00 . A A . 458 GLU CG 1 1 11 5124 1 1 26 GLU H H -6.695 -1.978 2.029 1.00 . A A . 458 GLU H 1 1 11 5125 1 1 26 GLU HA H -8.024 -0.047 3.795 1.00 . A A . 458 GLU HA 1 1 11 5126 1 1 26 GLU HB2 H -8.909 -2.040 4.951 1.00 . A A . 458 GLU HB2 1 1 11 5127 1 1 26 GLU HB3 H -9.336 -2.050 3.245 1.00 . A A . 458 GLU HB3 1 1 11 5128 1 1 26 GLU HG2 H -7.400 -3.578 2.852 1.00 . A A . 458 GLU HG2 1 1 11 5129 1 1 26 GLU HG3 H -7.198 -3.670 4.600 1.00 . A A . 458 GLU HG3 1 1 11 5130 1 1 26 GLU N N -7.004 -1.107 2.340 1.00 . A A . 458 GLU N 1 1 11 5131 1 1 26 GLU O O -5.354 -1.732 4.385 1.00 . A A . 458 GLU O 1 1 11 5132 1 1 26 GLU OE1 O -9.578 -4.798 4.916 1.00 . A A . 458 GLU OE1 1 1 11 5133 1 1 26 GLU OE2 O -9.115 -5.328 2.840 1.00 . A A . 458 GLU OE2 1 1 11 5134 1 1 27 LYS C C -5.585 -1.594 7.799 1.00 . A A . 459 LYS C 1 1 11 5135 1 1 27 LYS CA C -5.392 -0.463 6.797 1.00 . A A . 459 LYS CA 1 1 11 5136 1 1 27 LYS CB C -5.276 0.872 7.533 1.00 . A A . 459 LYS CB 1 1 11 5137 1 1 27 LYS CD C -4.368 3.220 7.485 1.00 . A A . 459 LYS CD 1 1 11 5138 1 1 27 LYS CE C -3.399 2.933 8.621 1.00 . A A . 459 LYS CE 1 1 11 5139 1 1 27 LYS CG C -4.679 1.971 6.676 1.00 . A A . 459 LYS CG 1 1 11 5140 1 1 27 LYS H H -7.298 0.053 6.020 1.00 . A A . 459 LYS H 1 1 11 5141 1 1 27 LYS HA H -4.477 -0.636 6.252 1.00 . A A . 459 LYS HA 1 1 11 5142 1 1 27 LYS HB2 H -6.261 1.183 7.851 1.00 . A A . 459 LYS HB2 1 1 11 5143 1 1 27 LYS HB3 H -4.650 0.738 8.403 1.00 . A A . 459 LYS HB3 1 1 11 5144 1 1 27 LYS HD2 H -3.922 3.953 6.829 1.00 . A A . 459 LYS HD2 1 1 11 5145 1 1 27 LYS HD3 H -5.287 3.611 7.894 1.00 . A A . 459 LYS HD3 1 1 11 5146 1 1 27 LYS HE2 H -3.840 2.197 9.276 1.00 . A A . 459 LYS HE2 1 1 11 5147 1 1 27 LYS HE3 H -2.484 2.541 8.204 1.00 . A A . 459 LYS HE3 1 1 11 5148 1 1 27 LYS HG2 H -3.764 1.608 6.231 1.00 . A A . 459 LYS HG2 1 1 11 5149 1 1 27 LYS HG3 H -5.382 2.226 5.896 1.00 . A A . 459 LYS HG3 1 1 11 5150 1 1 27 LYS HZ1 H -2.426 3.919 10.188 1.00 . A A . 459 LYS HZ1 1 1 11 5151 1 1 27 LYS HZ2 H -3.953 4.557 9.817 1.00 . A A . 459 LYS HZ2 1 1 11 5152 1 1 27 LYS HZ3 H -2.638 4.873 8.804 1.00 . A A . 459 LYS HZ3 1 1 11 5153 1 1 27 LYS N N -6.474 -0.435 5.819 1.00 . A A . 459 LYS N 1 1 11 5154 1 1 27 LYS NZ N -3.085 4.155 9.410 1.00 . A A . 459 LYS NZ 1 1 11 5155 1 1 27 LYS O O -6.599 -1.648 8.495 1.00 . A A . 459 LYS O 1 1 11 5156 1 1 28 PRO C C -4.376 -3.111 10.262 1.00 . A A . 460 PRO C 1 1 11 5157 1 1 28 PRO CA C -4.635 -3.615 8.843 1.00 . A A . 460 PRO CA 1 1 11 5158 1 1 28 PRO CB C -3.504 -4.540 8.380 1.00 . A A . 460 PRO CB 1 1 11 5159 1 1 28 PRO CD C -3.441 -2.589 6.980 1.00 . A A . 460 PRO CD 1 1 11 5160 1 1 28 PRO CG C -2.591 -3.674 7.583 1.00 . A A . 460 PRO CG 1 1 11 5161 1 1 28 PRO HA H -5.574 -4.148 8.819 1.00 . A A . 460 PRO HA 1 1 11 5162 1 1 28 PRO HB2 H -3.003 -4.951 9.244 1.00 . A A . 460 PRO HB2 1 1 11 5163 1 1 28 PRO HB3 H -3.912 -5.339 7.781 1.00 . A A . 460 PRO HB3 1 1 11 5164 1 1 28 PRO HD2 H -2.908 -1.649 6.983 1.00 . A A . 460 PRO HD2 1 1 11 5165 1 1 28 PRO HD3 H -3.731 -2.854 5.975 1.00 . A A . 460 PRO HD3 1 1 11 5166 1 1 28 PRO HG2 H -1.841 -3.244 8.230 1.00 . A A . 460 PRO HG2 1 1 11 5167 1 1 28 PRO HG3 H -2.122 -4.260 6.804 1.00 . A A . 460 PRO HG3 1 1 11 5168 1 1 28 PRO N N -4.619 -2.525 7.866 1.00 . A A . 460 PRO N 1 1 11 5169 1 1 28 PRO O O -5.315 -3.136 11.083 1.00 . A A . 460 PRO O 1 1 11 5170 1 1 28 PRO OXT O -3.243 -2.664 10.546 1.00 . A A . 460 PRO OXT 1 1 12 5171 1 1 1 SER C C 8.368 -1.747 5.758 1.00 . A A . 433 SER C 1 1 12 5172 1 1 1 SER CA C 8.680 -1.089 7.103 1.00 . A A . 433 SER CA 1 1 12 5173 1 1 1 SER CB C 10.175 -0.787 7.209 1.00 . A A . 433 SER CB 1 1 12 5174 1 1 1 SER H1 H 7.267 -2.194 8.171 1.00 . A A . 433 SER H1 1 1 12 5175 1 1 1 SER H2 H 8.466 -1.489 9.136 1.00 . A A . 433 SER H2 1 1 12 5176 1 1 1 SER H3 H 8.829 -2.852 8.202 1.00 . A A . 433 SER H3 1 1 12 5177 1 1 1 SER HA H 8.125 -0.164 7.178 1.00 . A A . 433 SER HA 1 1 12 5178 1 1 1 SER HB2 H 10.507 -0.304 6.302 1.00 . A A . 433 SER HB2 1 1 12 5179 1 1 1 SER HB3 H 10.348 -0.130 8.050 1.00 . A A . 433 SER HB3 1 1 12 5180 1 1 1 SER HG H 11.869 -1.747 7.443 1.00 . A A . 433 SER HG 1 1 12 5181 1 1 1 SER N N 8.283 -1.967 8.228 1.00 . A A . 433 SER N 1 1 12 5182 1 1 1 SER O O 8.863 -1.323 4.710 1.00 . A A . 433 SER O 1 1 12 5183 1 1 1 SER OG O 10.924 -1.975 7.393 1.00 . A A . 433 SER OG 1 1 12 5184 1 1 2 GLU C C 5.954 -2.962 3.901 1.00 . A A . 434 GLU C 1 1 12 5185 1 1 2 GLU CA C 7.176 -3.534 4.610 1.00 . A A . 434 GLU CA 1 1 12 5186 1 1 2 GLU CB C 6.924 -5.000 4.988 1.00 . A A . 434 GLU CB 1 1 12 5187 1 1 2 GLU CD C 6.264 -4.839 7.436 1.00 . A A . 434 GLU CD 1 1 12 5188 1 1 2 GLU CG C 5.828 -5.209 6.031 1.00 . A A . 434 GLU CG 1 1 12 5189 1 1 2 GLU H H 7.076 -2.988 6.646 1.00 . A A . 434 GLU H 1 1 12 5190 1 1 2 GLU HA H 8.018 -3.488 3.937 1.00 . A A . 434 GLU HA 1 1 12 5191 1 1 2 GLU HB2 H 6.646 -5.541 4.098 1.00 . A A . 434 GLU HB2 1 1 12 5192 1 1 2 GLU HB3 H 7.841 -5.417 5.377 1.00 . A A . 434 GLU HB3 1 1 12 5193 1 1 2 GLU HG2 H 4.979 -4.598 5.766 1.00 . A A . 434 GLU HG2 1 1 12 5194 1 1 2 GLU HG3 H 5.537 -6.250 6.021 1.00 . A A . 434 GLU HG3 1 1 12 5195 1 1 2 GLU N N 7.512 -2.757 5.793 1.00 . A A . 434 GLU N 1 1 12 5196 1 1 2 GLU O O 5.648 -3.338 2.769 1.00 . A A . 434 GLU O 1 1 12 5197 1 1 2 GLU OE1 O 6.152 -3.649 7.805 1.00 . A A . 434 GLU OE1 1 1 12 5198 1 1 2 GLU OE2 O 6.742 -5.727 8.168 1.00 . A A . 434 GLU OE2 1 1 12 5199 1 1 3 TRP C C 4.436 -0.153 3.278 1.00 . A A . 435 TRP C 1 1 12 5200 1 1 3 TRP CA C 4.063 -1.441 4.010 1.00 . A A . 435 TRP CA 1 1 12 5201 1 1 3 TRP CB C 3.048 -1.129 5.114 1.00 . A A . 435 TRP CB 1 1 12 5202 1 1 3 TRP CD1 C 2.747 -2.437 7.298 1.00 . A A . 435 TRP CD1 1 1 12 5203 1 1 3 TRP CD2 C 2.120 -3.564 5.471 1.00 . A A . 435 TRP CD2 1 1 12 5204 1 1 3 TRP CE2 C 1.900 -4.380 6.599 1.00 . A A . 435 TRP CE2 1 1 12 5205 1 1 3 TRP CE3 C 1.802 -4.064 4.210 1.00 . A A . 435 TRP CE3 1 1 12 5206 1 1 3 TRP CG C 2.656 -2.321 5.943 1.00 . A A . 435 TRP CG 1 1 12 5207 1 1 3 TRP CH2 C 1.077 -6.131 5.243 1.00 . A A . 435 TRP CH2 1 1 12 5208 1 1 3 TRP CZ2 C 1.375 -5.667 6.495 1.00 . A A . 435 TRP CZ2 1 1 12 5209 1 1 3 TRP CZ3 C 1.287 -5.342 4.112 1.00 . A A . 435 TRP CZ3 1 1 12 5210 1 1 3 TRP H H 5.534 -1.814 5.476 1.00 . A A . 435 TRP H 1 1 12 5211 1 1 3 TRP HA H 3.623 -2.137 3.312 1.00 . A A . 435 TRP HA 1 1 12 5212 1 1 3 TRP HB2 H 3.470 -0.388 5.777 1.00 . A A . 435 TRP HB2 1 1 12 5213 1 1 3 TRP HB3 H 2.154 -0.728 4.662 1.00 . A A . 435 TRP HB3 1 1 12 5214 1 1 3 TRP HD1 H 3.119 -1.661 7.950 1.00 . A A . 435 TRP HD1 1 1 12 5215 1 1 3 TRP HE1 H 2.247 -3.984 8.628 1.00 . A A . 435 TRP HE1 1 1 12 5216 1 1 3 TRP HE3 H 1.956 -3.473 3.318 1.00 . A A . 435 TRP HE3 1 1 12 5217 1 1 3 TRP HH2 H 0.671 -7.124 5.108 1.00 . A A . 435 TRP HH2 1 1 12 5218 1 1 3 TRP HZ2 H 1.207 -6.289 7.365 1.00 . A A . 435 TRP HZ2 1 1 12 5219 1 1 3 TRP HZ3 H 1.052 -5.751 3.139 1.00 . A A . 435 TRP HZ3 1 1 12 5220 1 1 3 TRP N N 5.250 -2.064 4.576 1.00 . A A . 435 TRP N 1 1 12 5221 1 1 3 TRP NE1 N 2.286 -3.667 7.701 1.00 . A A . 435 TRP NE1 1 1 12 5222 1 1 3 TRP O O 5.182 0.669 3.808 1.00 . A A . 435 TRP O 1 1 12 5223 1 1 4 THR C C 2.935 2.139 1.302 1.00 . A A . 436 THR C 1 1 12 5224 1 1 4 THR CA C 4.167 1.242 1.310 1.00 . A A . 436 THR CA 1 1 12 5225 1 1 4 THR CB C 4.547 0.924 -0.151 1.00 . A A . 436 THR CB 1 1 12 5226 1 1 4 THR CG2 C 4.743 2.207 -0.961 1.00 . A A . 436 THR CG2 1 1 12 5227 1 1 4 THR H H 3.369 -0.680 1.667 1.00 . A A . 436 THR H 1 1 12 5228 1 1 4 THR HA H 4.988 1.769 1.771 1.00 . A A . 436 THR HA 1 1 12 5229 1 1 4 THR HB H 3.739 0.361 -0.596 1.00 . A A . 436 THR HB 1 1 12 5230 1 1 4 THR HG1 H 5.500 -0.808 -0.119 1.00 . A A . 436 THR HG1 1 1 12 5231 1 1 4 THR HG21 H 5.512 2.809 -0.501 1.00 . A A . 436 THR HG21 1 1 12 5232 1 1 4 THR HG22 H 3.815 2.766 -0.986 1.00 . A A . 436 THR HG22 1 1 12 5233 1 1 4 THR HG23 H 5.036 1.955 -1.968 1.00 . A A . 436 THR HG23 1 1 12 5234 1 1 4 THR N N 3.923 0.024 2.067 1.00 . A A . 436 THR N 1 1 12 5235 1 1 4 THR O O 1.945 1.826 0.644 1.00 . A A . 436 THR O 1 1 12 5236 1 1 4 THR OG1 O 5.741 0.125 -0.189 1.00 . A A . 436 THR OG1 1 1 12 5237 1 1 5 GLU C C 2.236 5.230 0.862 1.00 . A A . 437 GLU C 1 1 12 5238 1 1 5 GLU CA C 1.920 4.231 1.959 1.00 . A A . 437 GLU CA 1 1 12 5239 1 1 5 GLU CB C 1.718 4.972 3.287 1.00 . A A . 437 GLU CB 1 1 12 5240 1 1 5 GLU CD C 2.411 3.229 4.975 1.00 . A A . 437 GLU CD 1 1 12 5241 1 1 5 GLU CG C 1.289 4.092 4.450 1.00 . A A . 437 GLU CG 1 1 12 5242 1 1 5 GLU H H 3.752 3.401 2.622 1.00 . A A . 437 GLU H 1 1 12 5243 1 1 5 GLU HA H 1.006 3.712 1.699 1.00 . A A . 437 GLU HA 1 1 12 5244 1 1 5 GLU HB2 H 2.648 5.448 3.559 1.00 . A A . 437 GLU HB2 1 1 12 5245 1 1 5 GLU HB3 H 0.966 5.733 3.147 1.00 . A A . 437 GLU HB3 1 1 12 5246 1 1 5 GLU HG2 H 0.938 4.724 5.253 1.00 . A A . 437 GLU HG2 1 1 12 5247 1 1 5 GLU HG3 H 0.484 3.450 4.123 1.00 . A A . 437 GLU HG3 1 1 12 5248 1 1 5 GLU N N 2.986 3.246 2.027 1.00 . A A . 437 GLU N 1 1 12 5249 1 1 5 GLU O O 2.972 6.196 1.080 1.00 . A A . 437 GLU O 1 1 12 5250 1 1 5 GLU OE1 O 3.474 3.786 5.327 1.00 . A A . 437 GLU OE1 1 1 12 5251 1 1 5 GLU OE2 O 2.239 1.998 5.043 1.00 . A A . 437 GLU OE2 1 1 12 5252 1 1 6 ARG C C 0.830 6.803 -1.669 1.00 . A A . 438 ARG C 1 1 12 5253 1 1 6 ARG CA C 2.006 5.837 -1.456 1.00 . A A . 438 ARG CA 1 1 12 5254 1 1 6 ARG CB C 2.220 4.991 -2.715 1.00 . A A . 438 ARG CB 1 1 12 5255 1 1 6 ARG CD C 2.763 4.930 -5.173 1.00 . A A . 438 ARG CD 1 1 12 5256 1 1 6 ARG CG C 2.531 5.812 -3.955 1.00 . A A . 438 ARG CG 1 1 12 5257 1 1 6 ARG CZ C 3.213 5.209 -7.587 1.00 . A A . 438 ARG CZ 1 1 12 5258 1 1 6 ARG H H 1.130 4.201 -0.443 1.00 . A A . 438 ARG H 1 1 12 5259 1 1 6 ARG HA H 2.915 6.371 -1.232 1.00 . A A . 438 ARG HA 1 1 12 5260 1 1 6 ARG HB2 H 3.042 4.313 -2.543 1.00 . A A . 438 ARG HB2 1 1 12 5261 1 1 6 ARG HB3 H 1.325 4.418 -2.905 1.00 . A A . 438 ARG HB3 1 1 12 5262 1 1 6 ARG HD2 H 3.612 4.291 -4.980 1.00 . A A . 438 ARG HD2 1 1 12 5263 1 1 6 ARG HD3 H 1.885 4.324 -5.336 1.00 . A A . 438 ARG HD3 1 1 12 5264 1 1 6 ARG HE H 3.078 6.701 -6.265 1.00 . A A . 438 ARG HE 1 1 12 5265 1 1 6 ARG HG2 H 1.701 6.473 -4.155 1.00 . A A . 438 ARG HG2 1 1 12 5266 1 1 6 ARG HG3 H 3.422 6.397 -3.770 1.00 . A A . 438 ARG HG3 1 1 12 5267 1 1 6 ARG HH11 H 2.912 3.279 -7.033 1.00 . A A . 438 ARG HH11 1 1 12 5268 1 1 6 ARG HH12 H 3.265 3.520 -8.719 1.00 . A A . 438 ARG HH12 1 1 12 5269 1 1 6 ARG HH21 H 3.538 7.018 -8.440 1.00 . A A . 438 ARG HH21 1 1 12 5270 1 1 6 ARG HH22 H 3.610 5.663 -9.529 1.00 . A A . 438 ARG HH22 1 1 12 5271 1 1 6 ARG N N 1.724 4.979 -0.325 1.00 . A A . 438 ARG N 1 1 12 5272 1 1 6 ARG NE N 3.027 5.720 -6.373 1.00 . A A . 438 ARG NE 1 1 12 5273 1 1 6 ARG NH1 N 3.122 3.899 -7.794 1.00 . A A . 438 ARG NH1 1 1 12 5274 1 1 6 ARG NH2 N 3.477 6.027 -8.600 1.00 . A A . 438 ARG NH2 1 1 12 5275 1 1 6 ARG O O -0.309 6.346 -1.766 1.00 . A A . 438 ARG O 1 1 12 5276 1 1 7 LYS C C -0.233 9.213 -3.488 1.00 . A A . 439 LYS C 1 1 12 5277 1 1 7 LYS CA C -0.030 9.041 -1.996 1.00 . A A . 439 LYS CA 1 1 12 5278 1 1 7 LYS CB C 0.221 10.399 -1.335 1.00 . A A . 439 LYS CB 1 1 12 5279 1 1 7 LYS CD C 0.266 11.736 0.786 1.00 . A A . 439 LYS CD 1 1 12 5280 1 1 7 LYS CE C 0.369 11.704 2.304 1.00 . A A . 439 LYS CE 1 1 12 5281 1 1 7 LYS CG C 0.307 10.342 0.181 1.00 . A A . 439 LYS CG 1 1 12 5282 1 1 7 LYS H H 1.975 8.483 -1.706 1.00 . A A . 439 LYS H 1 1 12 5283 1 1 7 LYS HA H -0.923 8.601 -1.574 1.00 . A A . 439 LYS HA 1 1 12 5284 1 1 7 LYS HB2 H 1.150 10.803 -1.710 1.00 . A A . 439 LYS HB2 1 1 12 5285 1 1 7 LYS HB3 H -0.583 11.069 -1.602 1.00 . A A . 439 LYS HB3 1 1 12 5286 1 1 7 LYS HD2 H 1.093 12.308 0.394 1.00 . A A . 439 LYS HD2 1 1 12 5287 1 1 7 LYS HD3 H -0.663 12.210 0.507 1.00 . A A . 439 LYS HD3 1 1 12 5288 1 1 7 LYS HE2 H 0.174 12.695 2.685 1.00 . A A . 439 LYS HE2 1 1 12 5289 1 1 7 LYS HE3 H -0.371 11.018 2.689 1.00 . A A . 439 LYS HE3 1 1 12 5290 1 1 7 LYS HG2 H -0.527 9.771 0.559 1.00 . A A . 439 LYS HG2 1 1 12 5291 1 1 7 LYS HG3 H 1.233 9.863 0.463 1.00 . A A . 439 LYS HG3 1 1 12 5292 1 1 7 LYS HZ1 H 1.894 10.282 2.479 1.00 . A A . 439 LYS HZ1 1 1 12 5293 1 1 7 LYS HZ2 H 1.785 11.343 3.800 1.00 . A A . 439 LYS HZ2 1 1 12 5294 1 1 7 LYS HZ3 H 2.447 11.878 2.333 1.00 . A A . 439 LYS HZ3 1 1 12 5295 1 1 7 LYS N N 1.067 8.122 -1.767 1.00 . A A . 439 LYS N 1 1 12 5296 1 1 7 LYS NZ N 1.716 11.269 2.759 1.00 . A A . 439 LYS NZ 1 1 12 5297 1 1 7 LYS O O 0.581 9.823 -4.176 1.00 . A A . 439 LYS O 1 1 12 5298 1 1 8 THR C C -2.459 9.864 -5.744 1.00 . A A . 440 THR C 1 1 12 5299 1 1 8 THR CA C -1.606 8.645 -5.397 1.00 . A A . 440 THR CA 1 1 12 5300 1 1 8 THR CB C -2.350 7.353 -5.757 1.00 . A A . 440 THR CB 1 1 12 5301 1 1 8 THR CG2 C -2.182 6.986 -7.218 1.00 . A A . 440 THR CG2 1 1 12 5302 1 1 8 THR H H -1.895 8.131 -3.370 1.00 . A A . 440 THR H 1 1 12 5303 1 1 8 THR HA H -0.678 8.680 -5.949 1.00 . A A . 440 THR HA 1 1 12 5304 1 1 8 THR HB H -3.402 7.482 -5.545 1.00 . A A . 440 THR HB 1 1 12 5305 1 1 8 THR HG1 H -1.176 6.643 -4.350 1.00 . A A . 440 THR HG1 1 1 12 5306 1 1 8 THR HG21 H -1.148 7.107 -7.505 1.00 . A A . 440 THR HG21 1 1 12 5307 1 1 8 THR HG22 H -2.804 7.625 -7.829 1.00 . A A . 440 THR HG22 1 1 12 5308 1 1 8 THR HG23 H -2.474 5.954 -7.354 1.00 . A A . 440 THR HG23 1 1 12 5309 1 1 8 THR N N -1.300 8.627 -3.980 1.00 . A A . 440 THR N 1 1 12 5310 1 1 8 THR O O -3.319 10.273 -4.960 1.00 . A A . 440 THR O 1 1 12 5311 1 1 8 THR OG1 O -1.832 6.290 -4.958 1.00 . A A . 440 THR OG1 1 1 12 5312 1 1 9 ALA C C -4.367 11.514 -7.564 1.00 . A A . 441 ALA C 1 1 12 5313 1 1 9 ALA CA C -2.864 11.677 -7.348 1.00 . A A . 441 ALA CA 1 1 12 5314 1 1 9 ALA CB C -2.206 12.206 -8.613 1.00 . A A . 441 ALA CB 1 1 12 5315 1 1 9 ALA H H -1.593 9.989 -7.550 1.00 . A A . 441 ALA H 1 1 12 5316 1 1 9 ALA HA H -2.703 12.404 -6.566 1.00 . A A . 441 ALA HA 1 1 12 5317 1 1 9 ALA HB1 H -1.146 12.319 -8.447 1.00 . A A . 441 ALA HB1 1 1 12 5318 1 1 9 ALA HB2 H -2.635 13.165 -8.867 1.00 . A A . 441 ALA HB2 1 1 12 5319 1 1 9 ALA HB3 H -2.372 11.512 -9.422 1.00 . A A . 441 ALA HB3 1 1 12 5320 1 1 9 ALA N N -2.222 10.428 -6.930 1.00 . A A . 441 ALA N 1 1 12 5321 1 1 9 ALA O O -5.061 12.471 -7.905 1.00 . A A . 441 ALA O 1 1 12 5322 1 1 10 ASP C C -6.965 10.448 -6.130 1.00 . A A . 442 ASP C 1 1 12 5323 1 1 10 ASP CA C -6.293 10.036 -7.441 1.00 . A A . 442 ASP CA 1 1 12 5324 1 1 10 ASP CB C -6.536 8.548 -7.726 1.00 . A A . 442 ASP CB 1 1 12 5325 1 1 10 ASP CG C -7.990 8.231 -8.013 1.00 . A A . 442 ASP CG 1 1 12 5326 1 1 10 ASP H H -4.250 9.565 -7.164 1.00 . A A . 442 ASP H 1 1 12 5327 1 1 10 ASP HA H -6.703 10.625 -8.246 1.00 . A A . 442 ASP HA 1 1 12 5328 1 1 10 ASP HB2 H -5.950 8.257 -8.585 1.00 . A A . 442 ASP HB2 1 1 12 5329 1 1 10 ASP HB3 H -6.222 7.970 -6.869 1.00 . A A . 442 ASP HB3 1 1 12 5330 1 1 10 ASP N N -4.863 10.301 -7.365 1.00 . A A . 442 ASP N 1 1 12 5331 1 1 10 ASP O O -8.186 10.407 -5.994 1.00 . A A . 442 ASP O 1 1 12 5332 1 1 10 ASP OD1 O -8.457 8.538 -9.129 1.00 . A A . 442 ASP OD1 1 1 12 5333 1 1 10 ASP OD2 O -8.673 7.680 -7.126 1.00 . A A . 442 ASP OD2 1 1 12 5334 1 1 11 GLY C C -6.695 10.078 -2.918 1.00 . A A . 443 GLY C 1 1 12 5335 1 1 11 GLY CA C -6.650 11.251 -3.869 1.00 . A A . 443 GLY CA 1 1 12 5336 1 1 11 GLY H H -5.183 10.915 -5.354 1.00 . A A . 443 GLY H 1 1 12 5337 1 1 11 GLY HA2 H -6.008 12.016 -3.456 1.00 . A A . 443 GLY HA2 1 1 12 5338 1 1 11 GLY HA3 H -7.647 11.651 -3.979 1.00 . A A . 443 GLY HA3 1 1 12 5339 1 1 11 GLY N N -6.146 10.866 -5.171 1.00 . A A . 443 GLY N 1 1 12 5340 1 1 11 GLY O O -7.403 10.104 -1.912 1.00 . A A . 443 GLY O 1 1 12 5341 1 1 12 LYS C C -4.498 7.445 -2.052 1.00 . A A . 444 LYS C 1 1 12 5342 1 1 12 LYS CA C -5.917 7.827 -2.448 1.00 . A A . 444 LYS CA 1 1 12 5343 1 1 12 LYS CB C -6.553 6.679 -3.240 1.00 . A A . 444 LYS CB 1 1 12 5344 1 1 12 LYS CD C -8.600 5.683 -4.304 1.00 . A A . 444 LYS CD 1 1 12 5345 1 1 12 LYS CE C -10.096 5.827 -4.537 1.00 . A A . 444 LYS CE 1 1 12 5346 1 1 12 LYS CG C -8.039 6.857 -3.515 1.00 . A A . 444 LYS CG 1 1 12 5347 1 1 12 LYS H H -5.330 9.118 -4.014 1.00 . A A . 444 LYS H 1 1 12 5348 1 1 12 LYS HA H -6.496 8.003 -1.553 1.00 . A A . 444 LYS HA 1 1 12 5349 1 1 12 LYS HB2 H -6.044 6.591 -4.187 1.00 . A A . 444 LYS HB2 1 1 12 5350 1 1 12 LYS HB3 H -6.420 5.763 -2.684 1.00 . A A . 444 LYS HB3 1 1 12 5351 1 1 12 LYS HD2 H -8.101 5.634 -5.261 1.00 . A A . 444 LYS HD2 1 1 12 5352 1 1 12 LYS HD3 H -8.416 4.771 -3.755 1.00 . A A . 444 LYS HD3 1 1 12 5353 1 1 12 LYS HE2 H -10.445 4.972 -5.100 1.00 . A A . 444 LYS HE2 1 1 12 5354 1 1 12 LYS HE3 H -10.595 5.852 -3.579 1.00 . A A . 444 LYS HE3 1 1 12 5355 1 1 12 LYS HG2 H -8.565 6.929 -2.576 1.00 . A A . 444 LYS HG2 1 1 12 5356 1 1 12 LYS HG3 H -8.183 7.764 -4.085 1.00 . A A . 444 LYS HG3 1 1 12 5357 1 1 12 LYS HZ1 H -10.295 7.905 -4.675 1.00 . A A . 444 LYS HZ1 1 1 12 5358 1 1 12 LYS HZ2 H -11.415 7.043 -5.610 1.00 . A A . 444 LYS HZ2 1 1 12 5359 1 1 12 LYS HZ3 H -9.798 7.165 -6.118 1.00 . A A . 444 LYS HZ3 1 1 12 5360 1 1 12 LYS N N -5.924 9.050 -3.235 1.00 . A A . 444 LYS N 1 1 12 5361 1 1 12 LYS NZ N -10.427 7.068 -5.287 1.00 . A A . 444 LYS NZ 1 1 12 5362 1 1 12 LYS O O -3.605 7.387 -2.891 1.00 . A A . 444 LYS O 1 1 12 5363 1 1 13 THR C C -3.107 5.151 -0.240 1.00 . A A . 445 THR C 1 1 12 5364 1 1 13 THR CA C -3.030 6.674 -0.291 1.00 . A A . 445 THR CA 1 1 12 5365 1 1 13 THR CB C -2.693 7.233 1.107 1.00 . A A . 445 THR CB 1 1 12 5366 1 1 13 THR CG2 C -1.283 6.843 1.524 1.00 . A A . 445 THR CG2 1 1 12 5367 1 1 13 THR H H -5.019 7.356 -0.131 1.00 . A A . 445 THR H 1 1 12 5368 1 1 13 THR HA H -2.254 6.971 -0.982 1.00 . A A . 445 THR HA 1 1 12 5369 1 1 13 THR HB H -3.391 6.824 1.823 1.00 . A A . 445 THR HB 1 1 12 5370 1 1 13 THR HG1 H -3.174 8.948 0.253 1.00 . A A . 445 THR HG1 1 1 12 5371 1 1 13 THR HG21 H -1.197 5.767 1.542 1.00 . A A . 445 THR HG21 1 1 12 5372 1 1 13 THR HG22 H -1.077 7.237 2.509 1.00 . A A . 445 THR HG22 1 1 12 5373 1 1 13 THR HG23 H -0.574 7.251 0.819 1.00 . A A . 445 THR HG23 1 1 12 5374 1 1 13 THR N N -4.297 7.195 -0.771 1.00 . A A . 445 THR N 1 1 12 5375 1 1 13 THR O O -3.668 4.585 0.699 1.00 . A A . 445 THR O 1 1 12 5376 1 1 13 THR OG1 O -2.814 8.663 1.098 1.00 . A A . 445 THR OG1 1 1 12 5377 1 1 14 TYR C C -1.483 2.343 -0.850 1.00 . A A . 446 TYR C 1 1 12 5378 1 1 14 TYR CA C -2.723 3.045 -1.361 1.00 . A A . 446 TYR CA 1 1 12 5379 1 1 14 TYR CB C -3.053 2.615 -2.795 1.00 . A A . 446 TYR CB 1 1 12 5380 1 1 14 TYR CD1 C -1.335 3.544 -4.408 1.00 . A A . 446 TYR CD1 1 1 12 5381 1 1 14 TYR CD2 C -1.350 1.197 -4.004 1.00 . A A . 446 TYR CD2 1 1 12 5382 1 1 14 TYR CE1 C -0.290 3.386 -5.294 1.00 . A A . 446 TYR CE1 1 1 12 5383 1 1 14 TYR CE2 C -0.304 1.035 -4.887 1.00 . A A . 446 TYR CE2 1 1 12 5384 1 1 14 TYR CG C -1.883 2.456 -3.745 1.00 . A A . 446 TYR CG 1 1 12 5385 1 1 14 TYR CZ C 0.222 2.131 -5.531 1.00 . A A . 446 TYR CZ 1 1 12 5386 1 1 14 TYR H H -2.053 4.970 -1.934 1.00 . A A . 446 TYR H 1 1 12 5387 1 1 14 TYR HA H -3.549 2.767 -0.723 1.00 . A A . 446 TYR HA 1 1 12 5388 1 1 14 TYR HB2 H -3.562 1.666 -2.759 1.00 . A A . 446 TYR HB2 1 1 12 5389 1 1 14 TYR HB3 H -3.723 3.342 -3.224 1.00 . A A . 446 TYR HB3 1 1 12 5390 1 1 14 TYR HD1 H -1.739 4.531 -4.230 1.00 . A A . 446 TYR HD1 1 1 12 5391 1 1 14 TYR HD2 H -1.765 0.338 -3.497 1.00 . A A . 446 TYR HD2 1 1 12 5392 1 1 14 TYR HE1 H 0.122 4.245 -5.799 1.00 . A A . 446 TYR HE1 1 1 12 5393 1 1 14 TYR HE2 H 0.088 0.049 -5.081 1.00 . A A . 446 TYR HE2 1 1 12 5394 1 1 14 TYR HH H 1.074 1.227 -7.005 1.00 . A A . 446 TYR HH 1 1 12 5395 1 1 14 TYR N N -2.573 4.487 -1.259 1.00 . A A . 446 TYR N 1 1 12 5396 1 1 14 TYR O O -0.359 2.829 -1.012 1.00 . A A . 446 TYR O 1 1 12 5397 1 1 14 TYR OH O 1.268 1.973 -6.414 1.00 . A A . 446 TYR OH 1 1 12 5398 1 1 15 TYR C C -0.187 -0.722 -0.423 1.00 . A A . 447 TYR C 1 1 12 5399 1 1 15 TYR CA C -0.637 0.475 0.414 1.00 . A A . 447 TYR CA 1 1 12 5400 1 1 15 TYR CB C -1.110 0.038 1.807 1.00 . A A . 447 TYR CB 1 1 12 5401 1 1 15 TYR CD1 C -1.383 2.243 3.022 1.00 . A A . 447 TYR CD1 1 1 12 5402 1 1 15 TYR CD2 C -3.336 0.958 2.571 1.00 . A A . 447 TYR CD2 1 1 12 5403 1 1 15 TYR CE1 C -2.159 3.222 3.609 1.00 . A A . 447 TYR CE1 1 1 12 5404 1 1 15 TYR CE2 C -4.118 1.929 3.163 1.00 . A A . 447 TYR CE2 1 1 12 5405 1 1 15 TYR CG C -1.957 1.095 2.490 1.00 . A A . 447 TYR CG 1 1 12 5406 1 1 15 TYR CZ C -3.525 3.061 3.679 1.00 . A A . 447 TYR CZ 1 1 12 5407 1 1 15 TYR H H -2.597 0.796 -0.265 1.00 . A A . 447 TYR H 1 1 12 5408 1 1 15 TYR HA H 0.193 1.154 0.530 1.00 . A A . 447 TYR HA 1 1 12 5409 1 1 15 TYR HB2 H -1.703 -0.862 1.719 1.00 . A A . 447 TYR HB2 1 1 12 5410 1 1 15 TYR HB3 H -0.251 -0.157 2.432 1.00 . A A . 447 TYR HB3 1 1 12 5411 1 1 15 TYR HD1 H -0.314 2.367 2.972 1.00 . A A . 447 TYR HD1 1 1 12 5412 1 1 15 TYR HD2 H -3.798 0.067 2.169 1.00 . A A . 447 TYR HD2 1 1 12 5413 1 1 15 TYR HE1 H -1.693 4.107 4.016 1.00 . A A . 447 TYR HE1 1 1 12 5414 1 1 15 TYR HE2 H -5.188 1.802 3.219 1.00 . A A . 447 TYR HE2 1 1 12 5415 1 1 15 TYR HH H -4.101 4.887 3.843 1.00 . A A . 447 TYR HH 1 1 12 5416 1 1 15 TYR N N -1.697 1.188 -0.252 1.00 . A A . 447 TYR N 1 1 12 5417 1 1 15 TYR O O -0.867 -1.737 -0.496 1.00 . A A . 447 TYR O 1 1 12 5418 1 1 15 TYR OH O -4.301 4.041 4.258 1.00 . A A . 447 TYR OH 1 1 12 5419 1 1 16 TYR C C 2.470 -2.484 -0.957 1.00 . A A . 448 TYR C 1 1 12 5420 1 1 16 TYR CA C 1.533 -1.669 -1.849 1.00 . A A . 448 TYR CA 1 1 12 5421 1 1 16 TYR CB C 2.323 -1.102 -3.033 1.00 . A A . 448 TYR CB 1 1 12 5422 1 1 16 TYR CD1 C 2.237 -2.736 -4.963 1.00 . A A . 448 TYR CD1 1 1 12 5423 1 1 16 TYR CD2 C 4.281 -2.529 -3.755 1.00 . A A . 448 TYR CD2 1 1 12 5424 1 1 16 TYR CE1 C 2.818 -3.677 -5.794 1.00 . A A . 448 TYR CE1 1 1 12 5425 1 1 16 TYR CE2 C 4.868 -3.469 -4.579 1.00 . A A . 448 TYR CE2 1 1 12 5426 1 1 16 TYR CG C 2.957 -2.146 -3.931 1.00 . A A . 448 TYR CG 1 1 12 5427 1 1 16 TYR CZ C 4.134 -4.039 -5.596 1.00 . A A . 448 TYR CZ 1 1 12 5428 1 1 16 TYR H H 1.347 0.314 -1.141 1.00 . A A . 448 TYR H 1 1 12 5429 1 1 16 TYR HA H 0.736 -2.300 -2.216 1.00 . A A . 448 TYR HA 1 1 12 5430 1 1 16 TYR HB2 H 1.667 -0.506 -3.637 1.00 . A A . 448 TYR HB2 1 1 12 5431 1 1 16 TYR HB3 H 3.113 -0.474 -2.651 1.00 . A A . 448 TYR HB3 1 1 12 5432 1 1 16 TYR HD1 H 1.206 -2.449 -5.115 1.00 . A A . 448 TYR HD1 1 1 12 5433 1 1 16 TYR HD2 H 4.855 -2.081 -2.958 1.00 . A A . 448 TYR HD2 1 1 12 5434 1 1 16 TYR HE1 H 2.242 -4.125 -6.590 1.00 . A A . 448 TYR HE1 1 1 12 5435 1 1 16 TYR HE2 H 5.898 -3.755 -4.423 1.00 . A A . 448 TYR HE2 1 1 12 5436 1 1 16 TYR HH H 4.601 -4.703 -7.341 1.00 . A A . 448 TYR HH 1 1 12 5437 1 1 16 TYR N N 0.943 -0.574 -1.090 1.00 . A A . 448 TYR N 1 1 12 5438 1 1 16 TYR O O 3.422 -1.951 -0.383 1.00 . A A . 448 TYR O 1 1 12 5439 1 1 16 TYR OH O 4.720 -4.970 -6.421 1.00 . A A . 448 TYR OH 1 1 12 5440 1 1 17 ASN C C 3.841 -5.576 -0.827 1.00 . A A . 449 ASN C 1 1 12 5441 1 1 17 ASN CA C 2.944 -4.673 0.007 1.00 . A A . 449 ASN CA 1 1 12 5442 1 1 17 ASN CB C 1.998 -5.538 0.838 1.00 . A A . 449 ASN CB 1 1 12 5443 1 1 17 ASN CG C 2.733 -6.573 1.665 1.00 . A A . 449 ASN CG 1 1 12 5444 1 1 17 ASN H H 1.409 -4.131 -1.339 1.00 . A A . 449 ASN H 1 1 12 5445 1 1 17 ASN HA H 3.558 -4.082 0.670 1.00 . A A . 449 ASN HA 1 1 12 5446 1 1 17 ASN HB2 H 1.436 -4.904 1.508 1.00 . A A . 449 ASN HB2 1 1 12 5447 1 1 17 ASN HB3 H 1.314 -6.050 0.177 1.00 . A A . 449 ASN HB3 1 1 12 5448 1 1 17 ASN HD21 H 1.189 -7.816 1.529 1.00 . A A . 449 ASN HD21 1 1 12 5449 1 1 17 ASN HD22 H 2.529 -8.386 2.461 1.00 . A A . 449 ASN HD22 1 1 12 5450 1 1 17 ASN N N 2.176 -3.771 -0.838 1.00 . A A . 449 ASN N 1 1 12 5451 1 1 17 ASN ND2 N 2.091 -7.707 1.902 1.00 . A A . 449 ASN ND2 1 1 12 5452 1 1 17 ASN O O 3.374 -6.264 -1.732 1.00 . A A . 449 ASN O 1 1 12 5453 1 1 17 ASN OD1 O 3.869 -6.359 2.084 1.00 . A A . 449 ASN OD1 1 1 12 5454 1 1 18 ASN C C 6.249 -7.782 -0.554 1.00 . A A . 450 ASN C 1 1 12 5455 1 1 18 ASN CA C 6.083 -6.420 -1.208 1.00 . A A . 450 ASN CA 1 1 12 5456 1 1 18 ASN CB C 7.443 -5.721 -1.288 1.00 . A A . 450 ASN CB 1 1 12 5457 1 1 18 ASN CG C 7.493 -4.650 -2.358 1.00 . A A . 450 ASN CG 1 1 12 5458 1 1 18 ASN H H 5.416 -5.083 0.290 1.00 . A A . 450 ASN H 1 1 12 5459 1 1 18 ASN HA H 5.705 -6.561 -2.209 1.00 . A A . 450 ASN HA 1 1 12 5460 1 1 18 ASN HB2 H 7.660 -5.259 -0.336 1.00 . A A . 450 ASN HB2 1 1 12 5461 1 1 18 ASN HB3 H 8.204 -6.457 -1.507 1.00 . A A . 450 ASN HB3 1 1 12 5462 1 1 18 ASN HD21 H 8.153 -5.980 -3.686 1.00 . A A . 450 ASN HD21 1 1 12 5463 1 1 18 ASN HD22 H 7.946 -4.361 -4.269 1.00 . A A . 450 ASN HD22 1 1 12 5464 1 1 18 ASN N N 5.118 -5.607 -0.481 1.00 . A A . 450 ASN N 1 1 12 5465 1 1 18 ASN ND2 N 7.905 -5.032 -3.558 1.00 . A A . 450 ASN ND2 1 1 12 5466 1 1 18 ASN O O 6.891 -8.669 -1.111 1.00 . A A . 450 ASN O 1 1 12 5467 1 1 18 ASN OD1 O 7.176 -3.487 -2.110 1.00 . A A . 450 ASN OD1 1 1 12 5468 1 1 19 ARG C C 5.083 -10.332 0.633 1.00 . A A . 451 ARG C 1 1 12 5469 1 1 19 ARG CA C 5.787 -9.202 1.366 1.00 . A A . 451 ARG CA 1 1 12 5470 1 1 19 ARG CB C 5.219 -9.077 2.784 1.00 . A A . 451 ARG CB 1 1 12 5471 1 1 19 ARG CD C 7.424 -8.471 3.827 1.00 . A A . 451 ARG CD 1 1 12 5472 1 1 19 ARG CG C 5.965 -8.080 3.652 1.00 . A A . 451 ARG CG 1 1 12 5473 1 1 19 ARG CZ C 8.767 -10.214 4.940 1.00 . A A . 451 ARG CZ 1 1 12 5474 1 1 19 ARG H H 5.157 -7.198 1.027 1.00 . A A . 451 ARG H 1 1 12 5475 1 1 19 ARG HA H 6.831 -9.433 1.435 1.00 . A A . 451 ARG HA 1 1 12 5476 1 1 19 ARG HB2 H 4.188 -8.764 2.718 1.00 . A A . 451 ARG HB2 1 1 12 5477 1 1 19 ARG HB3 H 5.264 -10.044 3.261 1.00 . A A . 451 ARG HB3 1 1 12 5478 1 1 19 ARG HD2 H 7.856 -8.636 2.852 1.00 . A A . 451 ARG HD2 1 1 12 5479 1 1 19 ARG HD3 H 7.944 -7.661 4.316 1.00 . A A . 451 ARG HD3 1 1 12 5480 1 1 19 ARG HE H 6.761 -10.116 4.973 1.00 . A A . 451 ARG HE 1 1 12 5481 1 1 19 ARG HG2 H 5.920 -7.107 3.186 1.00 . A A . 451 ARG HG2 1 1 12 5482 1 1 19 ARG HG3 H 5.494 -8.039 4.623 1.00 . A A . 451 ARG HG3 1 1 12 5483 1 1 19 ARG HH11 H 9.848 -8.938 3.788 1.00 . A A . 451 ARG HH11 1 1 12 5484 1 1 19 ARG HH12 H 10.776 -10.128 4.662 1.00 . A A . 451 ARG HH12 1 1 12 5485 1 1 19 ARG HH21 H 7.993 -11.686 6.108 1.00 . A A . 451 ARG HH21 1 1 12 5486 1 1 19 ARG HH22 H 9.729 -11.641 6.002 1.00 . A A . 451 ARG HH22 1 1 12 5487 1 1 19 ARG N N 5.668 -7.944 0.634 1.00 . A A . 451 ARG N 1 1 12 5488 1 1 19 ARG NE N 7.585 -9.686 4.626 1.00 . A A . 451 ARG NE 1 1 12 5489 1 1 19 ARG NH1 N 9.883 -9.717 4.424 1.00 . A A . 451 ARG NH1 1 1 12 5490 1 1 19 ARG NH2 N 8.833 -11.268 5.739 1.00 . A A . 451 ARG NH2 1 1 12 5491 1 1 19 ARG O O 5.626 -11.429 0.491 1.00 . A A . 451 ARG O 1 1 12 5492 1 1 20 THR C C 2.719 -10.580 -1.916 1.00 . A A . 452 THR C 1 1 12 5493 1 1 20 THR CA C 3.070 -11.057 -0.511 1.00 . A A . 452 THR CA 1 1 12 5494 1 1 20 THR CB C 1.779 -11.386 0.255 1.00 . A A . 452 THR CB 1 1 12 5495 1 1 20 THR CG2 C 2.084 -12.172 1.521 1.00 . A A . 452 THR CG2 1 1 12 5496 1 1 20 THR H H 3.481 -9.180 0.357 1.00 . A A . 452 THR H 1 1 12 5497 1 1 20 THR HA H 3.660 -11.961 -0.587 1.00 . A A . 452 THR HA 1 1 12 5498 1 1 20 THR HB H 1.148 -11.991 -0.379 1.00 . A A . 452 THR HB 1 1 12 5499 1 1 20 THR HG1 H 0.122 -10.352 0.550 1.00 . A A . 452 THR HG1 1 1 12 5500 1 1 20 THR HG21 H 2.716 -11.580 2.168 1.00 . A A . 452 THR HG21 1 1 12 5501 1 1 20 THR HG22 H 2.595 -13.086 1.258 1.00 . A A . 452 THR HG22 1 1 12 5502 1 1 20 THR HG23 H 1.163 -12.405 2.032 1.00 . A A . 452 THR HG23 1 1 12 5503 1 1 20 THR N N 3.866 -10.065 0.191 1.00 . A A . 452 THR N 1 1 12 5504 1 1 20 THR O O 2.029 -11.284 -2.656 1.00 . A A . 452 THR O 1 1 12 5505 1 1 20 THR OG1 O 1.080 -10.181 0.589 1.00 . A A . 452 THR OG1 1 1 12 5506 1 1 21 LEU C C 1.375 -8.298 -3.504 1.00 . A A . 453 LEU C 1 1 12 5507 1 1 21 LEU CA C 2.839 -8.714 -3.524 1.00 . A A . 453 LEU CA 1 1 12 5508 1 1 21 LEU CB C 3.124 -9.628 -4.724 1.00 . A A . 453 LEU CB 1 1 12 5509 1 1 21 LEU CD1 C 4.746 -10.942 -6.105 1.00 . A A . 453 LEU CD1 1 1 12 5510 1 1 21 LEU CD2 C 5.435 -8.740 -5.140 1.00 . A A . 453 LEU CD2 1 1 12 5511 1 1 21 LEU CG C 4.596 -9.993 -4.928 1.00 . A A . 453 LEU CG 1 1 12 5512 1 1 21 LEU H H 3.784 -8.907 -1.639 1.00 . A A . 453 LEU H 1 1 12 5513 1 1 21 LEU HA H 3.448 -7.826 -3.607 1.00 . A A . 453 LEU HA 1 1 12 5514 1 1 21 LEU HB2 H 2.561 -10.540 -4.598 1.00 . A A . 453 LEU HB2 1 1 12 5515 1 1 21 LEU HB3 H 2.774 -9.130 -5.618 1.00 . A A . 453 LEU HB3 1 1 12 5516 1 1 21 LEU HD11 H 4.372 -10.467 -7.001 1.00 . A A . 453 LEU HD11 1 1 12 5517 1 1 21 LEU HD12 H 4.183 -11.845 -5.916 1.00 . A A . 453 LEU HD12 1 1 12 5518 1 1 21 LEU HD13 H 5.788 -11.188 -6.238 1.00 . A A . 453 LEU HD13 1 1 12 5519 1 1 21 LEU HD21 H 5.336 -8.091 -4.282 1.00 . A A . 453 LEU HD21 1 1 12 5520 1 1 21 LEU HD22 H 5.093 -8.222 -6.024 1.00 . A A . 453 LEU HD22 1 1 12 5521 1 1 21 LEU HD23 H 6.472 -9.016 -5.263 1.00 . A A . 453 LEU HD23 1 1 12 5522 1 1 21 LEU HG H 4.959 -10.496 -4.044 1.00 . A A . 453 LEU HG 1 1 12 5523 1 1 21 LEU N N 3.185 -9.371 -2.257 1.00 . A A . 453 LEU N 1 1 12 5524 1 1 21 LEU O O 0.718 -8.212 -4.541 1.00 . A A . 453 LEU O 1 1 12 5525 1 1 22 GLU C C -0.727 -6.146 -2.268 1.00 . A A . 454 GLU C 1 1 12 5526 1 1 22 GLU CA C -0.499 -7.642 -2.092 1.00 . A A . 454 GLU CA 1 1 12 5527 1 1 22 GLU CB C -0.907 -8.049 -0.675 1.00 . A A . 454 GLU CB 1 1 12 5528 1 1 22 GLU CD C -2.725 -8.071 1.073 1.00 . A A . 454 GLU CD 1 1 12 5529 1 1 22 GLU CG C -2.390 -7.883 -0.389 1.00 . A A . 454 GLU CG 1 1 12 5530 1 1 22 GLU H H 1.516 -7.936 -1.554 1.00 . A A . 454 GLU H 1 1 12 5531 1 1 22 GLU HA H -1.097 -8.187 -2.808 1.00 . A A . 454 GLU HA 1 1 12 5532 1 1 22 GLU HB2 H -0.649 -9.087 -0.524 1.00 . A A . 454 GLU HB2 1 1 12 5533 1 1 22 GLU HB3 H -0.356 -7.444 0.032 1.00 . A A . 454 GLU HB3 1 1 12 5534 1 1 22 GLU HG2 H -2.695 -6.892 -0.687 1.00 . A A . 454 GLU HG2 1 1 12 5535 1 1 22 GLU HG3 H -2.933 -8.613 -0.961 1.00 . A A . 454 GLU HG3 1 1 12 5536 1 1 22 GLU N N 0.898 -7.977 -2.311 1.00 . A A . 454 GLU N 1 1 12 5537 1 1 22 GLU O O 0.064 -5.336 -1.789 1.00 . A A . 454 GLU O 1 1 12 5538 1 1 22 GLU OE1 O -2.379 -9.132 1.632 1.00 . A A . 454 GLU OE1 1 1 12 5539 1 1 22 GLU OE2 O -3.354 -7.167 1.661 1.00 . A A . 454 GLU OE2 1 1 12 5540 1 1 23 SER C C -3.315 -4.152 -1.994 1.00 . A A . 455 SER C 1 1 12 5541 1 1 23 SER CA C -2.197 -4.387 -3.009 1.00 . A A . 455 SER CA 1 1 12 5542 1 1 23 SER CB C -2.646 -4.017 -4.427 1.00 . A A . 455 SER CB 1 1 12 5543 1 1 23 SER H H -2.337 -6.448 -3.409 1.00 . A A . 455 SER H 1 1 12 5544 1 1 23 SER HA H -1.344 -3.783 -2.734 1.00 . A A . 455 SER HA 1 1 12 5545 1 1 23 SER HB2 H -1.946 -4.424 -5.140 1.00 . A A . 455 SER HB2 1 1 12 5546 1 1 23 SER HB3 H -3.627 -4.431 -4.611 1.00 . A A . 455 SER HB3 1 1 12 5547 1 1 23 SER HG H -1.812 -2.267 -4.717 1.00 . A A . 455 SER HG 1 1 12 5548 1 1 23 SER N N -1.798 -5.776 -2.945 1.00 . A A . 455 SER N 1 1 12 5549 1 1 23 SER O O -4.453 -4.573 -2.203 1.00 . A A . 455 SER O 1 1 12 5550 1 1 23 SER OG O -2.704 -2.610 -4.604 1.00 . A A . 455 SER OG 1 1 12 5551 1 1 24 THR C C -4.417 -1.903 0.221 1.00 . A A . 456 THR C 1 1 12 5552 1 1 24 THR CA C -3.888 -3.333 0.225 1.00 . A A . 456 THR CA 1 1 12 5553 1 1 24 THR CB C -3.179 -3.614 1.563 1.00 . A A . 456 THR CB 1 1 12 5554 1 1 24 THR CG2 C -4.184 -3.893 2.670 1.00 . A A . 456 THR CG2 1 1 12 5555 1 1 24 THR H H -2.058 -3.166 -0.801 1.00 . A A . 456 THR H 1 1 12 5556 1 1 24 THR HA H -4.712 -4.024 0.116 1.00 . A A . 456 THR HA 1 1 12 5557 1 1 24 THR HB H -2.596 -2.746 1.835 1.00 . A A . 456 THR HB 1 1 12 5558 1 1 24 THR HG1 H -2.810 -5.563 1.523 1.00 . A A . 456 THR HG1 1 1 12 5559 1 1 24 THR HG21 H -4.812 -3.026 2.810 1.00 . A A . 456 THR HG21 1 1 12 5560 1 1 24 THR HG22 H -3.657 -4.109 3.589 1.00 . A A . 456 THR HG22 1 1 12 5561 1 1 24 THR HG23 H -4.795 -4.740 2.397 1.00 . A A . 456 THR HG23 1 1 12 5562 1 1 24 THR N N -2.968 -3.528 -0.882 1.00 . A A . 456 THR N 1 1 12 5563 1 1 24 THR O O -3.643 -0.948 0.181 1.00 . A A . 456 THR O 1 1 12 5564 1 1 24 THR OG1 O -2.303 -4.741 1.421 1.00 . A A . 456 THR OG1 1 1 12 5565 1 1 25 TRP C C -7.113 -0.080 1.421 1.00 . A A . 457 TRP C 1 1 12 5566 1 1 25 TRP CA C -6.328 -0.423 0.154 1.00 . A A . 457 TRP CA 1 1 12 5567 1 1 25 TRP CB C -7.173 -0.301 -1.126 1.00 . A A . 457 TRP CB 1 1 12 5568 1 1 25 TRP CD1 C -5.555 -1.448 -2.743 1.00 . A A . 457 TRP CD1 1 1 12 5569 1 1 25 TRP CD2 C -6.035 0.667 -3.297 1.00 . A A . 457 TRP CD2 1 1 12 5570 1 1 25 TRP CE2 C -5.097 0.153 -4.215 1.00 . A A . 457 TRP CE2 1 1 12 5571 1 1 25 TRP CE3 C -6.487 1.982 -3.465 1.00 . A A . 457 TRP CE3 1 1 12 5572 1 1 25 TRP CG C -6.297 -0.372 -2.343 1.00 . A A . 457 TRP CG 1 1 12 5573 1 1 25 TRP CH2 C -5.055 2.180 -5.417 1.00 . A A . 457 TRP CH2 1 1 12 5574 1 1 25 TRP CZ2 C -4.597 0.898 -5.273 1.00 . A A . 457 TRP CZ2 1 1 12 5575 1 1 25 TRP CZ3 C -5.995 2.722 -4.530 1.00 . A A . 457 TRP CZ3 1 1 12 5576 1 1 25 TRP H H -6.313 -2.550 0.234 1.00 . A A . 457 TRP H 1 1 12 5577 1 1 25 TRP HA H -5.511 0.278 0.080 1.00 . A A . 457 TRP HA 1 1 12 5578 1 1 25 TRP HB2 H -7.888 -1.110 -1.167 1.00 . A A . 457 TRP HB2 1 1 12 5579 1 1 25 TRP HB3 H -7.688 0.647 -1.131 1.00 . A A . 457 TRP HB3 1 1 12 5580 1 1 25 TRP HD1 H -5.540 -2.398 -2.230 1.00 . A A . 457 TRP HD1 1 1 12 5581 1 1 25 TRP HE1 H -4.190 -1.738 -4.311 1.00 . A A . 457 TRP HE1 1 1 12 5582 1 1 25 TRP HE3 H -7.214 2.416 -2.791 1.00 . A A . 457 TRP HE3 1 1 12 5583 1 1 25 TRP HH2 H -4.700 2.794 -6.233 1.00 . A A . 457 TRP HH2 1 1 12 5584 1 1 25 TRP HZ2 H -3.851 0.495 -5.943 1.00 . A A . 457 TRP HZ2 1 1 12 5585 1 1 25 TRP HZ3 H -6.333 3.738 -4.680 1.00 . A A . 457 TRP HZ3 1 1 12 5586 1 1 25 TRP N N -5.731 -1.751 0.221 1.00 . A A . 457 TRP N 1 1 12 5587 1 1 25 TRP NE1 N -4.819 -1.130 -3.848 1.00 . A A . 457 TRP NE1 1 1 12 5588 1 1 25 TRP O O -7.631 1.027 1.559 1.00 . A A . 457 TRP O 1 1 12 5589 1 1 26 GLU C C -6.578 -1.104 4.692 1.00 . A A . 458 GLU C 1 1 12 5590 1 1 26 GLU CA C -7.679 -0.762 3.689 1.00 . A A . 458 GLU CA 1 1 12 5591 1 1 26 GLU CB C -8.942 -1.577 3.975 1.00 . A A . 458 GLU CB 1 1 12 5592 1 1 26 GLU CD C -9.975 0.229 5.411 1.00 . A A . 458 GLU CD 1 1 12 5593 1 1 26 GLU CG C -9.591 -1.236 5.308 1.00 . A A . 458 GLU CG 1 1 12 5594 1 1 26 GLU H H -6.913 -1.938 2.119 1.00 . A A . 458 GLU H 1 1 12 5595 1 1 26 GLU HA H -7.907 0.292 3.760 1.00 . A A . 458 GLU HA 1 1 12 5596 1 1 26 GLU HB2 H -9.660 -1.393 3.192 1.00 . A A . 458 GLU HB2 1 1 12 5597 1 1 26 GLU HB3 H -8.687 -2.628 3.981 1.00 . A A . 458 GLU HB3 1 1 12 5598 1 1 26 GLU HG2 H -10.484 -1.832 5.424 1.00 . A A . 458 GLU HG2 1 1 12 5599 1 1 26 GLU HG3 H -8.898 -1.467 6.103 1.00 . A A . 458 GLU HG3 1 1 12 5600 1 1 26 GLU N N -7.190 -1.029 2.344 1.00 . A A . 458 GLU N 1 1 12 5601 1 1 26 GLU O O -5.914 -2.128 4.551 1.00 . A A . 458 GLU O 1 1 12 5602 1 1 26 GLU OE1 O -9.071 1.082 5.562 1.00 . A A . 458 GLU OE1 1 1 12 5603 1 1 26 GLU OE2 O -11.184 0.536 5.347 1.00 . A A . 458 GLU OE2 1 1 12 5604 1 1 27 LYS C C -5.512 -1.658 7.548 1.00 . A A . 459 LYS C 1 1 12 5605 1 1 27 LYS CA C -5.298 -0.446 6.649 1.00 . A A . 459 LYS CA 1 1 12 5606 1 1 27 LYS CB C -5.091 0.811 7.495 1.00 . A A . 459 LYS CB 1 1 12 5607 1 1 27 LYS CD C -4.118 3.156 7.575 1.00 . A A . 459 LYS CD 1 1 12 5608 1 1 27 LYS CE C -2.997 2.905 8.586 1.00 . A A . 459 LYS CE 1 1 12 5609 1 1 27 LYS CG C -4.436 1.937 6.716 1.00 . A A . 459 LYS CG 1 1 12 5610 1 1 27 LYS H H -7.018 0.486 5.822 1.00 . A A . 459 LYS H 1 1 12 5611 1 1 27 LYS HA H -4.403 -0.614 6.069 1.00 . A A . 459 LYS HA 1 1 12 5612 1 1 27 LYS HB2 H -6.052 1.155 7.853 1.00 . A A . 459 LYS HB2 1 1 12 5613 1 1 27 LYS HB3 H -4.464 0.569 8.338 1.00 . A A . 459 LYS HB3 1 1 12 5614 1 1 27 LYS HD2 H -3.809 3.959 6.922 1.00 . A A . 459 LYS HD2 1 1 12 5615 1 1 27 LYS HD3 H -5.012 3.452 8.105 1.00 . A A . 459 LYS HD3 1 1 12 5616 1 1 27 LYS HE2 H -2.184 2.408 8.080 1.00 . A A . 459 LYS HE2 1 1 12 5617 1 1 27 LYS HE3 H -2.650 3.859 8.959 1.00 . A A . 459 LYS HE3 1 1 12 5618 1 1 27 LYS HG2 H -3.516 1.571 6.286 1.00 . A A . 459 LYS HG2 1 1 12 5619 1 1 27 LYS HG3 H -5.102 2.238 5.921 1.00 . A A . 459 LYS HG3 1 1 12 5620 1 1 27 LYS HZ1 H -4.362 2.371 10.086 1.00 . A A . 459 LYS HZ1 1 1 12 5621 1 1 27 LYS HZ2 H -2.741 2.156 10.520 1.00 . A A . 459 LYS HZ2 1 1 12 5622 1 1 27 LYS HZ3 H -3.479 1.064 9.465 1.00 . A A . 459 LYS HZ3 1 1 12 5623 1 1 27 LYS N N -6.394 -0.262 5.701 1.00 . A A . 459 LYS N 1 1 12 5624 1 1 27 LYS NZ N -3.427 2.066 9.740 1.00 . A A . 459 LYS NZ 1 1 12 5625 1 1 27 LYS O O -6.545 -1.785 8.209 1.00 . A A . 459 LYS O 1 1 12 5626 1 1 28 PRO C C -4.459 -3.421 9.909 1.00 . A A . 460 PRO C 1 1 12 5627 1 1 28 PRO CA C -4.535 -3.759 8.421 1.00 . A A . 460 PRO CA 1 1 12 5628 1 1 28 PRO CB C -3.287 -4.531 7.979 1.00 . A A . 460 PRO CB 1 1 12 5629 1 1 28 PRO CD C -3.281 -2.470 6.777 1.00 . A A . 460 PRO CD 1 1 12 5630 1 1 28 PRO CG C -2.383 -3.504 7.391 1.00 . A A . 460 PRO CG 1 1 12 5631 1 1 28 PRO HA H -5.416 -4.357 8.234 1.00 . A A . 460 PRO HA 1 1 12 5632 1 1 28 PRO HB2 H -2.834 -5.010 8.835 1.00 . A A . 460 PRO HB2 1 1 12 5633 1 1 28 PRO HB3 H -3.560 -5.276 7.248 1.00 . A A . 460 PRO HB3 1 1 12 5634 1 1 28 PRO HD2 H -2.838 -1.488 6.862 1.00 . A A . 460 PRO HD2 1 1 12 5635 1 1 28 PRO HD3 H -3.477 -2.708 5.741 1.00 . A A . 460 PRO HD3 1 1 12 5636 1 1 28 PRO HG2 H -1.775 -3.063 8.166 1.00 . A A . 460 PRO HG2 1 1 12 5637 1 1 28 PRO HG3 H -1.759 -3.954 6.633 1.00 . A A . 460 PRO HG3 1 1 12 5638 1 1 28 PRO N N -4.515 -2.559 7.578 1.00 . A A . 460 PRO N 1 1 12 5639 1 1 28 PRO O O -3.433 -2.861 10.340 1.00 . A A . 460 PRO O 1 1 12 5640 1 1 28 PRO OXT O -5.419 -3.733 10.643 1.00 . A A . 460 PRO OXT 1 1 13 5641 1 1 1 SER C C 7.853 -1.567 5.488 1.00 . A A . 433 SER C 1 1 13 5642 1 1 1 SER CA C 8.284 -0.115 5.672 1.00 . A A . 433 SER CA 1 1 13 5643 1 1 1 SER CB C 9.211 0.024 6.881 1.00 . A A . 433 SER CB 1 1 13 5644 1 1 1 SER H1 H 7.407 1.755 5.929 1.00 . A A . 433 SER H1 1 1 13 5645 1 1 1 SER H2 H 6.590 0.501 6.717 1.00 . A A . 433 SER H2 1 1 13 5646 1 1 1 SER H3 H 6.459 0.671 5.037 1.00 . A A . 433 SER H3 1 1 13 5647 1 1 1 SER HA H 8.811 0.205 4.786 1.00 . A A . 433 SER HA 1 1 13 5648 1 1 1 SER HB2 H 8.740 -0.414 7.748 1.00 . A A . 433 SER HB2 1 1 13 5649 1 1 1 SER HB3 H 10.143 -0.482 6.679 1.00 . A A . 433 SER HB3 1 1 13 5650 1 1 1 SER HG H 10.366 1.478 7.525 1.00 . A A . 433 SER HG 1 1 13 5651 1 1 1 SER N N 7.103 0.759 5.849 1.00 . A A . 433 SER N 1 1 13 5652 1 1 1 SER O O 8.332 -2.262 4.590 1.00 . A A . 433 SER O 1 1 13 5653 1 1 1 SER OG O 9.477 1.392 7.145 1.00 . A A . 433 SER OG 1 1 13 5654 1 1 2 GLU C C 5.252 -3.189 5.107 1.00 . A A . 434 GLU C 1 1 13 5655 1 1 2 GLU CA C 6.327 -3.327 6.172 1.00 . A A . 434 GLU CA 1 1 13 5656 1 1 2 GLU CB C 5.732 -3.811 7.498 1.00 . A A . 434 GLU CB 1 1 13 5657 1 1 2 GLU CD C 4.146 -5.361 8.700 1.00 . A A . 434 GLU CD 1 1 13 5658 1 1 2 GLU CG C 4.747 -4.960 7.367 1.00 . A A . 434 GLU CG 1 1 13 5659 1 1 2 GLU H H 6.724 -1.488 7.141 1.00 . A A . 434 GLU H 1 1 13 5660 1 1 2 GLU HA H 7.076 -4.029 5.834 1.00 . A A . 434 GLU HA 1 1 13 5661 1 1 2 GLU HB2 H 6.538 -4.133 8.140 1.00 . A A . 434 GLU HB2 1 1 13 5662 1 1 2 GLU HB3 H 5.222 -2.983 7.970 1.00 . A A . 434 GLU HB3 1 1 13 5663 1 1 2 GLU HG2 H 3.948 -4.661 6.706 1.00 . A A . 434 GLU HG2 1 1 13 5664 1 1 2 GLU HG3 H 5.261 -5.814 6.948 1.00 . A A . 434 GLU HG3 1 1 13 5665 1 1 2 GLU N N 6.963 -2.033 6.354 1.00 . A A . 434 GLU N 1 1 13 5666 1 1 2 GLU O O 5.059 -4.067 4.265 1.00 . A A . 434 GLU O 1 1 13 5667 1 1 2 GLU OE1 O 3.382 -4.563 9.280 1.00 . A A . 434 GLU OE1 1 1 13 5668 1 1 2 GLU OE2 O 4.438 -6.480 9.176 1.00 . A A . 434 GLU OE2 1 1 13 5669 1 1 3 TRP C C 4.060 -0.402 3.492 1.00 . A A . 435 TRP C 1 1 13 5670 1 1 3 TRP CA C 3.591 -1.687 4.157 1.00 . A A . 435 TRP CA 1 1 13 5671 1 1 3 TRP CB C 2.212 -1.471 4.795 1.00 . A A . 435 TRP CB 1 1 13 5672 1 1 3 TRP CD1 C 1.362 -2.642 6.912 1.00 . A A . 435 TRP CD1 1 1 13 5673 1 1 3 TRP CD2 C 1.570 -3.990 5.140 1.00 . A A . 435 TRP CD2 1 1 13 5674 1 1 3 TRP CE2 C 1.098 -4.749 6.227 1.00 . A A . 435 TRP CE2 1 1 13 5675 1 1 3 TRP CE3 C 1.777 -4.626 3.920 1.00 . A A . 435 TRP CE3 1 1 13 5676 1 1 3 TRP CG C 1.727 -2.643 5.597 1.00 . A A . 435 TRP CG 1 1 13 5677 1 1 3 TRP CH2 C 1.045 -6.710 4.916 1.00 . A A . 435 TRP CH2 1 1 13 5678 1 1 3 TRP CZ2 C 0.832 -6.113 6.126 1.00 . A A . 435 TRP CZ2 1 1 13 5679 1 1 3 TRP CZ3 C 1.515 -5.977 3.824 1.00 . A A . 435 TRP CZ3 1 1 13 5680 1 1 3 TRP H H 4.709 -1.457 5.921 1.00 . A A . 435 TRP H 1 1 13 5681 1 1 3 TRP HA H 3.535 -2.475 3.423 1.00 . A A . 435 TRP HA 1 1 13 5682 1 1 3 TRP HB2 H 2.258 -0.616 5.454 1.00 . A A . 435 TRP HB2 1 1 13 5683 1 1 3 TRP HB3 H 1.490 -1.279 4.017 1.00 . A A . 435 TRP HB3 1 1 13 5684 1 1 3 TRP HD1 H 1.374 -1.768 7.545 1.00 . A A . 435 TRP HD1 1 1 13 5685 1 1 3 TRP HE1 H 0.675 -4.164 8.191 1.00 . A A . 435 TRP HE1 1 1 13 5686 1 1 3 TRP HE3 H 2.140 -4.081 3.061 1.00 . A A . 435 TRP HE3 1 1 13 5687 1 1 3 TRP HH2 H 0.851 -7.765 4.785 1.00 . A A . 435 TRP HH2 1 1 13 5688 1 1 3 TRP HZ2 H 0.467 -6.687 6.964 1.00 . A A . 435 TRP HZ2 1 1 13 5689 1 1 3 TRP HZ3 H 1.680 -6.485 2.886 1.00 . A A . 435 TRP HZ3 1 1 13 5690 1 1 3 TRP N N 4.561 -2.062 5.166 1.00 . A A . 435 TRP N 1 1 13 5691 1 1 3 TRP NE1 N 0.980 -3.905 7.292 1.00 . A A . 435 TRP NE1 1 1 13 5692 1 1 3 TRP O O 4.671 0.446 4.147 1.00 . A A . 435 TRP O 1 1 13 5693 1 1 4 THR C C 2.972 1.955 1.573 1.00 . A A . 436 THR C 1 1 13 5694 1 1 4 THR CA C 4.128 0.968 1.500 1.00 . A A . 436 THR CA 1 1 13 5695 1 1 4 THR CB C 4.456 0.697 0.017 1.00 . A A . 436 THR CB 1 1 13 5696 1 1 4 THR CG2 C 4.748 1.994 -0.734 1.00 . A A . 436 THR CG2 1 1 13 5697 1 1 4 THR H H 3.358 -0.989 1.719 1.00 . A A . 436 THR H 1 1 13 5698 1 1 4 THR HA H 4.996 1.402 1.972 1.00 . A A . 436 THR HA 1 1 13 5699 1 1 4 THR HB H 3.598 0.225 -0.441 1.00 . A A . 436 THR HB 1 1 13 5700 1 1 4 THR HG1 H 5.257 -1.078 -0.284 1.00 . A A . 436 THR HG1 1 1 13 5701 1 1 4 THR HG21 H 5.010 1.767 -1.757 1.00 . A A . 436 THR HG21 1 1 13 5702 1 1 4 THR HG22 H 5.567 2.510 -0.258 1.00 . A A . 436 THR HG22 1 1 13 5703 1 1 4 THR HG23 H 3.868 2.627 -0.721 1.00 . A A . 436 THR HG23 1 1 13 5704 1 1 4 THR N N 3.790 -0.257 2.207 1.00 . A A . 436 THR N 1 1 13 5705 1 1 4 THR O O 1.980 1.807 0.861 1.00 . A A . 436 THR O 1 1 13 5706 1 1 4 THR OG1 O 5.577 -0.192 -0.085 1.00 . A A . 436 THR OG1 1 1 13 5707 1 1 5 GLU C C 2.470 5.106 1.567 1.00 . A A . 437 GLU C 1 1 13 5708 1 1 5 GLU CA C 2.081 3.988 2.518 1.00 . A A . 437 GLU CA 1 1 13 5709 1 1 5 GLU CB C 1.939 4.549 3.941 1.00 . A A . 437 GLU CB 1 1 13 5710 1 1 5 GLU CD C 3.684 3.635 5.516 1.00 . A A . 437 GLU CD 1 1 13 5711 1 1 5 GLU CG C 2.247 3.550 5.046 1.00 . A A . 437 GLU CG 1 1 13 5712 1 1 5 GLU H H 3.860 2.972 3.059 1.00 . A A . 437 GLU H 1 1 13 5713 1 1 5 GLU HA H 1.137 3.569 2.203 1.00 . A A . 437 GLU HA 1 1 13 5714 1 1 5 GLU HB2 H 2.613 5.388 4.050 1.00 . A A . 437 GLU HB2 1 1 13 5715 1 1 5 GLU HB3 H 0.927 4.899 4.075 1.00 . A A . 437 GLU HB3 1 1 13 5716 1 1 5 GLU HG2 H 1.600 3.748 5.887 1.00 . A A . 437 GLU HG2 1 1 13 5717 1 1 5 GLU HG3 H 2.062 2.552 4.677 1.00 . A A . 437 GLU HG3 1 1 13 5718 1 1 5 GLU N N 3.087 2.947 2.444 1.00 . A A . 437 GLU N 1 1 13 5719 1 1 5 GLU O O 3.388 5.878 1.843 1.00 . A A . 437 GLU O 1 1 13 5720 1 1 5 GLU OE1 O 4.593 3.360 4.712 1.00 . A A . 437 GLU OE1 1 1 13 5721 1 1 5 GLU OE2 O 3.906 3.989 6.694 1.00 . A A . 437 GLU OE2 1 1 13 5722 1 1 6 ARG C C 0.861 6.757 -1.149 1.00 . A A . 438 ARG C 1 1 13 5723 1 1 6 ARG CA C 2.142 6.154 -0.574 1.00 . A A . 438 ARG CA 1 1 13 5724 1 1 6 ARG CB C 2.976 5.521 -1.691 1.00 . A A . 438 ARG CB 1 1 13 5725 1 1 6 ARG CD C 4.480 5.881 -3.671 1.00 . A A . 438 ARG CD 1 1 13 5726 1 1 6 ARG CG C 3.516 6.530 -2.695 1.00 . A A . 438 ARG CG 1 1 13 5727 1 1 6 ARG CZ C 6.602 4.623 -3.603 1.00 . A A . 438 ARG CZ 1 1 13 5728 1 1 6 ARG H H 1.096 4.509 0.246 1.00 . A A . 438 ARG H 1 1 13 5729 1 1 6 ARG HA H 2.726 6.916 -0.081 1.00 . A A . 438 ARG HA 1 1 13 5730 1 1 6 ARG HB2 H 3.815 5.003 -1.250 1.00 . A A . 438 ARG HB2 1 1 13 5731 1 1 6 ARG HB3 H 2.364 4.810 -2.223 1.00 . A A . 438 ARG HB3 1 1 13 5732 1 1 6 ARG HD2 H 3.966 5.091 -4.196 1.00 . A A . 438 ARG HD2 1 1 13 5733 1 1 6 ARG HD3 H 4.811 6.628 -4.378 1.00 . A A . 438 ARG HD3 1 1 13 5734 1 1 6 ARG HE H 5.720 5.473 -2.015 1.00 . A A . 438 ARG HE 1 1 13 5735 1 1 6 ARG HG2 H 2.688 6.949 -3.247 1.00 . A A . 438 ARG HG2 1 1 13 5736 1 1 6 ARG HG3 H 4.029 7.314 -2.160 1.00 . A A . 438 ARG HG3 1 1 13 5737 1 1 6 ARG HH11 H 5.791 4.807 -5.458 1.00 . A A . 438 ARG HH11 1 1 13 5738 1 1 6 ARG HH12 H 7.262 3.881 -5.374 1.00 . A A . 438 ARG HH12 1 1 13 5739 1 1 6 ARG HH21 H 7.665 4.304 -1.912 1.00 . A A . 438 ARG HH21 1 1 13 5740 1 1 6 ARG HH22 H 8.351 3.617 -3.355 1.00 . A A . 438 ARG HH22 1 1 13 5741 1 1 6 ARG N N 1.816 5.156 0.423 1.00 . A A . 438 ARG N 1 1 13 5742 1 1 6 ARG NE N 5.647 5.322 -2.993 1.00 . A A . 438 ARG NE 1 1 13 5743 1 1 6 ARG NH1 N 6.551 4.424 -4.914 1.00 . A A . 438 ARG NH1 1 1 13 5744 1 1 6 ARG NH2 N 7.617 4.142 -2.899 1.00 . A A . 438 ARG NH2 1 1 13 5745 1 1 6 ARG O O -0.158 6.071 -1.231 1.00 . A A . 438 ARG O 1 1 13 5746 1 1 7 LYS C C -0.207 8.697 -3.628 1.00 . A A . 439 LYS C 1 1 13 5747 1 1 7 LYS CA C -0.259 8.679 -2.105 1.00 . A A . 439 LYS CA 1 1 13 5748 1 1 7 LYS CB C -0.356 10.106 -1.550 1.00 . A A . 439 LYS CB 1 1 13 5749 1 1 7 LYS CD C 0.787 12.301 -1.097 1.00 . A A . 439 LYS CD 1 1 13 5750 1 1 7 LYS CE C -0.276 13.110 -1.822 1.00 . A A . 439 LYS CE 1 1 13 5751 1 1 7 LYS CG C 0.931 10.909 -1.688 1.00 . A A . 439 LYS CG 1 1 13 5752 1 1 7 LYS H H 1.756 8.509 -1.553 1.00 . A A . 439 LYS H 1 1 13 5753 1 1 7 LYS HA H -1.130 8.121 -1.793 1.00 . A A . 439 LYS HA 1 1 13 5754 1 1 7 LYS HB2 H -1.139 10.631 -2.076 1.00 . A A . 439 LYS HB2 1 1 13 5755 1 1 7 LYS HB3 H -0.611 10.053 -0.501 1.00 . A A . 439 LYS HB3 1 1 13 5756 1 1 7 LYS HD2 H 0.512 12.214 -0.056 1.00 . A A . 439 LYS HD2 1 1 13 5757 1 1 7 LYS HD3 H 1.734 12.814 -1.178 1.00 . A A . 439 LYS HD3 1 1 13 5758 1 1 7 LYS HE2 H 0.019 13.230 -2.853 1.00 . A A . 439 LYS HE2 1 1 13 5759 1 1 7 LYS HE3 H -1.212 12.575 -1.776 1.00 . A A . 439 LYS HE3 1 1 13 5760 1 1 7 LYS HG2 H 1.724 10.390 -1.170 1.00 . A A . 439 LYS HG2 1 1 13 5761 1 1 7 LYS HG3 H 1.179 10.995 -2.736 1.00 . A A . 439 LYS HG3 1 1 13 5762 1 1 7 LYS HZ1 H 0.433 14.994 -1.262 1.00 . A A . 439 LYS HZ1 1 1 13 5763 1 1 7 LYS HZ2 H -0.736 14.357 -0.213 1.00 . A A . 439 LYS HZ2 1 1 13 5764 1 1 7 LYS HZ3 H -1.202 14.977 -1.720 1.00 . A A . 439 LYS HZ3 1 1 13 5765 1 1 7 LYS N N 0.911 8.017 -1.571 1.00 . A A . 439 LYS N 1 1 13 5766 1 1 7 LYS NZ N -0.458 14.452 -1.212 1.00 . A A . 439 LYS NZ 1 1 13 5767 1 1 7 LYS O O 0.742 9.201 -4.228 1.00 . A A . 439 LYS O 1 1 13 5768 1 1 8 THR C C -2.158 9.396 -6.095 1.00 . A A . 440 THR C 1 1 13 5769 1 1 8 THR CA C -1.354 8.163 -5.690 1.00 . A A . 440 THR CA 1 1 13 5770 1 1 8 THR CB C -2.025 6.885 -6.251 1.00 . A A . 440 THR CB 1 1 13 5771 1 1 8 THR CG2 C -3.427 6.695 -5.688 1.00 . A A . 440 THR CG2 1 1 13 5772 1 1 8 THR H H -1.884 7.629 -3.712 1.00 . A A . 440 THR H 1 1 13 5773 1 1 8 THR HA H -0.363 8.241 -6.112 1.00 . A A . 440 THR HA 1 1 13 5774 1 1 8 THR HB H -1.424 6.032 -5.965 1.00 . A A . 440 THR HB 1 1 13 5775 1 1 8 THR HG1 H -1.401 6.365 -8.058 1.00 . A A . 440 THR HG1 1 1 13 5776 1 1 8 THR HG21 H -3.866 5.798 -6.102 1.00 . A A . 440 THR HG21 1 1 13 5777 1 1 8 THR HG22 H -4.039 7.547 -5.947 1.00 . A A . 440 THR HG22 1 1 13 5778 1 1 8 THR HG23 H -3.372 6.605 -4.613 1.00 . A A . 440 THR HG23 1 1 13 5779 1 1 8 THR N N -1.220 8.119 -4.244 1.00 . A A . 440 THR N 1 1 13 5780 1 1 8 THR O O -3.003 9.872 -5.334 1.00 . A A . 440 THR O 1 1 13 5781 1 1 8 THR OG1 O -2.086 6.946 -7.682 1.00 . A A . 440 THR OG1 1 1 13 5782 1 1 9 ALA C C -4.002 11.059 -7.868 1.00 . A A . 441 ALA C 1 1 13 5783 1 1 9 ALA CA C -2.479 11.159 -7.776 1.00 . A A . 441 ALA CA 1 1 13 5784 1 1 9 ALA CB C -1.896 11.527 -9.131 1.00 . A A . 441 ALA CB 1 1 13 5785 1 1 9 ALA H H -1.227 9.453 -7.861 1.00 . A A . 441 ALA H 1 1 13 5786 1 1 9 ALA HA H -2.224 11.945 -7.081 1.00 . A A . 441 ALA HA 1 1 13 5787 1 1 9 ALA HB1 H -2.296 12.479 -9.451 1.00 . A A . 441 ALA HB1 1 1 13 5788 1 1 9 ALA HB2 H -2.157 10.766 -9.852 1.00 . A A . 441 ALA HB2 1 1 13 5789 1 1 9 ALA HB3 H -0.821 11.597 -9.055 1.00 . A A . 441 ALA HB3 1 1 13 5790 1 1 9 ALA N N -1.870 9.918 -7.288 1.00 . A A . 441 ALA N 1 1 13 5791 1 1 9 ALA O O -4.692 12.066 -8.036 1.00 . A A . 441 ALA O 1 1 13 5792 1 1 10 ASP C C -6.579 10.101 -6.419 1.00 . A A . 442 ASP C 1 1 13 5793 1 1 10 ASP CA C -5.970 9.634 -7.747 1.00 . A A . 442 ASP CA 1 1 13 5794 1 1 10 ASP CB C -6.287 8.156 -7.989 1.00 . A A . 442 ASP CB 1 1 13 5795 1 1 10 ASP CG C -7.767 7.902 -8.188 1.00 . A A . 442 ASP CG 1 1 13 5796 1 1 10 ASP H H -3.928 9.075 -7.659 1.00 . A A . 442 ASP H 1 1 13 5797 1 1 10 ASP HA H -6.392 10.223 -8.548 1.00 . A A . 442 ASP HA 1 1 13 5798 1 1 10 ASP HB2 H -5.763 7.822 -8.873 1.00 . A A . 442 ASP HB2 1 1 13 5799 1 1 10 ASP HB3 H -5.953 7.578 -7.140 1.00 . A A . 442 ASP HB3 1 1 13 5800 1 1 10 ASP N N -4.527 9.846 -7.747 1.00 . A A . 442 ASP N 1 1 13 5801 1 1 10 ASP O O -7.799 10.144 -6.256 1.00 . A A . 442 ASP O 1 1 13 5802 1 1 10 ASP OD1 O -8.296 8.266 -9.259 1.00 . A A . 442 ASP OD1 1 1 13 5803 1 1 10 ASP OD2 O -8.410 7.347 -7.275 1.00 . A A . 442 ASP OD2 1 1 13 5804 1 1 11 GLY C C -6.370 9.857 -3.180 1.00 . A A . 443 GLY C 1 1 13 5805 1 1 11 GLY CA C -6.168 10.959 -4.194 1.00 . A A . 443 GLY CA 1 1 13 5806 1 1 11 GLY H H -4.751 10.363 -5.648 1.00 . A A . 443 GLY H 1 1 13 5807 1 1 11 GLY HA2 H -5.438 11.658 -3.814 1.00 . A A . 443 GLY HA2 1 1 13 5808 1 1 11 GLY HA3 H -7.105 11.476 -4.338 1.00 . A A . 443 GLY HA3 1 1 13 5809 1 1 11 GLY N N -5.714 10.453 -5.474 1.00 . A A . 443 GLY N 1 1 13 5810 1 1 11 GLY O O -7.281 9.919 -2.352 1.00 . A A . 443 GLY O 1 1 13 5811 1 1 12 LYS C C -4.295 7.304 -1.777 1.00 . A A . 444 LYS C 1 1 13 5812 1 1 12 LYS CA C -5.645 7.689 -2.367 1.00 . A A . 444 LYS CA 1 1 13 5813 1 1 12 LYS CB C -6.215 6.497 -3.143 1.00 . A A . 444 LYS CB 1 1 13 5814 1 1 12 LYS CD C -8.636 6.359 -3.848 1.00 . A A . 444 LYS CD 1 1 13 5815 1 1 12 LYS CE C -8.905 7.842 -4.026 1.00 . A A . 444 LYS CE 1 1 13 5816 1 1 12 LYS CG C -7.630 6.097 -2.737 1.00 . A A . 444 LYS CG 1 1 13 5817 1 1 12 LYS H H -4.769 8.890 -3.868 1.00 . A A . 444 LYS H 1 1 13 5818 1 1 12 LYS HA H -6.321 7.946 -1.566 1.00 . A A . 444 LYS HA 1 1 13 5819 1 1 12 LYS HB2 H -6.227 6.740 -4.196 1.00 . A A . 444 LYS HB2 1 1 13 5820 1 1 12 LYS HB3 H -5.568 5.647 -2.989 1.00 . A A . 444 LYS HB3 1 1 13 5821 1 1 12 LYS HD2 H -8.244 5.963 -4.773 1.00 . A A . 444 LYS HD2 1 1 13 5822 1 1 12 LYS HD3 H -9.563 5.860 -3.606 1.00 . A A . 444 LYS HD3 1 1 13 5823 1 1 12 LYS HE2 H -9.366 8.220 -3.125 1.00 . A A . 444 LYS HE2 1 1 13 5824 1 1 12 LYS HE3 H -7.964 8.346 -4.185 1.00 . A A . 444 LYS HE3 1 1 13 5825 1 1 12 LYS HG2 H -7.638 5.045 -2.501 1.00 . A A . 444 LYS HG2 1 1 13 5826 1 1 12 LYS HG3 H -7.915 6.665 -1.863 1.00 . A A . 444 LYS HG3 1 1 13 5827 1 1 12 LYS HZ1 H -10.666 7.538 -5.110 1.00 . A A . 444 LYS HZ1 1 1 13 5828 1 1 12 LYS HZ2 H -9.313 7.887 -6.073 1.00 . A A . 444 LYS HZ2 1 1 13 5829 1 1 12 LYS HZ3 H -10.068 9.124 -5.189 1.00 . A A . 444 LYS HZ3 1 1 13 5830 1 1 12 LYS N N -5.518 8.847 -3.238 1.00 . A A . 444 LYS N 1 1 13 5831 1 1 12 LYS NZ N -9.801 8.117 -5.177 1.00 . A A . 444 LYS NZ 1 1 13 5832 1 1 12 LYS O O -3.307 7.163 -2.502 1.00 . A A . 444 LYS O 1 1 13 5833 1 1 13 THR C C -3.161 5.085 0.238 1.00 . A A . 445 THR C 1 1 13 5834 1 1 13 THR CA C -3.075 6.607 0.194 1.00 . A A . 445 THR CA 1 1 13 5835 1 1 13 THR CB C -2.931 7.170 1.625 1.00 . A A . 445 THR CB 1 1 13 5836 1 1 13 THR CG2 C -1.621 6.722 2.258 1.00 . A A . 445 THR CG2 1 1 13 5837 1 1 13 THR H H -5.062 7.320 0.070 1.00 . A A . 445 THR H 1 1 13 5838 1 1 13 THR HA H -2.211 6.900 -0.385 1.00 . A A . 445 THR HA 1 1 13 5839 1 1 13 THR HB H -3.750 6.801 2.227 1.00 . A A . 445 THR HB 1 1 13 5840 1 1 13 THR HG1 H -2.086 8.954 1.480 1.00 . A A . 445 THR HG1 1 1 13 5841 1 1 13 THR HG21 H -0.794 7.080 1.663 1.00 . A A . 445 THR HG21 1 1 13 5842 1 1 13 THR HG22 H -1.593 5.643 2.302 1.00 . A A . 445 THR HG22 1 1 13 5843 1 1 13 THR HG23 H -1.548 7.124 3.257 1.00 . A A . 445 THR HG23 1 1 13 5844 1 1 13 THR N N -4.260 7.119 -0.468 1.00 . A A . 445 THR N 1 1 13 5845 1 1 13 THR O O -3.790 4.511 1.128 1.00 . A A . 445 THR O 1 1 13 5846 1 1 13 THR OG1 O -2.979 8.607 1.598 1.00 . A A . 445 THR OG1 1 1 13 5847 1 1 14 TYR C C -1.473 2.286 -0.379 1.00 . A A . 446 TYR C 1 1 13 5848 1 1 14 TYR CA C -2.706 3.001 -0.903 1.00 . A A . 446 TYR CA 1 1 13 5849 1 1 14 TYR CB C -2.960 2.638 -2.368 1.00 . A A . 446 TYR CB 1 1 13 5850 1 1 14 TYR CD1 C -1.172 3.942 -3.605 1.00 . A A . 446 TYR CD1 1 1 13 5851 1 1 14 TYR CD2 C -1.222 1.571 -3.846 1.00 . A A . 446 TYR CD2 1 1 13 5852 1 1 14 TYR CE1 C -0.085 4.007 -4.457 1.00 . A A . 446 TYR CE1 1 1 13 5853 1 1 14 TYR CE2 C -0.138 1.627 -4.696 1.00 . A A . 446 TYR CE2 1 1 13 5854 1 1 14 TYR CG C -1.757 2.723 -3.284 1.00 . A A . 446 TYR CG 1 1 13 5855 1 1 14 TYR CZ C 0.428 2.848 -5.000 1.00 . A A . 446 TYR CZ 1 1 13 5856 1 1 14 TYR H H -2.014 4.938 -1.389 1.00 . A A . 446 TYR H 1 1 13 5857 1 1 14 TYR HA H -3.558 2.696 -0.317 1.00 . A A . 446 TYR HA 1 1 13 5858 1 1 14 TYR HB2 H -3.328 1.625 -2.416 1.00 . A A . 446 TYR HB2 1 1 13 5859 1 1 14 TYR HB3 H -3.718 3.301 -2.761 1.00 . A A . 446 TYR HB3 1 1 13 5860 1 1 14 TYR HD1 H -1.575 4.848 -3.176 1.00 . A A . 446 TYR HD1 1 1 13 5861 1 1 14 TYR HD2 H -1.668 0.617 -3.608 1.00 . A A . 446 TYR HD2 1 1 13 5862 1 1 14 TYR HE1 H 0.357 4.964 -4.694 1.00 . A A . 446 TYR HE1 1 1 13 5863 1 1 14 TYR HE2 H 0.257 0.716 -5.123 1.00 . A A . 446 TYR HE2 1 1 13 5864 1 1 14 TYR HH H 2.153 3.542 -5.502 1.00 . A A . 446 TYR HH 1 1 13 5865 1 1 14 TYR N N -2.568 4.438 -0.753 1.00 . A A . 446 TYR N 1 1 13 5866 1 1 14 TYR O O -0.349 2.771 -0.533 1.00 . A A . 446 TYR O 1 1 13 5867 1 1 14 TYR OH O 1.512 2.911 -5.850 1.00 . A A . 446 TYR OH 1 1 13 5868 1 1 15 TYR C C -0.249 -0.810 -0.099 1.00 . A A . 447 TYR C 1 1 13 5869 1 1 15 TYR CA C -0.604 0.366 0.803 1.00 . A A . 447 TYR CA 1 1 13 5870 1 1 15 TYR CB C -0.981 -0.109 2.215 1.00 . A A . 447 TYR CB 1 1 13 5871 1 1 15 TYR CD1 C -2.857 1.405 2.991 1.00 . A A . 447 TYR CD1 1 1 13 5872 1 1 15 TYR CD2 C -0.699 1.714 3.949 1.00 . A A . 447 TYR CD2 1 1 13 5873 1 1 15 TYR CE1 C -3.347 2.451 3.749 1.00 . A A . 447 TYR CE1 1 1 13 5874 1 1 15 TYR CE2 C -1.182 2.762 4.706 1.00 . A A . 447 TYR CE2 1 1 13 5875 1 1 15 TYR CG C -1.525 1.017 3.078 1.00 . A A . 447 TYR CG 1 1 13 5876 1 1 15 TYR CZ C -2.502 3.128 4.603 1.00 . A A . 447 TYR CZ 1 1 13 5877 1 1 15 TYR H H -2.599 0.766 0.266 1.00 . A A . 447 TYR H 1 1 13 5878 1 1 15 TYR HA H 0.252 1.021 0.876 1.00 . A A . 447 TYR HA 1 1 13 5879 1 1 15 TYR HB2 H -1.734 -0.882 2.147 1.00 . A A . 447 TYR HB2 1 1 13 5880 1 1 15 TYR HB3 H -0.104 -0.507 2.702 1.00 . A A . 447 TYR HB3 1 1 13 5881 1 1 15 TYR HD1 H -3.517 0.872 2.323 1.00 . A A . 447 TYR HD1 1 1 13 5882 1 1 15 TYR HD2 H 0.336 1.429 4.037 1.00 . A A . 447 TYR HD2 1 1 13 5883 1 1 15 TYR HE1 H -4.384 2.737 3.669 1.00 . A A . 447 TYR HE1 1 1 13 5884 1 1 15 TYR HE2 H -0.522 3.293 5.377 1.00 . A A . 447 TYR HE2 1 1 13 5885 1 1 15 TYR HH H -2.280 4.843 5.451 1.00 . A A . 447 TYR HH 1 1 13 5886 1 1 15 TYR N N -1.686 1.126 0.220 1.00 . A A . 447 TYR N 1 1 13 5887 1 1 15 TYR O O -0.942 -1.826 -0.118 1.00 . A A . 447 TYR O 1 1 13 5888 1 1 15 TYR OH O -2.977 4.181 5.351 1.00 . A A . 447 TYR OH 1 1 13 5889 1 1 16 TYR C C 2.308 -2.567 -0.999 1.00 . A A . 448 TYR C 1 1 13 5890 1 1 16 TYR CA C 1.280 -1.713 -1.744 1.00 . A A . 448 TYR CA 1 1 13 5891 1 1 16 TYR CB C 1.907 -1.124 -3.012 1.00 . A A . 448 TYR CB 1 1 13 5892 1 1 16 TYR CD1 C 1.603 -2.864 -4.818 1.00 . A A . 448 TYR CD1 1 1 13 5893 1 1 16 TYR CD2 C 3.813 -2.426 -4.037 1.00 . A A . 448 TYR CD2 1 1 13 5894 1 1 16 TYR CE1 C 2.099 -3.806 -5.701 1.00 . A A . 448 TYR CE1 1 1 13 5895 1 1 16 TYR CE2 C 4.315 -3.366 -4.917 1.00 . A A . 448 TYR CE2 1 1 13 5896 1 1 16 TYR CG C 2.450 -2.160 -3.972 1.00 . A A . 448 TYR CG 1 1 13 5897 1 1 16 TYR CZ C 3.454 -4.053 -5.747 1.00 . A A . 448 TYR CZ 1 1 13 5898 1 1 16 TYR H H 1.229 0.236 -0.934 1.00 . A A . 448 TYR H 1 1 13 5899 1 1 16 TYR HA H 0.434 -2.324 -2.018 1.00 . A A . 448 TYR HA 1 1 13 5900 1 1 16 TYR HB2 H 1.160 -0.549 -3.537 1.00 . A A . 448 TYR HB2 1 1 13 5901 1 1 16 TYR HB3 H 2.721 -0.471 -2.732 1.00 . A A . 448 TYR HB3 1 1 13 5902 1 1 16 TYR HD1 H 0.541 -2.669 -4.780 1.00 . A A . 448 TYR HD1 1 1 13 5903 1 1 16 TYR HD2 H 4.484 -1.886 -3.387 1.00 . A A . 448 TYR HD2 1 1 13 5904 1 1 16 TYR HE1 H 1.424 -4.343 -6.350 1.00 . A A . 448 TYR HE1 1 1 13 5905 1 1 16 TYR HE2 H 5.377 -3.558 -4.951 1.00 . A A . 448 TYR HE2 1 1 13 5906 1 1 16 TYR HH H 4.613 -5.522 -6.187 1.00 . A A . 448 TYR HH 1 1 13 5907 1 1 16 TYR N N 0.802 -0.644 -0.886 1.00 . A A . 448 TYR N 1 1 13 5908 1 1 16 TYR O O 3.337 -2.072 -0.536 1.00 . A A . 448 TYR O 1 1 13 5909 1 1 16 TYR OH O 3.950 -4.986 -6.629 1.00 . A A . 448 TYR OH 1 1 13 5910 1 1 17 ASN C C 3.881 -5.409 -1.107 1.00 . A A . 449 ASN C 1 1 13 5911 1 1 17 ASN CA C 2.859 -4.788 -0.170 1.00 . A A . 449 ASN CA 1 1 13 5912 1 1 17 ASN CB C 2.004 -5.884 0.469 1.00 . A A . 449 ASN CB 1 1 13 5913 1 1 17 ASN CG C 2.833 -6.915 1.211 1.00 . A A . 449 ASN CG 1 1 13 5914 1 1 17 ASN H H 1.176 -4.188 -1.287 1.00 . A A . 449 ASN H 1 1 13 5915 1 1 17 ASN HA H 3.377 -4.247 0.607 1.00 . A A . 449 ASN HA 1 1 13 5916 1 1 17 ASN HB2 H 1.317 -5.434 1.170 1.00 . A A . 449 ASN HB2 1 1 13 5917 1 1 17 ASN HB3 H 1.443 -6.390 -0.303 1.00 . A A . 449 ASN HB3 1 1 13 5918 1 1 17 ASN HD21 H 1.351 -8.235 1.079 1.00 . A A . 449 ASN HD21 1 1 13 5919 1 1 17 ASN HD22 H 2.756 -8.757 1.940 1.00 . A A . 449 ASN HD22 1 1 13 5920 1 1 17 ASN N N 2.008 -3.852 -0.883 1.00 . A A . 449 ASN N 1 1 13 5921 1 1 17 ASN ND2 N 2.264 -8.091 1.419 1.00 . A A . 449 ASN ND2 1 1 13 5922 1 1 17 ASN O O 3.535 -5.924 -2.169 1.00 . A A . 449 ASN O 1 1 13 5923 1 1 17 ASN OD1 O 3.962 -6.646 1.618 1.00 . A A . 449 ASN OD1 1 1 13 5924 1 1 18 ASN C C 6.555 -7.345 -1.106 1.00 . A A . 450 ASN C 1 1 13 5925 1 1 18 ASN CA C 6.224 -5.911 -1.502 1.00 . A A . 450 ASN CA 1 1 13 5926 1 1 18 ASN CB C 7.475 -5.019 -1.395 1.00 . A A . 450 ASN CB 1 1 13 5927 1 1 18 ASN CG C 8.234 -5.132 -0.070 1.00 . A A . 450 ASN CG 1 1 13 5928 1 1 18 ASN H H 5.334 -5.008 0.191 1.00 . A A . 450 ASN H 1 1 13 5929 1 1 18 ASN HA H 5.887 -5.911 -2.530 1.00 . A A . 450 ASN HA 1 1 13 5930 1 1 18 ASN HB2 H 8.156 -5.285 -2.189 1.00 . A A . 450 ASN HB2 1 1 13 5931 1 1 18 ASN HB3 H 7.175 -3.989 -1.525 1.00 . A A . 450 ASN HB3 1 1 13 5932 1 1 18 ASN HD21 H 6.576 -5.517 0.952 1.00 . A A . 450 ASN HD21 1 1 13 5933 1 1 18 ASN HD22 H 8.027 -5.465 1.883 1.00 . A A . 450 ASN HD22 1 1 13 5934 1 1 18 ASN N N 5.136 -5.385 -0.688 1.00 . A A . 450 ASN N 1 1 13 5935 1 1 18 ASN ND2 N 7.537 -5.400 1.028 1.00 . A A . 450 ASN ND2 1 1 13 5936 1 1 18 ASN O O 7.367 -8.002 -1.749 1.00 . A A . 450 ASN O 1 1 13 5937 1 1 18 ASN OD1 O 9.453 -4.965 -0.038 1.00 . A A . 450 ASN OD1 1 1 13 5938 1 1 19 ARG C C 5.550 -10.222 -0.492 1.00 . A A . 451 ARG C 1 1 13 5939 1 1 19 ARG CA C 6.158 -9.181 0.445 1.00 . A A . 451 ARG CA 1 1 13 5940 1 1 19 ARG CB C 5.610 -9.358 1.868 1.00 . A A . 451 ARG CB 1 1 13 5941 1 1 19 ARG CD C 5.889 -8.830 4.310 1.00 . A A . 451 ARG CD 1 1 13 5942 1 1 19 ARG CG C 6.274 -8.453 2.891 1.00 . A A . 451 ARG CG 1 1 13 5943 1 1 19 ARG CZ C 6.448 -7.961 6.556 1.00 . A A . 451 ARG CZ 1 1 13 5944 1 1 19 ARG H H 5.255 -7.256 0.416 1.00 . A A . 451 ARG H 1 1 13 5945 1 1 19 ARG HA H 7.228 -9.324 0.466 1.00 . A A . 451 ARG HA 1 1 13 5946 1 1 19 ARG HB2 H 4.551 -9.143 1.866 1.00 . A A . 451 ARG HB2 1 1 13 5947 1 1 19 ARG HB3 H 5.761 -10.383 2.176 1.00 . A A . 451 ARG HB3 1 1 13 5948 1 1 19 ARG HD2 H 4.881 -8.495 4.498 1.00 . A A . 451 ARG HD2 1 1 13 5949 1 1 19 ARG HD3 H 5.937 -9.905 4.409 1.00 . A A . 451 ARG HD3 1 1 13 5950 1 1 19 ARG HE H 7.697 -8.010 4.997 1.00 . A A . 451 ARG HE 1 1 13 5951 1 1 19 ARG HG2 H 7.337 -8.529 2.785 1.00 . A A . 451 ARG HG2 1 1 13 5952 1 1 19 ARG HG3 H 5.966 -7.434 2.706 1.00 . A A . 451 ARG HG3 1 1 13 5953 1 1 19 ARG HH11 H 4.551 -8.668 6.394 1.00 . A A . 451 ARG HH11 1 1 13 5954 1 1 19 ARG HH12 H 4.977 -8.022 7.949 1.00 . A A . 451 ARG HH12 1 1 13 5955 1 1 19 ARG HH21 H 8.277 -7.235 7.044 1.00 . A A . 451 ARG HH21 1 1 13 5956 1 1 19 ARG HH22 H 7.110 -7.232 8.334 1.00 . A A . 451 ARG HH22 1 1 13 5957 1 1 19 ARG N N 5.909 -7.827 -0.048 1.00 . A A . 451 ARG N 1 1 13 5958 1 1 19 ARG NE N 6.783 -8.223 5.295 1.00 . A A . 451 ARG NE 1 1 13 5959 1 1 19 ARG NH1 N 5.230 -8.244 7.003 1.00 . A A . 451 ARG NH1 1 1 13 5960 1 1 19 ARG NH2 N 7.348 -7.433 7.376 1.00 . A A . 451 ARG NH2 1 1 13 5961 1 1 19 ARG O O 6.264 -11.009 -1.110 1.00 . A A . 451 ARG O 1 1 13 5962 1 1 20 THR C C 3.017 -10.494 -2.720 1.00 . A A . 452 THR C 1 1 13 5963 1 1 20 THR CA C 3.529 -11.169 -1.455 1.00 . A A . 452 THR CA 1 1 13 5964 1 1 20 THR CB C 2.346 -11.814 -0.708 1.00 . A A . 452 THR CB 1 1 13 5965 1 1 20 THR CG2 C 2.841 -12.763 0.368 1.00 . A A . 452 THR CG2 1 1 13 5966 1 1 20 THR H H 3.705 -9.553 -0.115 1.00 . A A . 452 THR H 1 1 13 5967 1 1 20 THR HA H 4.225 -11.950 -1.729 1.00 . A A . 452 THR HA 1 1 13 5968 1 1 20 THR HB H 1.755 -12.375 -1.416 1.00 . A A . 452 THR HB 1 1 13 5969 1 1 20 THR HG1 H 0.589 -11.035 -0.243 1.00 . A A . 452 THR HG1 1 1 13 5970 1 1 20 THR HG21 H 1.997 -13.194 0.885 1.00 . A A . 452 THR HG21 1 1 13 5971 1 1 20 THR HG22 H 3.456 -12.221 1.070 1.00 . A A . 452 THR HG22 1 1 13 5972 1 1 20 THR HG23 H 3.423 -13.548 -0.089 1.00 . A A . 452 THR HG23 1 1 13 5973 1 1 20 THR N N 4.228 -10.214 -0.608 1.00 . A A . 452 THR N 1 1 13 5974 1 1 20 THR O O 2.415 -11.136 -3.582 1.00 . A A . 452 THR O 1 1 13 5975 1 1 20 THR OG1 O 1.521 -10.799 -0.115 1.00 . A A . 452 THR OG1 1 1 13 5976 1 1 21 LEU C C 1.221 -8.282 -3.757 1.00 . A A . 453 LEU C 1 1 13 5977 1 1 21 LEU CA C 2.740 -8.348 -3.877 1.00 . A A . 453 LEU CA 1 1 13 5978 1 1 21 LEU CB C 3.165 -8.811 -5.284 1.00 . A A . 453 LEU CB 1 1 13 5979 1 1 21 LEU CD1 C 5.611 -9.289 -4.851 1.00 . A A . 453 LEU CD1 1 1 13 5980 1 1 21 LEU CD2 C 4.827 -8.765 -7.167 1.00 . A A . 453 LEU CD2 1 1 13 5981 1 1 21 LEU CG C 4.616 -8.493 -5.685 1.00 . A A . 453 LEU CG 1 1 13 5982 1 1 21 LEU H H 3.886 -8.789 -2.159 1.00 . A A . 453 LEU H 1 1 13 5983 1 1 21 LEU HA H 3.126 -7.351 -3.712 1.00 . A A . 453 LEU HA 1 1 13 5984 1 1 21 LEU HB2 H 3.028 -9.880 -5.340 1.00 . A A . 453 LEU HB2 1 1 13 5985 1 1 21 LEU HB3 H 2.508 -8.345 -6.004 1.00 . A A . 453 LEU HB3 1 1 13 5986 1 1 21 LEU HD11 H 6.618 -9.017 -5.135 1.00 . A A . 453 LEU HD11 1 1 13 5987 1 1 21 LEU HD12 H 5.463 -10.345 -5.022 1.00 . A A . 453 LEU HD12 1 1 13 5988 1 1 21 LEU HD13 H 5.461 -9.068 -3.804 1.00 . A A . 453 LEU HD13 1 1 13 5989 1 1 21 LEU HD21 H 4.159 -8.143 -7.745 1.00 . A A . 453 LEU HD21 1 1 13 5990 1 1 21 LEU HD22 H 4.622 -9.804 -7.376 1.00 . A A . 453 LEU HD22 1 1 13 5991 1 1 21 LEU HD23 H 5.849 -8.538 -7.433 1.00 . A A . 453 LEU HD23 1 1 13 5992 1 1 21 LEU HG H 4.804 -7.444 -5.510 1.00 . A A . 453 LEU HG 1 1 13 5993 1 1 21 LEU N N 3.288 -9.192 -2.819 1.00 . A A . 453 LEU N 1 1 13 5994 1 1 21 LEU O O 0.485 -8.939 -4.498 1.00 . A A . 453 LEU O 1 1 13 5995 1 1 22 GLU C C -1.017 -5.926 -2.403 1.00 . A A . 454 GLU C 1 1 13 5996 1 1 22 GLU CA C -0.652 -7.398 -2.478 1.00 . A A . 454 GLU CA 1 1 13 5997 1 1 22 GLU CB C -0.967 -8.064 -1.136 1.00 . A A . 454 GLU CB 1 1 13 5998 1 1 22 GLU CD C -2.849 -8.243 0.550 1.00 . A A . 454 GLU CD 1 1 13 5999 1 1 22 GLU CG C -2.452 -8.286 -0.910 1.00 . A A . 454 GLU CG 1 1 13 6000 1 1 22 GLU H H 1.404 -7.008 -2.239 1.00 . A A . 454 GLU H 1 1 13 6001 1 1 22 GLU HA H -1.215 -7.874 -3.266 1.00 . A A . 454 GLU HA 1 1 13 6002 1 1 22 GLU HB2 H -0.470 -9.023 -1.097 1.00 . A A . 454 GLU HB2 1 1 13 6003 1 1 22 GLU HB3 H -0.593 -7.440 -0.338 1.00 . A A . 454 GLU HB3 1 1 13 6004 1 1 22 GLU HG2 H -3.004 -7.525 -1.439 1.00 . A A . 454 GLU HG2 1 1 13 6005 1 1 22 GLU HG3 H -2.713 -9.257 -1.303 1.00 . A A . 454 GLU HG3 1 1 13 6006 1 1 22 GLU N N 0.765 -7.521 -2.775 1.00 . A A . 454 GLU N 1 1 13 6007 1 1 22 GLU O O -0.277 -5.137 -1.823 1.00 . A A . 454 GLU O 1 1 13 6008 1 1 22 GLU OE1 O -2.518 -9.190 1.294 1.00 . A A . 454 GLU OE1 1 1 13 6009 1 1 22 GLU OE2 O -3.521 -7.267 0.955 1.00 . A A . 454 GLU OE2 1 1 13 6010 1 1 23 SER C C -3.603 -4.028 -1.743 1.00 . A A . 455 SER C 1 1 13 6011 1 1 23 SER CA C -2.594 -4.176 -2.876 1.00 . A A . 455 SER CA 1 1 13 6012 1 1 23 SER CB C -3.196 -3.709 -4.199 1.00 . A A . 455 SER CB 1 1 13 6013 1 1 23 SER H H -2.697 -6.212 -3.446 1.00 . A A . 455 SER H 1 1 13 6014 1 1 23 SER HA H -1.730 -3.565 -2.650 1.00 . A A . 455 SER HA 1 1 13 6015 1 1 23 SER HB2 H -4.066 -4.301 -4.426 1.00 . A A . 455 SER HB2 1 1 13 6016 1 1 23 SER HB3 H -3.480 -2.670 -4.114 1.00 . A A . 455 SER HB3 1 1 13 6017 1 1 23 SER HG H -2.614 -3.383 -6.045 1.00 . A A . 455 SER HG 1 1 13 6018 1 1 23 SER N N -2.144 -5.550 -2.970 1.00 . A A . 455 SER N 1 1 13 6019 1 1 23 SER O O -4.762 -4.423 -1.870 1.00 . A A . 455 SER O 1 1 13 6020 1 1 23 SER OG O -2.268 -3.840 -5.263 1.00 . A A . 455 SER OG 1 1 13 6021 1 1 24 THR C C -4.484 -1.872 0.608 1.00 . A A . 456 THR C 1 1 13 6022 1 1 24 THR CA C -3.984 -3.316 0.543 1.00 . A A . 456 THR CA 1 1 13 6023 1 1 24 THR CB C -3.198 -3.658 1.824 1.00 . A A . 456 THR CB 1 1 13 6024 1 1 24 THR CG2 C -4.134 -3.825 3.008 1.00 . A A . 456 THR CG2 1 1 13 6025 1 1 24 THR H H -2.203 -3.214 -0.578 1.00 . A A . 456 THR H 1 1 13 6026 1 1 24 THR HA H -4.828 -3.986 0.462 1.00 . A A . 456 THR HA 1 1 13 6027 1 1 24 THR HB H -2.513 -2.849 2.036 1.00 . A A . 456 THR HB 1 1 13 6028 1 1 24 THR HG1 H -3.040 -5.593 1.383 1.00 . A A . 456 THR HG1 1 1 13 6029 1 1 24 THR HG21 H -4.589 -2.874 3.243 1.00 . A A . 456 THR HG21 1 1 13 6030 1 1 24 THR HG22 H -3.575 -4.178 3.862 1.00 . A A . 456 THR HG22 1 1 13 6031 1 1 24 THR HG23 H -4.904 -4.540 2.761 1.00 . A A . 456 THR HG23 1 1 13 6032 1 1 24 THR N N -3.143 -3.497 -0.626 1.00 . A A . 456 THR N 1 1 13 6033 1 1 24 THR O O -3.703 -0.942 0.795 1.00 . A A . 456 THR O 1 1 13 6034 1 1 24 THR OG1 O -2.444 -4.868 1.631 1.00 . A A . 456 THR OG1 1 1 13 6035 1 1 25 TRP C C -7.127 0.020 1.609 1.00 . A A . 457 TRP C 1 1 13 6036 1 1 25 TRP CA C -6.337 -0.332 0.352 1.00 . A A . 457 TRP CA 1 1 13 6037 1 1 25 TRP CB C -7.177 -0.188 -0.924 1.00 . A A . 457 TRP CB 1 1 13 6038 1 1 25 TRP CD1 C -5.651 -1.356 -2.614 1.00 . A A . 457 TRP CD1 1 1 13 6039 1 1 25 TRP CD2 C -6.010 0.807 -3.057 1.00 . A A . 457 TRP CD2 1 1 13 6040 1 1 25 TRP CE2 C -5.126 0.286 -4.023 1.00 . A A . 457 TRP CE2 1 1 13 6041 1 1 25 TRP CE3 C -6.383 2.152 -3.145 1.00 . A A . 457 TRP CE3 1 1 13 6042 1 1 25 TRP CG C -6.317 -0.259 -2.151 1.00 . A A . 457 TRP CG 1 1 13 6043 1 1 25 TRP CH2 C -4.989 2.369 -5.119 1.00 . A A . 457 TRP CH2 1 1 13 6044 1 1 25 TRP CZ2 C -4.608 1.057 -5.055 1.00 . A A . 457 TRP CZ2 1 1 13 6045 1 1 25 TRP CZ3 C -5.873 2.917 -4.180 1.00 . A A . 457 TRP CZ3 1 1 13 6046 1 1 25 TRP H H -6.387 -2.453 0.349 1.00 . A A . 457 TRP H 1 1 13 6047 1 1 25 TRP HA H -5.501 0.349 0.286 1.00 . A A . 457 TRP HA 1 1 13 6048 1 1 25 TRP HB2 H -7.904 -0.986 -0.971 1.00 . A A . 457 TRP HB2 1 1 13 6049 1 1 25 TRP HB3 H -7.684 0.765 -0.920 1.00 . A A . 457 TRP HB3 1 1 13 6050 1 1 25 TRP HD1 H -5.685 -2.329 -2.149 1.00 . A A . 457 TRP HD1 1 1 13 6051 1 1 25 TRP HE1 H -4.351 -1.645 -4.235 1.00 . A A . 457 TRP HE1 1 1 13 6052 1 1 25 TRP HE3 H -7.062 2.592 -2.429 1.00 . A A . 457 TRP HE3 1 1 13 6053 1 1 25 TRP HH2 H -4.615 3.004 -5.909 1.00 . A A . 457 TRP HH2 1 1 13 6054 1 1 25 TRP HZ2 H -3.909 0.650 -5.771 1.00 . A A . 457 TRP HZ2 1 1 13 6055 1 1 25 TRP HZ3 H -6.152 3.955 -4.268 1.00 . A A . 457 TRP HZ3 1 1 13 6056 1 1 25 TRP N N -5.785 -1.679 0.430 1.00 . A A . 457 TRP N 1 1 13 6057 1 1 25 TRP NE1 N -4.922 -1.031 -3.728 1.00 . A A . 457 TRP NE1 1 1 13 6058 1 1 25 TRP O O -7.597 1.147 1.770 1.00 . A A . 457 TRP O 1 1 13 6059 1 1 26 GLU C C -6.747 -1.078 4.863 1.00 . A A . 458 GLU C 1 1 13 6060 1 1 26 GLU CA C -7.805 -0.720 3.823 1.00 . A A . 458 GLU CA 1 1 13 6061 1 1 26 GLU CB C -9.073 -1.555 4.021 1.00 . A A . 458 GLU CB 1 1 13 6062 1 1 26 GLU CD C -10.297 0.300 5.217 1.00 . A A . 458 GLU CD 1 1 13 6063 1 1 26 GLU CG C -9.875 -1.157 5.250 1.00 . A A . 458 GLU CG 1 1 13 6064 1 1 26 GLU H H -6.942 -1.851 2.267 1.00 . A A . 458 GLU H 1 1 13 6065 1 1 26 GLU HA H -8.045 0.330 3.911 1.00 . A A . 458 GLU HA 1 1 13 6066 1 1 26 GLU HB2 H -9.706 -1.440 3.153 1.00 . A A . 458 GLU HB2 1 1 13 6067 1 1 26 GLU HB3 H -8.794 -2.593 4.119 1.00 . A A . 458 GLU HB3 1 1 13 6068 1 1 26 GLU HG2 H -10.762 -1.771 5.301 1.00 . A A . 458 GLU HG2 1 1 13 6069 1 1 26 GLU HG3 H -9.271 -1.322 6.131 1.00 . A A . 458 GLU HG3 1 1 13 6070 1 1 26 GLU N N -7.245 -0.950 2.502 1.00 . A A . 458 GLU N 1 1 13 6071 1 1 26 GLU O O -6.147 -2.147 4.787 1.00 . A A . 458 GLU O 1 1 13 6072 1 1 26 GLU OE1 O -9.497 1.168 5.628 1.00 . A A . 458 GLU OE1 1 1 13 6073 1 1 26 GLU OE2 O -11.427 0.589 4.777 1.00 . A A . 458 GLU OE2 1 1 13 6074 1 1 27 LYS C C -5.489 -1.577 7.631 1.00 . A A . 459 LYS C 1 1 13 6075 1 1 27 LYS CA C -5.404 -0.333 6.754 1.00 . A A . 459 LYS CA 1 1 13 6076 1 1 27 LYS CB C -5.274 0.884 7.662 1.00 . A A . 459 LYS CB 1 1 13 6077 1 1 27 LYS CD C -3.703 2.808 8.113 1.00 . A A . 459 LYS CD 1 1 13 6078 1 1 27 LYS CE C -2.633 2.004 8.854 1.00 . A A . 459 LYS CE 1 1 13 6079 1 1 27 LYS CG C -4.431 1.983 7.058 1.00 . A A . 459 LYS CG 1 1 13 6080 1 1 27 LYS H H -7.134 0.573 5.921 1.00 . A A . 459 LYS H 1 1 13 6081 1 1 27 LYS HA H -4.508 -0.394 6.158 1.00 . A A . 459 LYS HA 1 1 13 6082 1 1 27 LYS HB2 H -6.259 1.280 7.862 1.00 . A A . 459 LYS HB2 1 1 13 6083 1 1 27 LYS HB3 H -4.819 0.580 8.593 1.00 . A A . 459 LYS HB3 1 1 13 6084 1 1 27 LYS HD2 H -3.221 3.641 7.620 1.00 . A A . 459 LYS HD2 1 1 13 6085 1 1 27 LYS HD3 H -4.424 3.179 8.827 1.00 . A A . 459 LYS HD3 1 1 13 6086 1 1 27 LYS HE2 H -2.052 1.458 8.125 1.00 . A A . 459 LYS HE2 1 1 13 6087 1 1 27 LYS HE3 H -1.988 2.695 9.375 1.00 . A A . 459 LYS HE3 1 1 13 6088 1 1 27 LYS HG2 H -3.699 1.537 6.402 1.00 . A A . 459 LYS HG2 1 1 13 6089 1 1 27 LYS HG3 H -5.074 2.636 6.485 1.00 . A A . 459 LYS HG3 1 1 13 6090 1 1 27 LYS HZ1 H -2.431 0.591 10.386 1.00 . A A . 459 LYS HZ1 1 1 13 6091 1 1 27 LYS HZ2 H -3.732 0.287 9.349 1.00 . A A . 459 LYS HZ2 1 1 13 6092 1 1 27 LYS HZ3 H -3.838 1.527 10.501 1.00 . A A . 459 LYS HZ3 1 1 13 6093 1 1 27 LYS N N -6.524 -0.189 5.824 1.00 . A A . 459 LYS N 1 1 13 6094 1 1 27 LYS NZ N -3.199 1.035 9.837 1.00 . A A . 459 LYS NZ 1 1 13 6095 1 1 27 LYS O O -6.494 -1.804 8.307 1.00 . A A . 459 LYS O 1 1 13 6096 1 1 28 PRO C C -4.246 -2.833 10.048 1.00 . A A . 460 PRO C 1 1 13 6097 1 1 28 PRO CA C -4.217 -3.426 8.643 1.00 . A A . 460 PRO CA 1 1 13 6098 1 1 28 PRO CB C -2.823 -3.977 8.334 1.00 . A A . 460 PRO CB 1 1 13 6099 1 1 28 PRO CD C -3.346 -2.396 6.616 1.00 . A A . 460 PRO CD 1 1 13 6100 1 1 28 PRO CG C -2.589 -3.661 6.902 1.00 . A A . 460 PRO CG 1 1 13 6101 1 1 28 PRO HA H -4.952 -4.213 8.564 1.00 . A A . 460 PRO HA 1 1 13 6102 1 1 28 PRO HB2 H -2.096 -3.490 8.968 1.00 . A A . 460 PRO HB2 1 1 13 6103 1 1 28 PRO HB3 H -2.807 -5.042 8.512 1.00 . A A . 460 PRO HB3 1 1 13 6104 1 1 28 PRO HD2 H -2.703 -1.535 6.732 1.00 . A A . 460 PRO HD2 1 1 13 6105 1 1 28 PRO HD3 H -3.758 -2.433 5.618 1.00 . A A . 460 PRO HD3 1 1 13 6106 1 1 28 PRO HG2 H -1.535 -3.512 6.729 1.00 . A A . 460 PRO HG2 1 1 13 6107 1 1 28 PRO HG3 H -2.961 -4.466 6.285 1.00 . A A . 460 PRO HG3 1 1 13 6108 1 1 28 PRO N N -4.419 -2.391 7.630 1.00 . A A . 460 PRO N 1 1 13 6109 1 1 28 PRO O O -3.575 -1.798 10.271 1.00 . A A . 460 PRO O 1 1 13 6110 1 1 28 PRO OXT O -4.927 -3.403 10.925 1.00 . A A . 460 PRO OXT 1 1 14 6111 1 1 1 SER C C 7.765 -2.013 5.533 1.00 . A A . 433 SER C 1 1 14 6112 1 1 1 SER CA C 8.241 -1.126 6.681 1.00 . A A . 433 SER CA 1 1 14 6113 1 1 1 SER CB C 9.752 -1.277 6.863 1.00 . A A . 433 SER CB 1 1 14 6114 1 1 1 SER H1 H 7.723 -2.451 8.209 1.00 . A A . 433 SER H1 1 1 14 6115 1 1 1 SER H2 H 6.517 -1.315 7.837 1.00 . A A . 433 SER H2 1 1 14 6116 1 1 1 SER H3 H 7.883 -0.840 8.716 1.00 . A A . 433 SER H3 1 1 14 6117 1 1 1 SER HA H 8.021 -0.098 6.435 1.00 . A A . 433 SER HA 1 1 14 6118 1 1 1 SER HB2 H 9.978 -2.284 7.184 1.00 . A A . 433 SER HB2 1 1 14 6119 1 1 1 SER HB3 H 10.249 -1.079 5.924 1.00 . A A . 433 SER HB3 1 1 14 6120 1 1 1 SER HG H 10.527 0.449 7.393 1.00 . A A . 433 SER HG 1 1 14 6121 1 1 1 SER N N 7.543 -1.456 7.946 1.00 . A A . 433 SER N 1 1 14 6122 1 1 1 SER O O 8.179 -1.833 4.389 1.00 . A A . 433 SER O 1 1 14 6123 1 1 1 SER OG O 10.237 -0.367 7.835 1.00 . A A . 433 SER OG 1 1 14 6124 1 1 2 GLU C C 5.261 -3.251 4.016 1.00 . A A . 434 GLU C 1 1 14 6125 1 1 2 GLU CA C 6.392 -3.885 4.820 1.00 . A A . 434 GLU CA 1 1 14 6126 1 1 2 GLU CB C 5.907 -5.174 5.481 1.00 . A A . 434 GLU CB 1 1 14 6127 1 1 2 GLU CD C 4.496 -6.119 7.347 1.00 . A A . 434 GLU CD 1 1 14 6128 1 1 2 GLU CG C 4.726 -4.958 6.412 1.00 . A A . 434 GLU CG 1 1 14 6129 1 1 2 GLU H H 6.563 -3.049 6.754 1.00 . A A . 434 GLU H 1 1 14 6130 1 1 2 GLU HA H 7.210 -4.116 4.152 1.00 . A A . 434 GLU HA 1 1 14 6131 1 1 2 GLU HB2 H 5.613 -5.873 4.711 1.00 . A A . 434 GLU HB2 1 1 14 6132 1 1 2 GLU HB3 H 6.717 -5.600 6.054 1.00 . A A . 434 GLU HB3 1 1 14 6133 1 1 2 GLU HG2 H 4.908 -4.074 7.005 1.00 . A A . 434 GLU HG2 1 1 14 6134 1 1 2 GLU HG3 H 3.836 -4.812 5.815 1.00 . A A . 434 GLU HG3 1 1 14 6135 1 1 2 GLU N N 6.886 -2.962 5.833 1.00 . A A . 434 GLU N 1 1 14 6136 1 1 2 GLU O O 4.903 -3.731 2.938 1.00 . A A . 434 GLU O 1 1 14 6137 1 1 2 GLU OE1 O 3.830 -7.089 6.944 1.00 . A A . 434 GLU OE1 1 1 14 6138 1 1 2 GLU OE2 O 4.980 -6.055 8.494 1.00 . A A . 434 GLU OE2 1 1 14 6139 1 1 3 TRP C C 4.076 -0.245 3.192 1.00 . A A . 435 TRP C 1 1 14 6140 1 1 3 TRP CA C 3.589 -1.495 3.922 1.00 . A A . 435 TRP CA 1 1 14 6141 1 1 3 TRP CB C 2.532 -1.097 4.961 1.00 . A A . 435 TRP CB 1 1 14 6142 1 1 3 TRP CD1 C 1.732 -2.364 7.044 1.00 . A A . 435 TRP CD1 1 1 14 6143 1 1 3 TRP CD2 C 1.471 -3.491 5.126 1.00 . A A . 435 TRP CD2 1 1 14 6144 1 1 3 TRP CE2 C 0.994 -4.289 6.183 1.00 . A A . 435 TRP CE2 1 1 14 6145 1 1 3 TRP CE3 C 1.411 -3.994 3.825 1.00 . A A . 435 TRP CE3 1 1 14 6146 1 1 3 TRP CG C 1.935 -2.262 5.695 1.00 . A A . 435 TRP CG 1 1 14 6147 1 1 3 TRP CH2 C 0.422 -6.026 4.691 1.00 . A A . 435 TRP CH2 1 1 14 6148 1 1 3 TRP CZ2 C 0.465 -5.561 5.976 1.00 . A A . 435 TRP CZ2 1 1 14 6149 1 1 3 TRP CZ3 C 0.889 -5.254 3.623 1.00 . A A . 435 TRP CZ3 1 1 14 6150 1 1 3 TRP H H 5.037 -1.839 5.415 1.00 . A A . 435 TRP H 1 1 14 6151 1 1 3 TRP HA H 3.143 -2.178 3.215 1.00 . A A . 435 TRP HA 1 1 14 6152 1 1 3 TRP HB2 H 2.987 -0.445 5.691 1.00 . A A . 435 TRP HB2 1 1 14 6153 1 1 3 TRP HB3 H 1.731 -0.568 4.464 1.00 . A A . 435 TRP HB3 1 1 14 6154 1 1 3 TRP HD1 H 1.982 -1.593 7.757 1.00 . A A . 435 TRP HD1 1 1 14 6155 1 1 3 TRP HE1 H 0.917 -3.890 8.242 1.00 . A A . 435 TRP HE1 1 1 14 6156 1 1 3 TRP HE3 H 1.766 -3.415 2.985 1.00 . A A . 435 TRP HE3 1 1 14 6157 1 1 3 TRP HH2 H 0.021 -7.009 4.483 1.00 . A A . 435 TRP HH2 1 1 14 6158 1 1 3 TRP HZ2 H 0.099 -6.167 6.792 1.00 . A A . 435 TRP HZ2 1 1 14 6159 1 1 3 TRP HZ3 H 0.844 -5.664 2.622 1.00 . A A . 435 TRP HZ3 1 1 14 6160 1 1 3 TRP N N 4.697 -2.178 4.560 1.00 . A A . 435 TRP N 1 1 14 6161 1 1 3 TRP NE1 N 1.162 -3.579 7.344 1.00 . A A . 435 TRP NE1 1 1 14 6162 1 1 3 TRP O O 4.668 0.645 3.807 1.00 . A A . 435 TRP O 1 1 14 6163 1 1 4 THR C C 2.869 1.902 1.133 1.00 . A A . 436 THR C 1 1 14 6164 1 1 4 THR CA C 4.112 1.028 1.135 1.00 . A A . 436 THR CA 1 1 14 6165 1 1 4 THR CB C 4.530 0.714 -0.316 1.00 . A A . 436 THR CB 1 1 14 6166 1 1 4 THR CG2 C 4.711 1.995 -1.128 1.00 . A A . 436 THR CG2 1 1 14 6167 1 1 4 THR H H 3.486 -0.961 1.411 1.00 . A A . 436 THR H 1 1 14 6168 1 1 4 THR HA H 4.919 1.559 1.621 1.00 . A A . 436 THR HA 1 1 14 6169 1 1 4 THR HB H 3.750 0.122 -0.777 1.00 . A A . 436 THR HB 1 1 14 6170 1 1 4 THR HG1 H 5.943 -0.318 0.589 1.00 . A A . 436 THR HG1 1 1 14 6171 1 1 4 THR HG21 H 5.469 2.611 -0.667 1.00 . A A . 436 THR HG21 1 1 14 6172 1 1 4 THR HG22 H 3.773 2.540 -1.161 1.00 . A A . 436 THR HG22 1 1 14 6173 1 1 4 THR HG23 H 5.012 1.744 -2.133 1.00 . A A . 436 THR HG23 1 1 14 6174 1 1 4 THR N N 3.846 -0.179 1.887 1.00 . A A . 436 THR N 1 1 14 6175 1 1 4 THR O O 1.988 1.752 0.283 1.00 . A A . 436 THR O 1 1 14 6176 1 1 4 THR OG1 O 5.749 -0.045 -0.312 1.00 . A A . 436 THR OG1 1 1 14 6177 1 1 5 GLU C C 1.978 4.958 1.458 1.00 . A A . 437 GLU C 1 1 14 6178 1 1 5 GLU CA C 1.652 3.684 2.216 1.00 . A A . 437 GLU CA 1 1 14 6179 1 1 5 GLU CB C 1.307 3.977 3.681 1.00 . A A . 437 GLU CB 1 1 14 6180 1 1 5 GLU CD C 0.609 2.987 5.908 1.00 . A A . 437 GLU CD 1 1 14 6181 1 1 5 GLU CG C 1.160 2.715 4.525 1.00 . A A . 437 GLU CG 1 1 14 6182 1 1 5 GLU H H 3.483 2.814 2.798 1.00 . A A . 437 GLU H 1 1 14 6183 1 1 5 GLU HA H 0.807 3.207 1.744 1.00 . A A . 437 GLU HA 1 1 14 6184 1 1 5 GLU HB2 H 2.090 4.584 4.114 1.00 . A A . 437 GLU HB2 1 1 14 6185 1 1 5 GLU HB3 H 0.375 4.520 3.721 1.00 . A A . 437 GLU HB3 1 1 14 6186 1 1 5 GLU HG2 H 0.496 2.033 4.018 1.00 . A A . 437 GLU HG2 1 1 14 6187 1 1 5 GLU HG3 H 2.133 2.254 4.627 1.00 . A A . 437 GLU HG3 1 1 14 6188 1 1 5 GLU N N 2.777 2.777 2.121 1.00 . A A . 437 GLU N 1 1 14 6189 1 1 5 GLU O O 2.659 5.853 1.969 1.00 . A A . 437 GLU O 1 1 14 6190 1 1 5 GLU OE1 O -0.606 3.259 6.026 1.00 . A A . 437 GLU OE1 1 1 14 6191 1 1 5 GLU OE2 O 1.383 2.912 6.885 1.00 . A A . 437 GLU OE2 1 1 14 6192 1 1 6 ARG C C 0.657 6.723 -1.290 1.00 . A A . 438 ARG C 1 1 14 6193 1 1 6 ARG CA C 1.908 6.078 -0.690 1.00 . A A . 438 ARG CA 1 1 14 6194 1 1 6 ARG CB C 2.791 5.515 -1.809 1.00 . A A . 438 ARG CB 1 1 14 6195 1 1 6 ARG CD C 3.933 5.896 -4.011 1.00 . A A . 438 ARG CD 1 1 14 6196 1 1 6 ARG CG C 3.188 6.540 -2.857 1.00 . A A . 438 ARG CG 1 1 14 6197 1 1 6 ARG CZ C 5.575 4.057 -3.949 1.00 . A A . 438 ARG CZ 1 1 14 6198 1 1 6 ARG H H 0.930 4.299 -0.111 1.00 . A A . 438 ARG H 1 1 14 6199 1 1 6 ARG HA H 2.471 6.800 -0.121 1.00 . A A . 438 ARG HA 1 1 14 6200 1 1 6 ARG HB2 H 3.693 5.115 -1.372 1.00 . A A . 438 ARG HB2 1 1 14 6201 1 1 6 ARG HB3 H 2.259 4.715 -2.305 1.00 . A A . 438 ARG HB3 1 1 14 6202 1 1 6 ARG HD2 H 3.300 5.140 -4.452 1.00 . A A . 438 ARG HD2 1 1 14 6203 1 1 6 ARG HD3 H 4.153 6.655 -4.747 1.00 . A A . 438 ARG HD3 1 1 14 6204 1 1 6 ARG HE H 5.767 5.805 -2.980 1.00 . A A . 438 ARG HE 1 1 14 6205 1 1 6 ARG HG2 H 2.298 7.018 -3.239 1.00 . A A . 438 ARG HG2 1 1 14 6206 1 1 6 ARG HG3 H 3.826 7.280 -2.396 1.00 . A A . 438 ARG HG3 1 1 14 6207 1 1 6 ARG HH11 H 3.924 3.673 -5.071 1.00 . A A . 438 ARG HH11 1 1 14 6208 1 1 6 ARG HH12 H 5.116 2.401 -5.037 1.00 . A A . 438 ARG HH12 1 1 14 6209 1 1 6 ARG HH21 H 7.305 4.119 -2.891 1.00 . A A . 438 ARG HH21 1 1 14 6210 1 1 6 ARG HH22 H 7.024 2.646 -3.777 1.00 . A A . 438 ARG HH22 1 1 14 6211 1 1 6 ARG N N 1.536 5.005 0.212 1.00 . A A . 438 ARG N 1 1 14 6212 1 1 6 ARG NE N 5.182 5.275 -3.579 1.00 . A A . 438 ARG NE 1 1 14 6213 1 1 6 ARG NH1 N 4.809 3.320 -4.746 1.00 . A A . 438 ARG NH1 1 1 14 6214 1 1 6 ARG NH2 N 6.728 3.570 -3.508 1.00 . A A . 438 ARG NH2 1 1 14 6215 1 1 6 ARG O O -0.353 6.044 -1.482 1.00 . A A . 438 ARG O 1 1 14 6216 1 1 7 LYS C C -0.237 8.676 -3.757 1.00 . A A . 439 LYS C 1 1 14 6217 1 1 7 LYS CA C -0.407 8.670 -2.248 1.00 . A A . 439 LYS CA 1 1 14 6218 1 1 7 LYS CB C -0.566 10.101 -1.738 1.00 . A A . 439 LYS CB 1 1 14 6219 1 1 7 LYS CD C -1.314 11.614 0.120 1.00 . A A . 439 LYS CD 1 1 14 6220 1 1 7 LYS CE C -2.480 12.131 -0.707 1.00 . A A . 439 LYS CE 1 1 14 6221 1 1 7 LYS CG C -0.955 10.190 -0.270 1.00 . A A . 439 LYS CG 1 1 14 6222 1 1 7 LYS H H 1.532 8.537 -1.443 1.00 . A A . 439 LYS H 1 1 14 6223 1 1 7 LYS HA H -1.294 8.112 -2.006 1.00 . A A . 439 LYS HA 1 1 14 6224 1 1 7 LYS HB2 H 0.368 10.625 -1.872 1.00 . A A . 439 LYS HB2 1 1 14 6225 1 1 7 LYS HB3 H -1.331 10.593 -2.320 1.00 . A A . 439 LYS HB3 1 1 14 6226 1 1 7 LYS HD2 H -1.587 11.633 1.164 1.00 . A A . 439 LYS HD2 1 1 14 6227 1 1 7 LYS HD3 H -0.457 12.251 -0.043 1.00 . A A . 439 LYS HD3 1 1 14 6228 1 1 7 LYS HE2 H -2.225 12.050 -1.752 1.00 . A A . 439 LYS HE2 1 1 14 6229 1 1 7 LYS HE3 H -3.349 11.522 -0.500 1.00 . A A . 439 LYS HE3 1 1 14 6230 1 1 7 LYS HG2 H -1.810 9.554 -0.095 1.00 . A A . 439 LYS HG2 1 1 14 6231 1 1 7 LYS HG3 H -0.126 9.857 0.335 1.00 . A A . 439 LYS HG3 1 1 14 6232 1 1 7 LYS HZ1 H -3.544 13.894 -1.039 1.00 . A A . 439 LYS HZ1 1 1 14 6233 1 1 7 LYS HZ2 H -1.949 14.143 -0.517 1.00 . A A . 439 LYS HZ2 1 1 14 6234 1 1 7 LYS HZ3 H -3.133 13.635 0.586 1.00 . A A . 439 LYS HZ3 1 1 14 6235 1 1 7 LYS N N 0.714 8.013 -1.615 1.00 . A A . 439 LYS N 1 1 14 6236 1 1 7 LYS NZ N -2.798 13.547 -0.397 1.00 . A A . 439 LYS NZ 1 1 14 6237 1 1 7 LYS O O 0.775 9.146 -4.282 1.00 . A A . 439 LYS O 1 1 14 6238 1 1 8 THR C C -1.976 9.512 -6.314 1.00 . A A . 440 THR C 1 1 14 6239 1 1 8 THR CA C -1.266 8.224 -5.893 1.00 . A A . 440 THR CA 1 1 14 6240 1 1 8 THR CB C -1.971 6.989 -6.506 1.00 . A A . 440 THR CB 1 1 14 6241 1 1 8 THR CG2 C -3.435 6.920 -6.091 1.00 . A A . 440 THR CG2 1 1 14 6242 1 1 8 THR H H -1.952 7.692 -3.963 1.00 . A A . 440 THR H 1 1 14 6243 1 1 8 THR HA H -0.246 8.252 -6.251 1.00 . A A . 440 THR HA 1 1 14 6244 1 1 8 THR HB H -1.473 6.101 -6.145 1.00 . A A . 440 THR HB 1 1 14 6245 1 1 8 THR HG1 H -1.964 6.112 -8.283 1.00 . A A . 440 THR HG1 1 1 14 6246 1 1 8 THR HG21 H -3.898 6.055 -6.544 1.00 . A A . 440 THR HG21 1 1 14 6247 1 1 8 THR HG22 H -3.945 7.814 -6.420 1.00 . A A . 440 THR HG22 1 1 14 6248 1 1 8 THR HG23 H -3.503 6.843 -5.016 1.00 . A A . 440 THR HG23 1 1 14 6249 1 1 8 THR N N -1.231 8.158 -4.446 1.00 . A A . 440 THR N 1 1 14 6250 1 1 8 THR O O -2.840 10.014 -5.585 1.00 . A A . 440 THR O 1 1 14 6251 1 1 8 THR OG1 O -1.885 7.019 -7.937 1.00 . A A . 440 THR OG1 1 1 14 6252 1 1 9 ALA C C -3.555 11.462 -8.081 1.00 . A A . 441 ALA C 1 1 14 6253 1 1 9 ALA CA C -2.039 11.369 -7.925 1.00 . A A . 441 ALA CA 1 1 14 6254 1 1 9 ALA CB C -1.354 11.733 -9.234 1.00 . A A . 441 ALA CB 1 1 14 6255 1 1 9 ALA H H -0.976 9.537 -8.050 1.00 . A A . 441 ALA H 1 1 14 6256 1 1 9 ALA HA H -1.727 12.089 -7.183 1.00 . A A . 441 ALA HA 1 1 14 6257 1 1 9 ALA HB1 H -1.681 11.060 -10.012 1.00 . A A . 441 ALA HB1 1 1 14 6258 1 1 9 ALA HB2 H -0.284 11.654 -9.114 1.00 . A A . 441 ALA HB2 1 1 14 6259 1 1 9 ALA HB3 H -1.612 12.747 -9.506 1.00 . A A . 441 ALA HB3 1 1 14 6260 1 1 9 ALA N N -1.591 10.050 -7.472 1.00 . A A . 441 ALA N 1 1 14 6261 1 1 9 ALA O O -4.099 12.552 -8.244 1.00 . A A . 441 ALA O 1 1 14 6262 1 1 10 ASP C C -6.269 10.827 -6.742 1.00 . A A . 442 ASP C 1 1 14 6263 1 1 10 ASP CA C -5.697 10.312 -8.064 1.00 . A A . 442 ASP CA 1 1 14 6264 1 1 10 ASP CB C -6.207 8.896 -8.346 1.00 . A A . 442 ASP CB 1 1 14 6265 1 1 10 ASP CG C -7.682 8.866 -8.703 1.00 . A A . 442 ASP CG 1 1 14 6266 1 1 10 ASP H H -3.752 9.479 -7.934 1.00 . A A . 442 ASP H 1 1 14 6267 1 1 10 ASP HA H -6.010 10.968 -8.863 1.00 . A A . 442 ASP HA 1 1 14 6268 1 1 10 ASP HB2 H -5.650 8.478 -9.172 1.00 . A A . 442 ASP HB2 1 1 14 6269 1 1 10 ASP HB3 H -6.055 8.284 -7.470 1.00 . A A . 442 ASP HB3 1 1 14 6270 1 1 10 ASP N N -4.239 10.326 -8.016 1.00 . A A . 442 ASP N 1 1 14 6271 1 1 10 ASP O O -7.470 11.064 -6.610 1.00 . A A . 442 ASP O 1 1 14 6272 1 1 10 ASP OD1 O -8.007 9.010 -9.902 1.00 . A A . 442 ASP OD1 1 1 14 6273 1 1 10 ASP OD2 O -8.520 8.706 -7.794 1.00 . A A . 442 ASP OD2 1 1 14 6274 1 1 11 GLY C C -6.166 10.362 -3.526 1.00 . A A . 443 GLY C 1 1 14 6275 1 1 11 GLY CA C -5.799 11.490 -4.465 1.00 . A A . 443 GLY CA 1 1 14 6276 1 1 11 GLY H H -4.440 10.807 -5.932 1.00 . A A . 443 GLY H 1 1 14 6277 1 1 11 GLY HA2 H -4.990 12.059 -4.031 1.00 . A A . 443 GLY HA2 1 1 14 6278 1 1 11 GLY HA3 H -6.656 12.137 -4.586 1.00 . A A . 443 GLY HA3 1 1 14 6279 1 1 11 GLY N N -5.388 11.006 -5.764 1.00 . A A . 443 GLY N 1 1 14 6280 1 1 11 GLY O O -6.978 10.540 -2.620 1.00 . A A . 443 GLY O 1 1 14 6281 1 1 12 LYS C C -4.565 7.526 -2.253 1.00 . A A . 444 LYS C 1 1 14 6282 1 1 12 LYS CA C -5.841 8.033 -2.906 1.00 . A A . 444 LYS CA 1 1 14 6283 1 1 12 LYS CB C -6.476 6.911 -3.734 1.00 . A A . 444 LYS CB 1 1 14 6284 1 1 12 LYS CD C -8.461 6.120 -5.055 1.00 . A A . 444 LYS CD 1 1 14 6285 1 1 12 LYS CE C -9.684 6.539 -5.859 1.00 . A A . 444 LYS CE 1 1 14 6286 1 1 12 LYS CG C -7.745 7.322 -4.459 1.00 . A A . 444 LYS CG 1 1 14 6287 1 1 12 LYS H H -4.896 9.130 -4.455 1.00 . A A . 444 LYS H 1 1 14 6288 1 1 12 LYS HA H -6.532 8.335 -2.130 1.00 . A A . 444 LYS HA 1 1 14 6289 1 1 12 LYS HB2 H -5.762 6.572 -4.468 1.00 . A A . 444 LYS HB2 1 1 14 6290 1 1 12 LYS HB3 H -6.715 6.088 -3.076 1.00 . A A . 444 LYS HB3 1 1 14 6291 1 1 12 LYS HD2 H -7.779 5.592 -5.705 1.00 . A A . 444 LYS HD2 1 1 14 6292 1 1 12 LYS HD3 H -8.775 5.467 -4.254 1.00 . A A . 444 LYS HD3 1 1 14 6293 1 1 12 LYS HE2 H -9.353 7.060 -6.744 1.00 . A A . 444 LYS HE2 1 1 14 6294 1 1 12 LYS HE3 H -10.230 5.653 -6.147 1.00 . A A . 444 LYS HE3 1 1 14 6295 1 1 12 LYS HG2 H -8.407 7.809 -3.760 1.00 . A A . 444 LYS HG2 1 1 14 6296 1 1 12 LYS HG3 H -7.489 8.007 -5.254 1.00 . A A . 444 LYS HG3 1 1 14 6297 1 1 12 LYS HZ1 H -10.157 8.378 -4.982 1.00 . A A . 444 LYS HZ1 1 1 14 6298 1 1 12 LYS HZ2 H -10.747 7.038 -4.127 1.00 . A A . 444 LYS HZ2 1 1 14 6299 1 1 12 LYS HZ3 H -11.505 7.526 -5.563 1.00 . A A . 444 LYS HZ3 1 1 14 6300 1 1 12 LYS N N -5.559 9.200 -3.735 1.00 . A A . 444 LYS N 1 1 14 6301 1 1 12 LYS NZ N -10.585 7.431 -5.081 1.00 . A A . 444 LYS NZ 1 1 14 6302 1 1 12 LYS O O -3.533 7.375 -2.915 1.00 . A A . 444 LYS O 1 1 14 6303 1 1 13 THR C C -3.576 5.182 -0.290 1.00 . A A . 445 THR C 1 1 14 6304 1 1 13 THR CA C -3.515 6.704 -0.239 1.00 . A A . 445 THR CA 1 1 14 6305 1 1 13 THR CB C -3.511 7.175 1.225 1.00 . A A . 445 THR CB 1 1 14 6306 1 1 13 THR CG2 C -2.133 6.995 1.843 1.00 . A A . 445 THR CG2 1 1 14 6307 1 1 13 THR H H -5.481 7.424 -0.483 1.00 . A A . 445 THR H 1 1 14 6308 1 1 13 THR HA H -2.608 7.042 -0.712 1.00 . A A . 445 THR HA 1 1 14 6309 1 1 13 THR HB H -4.221 6.582 1.784 1.00 . A A . 445 THR HB 1 1 14 6310 1 1 13 THR HG1 H -4.762 8.624 1.716 1.00 . A A . 445 THR HG1 1 1 14 6311 1 1 13 THR HG21 H -1.395 7.482 1.222 1.00 . A A . 445 THR HG21 1 1 14 6312 1 1 13 THR HG22 H -1.904 5.943 1.915 1.00 . A A . 445 THR HG22 1 1 14 6313 1 1 13 THR HG23 H -2.119 7.438 2.828 1.00 . A A . 445 THR HG23 1 1 14 6314 1 1 13 THR N N -4.641 7.256 -0.963 1.00 . A A . 445 THR N 1 1 14 6315 1 1 13 THR O O -4.358 4.563 0.432 1.00 . A A . 445 THR O 1 1 14 6316 1 1 13 THR OG1 O -3.892 8.558 1.297 1.00 . A A . 445 THR OG1 1 1 14 6317 1 1 14 TYR C C -1.725 2.449 -0.608 1.00 . A A . 446 TYR C 1 1 14 6318 1 1 14 TYR CA C -2.843 3.146 -1.365 1.00 . A A . 446 TYR CA 1 1 14 6319 1 1 14 TYR CB C -2.784 2.788 -2.857 1.00 . A A . 446 TYR CB 1 1 14 6320 1 1 14 TYR CD1 C -1.002 4.266 -3.885 1.00 . A A . 446 TYR CD1 1 1 14 6321 1 1 14 TYR CD2 C -0.658 1.907 -3.879 1.00 . A A . 446 TYR CD2 1 1 14 6322 1 1 14 TYR CE1 C 0.205 4.441 -4.536 1.00 . A A . 446 TYR CE1 1 1 14 6323 1 1 14 TYR CE2 C 0.548 2.075 -4.525 1.00 . A A . 446 TYR CE2 1 1 14 6324 1 1 14 TYR CG C -1.452 2.997 -3.543 1.00 . A A . 446 TYR CG 1 1 14 6325 1 1 14 TYR CZ C 0.975 3.343 -4.853 1.00 . A A . 446 TYR CZ 1 1 14 6326 1 1 14 TYR H H -2.114 5.108 -1.661 1.00 . A A . 446 TYR H 1 1 14 6327 1 1 14 TYR HA H -3.792 2.814 -0.968 1.00 . A A . 446 TYR HA 1 1 14 6328 1 1 14 TYR HB2 H -3.039 1.745 -2.969 1.00 . A A . 446 TYR HB2 1 1 14 6329 1 1 14 TYR HB3 H -3.519 3.379 -3.381 1.00 . A A . 446 TYR HB3 1 1 14 6330 1 1 14 TYR HD1 H -1.607 5.124 -3.632 1.00 . A A . 446 TYR HD1 1 1 14 6331 1 1 14 TYR HD2 H -0.995 0.914 -3.623 1.00 . A A . 446 TYR HD2 1 1 14 6332 1 1 14 TYR HE1 H 0.540 5.436 -4.793 1.00 . A A . 446 TYR HE1 1 1 14 6333 1 1 14 TYR HE2 H 1.148 1.213 -4.777 1.00 . A A . 446 TYR HE2 1 1 14 6334 1 1 14 TYR HH H 2.242 2.867 -6.227 1.00 . A A . 446 TYR HH 1 1 14 6335 1 1 14 TYR N N -2.778 4.580 -1.163 1.00 . A A . 446 TYR N 1 1 14 6336 1 1 14 TYR O O -0.586 2.921 -0.592 1.00 . A A . 446 TYR O 1 1 14 6337 1 1 14 TYR OH O 2.176 3.515 -5.503 1.00 . A A . 446 TYR OH 1 1 14 6338 1 1 15 TYR C C -0.626 -0.644 -0.034 1.00 . A A . 447 TYR C 1 1 14 6339 1 1 15 TYR CA C -1.065 0.581 0.764 1.00 . A A . 447 TYR CA 1 1 14 6340 1 1 15 TYR CB C -1.630 0.172 2.127 1.00 . A A . 447 TYR CB 1 1 14 6341 1 1 15 TYR CD1 C -2.151 2.493 2.999 1.00 . A A . 447 TYR CD1 1 1 14 6342 1 1 15 TYR CD2 C -3.889 0.864 3.015 1.00 . A A . 447 TYR CD2 1 1 14 6343 1 1 15 TYR CE1 C -3.011 3.425 3.538 1.00 . A A . 447 TYR CE1 1 1 14 6344 1 1 15 TYR CE2 C -4.757 1.792 3.555 1.00 . A A . 447 TYR CE2 1 1 14 6345 1 1 15 TYR CG C -2.573 1.198 2.726 1.00 . A A . 447 TYR CG 1 1 14 6346 1 1 15 TYR CZ C -4.313 3.071 3.816 1.00 . A A . 447 TYR CZ 1 1 14 6347 1 1 15 TYR H H -2.958 0.965 -0.062 1.00 . A A . 447 TYR H 1 1 14 6348 1 1 15 TYR HA H -0.214 1.228 0.916 1.00 . A A . 447 TYR HA 1 1 14 6349 1 1 15 TYR HB2 H -2.174 -0.754 2.023 1.00 . A A . 447 TYR HB2 1 1 14 6350 1 1 15 TYR HB3 H -0.814 0.029 2.821 1.00 . A A . 447 TYR HB3 1 1 14 6351 1 1 15 TYR HD1 H -1.135 2.772 2.775 1.00 . A A . 447 TYR HD1 1 1 14 6352 1 1 15 TYR HD2 H -4.232 -0.140 2.811 1.00 . A A . 447 TYR HD2 1 1 14 6353 1 1 15 TYR HE1 H -2.661 4.424 3.747 1.00 . A A . 447 TYR HE1 1 1 14 6354 1 1 15 TYR HE2 H -5.774 1.510 3.779 1.00 . A A . 447 TYR HE2 1 1 14 6355 1 1 15 TYR HH H -5.718 3.586 5.037 1.00 . A A . 447 TYR HH 1 1 14 6356 1 1 15 TYR N N -2.046 1.319 0.005 1.00 . A A . 447 TYR N 1 1 14 6357 1 1 15 TYR O O -1.320 -1.659 -0.083 1.00 . A A . 447 TYR O 1 1 14 6358 1 1 15 TYR OH O -5.177 4.004 4.350 1.00 . A A . 447 TYR OH 1 1 14 6359 1 1 16 TYR C C 1.937 -2.510 -0.642 1.00 . A A . 448 TYR C 1 1 14 6360 1 1 16 TYR CA C 1.031 -1.622 -1.494 1.00 . A A . 448 TYR CA 1 1 14 6361 1 1 16 TYR CB C 1.806 -1.063 -2.690 1.00 . A A . 448 TYR CB 1 1 14 6362 1 1 16 TYR CD1 C 1.395 -2.754 -4.518 1.00 . A A . 448 TYR CD1 1 1 14 6363 1 1 16 TYR CD2 C 3.633 -2.447 -3.754 1.00 . A A . 448 TYR CD2 1 1 14 6364 1 1 16 TYR CE1 C 1.829 -3.701 -5.422 1.00 . A A . 448 TYR CE1 1 1 14 6365 1 1 16 TYR CE2 C 4.075 -3.394 -4.656 1.00 . A A . 448 TYR CE2 1 1 14 6366 1 1 16 TYR CG C 2.288 -2.112 -3.668 1.00 . A A . 448 TYR CG 1 1 14 6367 1 1 16 TYR CZ C 3.168 -4.017 -5.488 1.00 . A A . 448 TYR CZ 1 1 14 6368 1 1 16 TYR H H 0.956 0.339 -0.722 1.00 . A A . 448 TYR H 1 1 14 6369 1 1 16 TYR HA H 0.197 -2.205 -1.854 1.00 . A A . 448 TYR HA 1 1 14 6370 1 1 16 TYR HB2 H 1.170 -0.382 -3.233 1.00 . A A . 448 TYR HB2 1 1 14 6371 1 1 16 TYR HB3 H 2.671 -0.525 -2.330 1.00 . A A . 448 TYR HB3 1 1 14 6372 1 1 16 TYR HD1 H 0.346 -2.505 -4.463 1.00 . A A . 448 TYR HD1 1 1 14 6373 1 1 16 TYR HD2 H 4.339 -1.957 -3.100 1.00 . A A . 448 TYR HD2 1 1 14 6374 1 1 16 TYR HE1 H 1.121 -4.189 -6.074 1.00 . A A . 448 TYR HE1 1 1 14 6375 1 1 16 TYR HE2 H 5.123 -3.644 -4.708 1.00 . A A . 448 TYR HE2 1 1 14 6376 1 1 16 TYR HH H 4.308 -5.474 -5.999 1.00 . A A . 448 TYR HH 1 1 14 6377 1 1 16 TYR N N 0.503 -0.526 -0.702 1.00 . A A . 448 TYR N 1 1 14 6378 1 1 16 TYR O O 2.815 -2.034 0.073 1.00 . A A . 448 TYR O 1 1 14 6379 1 1 16 TYR OH O 3.603 -4.956 -6.393 1.00 . A A . 448 TYR OH 1 1 14 6380 1 1 17 ASN C C 3.680 -5.255 -0.661 1.00 . A A . 449 ASN C 1 1 14 6381 1 1 17 ASN CA C 2.410 -4.805 0.046 1.00 . A A . 449 ASN CA 1 1 14 6382 1 1 17 ASN CB C 1.471 -5.999 0.264 1.00 . A A . 449 ASN CB 1 1 14 6383 1 1 17 ASN CG C 2.174 -7.250 0.760 1.00 . A A . 449 ASN CG 1 1 14 6384 1 1 17 ASN H H 1.041 -4.116 -1.398 1.00 . A A . 449 ASN H 1 1 14 6385 1 1 17 ASN HA H 2.662 -4.368 1.000 1.00 . A A . 449 ASN HA 1 1 14 6386 1 1 17 ASN HB2 H 0.722 -5.725 0.992 1.00 . A A . 449 ASN HB2 1 1 14 6387 1 1 17 ASN HB3 H 0.983 -6.232 -0.671 1.00 . A A . 449 ASN HB3 1 1 14 6388 1 1 17 ASN HD21 H 1.701 -6.816 2.634 1.00 . A A . 449 ASN HD21 1 1 14 6389 1 1 17 ASN HD22 H 2.577 -8.287 2.400 1.00 . A A . 449 ASN HD22 1 1 14 6390 1 1 17 ASN N N 1.714 -3.806 -0.749 1.00 . A A . 449 ASN N 1 1 14 6391 1 1 17 ASN ND2 N 2.157 -7.468 2.061 1.00 . A A . 449 ASN ND2 1 1 14 6392 1 1 17 ASN O O 3.642 -5.691 -1.811 1.00 . A A . 449 ASN O 1 1 14 6393 1 1 17 ASN OD1 O 2.703 -8.029 -0.027 1.00 . A A . 449 ASN OD1 1 1 14 6394 1 1 18 ASN C C 6.456 -6.941 -0.225 1.00 . A A . 450 ASN C 1 1 14 6395 1 1 18 ASN CA C 6.095 -5.492 -0.541 1.00 . A A . 450 ASN CA 1 1 14 6396 1 1 18 ASN CB C 7.172 -4.542 0.000 1.00 . A A . 450 ASN CB 1 1 14 6397 1 1 18 ASN CG C 8.508 -4.674 -0.716 1.00 . A A . 450 ASN CG 1 1 14 6398 1 1 18 ASN H H 4.758 -4.870 0.976 1.00 . A A . 450 ASN H 1 1 14 6399 1 1 18 ASN HA H 6.024 -5.374 -1.610 1.00 . A A . 450 ASN HA 1 1 14 6400 1 1 18 ASN HB2 H 6.829 -3.524 -0.113 1.00 . A A . 450 ASN HB2 1 1 14 6401 1 1 18 ASN HB3 H 7.326 -4.747 1.050 1.00 . A A . 450 ASN HB3 1 1 14 6402 1 1 18 ASN HD21 H 7.596 -5.058 -2.439 1.00 . A A . 450 ASN HD21 1 1 14 6403 1 1 18 ASN HD22 H 9.326 -5.052 -2.493 1.00 . A A . 450 ASN HD22 1 1 14 6404 1 1 18 ASN N N 4.801 -5.162 0.039 1.00 . A A . 450 ASN N 1 1 14 6405 1 1 18 ASN ND2 N 8.470 -4.954 -2.013 1.00 . A A . 450 ASN ND2 1 1 14 6406 1 1 18 ASN O O 7.460 -7.466 -0.699 1.00 . A A . 450 ASN O 1 1 14 6407 1 1 18 ASN OD1 O 9.567 -4.502 -0.112 1.00 . A A . 450 ASN OD1 1 1 14 6408 1 1 19 ARG C C 5.659 -9.936 -0.171 1.00 . A A . 451 ARG C 1 1 14 6409 1 1 19 ARG CA C 5.876 -8.962 0.986 1.00 . A A . 451 ARG CA 1 1 14 6410 1 1 19 ARG CB C 4.984 -9.366 2.162 1.00 . A A . 451 ARG CB 1 1 14 6411 1 1 19 ARG CD C 4.399 -9.024 4.587 1.00 . A A . 451 ARG CD 1 1 14 6412 1 1 19 ARG CG C 5.050 -8.419 3.349 1.00 . A A . 451 ARG CG 1 1 14 6413 1 1 19 ARG CZ C 2.068 -9.647 5.127 1.00 . A A . 451 ARG CZ 1 1 14 6414 1 1 19 ARG H H 4.807 -7.128 0.881 1.00 . A A . 451 ARG H 1 1 14 6415 1 1 19 ARG HA H 6.906 -9.015 1.297 1.00 . A A . 451 ARG HA 1 1 14 6416 1 1 19 ARG HB2 H 3.960 -9.409 1.822 1.00 . A A . 451 ARG HB2 1 1 14 6417 1 1 19 ARG HB3 H 5.280 -10.349 2.498 1.00 . A A . 451 ARG HB3 1 1 14 6418 1 1 19 ARG HD2 H 5.064 -9.771 4.997 1.00 . A A . 451 ARG HD2 1 1 14 6419 1 1 19 ARG HD3 H 4.250 -8.241 5.317 1.00 . A A . 451 ARG HD3 1 1 14 6420 1 1 19 ARG HE H 3.033 -10.152 3.445 1.00 . A A . 451 ARG HE 1 1 14 6421 1 1 19 ARG HG2 H 6.086 -8.203 3.568 1.00 . A A . 451 ARG HG2 1 1 14 6422 1 1 19 ARG HG3 H 4.536 -7.504 3.093 1.00 . A A . 451 ARG HG3 1 1 14 6423 1 1 19 ARG HH11 H 2.920 -8.374 6.478 1.00 . A A . 451 ARG HH11 1 1 14 6424 1 1 19 ARG HH12 H 1.324 -8.944 6.881 1.00 . A A . 451 ARG HH12 1 1 14 6425 1 1 19 ARG HH21 H 0.937 -10.860 3.963 1.00 . A A . 451 ARG HH21 1 1 14 6426 1 1 19 ARG HH22 H 0.193 -10.354 5.448 1.00 . A A . 451 ARG HH22 1 1 14 6427 1 1 19 ARG N N 5.616 -7.586 0.570 1.00 . A A . 451 ARG N 1 1 14 6428 1 1 19 ARG NE N 3.110 -9.652 4.294 1.00 . A A . 451 ARG NE 1 1 14 6429 1 1 19 ARG NH1 N 2.102 -8.931 6.249 1.00 . A A . 451 ARG NH1 1 1 14 6430 1 1 19 ARG NH2 N 0.977 -10.338 4.821 1.00 . A A . 451 ARG NH2 1 1 14 6431 1 1 19 ARG O O 6.566 -10.669 -0.565 1.00 . A A . 451 ARG O 1 1 14 6432 1 1 20 THR C C 3.653 -10.132 -3.033 1.00 . A A . 452 THR C 1 1 14 6433 1 1 20 THR CA C 4.061 -10.871 -1.755 1.00 . A A . 452 THR CA 1 1 14 6434 1 1 20 THR CB C 2.889 -11.754 -1.265 1.00 . A A . 452 THR CB 1 1 14 6435 1 1 20 THR CG2 C 2.703 -12.977 -2.154 1.00 . A A . 452 THR CG2 1 1 14 6436 1 1 20 THR H H 3.784 -9.281 -0.387 1.00 . A A . 452 THR H 1 1 14 6437 1 1 20 THR HA H 4.905 -11.511 -1.969 1.00 . A A . 452 THR HA 1 1 14 6438 1 1 20 THR HB H 1.979 -11.170 -1.284 1.00 . A A . 452 THR HB 1 1 14 6439 1 1 20 THR HG1 H 3.937 -12.737 0.091 1.00 . A A . 452 THR HG1 1 1 14 6440 1 1 20 THR HG21 H 3.606 -13.569 -2.144 1.00 . A A . 452 THR HG21 1 1 14 6441 1 1 20 THR HG22 H 2.493 -12.659 -3.164 1.00 . A A . 452 THR HG22 1 1 14 6442 1 1 20 THR HG23 H 1.881 -13.570 -1.782 1.00 . A A . 452 THR HG23 1 1 14 6443 1 1 20 THR N N 4.449 -9.933 -0.710 1.00 . A A . 452 THR N 1 1 14 6444 1 1 20 THR O O 3.311 -10.753 -4.041 1.00 . A A . 452 THR O 1 1 14 6445 1 1 20 THR OG1 O 3.146 -12.181 0.080 1.00 . A A . 452 THR OG1 1 1 14 6446 1 1 21 LEU C C 1.693 -8.011 -4.084 1.00 . A A . 453 LEU C 1 1 14 6447 1 1 21 LEU CA C 3.216 -7.939 -4.051 1.00 . A A . 453 LEU CA 1 1 14 6448 1 1 21 LEU CB C 3.827 -8.269 -5.427 1.00 . A A . 453 LEU CB 1 1 14 6449 1 1 21 LEU CD1 C 6.248 -8.557 -4.750 1.00 . A A . 453 LEU CD1 1 1 14 6450 1 1 21 LEU CD2 C 5.666 -7.970 -7.106 1.00 . A A . 453 LEU CD2 1 1 14 6451 1 1 21 LEU CG C 5.275 -7.803 -5.646 1.00 . A A . 453 LEU CG 1 1 14 6452 1 1 21 LEU H H 4.120 -8.382 -2.190 1.00 . A A . 453 LEU H 1 1 14 6453 1 1 21 LEU HA H 3.491 -6.925 -3.789 1.00 . A A . 453 LEU HA 1 1 14 6454 1 1 21 LEU HB2 H 3.795 -9.341 -5.560 1.00 . A A . 453 LEU HB2 1 1 14 6455 1 1 21 LEU HB3 H 3.210 -7.815 -6.188 1.00 . A A . 453 LEU HB3 1 1 14 6456 1 1 21 LEU HD11 H 5.986 -8.395 -3.714 1.00 . A A . 453 LEU HD11 1 1 14 6457 1 1 21 LEU HD12 H 7.252 -8.200 -4.927 1.00 . A A . 453 LEU HD12 1 1 14 6458 1 1 21 LEU HD13 H 6.197 -9.613 -4.972 1.00 . A A . 453 LEU HD13 1 1 14 6459 1 1 21 LEU HD21 H 5.016 -7.366 -7.723 1.00 . A A . 453 LEU HD21 1 1 14 6460 1 1 21 LEU HD22 H 5.566 -9.008 -7.387 1.00 . A A . 453 LEU HD22 1 1 14 6461 1 1 21 LEU HD23 H 6.689 -7.656 -7.244 1.00 . A A . 453 LEU HD23 1 1 14 6462 1 1 21 LEU HG H 5.348 -6.752 -5.402 1.00 . A A . 453 LEU HG 1 1 14 6463 1 1 21 LEU N N 3.721 -8.799 -2.978 1.00 . A A . 453 LEU N 1 1 14 6464 1 1 21 LEU O O 1.091 -8.695 -4.910 1.00 . A A . 453 LEU O 1 1 14 6465 1 1 22 GLU C C -0.894 -6.010 -2.731 1.00 . A A . 454 GLU C 1 1 14 6466 1 1 22 GLU CA C -0.336 -7.421 -2.869 1.00 . A A . 454 GLU CA 1 1 14 6467 1 1 22 GLU CB C -0.556 -8.225 -1.583 1.00 . A A . 454 GLU CB 1 1 14 6468 1 1 22 GLU CD C -2.145 -9.180 0.115 1.00 . A A . 454 GLU CD 1 1 14 6469 1 1 22 GLU CG C -2.006 -8.434 -1.194 1.00 . A A . 454 GLU CG 1 1 14 6470 1 1 22 GLU H H 1.634 -6.761 -2.542 1.00 . A A . 454 GLU H 1 1 14 6471 1 1 22 GLU HA H -0.809 -7.922 -3.702 1.00 . A A . 454 GLU HA 1 1 14 6472 1 1 22 GLU HB2 H -0.100 -9.196 -1.702 1.00 . A A . 454 GLU HB2 1 1 14 6473 1 1 22 GLU HB3 H -0.062 -7.710 -0.770 1.00 . A A . 454 GLU HB3 1 1 14 6474 1 1 22 GLU HG2 H -2.484 -7.470 -1.094 1.00 . A A . 454 GLU HG2 1 1 14 6475 1 1 22 GLU HG3 H -2.498 -9.000 -1.970 1.00 . A A . 454 GLU HG3 1 1 14 6476 1 1 22 GLU N N 1.092 -7.343 -3.117 1.00 . A A . 454 GLU N 1 1 14 6477 1 1 22 GLU O O -0.182 -5.112 -2.306 1.00 . A A . 454 GLU O 1 1 14 6478 1 1 22 GLU OE1 O -1.917 -10.409 0.134 1.00 . A A . 454 GLU OE1 1 1 14 6479 1 1 22 GLU OE2 O -2.488 -8.547 1.132 1.00 . A A . 454 GLU OE2 1 1 14 6480 1 1 23 SER C C -3.661 -4.437 -1.734 1.00 . A A . 455 SER C 1 1 14 6481 1 1 23 SER CA C -2.732 -4.474 -2.948 1.00 . A A . 455 SER CA 1 1 14 6482 1 1 23 SER CB C -3.469 -4.070 -4.229 1.00 . A A . 455 SER CB 1 1 14 6483 1 1 23 SER H H -2.684 -6.532 -3.453 1.00 . A A . 455 SER H 1 1 14 6484 1 1 23 SER HA H -1.922 -3.777 -2.780 1.00 . A A . 455 SER HA 1 1 14 6485 1 1 23 SER HB2 H -3.927 -3.101 -4.089 1.00 . A A . 455 SER HB2 1 1 14 6486 1 1 23 SER HB3 H -2.759 -4.014 -5.041 1.00 . A A . 455 SER HB3 1 1 14 6487 1 1 23 SER HG H -4.608 -5.623 -3.829 1.00 . A A . 455 SER HG 1 1 14 6488 1 1 23 SER N N -2.145 -5.795 -3.096 1.00 . A A . 455 SER N 1 1 14 6489 1 1 23 SER O O -4.712 -5.076 -1.730 1.00 . A A . 455 SER O 1 1 14 6490 1 1 23 SER OG O -4.476 -5.011 -4.568 1.00 . A A . 455 SER OG 1 1 14 6491 1 1 24 THR C C -4.611 -2.239 0.709 1.00 . A A . 456 THR C 1 1 14 6492 1 1 24 THR CA C -4.018 -3.637 0.536 1.00 . A A . 456 THR CA 1 1 14 6493 1 1 24 THR CB C -3.113 -3.978 1.739 1.00 . A A . 456 THR CB 1 1 14 6494 1 1 24 THR CG2 C -3.940 -4.222 2.993 1.00 . A A . 456 THR CG2 1 1 14 6495 1 1 24 THR H H -2.429 -3.181 -0.776 1.00 . A A . 456 THR H 1 1 14 6496 1 1 24 THR HA H -4.818 -4.362 0.488 1.00 . A A . 456 THR HA 1 1 14 6497 1 1 24 THR HB H -2.449 -3.143 1.918 1.00 . A A . 456 THR HB 1 1 14 6498 1 1 24 THR HG1 H -2.886 -5.930 1.492 1.00 . A A . 456 THR HG1 1 1 14 6499 1 1 24 THR HG21 H -4.469 -3.319 3.258 1.00 . A A . 456 THR HG21 1 1 14 6500 1 1 24 THR HG22 H -3.288 -4.507 3.805 1.00 . A A . 456 THR HG22 1 1 14 6501 1 1 24 THR HG23 H -4.651 -5.014 2.808 1.00 . A A . 456 THR HG23 1 1 14 6502 1 1 24 THR N N -3.260 -3.705 -0.704 1.00 . A A . 456 THR N 1 1 14 6503 1 1 24 THR O O -3.903 -1.241 0.612 1.00 . A A . 456 THR O 1 1 14 6504 1 1 24 THR OG1 O -2.330 -5.146 1.446 1.00 . A A . 456 THR OG1 1 1 14 6505 1 1 25 TRP C C -7.273 -0.634 2.338 1.00 . A A . 457 TRP C 1 1 14 6506 1 1 25 TRP CA C -6.573 -0.851 0.999 1.00 . A A . 457 TRP CA 1 1 14 6507 1 1 25 TRP CB C -7.522 -0.684 -0.193 1.00 . A A . 457 TRP CB 1 1 14 6508 1 1 25 TRP CD1 C -6.138 -1.647 -2.117 1.00 . A A . 457 TRP CD1 1 1 14 6509 1 1 25 TRP CD2 C -6.487 0.559 -2.265 1.00 . A A . 457 TRP CD2 1 1 14 6510 1 1 25 TRP CE2 C -5.684 0.152 -3.347 1.00 . A A . 457 TRP CE2 1 1 14 6511 1 1 25 TRP CE3 C -6.843 1.909 -2.161 1.00 . A A . 457 TRP CE3 1 1 14 6512 1 1 25 TRP CG C -6.753 -0.610 -1.479 1.00 . A A . 457 TRP CG 1 1 14 6513 1 1 25 TRP CH2 C -5.588 2.354 -4.185 1.00 . A A . 457 TRP CH2 1 1 14 6514 1 1 25 TRP CZ2 C -5.224 1.041 -4.308 1.00 . A A . 457 TRP CZ2 1 1 14 6515 1 1 25 TRP CZ3 C -6.393 2.791 -3.126 1.00 . A A . 457 TRP CZ3 1 1 14 6516 1 1 25 TRP H H -6.451 -2.982 1.009 1.00 . A A . 457 TRP H 1 1 14 6517 1 1 25 TRP HA H -5.794 -0.106 0.914 1.00 . A A . 457 TRP HA 1 1 14 6518 1 1 25 TRP HB2 H -8.193 -1.529 -0.243 1.00 . A A . 457 TRP HB2 1 1 14 6519 1 1 25 TRP HB3 H -8.088 0.228 -0.081 1.00 . A A . 457 TRP HB3 1 1 14 6520 1 1 25 TRP HD1 H -6.156 -2.671 -1.769 1.00 . A A . 457 TRP HD1 1 1 14 6521 1 1 25 TRP HE1 H -4.956 -1.747 -3.844 1.00 . A A . 457 TRP HE1 1 1 14 6522 1 1 25 TRP HE3 H -7.465 2.263 -1.353 1.00 . A A . 457 TRP HE3 1 1 14 6523 1 1 25 TRP HH2 H -5.260 3.077 -4.915 1.00 . A A . 457 TRP HH2 1 1 14 6524 1 1 25 TRP HZ2 H -4.579 0.721 -5.115 1.00 . A A . 457 TRP HZ2 1 1 14 6525 1 1 25 TRP HZ3 H -6.658 3.837 -3.066 1.00 . A A . 457 TRP HZ3 1 1 14 6526 1 1 25 TRP N N -5.916 -2.155 0.923 1.00 . A A . 457 TRP N 1 1 14 6527 1 1 25 TRP NE1 N -5.479 -1.194 -3.228 1.00 . A A . 457 TRP NE1 1 1 14 6528 1 1 25 TRP O O -7.945 0.377 2.545 1.00 . A A . 457 TRP O 1 1 14 6529 1 1 26 GLU C C -6.293 -1.507 5.549 1.00 . A A . 458 GLU C 1 1 14 6530 1 1 26 GLU CA C -7.510 -1.418 4.633 1.00 . A A . 458 GLU CA 1 1 14 6531 1 1 26 GLU CB C -8.532 -2.496 5.008 1.00 . A A . 458 GLU CB 1 1 14 6532 1 1 26 GLU CD C -10.503 -1.067 4.316 1.00 . A A . 458 GLU CD 1 1 14 6533 1 1 26 GLU CG C -9.824 -2.420 4.211 1.00 . A A . 458 GLU CG 1 1 14 6534 1 1 26 GLU H H -6.618 -2.397 2.994 1.00 . A A . 458 GLU H 1 1 14 6535 1 1 26 GLU HA H -7.960 -0.443 4.737 1.00 . A A . 458 GLU HA 1 1 14 6536 1 1 26 GLU HB2 H -8.090 -3.467 4.842 1.00 . A A . 458 GLU HB2 1 1 14 6537 1 1 26 GLU HB3 H -8.775 -2.396 6.056 1.00 . A A . 458 GLU HB3 1 1 14 6538 1 1 26 GLU HG2 H -9.603 -2.612 3.172 1.00 . A A . 458 GLU HG2 1 1 14 6539 1 1 26 GLU HG3 H -10.502 -3.177 4.578 1.00 . A A . 458 GLU HG3 1 1 14 6540 1 1 26 GLU N N -7.075 -1.575 3.252 1.00 . A A . 458 GLU N 1 1 14 6541 1 1 26 GLU O O -5.494 -2.432 5.426 1.00 . A A . 458 GLU O 1 1 14 6542 1 1 26 GLU OE1 O -10.770 -0.610 5.451 1.00 . A A . 458 GLU OE1 1 1 14 6543 1 1 26 GLU OE2 O -10.800 -0.460 3.267 1.00 . A A . 458 GLU OE2 1 1 14 6544 1 1 27 LYS C C -5.011 -1.525 8.428 1.00 . A A . 459 LYS C 1 1 14 6545 1 1 27 LYS CA C -4.976 -0.479 7.319 1.00 . A A . 459 LYS CA 1 1 14 6546 1 1 27 LYS CB C -4.836 0.911 7.941 1.00 . A A . 459 LYS CB 1 1 14 6547 1 1 27 LYS CD C -4.095 3.301 7.638 1.00 . A A . 459 LYS CD 1 1 14 6548 1 1 27 LYS CE C -3.036 3.165 8.724 1.00 . A A . 459 LYS CE 1 1 14 6549 1 1 27 LYS CG C -4.392 1.974 6.953 1.00 . A A . 459 LYS CG 1 1 14 6550 1 1 27 LYS H H -6.873 0.114 6.573 1.00 . A A . 459 LYS H 1 1 14 6551 1 1 27 LYS HA H -4.113 -0.662 6.699 1.00 . A A . 459 LYS HA 1 1 14 6552 1 1 27 LYS HB2 H -5.790 1.210 8.351 1.00 . A A . 459 LYS HB2 1 1 14 6553 1 1 27 LYS HB3 H -4.109 0.865 8.737 1.00 . A A . 459 LYS HB3 1 1 14 6554 1 1 27 LYS HD2 H -3.745 4.004 6.899 1.00 . A A . 459 LYS HD2 1 1 14 6555 1 1 27 LYS HD3 H -5.008 3.671 8.084 1.00 . A A . 459 LYS HD3 1 1 14 6556 1 1 27 LYS HE2 H -2.821 4.145 9.121 1.00 . A A . 459 LYS HE2 1 1 14 6557 1 1 27 LYS HE3 H -3.428 2.540 9.514 1.00 . A A . 459 LYS HE3 1 1 14 6558 1 1 27 LYS HG2 H -3.503 1.633 6.446 1.00 . A A . 459 LYS HG2 1 1 14 6559 1 1 27 LYS HG3 H -5.179 2.124 6.229 1.00 . A A . 459 LYS HG3 1 1 14 6560 1 1 27 LYS HZ1 H -1.923 1.570 7.970 1.00 . A A . 459 LYS HZ1 1 1 14 6561 1 1 27 LYS HZ2 H -1.028 2.624 8.944 1.00 . A A . 459 LYS HZ2 1 1 14 6562 1 1 27 LYS HZ3 H -1.446 3.077 7.361 1.00 . A A . 459 LYS HZ3 1 1 14 6563 1 1 27 LYS N N -6.155 -0.550 6.461 1.00 . A A . 459 LYS N 1 1 14 6564 1 1 27 LYS NZ N -1.774 2.566 8.216 1.00 . A A . 459 LYS NZ 1 1 14 6565 1 1 27 LYS O O -5.899 -1.503 9.282 1.00 . A A . 459 LYS O 1 1 14 6566 1 1 28 PRO C C -2.994 -2.834 10.619 1.00 . A A . 460 PRO C 1 1 14 6567 1 1 28 PRO CA C -3.875 -3.411 9.512 1.00 . A A . 460 PRO CA 1 1 14 6568 1 1 28 PRO CB C -3.191 -4.590 8.824 1.00 . A A . 460 PRO CB 1 1 14 6569 1 1 28 PRO CD C -3.071 -2.691 7.342 1.00 . A A . 460 PRO CD 1 1 14 6570 1 1 28 PRO CG C -2.377 -3.973 7.736 1.00 . A A . 460 PRO CG 1 1 14 6571 1 1 28 PRO HA H -4.823 -3.726 9.925 1.00 . A A . 460 PRO HA 1 1 14 6572 1 1 28 PRO HB2 H -2.568 -5.113 9.536 1.00 . A A . 460 PRO HB2 1 1 14 6573 1 1 28 PRO HB3 H -3.936 -5.261 8.428 1.00 . A A . 460 PRO HB3 1 1 14 6574 1 1 28 PRO HD2 H -2.360 -1.879 7.290 1.00 . A A . 460 PRO HD2 1 1 14 6575 1 1 28 PRO HD3 H -3.569 -2.818 6.392 1.00 . A A . 460 PRO HD3 1 1 14 6576 1 1 28 PRO HG2 H -1.383 -3.763 8.100 1.00 . A A . 460 PRO HG2 1 1 14 6577 1 1 28 PRO HG3 H -2.330 -4.647 6.892 1.00 . A A . 460 PRO HG3 1 1 14 6578 1 1 28 PRO N N -4.050 -2.462 8.423 1.00 . A A . 460 PRO N 1 1 14 6579 1 1 28 PRO O O -3.502 -2.026 11.423 1.00 . A A . 460 PRO O 1 1 14 6580 1 1 28 PRO OXT O -1.794 -3.175 10.673 1.00 . A A . 460 PRO OXT 1 1 15 6581 1 1 1 SER C C 7.619 -1.032 6.769 1.00 . A A . 433 SER C 1 1 15 6582 1 1 1 SER CA C 7.573 0.105 7.797 1.00 . A A . 433 SER CA 1 1 15 6583 1 1 1 SER CB C 6.648 -0.235 8.970 1.00 . A A . 433 SER CB 1 1 15 6584 1 1 1 SER H1 H 7.643 1.523 6.274 1.00 . A A . 433 SER H1 1 1 15 6585 1 1 1 SER H2 H 7.273 2.161 7.798 1.00 . A A . 433 SER H2 1 1 15 6586 1 1 1 SER H3 H 6.098 1.297 6.941 1.00 . A A . 433 SER H3 1 1 15 6587 1 1 1 SER HA H 8.575 0.269 8.173 1.00 . A A . 433 SER HA 1 1 15 6588 1 1 1 SER HB2 H 6.917 -1.199 9.376 1.00 . A A . 433 SER HB2 1 1 15 6589 1 1 1 SER HB3 H 6.753 0.518 9.736 1.00 . A A . 433 SER HB3 1 1 15 6590 1 1 1 SER HG H 4.730 0.117 9.242 1.00 . A A . 433 SER HG 1 1 15 6591 1 1 1 SER N N 7.112 1.355 7.159 1.00 . A A . 433 SER N 1 1 15 6592 1 1 1 SER O O 8.460 -1.019 5.872 1.00 . A A . 433 SER O 1 1 15 6593 1 1 1 SER OG O 5.292 -0.273 8.552 1.00 . A A . 433 SER OG 1 1 15 6594 1 1 2 GLU C C 5.625 -2.776 4.819 1.00 . A A . 434 GLU C 1 1 15 6595 1 1 2 GLU CA C 6.637 -3.088 5.918 1.00 . A A . 434 GLU CA 1 1 15 6596 1 1 2 GLU CB C 6.279 -4.397 6.635 1.00 . A A . 434 GLU CB 1 1 15 6597 1 1 2 GLU CD C 5.975 -6.901 6.457 1.00 . A A . 434 GLU CD 1 1 15 6598 1 1 2 GLU CG C 6.148 -5.596 5.710 1.00 . A A . 434 GLU CG 1 1 15 6599 1 1 2 GLU H H 6.050 -1.958 7.608 1.00 . A A . 434 GLU H 1 1 15 6600 1 1 2 GLU HA H 7.614 -3.189 5.468 1.00 . A A . 434 GLU HA 1 1 15 6601 1 1 2 GLU HB2 H 7.048 -4.615 7.363 1.00 . A A . 434 GLU HB2 1 1 15 6602 1 1 2 GLU HB3 H 5.339 -4.264 7.151 1.00 . A A . 434 GLU HB3 1 1 15 6603 1 1 2 GLU HG2 H 5.288 -5.448 5.075 1.00 . A A . 434 GLU HG2 1 1 15 6604 1 1 2 GLU HG3 H 7.037 -5.661 5.100 1.00 . A A . 434 GLU HG3 1 1 15 6605 1 1 2 GLU N N 6.701 -1.989 6.873 1.00 . A A . 434 GLU N 1 1 15 6606 1 1 2 GLU O O 5.672 -3.343 3.727 1.00 . A A . 434 GLU O 1 1 15 6607 1 1 2 GLU OE1 O 4.913 -7.104 7.081 1.00 . A A . 434 GLU OE1 1 1 15 6608 1 1 2 GLU OE2 O 6.903 -7.736 6.417 1.00 . A A . 434 GLU OE2 1 1 15 6609 1 1 3 TRP C C 4.077 -0.241 3.406 1.00 . A A . 435 TRP C 1 1 15 6610 1 1 3 TRP CA C 3.674 -1.491 4.173 1.00 . A A . 435 TRP CA 1 1 15 6611 1 1 3 TRP CB C 2.355 -1.253 4.913 1.00 . A A . 435 TRP CB 1 1 15 6612 1 1 3 TRP CD1 C 1.512 -2.604 6.927 1.00 . A A . 435 TRP CD1 1 1 15 6613 1 1 3 TRP CD2 C 1.612 -3.756 5.013 1.00 . A A . 435 TRP CD2 1 1 15 6614 1 1 3 TRP CE2 C 1.137 -4.613 6.024 1.00 . A A . 435 TRP CE2 1 1 15 6615 1 1 3 TRP CE3 C 1.760 -4.258 3.721 1.00 . A A . 435 TRP CE3 1 1 15 6616 1 1 3 TRP CG C 1.840 -2.477 5.608 1.00 . A A . 435 TRP CG 1 1 15 6617 1 1 3 TRP CH2 C 0.967 -6.408 4.498 1.00 . A A . 435 TRP CH2 1 1 15 6618 1 1 3 TRP CZ2 C 0.809 -5.946 5.777 1.00 . A A . 435 TRP CZ2 1 1 15 6619 1 1 3 TRP CZ3 C 1.438 -5.576 3.479 1.00 . A A . 435 TRP CZ3 1 1 15 6620 1 1 3 TRP H H 4.740 -1.426 5.989 1.00 . A A . 435 TRP H 1 1 15 6621 1 1 3 TRP HA H 3.546 -2.308 3.479 1.00 . A A . 435 TRP HA 1 1 15 6622 1 1 3 TRP HB2 H 2.502 -0.483 5.656 1.00 . A A . 435 TRP HB2 1 1 15 6623 1 1 3 TRP HB3 H 1.605 -0.929 4.206 1.00 . A A . 435 TRP HB3 1 1 15 6624 1 1 3 TRP HD1 H 1.580 -1.806 7.650 1.00 . A A . 435 TRP HD1 1 1 15 6625 1 1 3 TRP HE1 H 0.790 -4.224 8.056 1.00 . A A . 435 TRP HE1 1 1 15 6626 1 1 3 TRP HE3 H 2.121 -3.635 2.918 1.00 . A A . 435 TRP HE3 1 1 15 6627 1 1 3 TRP HH2 H 0.725 -7.434 4.251 1.00 . A A . 435 TRP HH2 1 1 15 6628 1 1 3 TRP HZ2 H 0.446 -6.600 6.555 1.00 . A A . 435 TRP HZ2 1 1 15 6629 1 1 3 TRP HZ3 H 1.553 -5.983 2.483 1.00 . A A . 435 TRP HZ3 1 1 15 6630 1 1 3 TRP N N 4.712 -1.865 5.117 1.00 . A A . 435 TRP N 1 1 15 6631 1 1 3 TRP NE1 N 1.083 -3.884 7.183 1.00 . A A . 435 TRP NE1 1 1 15 6632 1 1 3 TRP O O 4.577 0.722 3.997 1.00 . A A . 435 TRP O 1 1 15 6633 1 1 4 THR C C 3.001 1.880 1.241 1.00 . A A . 436 THR C 1 1 15 6634 1 1 4 THR CA C 4.165 0.910 1.277 1.00 . A A . 436 THR CA 1 1 15 6635 1 1 4 THR CB C 4.510 0.495 -0.169 1.00 . A A . 436 THR CB 1 1 15 6636 1 1 4 THR CG2 C 4.784 1.720 -1.043 1.00 . A A . 436 THR CG2 1 1 15 6637 1 1 4 THR H H 3.409 -1.019 1.684 1.00 . A A . 436 THR H 1 1 15 6638 1 1 4 THR HA H 5.026 1.398 1.712 1.00 . A A . 436 THR HA 1 1 15 6639 1 1 4 THR HB H 3.660 -0.032 -0.579 1.00 . A A . 436 THR HB 1 1 15 6640 1 1 4 THR HG1 H 5.334 -1.297 -0.165 1.00 . A A . 436 THR HG1 1 1 15 6641 1 1 4 THR HG21 H 5.588 2.298 -0.614 1.00 . A A . 436 THR HG21 1 1 15 6642 1 1 4 THR HG22 H 3.891 2.332 -1.104 1.00 . A A . 436 THR HG22 1 1 15 6643 1 1 4 THR HG23 H 5.066 1.397 -2.035 1.00 . A A . 436 THR HG23 1 1 15 6644 1 1 4 THR N N 3.829 -0.236 2.102 1.00 . A A . 436 THR N 1 1 15 6645 1 1 4 THR O O 2.029 1.669 0.520 1.00 . A A . 436 THR O 1 1 15 6646 1 1 4 THR OG1 O 5.644 -0.385 -0.177 1.00 . A A . 436 THR OG1 1 1 15 6647 1 1 5 GLU C C 2.495 5.034 1.049 1.00 . A A . 437 GLU C 1 1 15 6648 1 1 5 GLU CA C 2.090 3.966 2.046 1.00 . A A . 437 GLU CA 1 1 15 6649 1 1 5 GLU CB C 1.913 4.543 3.455 1.00 . A A . 437 GLU CB 1 1 15 6650 1 1 5 GLU CD C 1.463 4.013 5.899 1.00 . A A . 437 GLU CD 1 1 15 6651 1 1 5 GLU CG C 1.526 3.485 4.483 1.00 . A A . 437 GLU CG 1 1 15 6652 1 1 5 GLU H H 3.850 2.986 2.663 1.00 . A A . 437 GLU H 1 1 15 6653 1 1 5 GLU HA H 1.159 3.535 1.721 1.00 . A A . 437 GLU HA 1 1 15 6654 1 1 5 GLU HB2 H 2.842 4.999 3.766 1.00 . A A . 437 GLU HB2 1 1 15 6655 1 1 5 GLU HB3 H 1.140 5.295 3.434 1.00 . A A . 437 GLU HB3 1 1 15 6656 1 1 5 GLU HG2 H 0.555 3.098 4.228 1.00 . A A . 437 GLU HG2 1 1 15 6657 1 1 5 GLU HG3 H 2.252 2.686 4.445 1.00 . A A . 437 GLU HG3 1 1 15 6658 1 1 5 GLU N N 3.089 2.920 2.049 1.00 . A A . 437 GLU N 1 1 15 6659 1 1 5 GLU O O 3.291 5.924 1.349 1.00 . A A . 437 GLU O 1 1 15 6660 1 1 5 GLU OE1 O 2.532 4.144 6.533 1.00 . A A . 437 GLU OE1 1 1 15 6661 1 1 5 GLU OE2 O 0.345 4.280 6.390 1.00 . A A . 437 GLU OE2 1 1 15 6662 1 1 6 ARG C C 1.166 6.576 -1.719 1.00 . A A . 438 ARG C 1 1 15 6663 1 1 6 ARG CA C 2.380 5.755 -1.261 1.00 . A A . 438 ARG CA 1 1 15 6664 1 1 6 ARG CB C 2.911 4.899 -2.415 1.00 . A A . 438 ARG CB 1 1 15 6665 1 1 6 ARG CD C 3.926 4.797 -4.709 1.00 . A A . 438 ARG CD 1 1 15 6666 1 1 6 ARG CG C 3.422 5.704 -3.595 1.00 . A A . 438 ARG CG 1 1 15 6667 1 1 6 ARG CZ C 5.549 2.942 -4.916 1.00 . A A . 438 ARG CZ 1 1 15 6668 1 1 6 ARG H H 1.326 4.184 -0.331 1.00 . A A . 438 ARG H 1 1 15 6669 1 1 6 ARG HA H 3.167 6.397 -0.898 1.00 . A A . 438 ARG HA 1 1 15 6670 1 1 6 ARG HB2 H 3.722 4.287 -2.049 1.00 . A A . 438 ARG HB2 1 1 15 6671 1 1 6 ARG HB3 H 2.117 4.256 -2.764 1.00 . A A . 438 ARG HB3 1 1 15 6672 1 1 6 ARG HD2 H 3.149 4.088 -4.955 1.00 . A A . 438 ARG HD2 1 1 15 6673 1 1 6 ARG HD3 H 4.143 5.403 -5.576 1.00 . A A . 438 ARG HD3 1 1 15 6674 1 1 6 ARG HE H 5.689 4.457 -3.601 1.00 . A A . 438 ARG HE 1 1 15 6675 1 1 6 ARG HG2 H 2.618 6.316 -3.977 1.00 . A A . 438 ARG HG2 1 1 15 6676 1 1 6 ARG HG3 H 4.233 6.335 -3.263 1.00 . A A . 438 ARG HG3 1 1 15 6677 1 1 6 ARG HH11 H 3.903 2.728 -6.087 1.00 . A A . 438 ARG HH11 1 1 15 6678 1 1 6 ARG HH12 H 5.131 1.512 -6.295 1.00 . A A . 438 ARG HH12 1 1 15 6679 1 1 6 ARG HH21 H 7.282 2.822 -3.854 1.00 . A A . 438 ARG HH21 1 1 15 6680 1 1 6 ARG HH22 H 7.021 1.554 -5.015 1.00 . A A . 438 ARG HH22 1 1 15 6681 1 1 6 ARG N N 1.990 4.892 -0.166 1.00 . A A . 438 ARG N 1 1 15 6682 1 1 6 ARG NE N 5.134 4.065 -4.326 1.00 . A A . 438 ARG NE 1 1 15 6683 1 1 6 ARG NH1 N 4.797 2.347 -5.834 1.00 . A A . 438 ARG NH1 1 1 15 6684 1 1 6 ARG NH2 N 6.708 2.395 -4.567 1.00 . A A . 438 ARG NH2 1 1 15 6685 1 1 6 ARG O O 0.069 6.027 -1.835 1.00 . A A . 438 ARG O 1 1 15 6686 1 1 7 LYS C C -0.030 8.724 -3.839 1.00 . A A . 439 LYS C 1 1 15 6687 1 1 7 LYS CA C 0.207 8.708 -2.338 1.00 . A A . 439 LYS CA 1 1 15 6688 1 1 7 LYS CB C 0.432 10.135 -1.840 1.00 . A A . 439 LYS CB 1 1 15 6689 1 1 7 LYS CD C 0.918 11.676 0.082 1.00 . A A . 439 LYS CD 1 1 15 6690 1 1 7 LYS CE C 1.969 12.404 -0.744 1.00 . A A . 439 LYS CE 1 1 15 6691 1 1 7 LYS CG C 0.758 10.230 -0.358 1.00 . A A . 439 LYS CG 1 1 15 6692 1 1 7 LYS H H 2.238 8.267 -2.010 1.00 . A A . 439 LYS H 1 1 15 6693 1 1 7 LYS HA H -0.664 8.300 -1.851 1.00 . A A . 439 LYS HA 1 1 15 6694 1 1 7 LYS HB2 H 1.250 10.571 -2.393 1.00 . A A . 439 LYS HB2 1 1 15 6695 1 1 7 LYS HB3 H -0.463 10.712 -2.026 1.00 . A A . 439 LYS HB3 1 1 15 6696 1 1 7 LYS HD2 H -0.029 12.183 -0.034 1.00 . A A . 439 LYS HD2 1 1 15 6697 1 1 7 LYS HD3 H 1.212 11.696 1.122 1.00 . A A . 439 LYS HD3 1 1 15 6698 1 1 7 LYS HE2 H 1.675 12.373 -1.783 1.00 . A A . 439 LYS HE2 1 1 15 6699 1 1 7 LYS HE3 H 2.015 13.432 -0.417 1.00 . A A . 439 LYS HE3 1 1 15 6700 1 1 7 LYS HG2 H -0.042 9.777 0.208 1.00 . A A . 439 LYS HG2 1 1 15 6701 1 1 7 LYS HG3 H 1.681 9.701 -0.168 1.00 . A A . 439 LYS HG3 1 1 15 6702 1 1 7 LYS HZ1 H 3.651 11.880 0.378 1.00 . A A . 439 LYS HZ1 1 1 15 6703 1 1 7 LYS HZ2 H 3.997 12.277 -1.232 1.00 . A A . 439 LYS HZ2 1 1 15 6704 1 1 7 LYS HZ3 H 3.288 10.784 -0.868 1.00 . A A . 439 LYS HZ3 1 1 15 6705 1 1 7 LYS N N 1.340 7.869 -2.003 1.00 . A A . 439 LYS N 1 1 15 6706 1 1 7 LYS NZ N 3.318 11.793 -0.607 1.00 . A A . 439 LYS NZ 1 1 15 6707 1 1 7 LYS O O 0.817 9.174 -4.613 1.00 . A A . 439 LYS O 1 1 15 6708 1 1 8 THR C C -2.401 9.592 -5.833 1.00 . A A . 440 THR C 1 1 15 6709 1 1 8 THR CA C -1.598 8.309 -5.632 1.00 . A A . 440 THR CA 1 1 15 6710 1 1 8 THR CB C -2.459 7.099 -6.042 1.00 . A A . 440 THR CB 1 1 15 6711 1 1 8 THR CG2 C -1.950 6.485 -7.333 1.00 . A A . 440 THR CG2 1 1 15 6712 1 1 8 THR H H -1.729 7.719 -3.604 1.00 . A A . 440 THR H 1 1 15 6713 1 1 8 THR HA H -0.718 8.336 -6.257 1.00 . A A . 440 THR HA 1 1 15 6714 1 1 8 THR HB H -3.476 7.429 -6.193 1.00 . A A . 440 THR HB 1 1 15 6715 1 1 8 THR HG1 H -2.926 6.437 -4.244 1.00 . A A . 440 THR HG1 1 1 15 6716 1 1 8 THR HG21 H -0.874 6.385 -7.284 1.00 . A A . 440 THR HG21 1 1 15 6717 1 1 8 THR HG22 H -2.219 7.117 -8.166 1.00 . A A . 440 THR HG22 1 1 15 6718 1 1 8 THR HG23 H -2.393 5.508 -7.460 1.00 . A A . 440 THR HG23 1 1 15 6719 1 1 8 THR N N -1.174 8.212 -4.246 1.00 . A A . 440 THR N 1 1 15 6720 1 1 8 THR O O -3.214 9.964 -4.981 1.00 . A A . 440 THR O 1 1 15 6721 1 1 8 THR OG1 O -2.436 6.111 -5.010 1.00 . A A . 440 THR OG1 1 1 15 6722 1 1 9 ALA C C -4.285 11.532 -7.290 1.00 . A A . 441 ALA C 1 1 15 6723 1 1 9 ALA CA C -2.757 11.571 -7.232 1.00 . A A . 441 ALA CA 1 1 15 6724 1 1 9 ALA CB C -2.195 12.132 -8.530 1.00 . A A . 441 ALA CB 1 1 15 6725 1 1 9 ALA H H -1.560 9.871 -7.624 1.00 . A A . 441 ALA H 1 1 15 6726 1 1 9 ALA HA H -2.461 12.235 -6.433 1.00 . A A . 441 ALA HA 1 1 15 6727 1 1 9 ALA HB1 H -1.116 12.146 -8.477 1.00 . A A . 441 ALA HB1 1 1 15 6728 1 1 9 ALA HB2 H -2.562 13.136 -8.676 1.00 . A A . 441 ALA HB2 1 1 15 6729 1 1 9 ALA HB3 H -2.508 11.509 -9.356 1.00 . A A . 441 ALA HB3 1 1 15 6730 1 1 9 ALA N N -2.167 10.261 -6.959 1.00 . A A . 441 ALA N 1 1 15 6731 1 1 9 ALA O O -4.932 12.576 -7.305 1.00 . A A . 441 ALA O 1 1 15 6732 1 1 10 ASP C C -6.939 10.506 -5.999 1.00 . A A . 442 ASP C 1 1 15 6733 1 1 10 ASP CA C -6.314 10.184 -7.358 1.00 . A A . 442 ASP CA 1 1 15 6734 1 1 10 ASP CB C -6.686 8.759 -7.779 1.00 . A A . 442 ASP CB 1 1 15 6735 1 1 10 ASP CG C -8.170 8.594 -8.053 1.00 . A A . 442 ASP CG 1 1 15 6736 1 1 10 ASP H H -4.295 9.534 -7.295 1.00 . A A . 442 ASP H 1 1 15 6737 1 1 10 ASP HA H -6.696 10.878 -8.092 1.00 . A A . 442 ASP HA 1 1 15 6738 1 1 10 ASP HB2 H -6.144 8.502 -8.677 1.00 . A A . 442 ASP HB2 1 1 15 6739 1 1 10 ASP HB3 H -6.408 8.075 -6.990 1.00 . A A . 442 ASP HB3 1 1 15 6740 1 1 10 ASP N N -4.860 10.334 -7.310 1.00 . A A . 442 ASP N 1 1 15 6741 1 1 10 ASP O O -8.161 10.559 -5.858 1.00 . A A . 442 ASP O 1 1 15 6742 1 1 10 ASP OD1 O -8.646 9.099 -9.093 1.00 . A A . 442 ASP OD1 1 1 15 6743 1 1 10 ASP OD2 O -8.869 7.966 -7.233 1.00 . A A . 442 ASP OD2 1 1 15 6744 1 1 11 GLY C C -6.686 9.716 -2.875 1.00 . A A . 443 GLY C 1 1 15 6745 1 1 11 GLY CA C -6.570 11.000 -3.663 1.00 . A A . 443 GLY CA 1 1 15 6746 1 1 11 GLY H H -5.128 10.753 -5.189 1.00 . A A . 443 GLY H 1 1 15 6747 1 1 11 GLY HA2 H -5.884 11.664 -3.159 1.00 . A A . 443 GLY HA2 1 1 15 6748 1 1 11 GLY HA3 H -7.543 11.468 -3.716 1.00 . A A . 443 GLY HA3 1 1 15 6749 1 1 11 GLY N N -6.092 10.749 -5.008 1.00 . A A . 443 GLY N 1 1 15 6750 1 1 11 GLY O O -7.613 9.532 -2.084 1.00 . A A . 443 GLY O 1 1 15 6751 1 1 12 LYS C C -4.297 7.169 -2.037 1.00 . A A . 444 LYS C 1 1 15 6752 1 1 12 LYS CA C -5.714 7.528 -2.446 1.00 . A A . 444 LYS CA 1 1 15 6753 1 1 12 LYS CB C -6.251 6.437 -3.376 1.00 . A A . 444 LYS CB 1 1 15 6754 1 1 12 LYS CD C -8.186 5.484 -4.652 1.00 . A A . 444 LYS CD 1 1 15 6755 1 1 12 LYS CE C -9.642 5.662 -5.046 1.00 . A A . 444 LYS CE 1 1 15 6756 1 1 12 LYS CG C -7.692 6.642 -3.805 1.00 . A A . 444 LYS CG 1 1 15 6757 1 1 12 LYS H H -5.016 9.045 -3.735 1.00 . A A . 444 LYS H 1 1 15 6758 1 1 12 LYS HA H -6.335 7.587 -1.567 1.00 . A A . 444 LYS HA 1 1 15 6759 1 1 12 LYS HB2 H -5.639 6.407 -4.264 1.00 . A A . 444 LYS HB2 1 1 15 6760 1 1 12 LYS HB3 H -6.182 5.485 -2.870 1.00 . A A . 444 LYS HB3 1 1 15 6761 1 1 12 LYS HD2 H -7.586 5.426 -5.549 1.00 . A A . 444 LYS HD2 1 1 15 6762 1 1 12 LYS HD3 H -8.084 4.568 -4.089 1.00 . A A . 444 LYS HD3 1 1 15 6763 1 1 12 LYS HE2 H -9.739 6.573 -5.617 1.00 . A A . 444 LYS HE2 1 1 15 6764 1 1 12 LYS HE3 H -9.941 4.822 -5.656 1.00 . A A . 444 LYS HE3 1 1 15 6765 1 1 12 LYS HG2 H -8.312 6.721 -2.923 1.00 . A A . 444 LYS HG2 1 1 15 6766 1 1 12 LYS HG3 H -7.760 7.554 -4.378 1.00 . A A . 444 LYS HG3 1 1 15 6767 1 1 12 LYS HZ1 H -10.475 4.854 -3.308 1.00 . A A . 444 LYS HZ1 1 1 15 6768 1 1 12 LYS HZ2 H -11.523 5.877 -4.163 1.00 . A A . 444 LYS HZ2 1 1 15 6769 1 1 12 LYS HZ3 H -10.256 6.539 -3.247 1.00 . A A . 444 LYS HZ3 1 1 15 6770 1 1 12 LYS N N -5.734 8.822 -3.106 1.00 . A A . 444 LYS N 1 1 15 6771 1 1 12 LYS NZ N -10.533 5.739 -3.859 1.00 . A A . 444 LYS NZ 1 1 15 6772 1 1 12 LYS O O -3.391 7.153 -2.865 1.00 . A A . 444 LYS O 1 1 15 6773 1 1 13 THR C C -2.912 4.836 -0.352 1.00 . A A . 445 THR C 1 1 15 6774 1 1 13 THR CA C -2.842 6.357 -0.301 1.00 . A A . 445 THR CA 1 1 15 6775 1 1 13 THR CB C -2.534 6.817 1.138 1.00 . A A . 445 THR CB 1 1 15 6776 1 1 13 THR CG2 C -1.095 6.498 1.517 1.00 . A A . 445 THR CG2 1 1 15 6777 1 1 13 THR H H -4.829 7.045 -0.122 1.00 . A A . 445 THR H 1 1 15 6778 1 1 13 THR HA H -2.057 6.704 -0.957 1.00 . A A . 445 THR HA 1 1 15 6779 1 1 13 THR HB H -3.195 6.296 1.818 1.00 . A A . 445 THR HB 1 1 15 6780 1 1 13 THR HG1 H -3.710 8.399 1.295 1.00 . A A . 445 THR HG1 1 1 15 6781 1 1 13 THR HG21 H -0.925 5.436 1.422 1.00 . A A . 445 THR HG21 1 1 15 6782 1 1 13 THR HG22 H -0.915 6.802 2.537 1.00 . A A . 445 THR HG22 1 1 15 6783 1 1 13 THR HG23 H -0.424 7.030 0.858 1.00 . A A . 445 THR HG23 1 1 15 6784 1 1 13 THR N N -4.103 6.890 -0.766 1.00 . A A . 445 THR N 1 1 15 6785 1 1 13 THR O O -3.514 4.211 0.522 1.00 . A A . 445 THR O 1 1 15 6786 1 1 13 THR OG1 O -2.759 8.228 1.253 1.00 . A A . 445 THR OG1 1 1 15 6787 1 1 14 TYR C C -1.320 2.069 -0.964 1.00 . A A . 446 TYR C 1 1 15 6788 1 1 14 TYR CA C -2.482 2.808 -1.583 1.00 . A A . 446 TYR CA 1 1 15 6789 1 1 14 TYR CB C -2.623 2.439 -3.060 1.00 . A A . 446 TYR CB 1 1 15 6790 1 1 14 TYR CD1 C -0.933 3.746 -4.414 1.00 . A A . 446 TYR CD1 1 1 15 6791 1 1 14 TYR CD2 C -0.646 1.391 -4.221 1.00 . A A . 446 TYR CD2 1 1 15 6792 1 1 14 TYR CE1 C 0.189 3.822 -5.211 1.00 . A A . 446 TYR CE1 1 1 15 6793 1 1 14 TYR CE2 C 0.480 1.456 -5.015 1.00 . A A . 446 TYR CE2 1 1 15 6794 1 1 14 TYR CG C -1.370 2.534 -3.906 1.00 . A A . 446 TYR CG 1 1 15 6795 1 1 14 TYR CZ C 0.893 2.678 -5.511 1.00 . A A . 446 TYR CZ 1 1 15 6796 1 1 14 TYR H H -1.798 4.765 -2.016 1.00 . A A . 446 TYR H 1 1 15 6797 1 1 14 TYR HA H -3.384 2.509 -1.068 1.00 . A A . 446 TYR HA 1 1 15 6798 1 1 14 TYR HB2 H -2.973 1.420 -3.124 1.00 . A A . 446 TYR HB2 1 1 15 6799 1 1 14 TYR HB3 H -3.366 3.083 -3.502 1.00 . A A . 446 TYR HB3 1 1 15 6800 1 1 14 TYR HD1 H -1.486 4.644 -4.184 1.00 . A A . 446 TYR HD1 1 1 15 6801 1 1 14 TYR HD2 H -0.974 0.438 -3.831 1.00 . A A . 446 TYR HD2 1 1 15 6802 1 1 14 TYR HE1 H 0.511 4.776 -5.598 1.00 . A A . 446 TYR HE1 1 1 15 6803 1 1 14 TYR HE2 H 1.024 0.553 -5.251 1.00 . A A . 446 TYR HE2 1 1 15 6804 1 1 14 TYR HH H 2.288 3.689 -6.359 1.00 . A A . 446 TYR HH 1 1 15 6805 1 1 14 TYR N N -2.340 4.240 -1.391 1.00 . A A . 446 TYR N 1 1 15 6806 1 1 14 TYR O O -0.184 2.547 -0.980 1.00 . A A . 446 TYR O 1 1 15 6807 1 1 14 TYR OH O 2.014 2.766 -6.304 1.00 . A A . 446 TYR OH 1 1 15 6808 1 1 15 TYR C C -0.176 -1.053 -0.556 1.00 . A A . 447 TYR C 1 1 15 6809 1 1 15 TYR CA C -0.629 0.129 0.285 1.00 . A A . 447 TYR CA 1 1 15 6810 1 1 15 TYR CB C -1.216 -0.319 1.629 1.00 . A A . 447 TYR CB 1 1 15 6811 1 1 15 TYR CD1 C -1.330 1.962 2.664 1.00 . A A . 447 TYR CD1 1 1 15 6812 1 1 15 TYR CD2 C -3.358 0.734 2.478 1.00 . A A . 447 TYR CD2 1 1 15 6813 1 1 15 TYR CE1 C -2.014 3.028 3.208 1.00 . A A . 447 TYR CE1 1 1 15 6814 1 1 15 TYR CE2 C -4.052 1.792 3.035 1.00 . A A . 447 TYR CE2 1 1 15 6815 1 1 15 TYR CG C -1.982 0.804 2.289 1.00 . A A . 447 TYR CG 1 1 15 6816 1 1 15 TYR CZ C -3.375 2.938 3.392 1.00 . A A . 447 TYR CZ 1 1 15 6817 1 1 15 TYR H H -2.514 0.526 -0.543 1.00 . A A . 447 TYR H 1 1 15 6818 1 1 15 TYR HA H 0.217 0.773 0.474 1.00 . A A . 447 TYR HA 1 1 15 6819 1 1 15 TYR HB2 H -1.891 -1.148 1.471 1.00 . A A . 447 TYR HB2 1 1 15 6820 1 1 15 TYR HB3 H -0.418 -0.619 2.293 1.00 . A A . 447 TYR HB3 1 1 15 6821 1 1 15 TYR HD1 H -0.267 2.022 2.522 1.00 . A A . 447 TYR HD1 1 1 15 6822 1 1 15 TYR HD2 H -3.882 -0.168 2.198 1.00 . A A . 447 TYR HD2 1 1 15 6823 1 1 15 TYR HE1 H -1.482 3.924 3.493 1.00 . A A . 447 TYR HE1 1 1 15 6824 1 1 15 TYR HE2 H -5.118 1.721 3.185 1.00 . A A . 447 TYR HE2 1 1 15 6825 1 1 15 TYR HH H -3.786 4.814 3.472 1.00 . A A . 447 TYR HH 1 1 15 6826 1 1 15 TYR N N -1.610 0.894 -0.436 1.00 . A A . 447 TYR N 1 1 15 6827 1 1 15 TYR O O -0.882 -2.044 -0.690 1.00 . A A . 447 TYR O 1 1 15 6828 1 1 15 TYR OH O -4.066 4.007 3.915 1.00 . A A . 447 TYR OH 1 1 15 6829 1 1 16 TYR C C 2.418 -2.907 -1.022 1.00 . A A . 448 TYR C 1 1 15 6830 1 1 16 TYR CA C 1.555 -2.012 -1.923 1.00 . A A . 448 TYR CA 1 1 15 6831 1 1 16 TYR CB C 2.402 -1.459 -3.074 1.00 . A A . 448 TYR CB 1 1 15 6832 1 1 16 TYR CD1 C 2.412 -3.319 -4.792 1.00 . A A . 448 TYR CD1 1 1 15 6833 1 1 16 TYR CD2 C 4.477 -2.729 -3.758 1.00 . A A . 448 TYR CD2 1 1 15 6834 1 1 16 TYR CE1 C 3.059 -4.289 -5.538 1.00 . A A . 448 TYR CE1 1 1 15 6835 1 1 16 TYR CE2 C 5.131 -3.697 -4.499 1.00 . A A . 448 TYR CE2 1 1 15 6836 1 1 16 TYR CG C 3.108 -2.524 -3.889 1.00 . A A . 448 TYR CG 1 1 15 6837 1 1 16 TYR CZ C 4.418 -4.473 -5.388 1.00 . A A . 448 TYR CZ 1 1 15 6838 1 1 16 TYR H H 1.414 -0.049 -1.183 1.00 . A A . 448 TYR H 1 1 15 6839 1 1 16 TYR HA H 0.737 -2.583 -2.332 1.00 . A A . 448 TYR HA 1 1 15 6840 1 1 16 TYR HB2 H 1.766 -0.900 -3.742 1.00 . A A . 448 TYR HB2 1 1 15 6841 1 1 16 TYR HB3 H 3.156 -0.798 -2.671 1.00 . A A . 448 TYR HB3 1 1 15 6842 1 1 16 TYR HD1 H 1.348 -3.173 -4.907 1.00 . A A . 448 TYR HD1 1 1 15 6843 1 1 16 TYR HD2 H 5.033 -2.121 -3.060 1.00 . A A . 448 TYR HD2 1 1 15 6844 1 1 16 TYR HE1 H 2.500 -4.894 -6.234 1.00 . A A . 448 TYR HE1 1 1 15 6845 1 1 16 TYR HE2 H 6.195 -3.841 -4.379 1.00 . A A . 448 TYR HE2 1 1 15 6846 1 1 16 TYR HH H 4.747 -5.404 -7.037 1.00 . A A . 448 TYR HH 1 1 15 6847 1 1 16 TYR N N 0.985 -0.923 -1.162 1.00 . A A . 448 TYR N 1 1 15 6848 1 1 16 TYR O O 3.366 -2.447 -0.372 1.00 . A A . 448 TYR O 1 1 15 6849 1 1 16 TYR OH O 5.065 -5.436 -6.129 1.00 . A A . 448 TYR OH 1 1 15 6850 1 1 17 ASN C C 3.833 -5.820 -1.083 1.00 . A A . 449 ASN C 1 1 15 6851 1 1 17 ASN CA C 2.738 -5.207 -0.224 1.00 . A A . 449 ASN CA 1 1 15 6852 1 1 17 ASN CB C 1.715 -6.288 0.175 1.00 . A A . 449 ASN CB 1 1 15 6853 1 1 17 ASN CG C 2.295 -7.422 1.006 1.00 . A A . 449 ASN CG 1 1 15 6854 1 1 17 ASN H H 1.282 -4.468 -1.527 1.00 . A A . 449 ASN H 1 1 15 6855 1 1 17 ASN HA H 3.166 -4.759 0.660 1.00 . A A . 449 ASN HA 1 1 15 6856 1 1 17 ASN HB2 H 0.927 -5.826 0.750 1.00 . A A . 449 ASN HB2 1 1 15 6857 1 1 17 ASN HB3 H 1.291 -6.711 -0.723 1.00 . A A . 449 ASN HB3 1 1 15 6858 1 1 17 ASN HD21 H 0.486 -7.887 1.683 1.00 . A A . 449 ASN HD21 1 1 15 6859 1 1 17 ASN HD22 H 1.785 -8.866 2.275 1.00 . A A . 449 ASN HD22 1 1 15 6860 1 1 17 ASN N N 2.057 -4.186 -0.993 1.00 . A A . 449 ASN N 1 1 15 6861 1 1 17 ASN ND2 N 1.436 -8.127 1.724 1.00 . A A . 449 ASN ND2 1 1 15 6862 1 1 17 ASN O O 3.546 -6.442 -2.106 1.00 . A A . 449 ASN O 1 1 15 6863 1 1 17 ASN OD1 O 3.488 -7.684 0.981 1.00 . A A . 449 ASN OD1 1 1 15 6864 1 1 18 ASN C C 6.595 -7.521 -1.069 1.00 . A A . 450 ASN C 1 1 15 6865 1 1 18 ASN CA C 6.213 -6.102 -1.456 1.00 . A A . 450 ASN CA 1 1 15 6866 1 1 18 ASN CB C 7.411 -5.150 -1.295 1.00 . A A . 450 ASN CB 1 1 15 6867 1 1 18 ASN CG C 7.876 -4.988 0.145 1.00 . A A . 450 ASN CG 1 1 15 6868 1 1 18 ASN H H 5.236 -5.243 0.212 1.00 . A A . 450 ASN H 1 1 15 6869 1 1 18 ASN HA H 5.908 -6.103 -2.492 1.00 . A A . 450 ASN HA 1 1 15 6870 1 1 18 ASN HB2 H 8.241 -5.530 -1.873 1.00 . A A . 450 ASN HB2 1 1 15 6871 1 1 18 ASN HB3 H 7.136 -4.177 -1.673 1.00 . A A . 450 ASN HB3 1 1 15 6872 1 1 18 ASN HD21 H 8.434 -3.115 -0.222 1.00 . A A . 450 ASN HD21 1 1 15 6873 1 1 18 ASN HD22 H 8.696 -3.679 1.392 1.00 . A A . 450 ASN HD22 1 1 15 6874 1 1 18 ASN N N 5.077 -5.650 -0.664 1.00 . A A . 450 ASN N 1 1 15 6875 1 1 18 ASN ND2 N 8.384 -3.811 0.471 1.00 . A A . 450 ASN ND2 1 1 15 6876 1 1 18 ASN O O 7.492 -8.121 -1.659 1.00 . A A . 450 ASN O 1 1 15 6877 1 1 18 ASN OD1 O 7.777 -5.905 0.959 1.00 . A A . 450 ASN OD1 1 1 15 6878 1 1 19 ARG C C 5.351 -10.388 -0.509 1.00 . A A . 451 ARG C 1 1 15 6879 1 1 19 ARG CA C 6.125 -9.415 0.374 1.00 . A A . 451 ARG CA 1 1 15 6880 1 1 19 ARG CB C 5.687 -9.611 1.832 1.00 . A A . 451 ARG CB 1 1 15 6881 1 1 19 ARG CD C 7.762 -8.681 2.944 1.00 . A A . 451 ARG CD 1 1 15 6882 1 1 19 ARG CG C 6.248 -8.592 2.814 1.00 . A A . 451 ARG CG 1 1 15 6883 1 1 19 ARG CZ C 9.382 -7.256 4.163 1.00 . A A . 451 ARG CZ 1 1 15 6884 1 1 19 ARG H H 5.219 -7.498 0.381 1.00 . A A . 451 ARG H 1 1 15 6885 1 1 19 ARG HA H 7.177 -9.623 0.292 1.00 . A A . 451 ARG HA 1 1 15 6886 1 1 19 ARG HB2 H 4.610 -9.560 1.878 1.00 . A A . 451 ARG HB2 1 1 15 6887 1 1 19 ARG HB3 H 6.000 -10.594 2.154 1.00 . A A . 451 ARG HB3 1 1 15 6888 1 1 19 ARG HD2 H 8.042 -9.718 3.048 1.00 . A A . 451 ARG HD2 1 1 15 6889 1 1 19 ARG HD3 H 8.216 -8.270 2.054 1.00 . A A . 451 ARG HD3 1 1 15 6890 1 1 19 ARG HE H 7.661 -7.947 4.920 1.00 . A A . 451 ARG HE 1 1 15 6891 1 1 19 ARG HG2 H 5.989 -7.602 2.471 1.00 . A A . 451 ARG HG2 1 1 15 6892 1 1 19 ARG HG3 H 5.804 -8.763 3.784 1.00 . A A . 451 ARG HG3 1 1 15 6893 1 1 19 ARG HH11 H 9.943 -7.674 2.264 1.00 . A A . 451 ARG HH11 1 1 15 6894 1 1 19 ARG HH12 H 11.053 -6.688 3.165 1.00 . A A . 451 ARG HH12 1 1 15 6895 1 1 19 ARG HH21 H 9.113 -6.645 6.080 1.00 . A A . 451 ARG HH21 1 1 15 6896 1 1 19 ARG HH22 H 10.581 -6.099 5.319 1.00 . A A . 451 ARG HH22 1 1 15 6897 1 1 19 ARG N N 5.902 -8.048 -0.071 1.00 . A A . 451 ARG N 1 1 15 6898 1 1 19 ARG NE N 8.239 -7.935 4.111 1.00 . A A . 451 ARG NE 1 1 15 6899 1 1 19 ARG NH1 N 10.188 -7.203 3.110 1.00 . A A . 451 ARG NH1 1 1 15 6900 1 1 19 ARG NH2 N 9.718 -6.616 5.278 1.00 . A A . 451 ARG NH2 1 1 15 6901 1 1 19 ARG O O 5.843 -11.462 -0.854 1.00 . A A . 451 ARG O 1 1 15 6902 1 1 20 THR C C 2.817 -10.272 -2.943 1.00 . A A . 452 THR C 1 1 15 6903 1 1 20 THR CA C 3.234 -10.888 -1.601 1.00 . A A . 452 THR CA 1 1 15 6904 1 1 20 THR CB C 1.969 -11.190 -0.769 1.00 . A A . 452 THR CB 1 1 15 6905 1 1 20 THR CG2 C 1.307 -12.486 -1.217 1.00 . A A . 452 THR CG2 1 1 15 6906 1 1 20 THR H H 3.802 -9.130 -0.572 1.00 . A A . 452 THR H 1 1 15 6907 1 1 20 THR HA H 3.750 -11.818 -1.783 1.00 . A A . 452 THR HA 1 1 15 6908 1 1 20 THR HB H 1.266 -10.379 -0.898 1.00 . A A . 452 THR HB 1 1 15 6909 1 1 20 THR HG1 H 1.515 -11.162 1.156 1.00 . A A . 452 THR HG1 1 1 15 6910 1 1 20 THR HG21 H 0.421 -12.660 -0.624 1.00 . A A . 452 THR HG21 1 1 15 6911 1 1 20 THR HG22 H 1.996 -13.306 -1.083 1.00 . A A . 452 THR HG22 1 1 15 6912 1 1 20 THR HG23 H 1.035 -12.409 -2.260 1.00 . A A . 452 THR HG23 1 1 15 6913 1 1 20 THR N N 4.125 -10.009 -0.853 1.00 . A A . 452 THR N 1 1 15 6914 1 1 20 THR O O 2.064 -10.882 -3.705 1.00 . A A . 452 THR O 1 1 15 6915 1 1 20 THR OG1 O 2.313 -11.295 0.620 1.00 . A A . 452 THR OG1 1 1 15 6916 1 1 21 LEU C C 1.433 -7.983 -4.392 1.00 . A A . 453 LEU C 1 1 15 6917 1 1 21 LEU CA C 2.925 -8.317 -4.435 1.00 . A A . 453 LEU CA 1 1 15 6918 1 1 21 LEU CB C 3.258 -9.101 -5.715 1.00 . A A . 453 LEU CB 1 1 15 6919 1 1 21 LEU CD1 C 5.561 -9.965 -5.159 1.00 . A A . 453 LEU CD1 1 1 15 6920 1 1 21 LEU CD2 C 4.887 -9.636 -7.539 1.00 . A A . 453 LEU CD2 1 1 15 6921 1 1 21 LEU CG C 4.737 -9.122 -6.118 1.00 . A A . 453 LEU CG 1 1 15 6922 1 1 21 LEU H H 3.952 -8.655 -2.608 1.00 . A A . 453 LEU H 1 1 15 6923 1 1 21 LEU HA H 3.483 -7.391 -4.438 1.00 . A A . 453 LEU HA 1 1 15 6924 1 1 21 LEU HB2 H 2.929 -10.122 -5.579 1.00 . A A . 453 LEU HB2 1 1 15 6925 1 1 21 LEU HB3 H 2.694 -8.669 -6.529 1.00 . A A . 453 LEU HB3 1 1 15 6926 1 1 21 LEU HD11 H 5.487 -9.554 -4.164 1.00 . A A . 453 LEU HD11 1 1 15 6927 1 1 21 LEU HD12 H 6.594 -9.962 -5.475 1.00 . A A . 453 LEU HD12 1 1 15 6928 1 1 21 LEU HD13 H 5.187 -10.977 -5.159 1.00 . A A . 453 LEU HD13 1 1 15 6929 1 1 21 LEU HD21 H 4.349 -8.987 -8.214 1.00 . A A . 453 LEU HD21 1 1 15 6930 1 1 21 LEU HD22 H 4.486 -10.636 -7.605 1.00 . A A . 453 LEU HD22 1 1 15 6931 1 1 21 LEU HD23 H 5.934 -9.649 -7.810 1.00 . A A . 453 LEU HD23 1 1 15 6932 1 1 21 LEU HG H 5.124 -8.114 -6.087 1.00 . A A . 453 LEU HG 1 1 15 6933 1 1 21 LEU N N 3.312 -9.061 -3.227 1.00 . A A . 453 LEU N 1 1 15 6934 1 1 21 LEU O O 0.796 -7.760 -5.419 1.00 . A A . 453 LEU O 1 1 15 6935 1 1 22 GLU C C -0.787 -6.168 -2.881 1.00 . A A . 454 GLU C 1 1 15 6936 1 1 22 GLU CA C -0.499 -7.662 -2.930 1.00 . A A . 454 GLU CA 1 1 15 6937 1 1 22 GLU CB C -0.872 -8.304 -1.587 1.00 . A A . 454 GLU CB 1 1 15 6938 1 1 22 GLU CD C -2.604 -8.475 0.246 1.00 . A A . 454 GLU CD 1 1 15 6939 1 1 22 GLU CG C -2.333 -8.135 -1.204 1.00 . A A . 454 GLU CG 1 1 15 6940 1 1 22 GLU H H 1.533 -7.913 -2.411 1.00 . A A . 454 GLU H 1 1 15 6941 1 1 22 GLU HA H -1.064 -8.120 -3.725 1.00 . A A . 454 GLU HA 1 1 15 6942 1 1 22 GLU HB2 H -0.657 -9.361 -1.635 1.00 . A A . 454 GLU HB2 1 1 15 6943 1 1 22 GLU HB3 H -0.267 -7.861 -0.810 1.00 . A A . 454 GLU HB3 1 1 15 6944 1 1 22 GLU HG2 H -2.621 -7.109 -1.374 1.00 . A A . 454 GLU HG2 1 1 15 6945 1 1 22 GLU HG3 H -2.929 -8.782 -1.823 1.00 . A A . 454 GLU HG3 1 1 15 6946 1 1 22 GLU N N 0.923 -7.876 -3.174 1.00 . A A . 454 GLU N 1 1 15 6947 1 1 22 GLU O O 0.072 -5.391 -2.504 1.00 . A A . 454 GLU O 1 1 15 6948 1 1 22 GLU OE1 O -2.589 -9.674 0.592 1.00 . A A . 454 GLU OE1 1 1 15 6949 1 1 22 GLU OE2 O -2.834 -7.546 1.045 1.00 . A A . 454 GLU OE2 1 1 15 6950 1 1 23 SER C C -3.456 -4.247 -2.023 1.00 . A A . 455 SER C 1 1 15 6951 1 1 23 SER CA C -2.347 -4.363 -3.079 1.00 . A A . 455 SER CA 1 1 15 6952 1 1 23 SER CB C -2.755 -3.732 -4.410 1.00 . A A . 455 SER CB 1 1 15 6953 1 1 23 SER H H -2.617 -6.380 -3.663 1.00 . A A . 455 SER H 1 1 15 6954 1 1 23 SER HA H -1.468 -3.849 -2.714 1.00 . A A . 455 SER HA 1 1 15 6955 1 1 23 SER HB2 H -3.659 -4.193 -4.769 1.00 . A A . 455 SER HB2 1 1 15 6956 1 1 23 SER HB3 H -2.920 -2.675 -4.271 1.00 . A A . 455 SER HB3 1 1 15 6957 1 1 23 SER HG H -0.964 -4.305 -4.951 1.00 . A A . 455 SER HG 1 1 15 6958 1 1 23 SER N N -1.978 -5.752 -3.260 1.00 . A A . 455 SER N 1 1 15 6959 1 1 23 SER O O -4.598 -4.654 -2.253 1.00 . A A . 455 SER O 1 1 15 6960 1 1 23 SER OG O -1.733 -3.912 -5.377 1.00 . A A . 455 SER OG 1 1 15 6961 1 1 24 THR C C -4.503 -2.150 0.324 1.00 . A A . 456 THR C 1 1 15 6962 1 1 24 THR CA C -4.001 -3.591 0.268 1.00 . A A . 456 THR CA 1 1 15 6963 1 1 24 THR CB C -3.265 -3.939 1.579 1.00 . A A . 456 THR CB 1 1 15 6964 1 1 24 THR CG2 C -4.229 -4.453 2.636 1.00 . A A . 456 THR CG2 1 1 15 6965 1 1 24 THR H H -2.172 -3.398 -0.746 1.00 . A A . 456 THR H 1 1 15 6966 1 1 24 THR HA H -4.832 -4.267 0.133 1.00 . A A . 456 THR HA 1 1 15 6967 1 1 24 THR HB H -2.781 -3.048 1.953 1.00 . A A . 456 THR HB 1 1 15 6968 1 1 24 THR HG1 H -2.699 -5.807 1.204 1.00 . A A . 456 THR HG1 1 1 15 6969 1 1 24 THR HG21 H -4.963 -3.694 2.854 1.00 . A A . 456 THR HG21 1 1 15 6970 1 1 24 THR HG22 H -3.681 -4.691 3.537 1.00 . A A . 456 THR HG22 1 1 15 6971 1 1 24 THR HG23 H -4.724 -5.340 2.271 1.00 . A A . 456 THR HG23 1 1 15 6972 1 1 24 THR N N -3.093 -3.727 -0.857 1.00 . A A . 456 THR N 1 1 15 6973 1 1 24 THR O O -3.733 -1.218 0.097 1.00 . A A . 456 THR O 1 1 15 6974 1 1 24 THR OG1 O -2.270 -4.943 1.322 1.00 . A A . 456 THR OG1 1 1 15 6975 1 1 25 TRP C C -7.086 -0.243 1.824 1.00 . A A . 457 TRP C 1 1 15 6976 1 1 25 TRP CA C -6.362 -0.610 0.527 1.00 . A A . 457 TRP CA 1 1 15 6977 1 1 25 TRP CB C -7.268 -0.486 -0.708 1.00 . A A . 457 TRP CB 1 1 15 6978 1 1 25 TRP CD1 C -5.889 -1.734 -2.467 1.00 . A A . 457 TRP CD1 1 1 15 6979 1 1 25 TRP CD2 C -6.113 0.454 -2.875 1.00 . A A . 457 TRP CD2 1 1 15 6980 1 1 25 TRP CE2 C -5.294 -0.114 -3.871 1.00 . A A . 457 TRP CE2 1 1 15 6981 1 1 25 TRP CE3 C -6.402 1.821 -2.942 1.00 . A A . 457 TRP CE3 1 1 15 6982 1 1 25 TRP CG C -6.463 -0.600 -1.970 1.00 . A A . 457 TRP CG 1 1 15 6983 1 1 25 TRP CH2 C -5.052 1.965 -4.953 1.00 . A A . 457 TRP CH2 1 1 15 6984 1 1 25 TRP CZ2 C -4.753 0.629 -4.906 1.00 . A A . 457 TRP CZ2 1 1 15 6985 1 1 25 TRP CZ3 C -5.874 2.562 -3.984 1.00 . A A . 457 TRP CZ3 1 1 15 6986 1 1 25 TRP H H -6.371 -2.728 0.776 1.00 . A A . 457 TRP H 1 1 15 6987 1 1 25 TRP HA H -5.535 0.074 0.407 1.00 . A A . 457 TRP HA 1 1 15 6988 1 1 25 TRP HB2 H -8.006 -1.275 -0.699 1.00 . A A . 457 TRP HB2 1 1 15 6989 1 1 25 TRP HB3 H -7.758 0.475 -0.704 1.00 . A A . 457 TRP HB3 1 1 15 6990 1 1 25 TRP HD1 H -5.974 -2.708 -2.009 1.00 . A A . 457 TRP HD1 1 1 15 6991 1 1 25 TRP HE1 H -4.655 -2.093 -4.121 1.00 . A A . 457 TRP HE1 1 1 15 6992 1 1 25 TRP HE3 H -7.033 2.295 -2.204 1.00 . A A . 457 TRP HE3 1 1 15 6993 1 1 25 TRP HH2 H -4.662 2.581 -5.750 1.00 . A A . 457 TRP HH2 1 1 15 6994 1 1 25 TRP HZ2 H -4.090 0.186 -5.638 1.00 . A A . 457 TRP HZ2 1 1 15 6995 1 1 25 TRP HZ3 H -6.088 3.618 -4.054 1.00 . A A . 457 TRP HZ3 1 1 15 6996 1 1 25 TRP N N -5.791 -1.957 0.575 1.00 . A A . 457 TRP N 1 1 15 6997 1 1 25 TRP NE1 N -5.168 -1.445 -3.591 1.00 . A A . 457 TRP NE1 1 1 15 6998 1 1 25 TRP O O -7.748 0.792 1.910 1.00 . A A . 457 TRP O 1 1 15 6999 1 1 26 GLU C C -6.236 -0.799 5.146 1.00 . A A . 458 GLU C 1 1 15 7000 1 1 26 GLU CA C -7.413 -0.806 4.171 1.00 . A A . 458 GLU CA 1 1 15 7001 1 1 26 GLU CB C -8.449 -1.861 4.594 1.00 . A A . 458 GLU CB 1 1 15 7002 1 1 26 GLU CD C -8.186 -3.906 3.106 1.00 . A A . 458 GLU CD 1 1 15 7003 1 1 26 GLU CG C -7.962 -3.304 4.483 1.00 . A A . 458 GLU CG 1 1 15 7004 1 1 26 GLU H H -6.454 -1.925 2.680 1.00 . A A . 458 GLU H 1 1 15 7005 1 1 26 GLU HA H -7.875 0.170 4.166 1.00 . A A . 458 GLU HA 1 1 15 7006 1 1 26 GLU HB2 H -8.729 -1.680 5.621 1.00 . A A . 458 GLU HB2 1 1 15 7007 1 1 26 GLU HB3 H -9.325 -1.754 3.971 1.00 . A A . 458 GLU HB3 1 1 15 7008 1 1 26 GLU HG2 H -6.904 -3.329 4.701 1.00 . A A . 458 GLU HG2 1 1 15 7009 1 1 26 GLU HG3 H -8.489 -3.904 5.212 1.00 . A A . 458 GLU HG3 1 1 15 7010 1 1 26 GLU N N -6.923 -1.083 2.835 1.00 . A A . 458 GLU N 1 1 15 7011 1 1 26 GLU O O -5.359 -1.660 5.066 1.00 . A A . 458 GLU O 1 1 15 7012 1 1 26 GLU OE1 O -7.373 -3.657 2.190 1.00 . A A . 458 GLU OE1 1 1 15 7013 1 1 26 GLU OE2 O -9.180 -4.644 2.935 1.00 . A A . 458 GLU OE2 1 1 15 7014 1 1 27 LYS C C -5.473 -0.684 8.244 1.00 . A A . 459 LYS C 1 1 15 7015 1 1 27 LYS CA C -5.142 0.215 7.060 1.00 . A A . 459 LYS CA 1 1 15 7016 1 1 27 LYS CB C -4.905 1.644 7.557 1.00 . A A . 459 LYS CB 1 1 15 7017 1 1 27 LYS CD C -3.831 3.887 7.124 1.00 . A A . 459 LYS CD 1 1 15 7018 1 1 27 LYS CE C -2.867 3.761 8.298 1.00 . A A . 459 LYS CE 1 1 15 7019 1 1 27 LYS CG C -4.217 2.533 6.540 1.00 . A A . 459 LYS CG 1 1 15 7020 1 1 27 LYS H H -6.903 0.861 6.059 1.00 . A A . 459 LYS H 1 1 15 7021 1 1 27 LYS HA H -4.237 -0.143 6.595 1.00 . A A . 459 LYS HA 1 1 15 7022 1 1 27 LYS HB2 H -5.857 2.090 7.809 1.00 . A A . 459 LYS HB2 1 1 15 7023 1 1 27 LYS HB3 H -4.290 1.606 8.444 1.00 . A A . 459 LYS HB3 1 1 15 7024 1 1 27 LYS HD2 H -3.361 4.477 6.352 1.00 . A A . 459 LYS HD2 1 1 15 7025 1 1 27 LYS HD3 H -4.728 4.388 7.460 1.00 . A A . 459 LYS HD3 1 1 15 7026 1 1 27 LYS HE2 H -2.677 4.747 8.694 1.00 . A A . 459 LYS HE2 1 1 15 7027 1 1 27 LYS HE3 H -3.332 3.155 9.062 1.00 . A A . 459 LYS HE3 1 1 15 7028 1 1 27 LYS HG2 H -3.328 2.039 6.184 1.00 . A A . 459 LYS HG2 1 1 15 7029 1 1 27 LYS HG3 H -4.891 2.692 5.712 1.00 . A A . 459 LYS HG3 1 1 15 7030 1 1 27 LYS HZ1 H -1.080 3.722 7.188 1.00 . A A . 459 LYS HZ1 1 1 15 7031 1 1 27 LYS HZ2 H -1.723 2.188 7.529 1.00 . A A . 459 LYS HZ2 1 1 15 7032 1 1 27 LYS HZ3 H -0.948 3.066 8.750 1.00 . A A . 459 LYS HZ3 1 1 15 7033 1 1 27 LYS N N -6.202 0.167 6.056 1.00 . A A . 459 LYS N 1 1 15 7034 1 1 27 LYS NZ N -1.567 3.142 7.911 1.00 . A A . 459 LYS NZ 1 1 15 7035 1 1 27 LYS O O -6.481 -0.472 8.920 1.00 . A A . 459 LYS O 1 1 15 7036 1 1 28 PRO C C -4.837 -1.730 10.957 1.00 . A A . 460 PRO C 1 1 15 7037 1 1 28 PRO CA C -4.758 -2.561 9.682 1.00 . A A . 460 PRO CA 1 1 15 7038 1 1 28 PRO CB C -3.468 -3.381 9.666 1.00 . A A . 460 PRO CB 1 1 15 7039 1 1 28 PRO CD C -3.551 -2.169 7.601 1.00 . A A . 460 PRO CD 1 1 15 7040 1 1 28 PRO CG C -3.076 -3.451 8.233 1.00 . A A . 460 PRO CG 1 1 15 7041 1 1 28 PRO HA H -5.612 -3.221 9.624 1.00 . A A . 460 PRO HA 1 1 15 7042 1 1 28 PRO HB2 H -2.715 -2.881 10.257 1.00 . A A . 460 PRO HB2 1 1 15 7043 1 1 28 PRO HB3 H -3.657 -4.364 10.071 1.00 . A A . 460 PRO HB3 1 1 15 7044 1 1 28 PRO HD2 H -2.754 -1.444 7.575 1.00 . A A . 460 PRO HD2 1 1 15 7045 1 1 28 PRO HD3 H -3.921 -2.363 6.603 1.00 . A A . 460 PRO HD3 1 1 15 7046 1 1 28 PRO HG2 H -2.001 -3.532 8.150 1.00 . A A . 460 PRO HG2 1 1 15 7047 1 1 28 PRO HG3 H -3.553 -4.299 7.764 1.00 . A A . 460 PRO HG3 1 1 15 7048 1 1 28 PRO N N -4.644 -1.719 8.489 1.00 . A A . 460 PRO N 1 1 15 7049 1 1 28 PRO O O -3.826 -1.081 11.307 1.00 . A A . 460 PRO O 1 1 15 7050 1 1 28 PRO OXT O -5.907 -1.723 11.602 1.00 . A A . 460 PRO OXT 1 1 16 7051 1 1 1 SER C C 8.324 -2.066 5.401 1.00 . A A . 433 SER C 1 1 16 7052 1 1 1 SER CA C 8.912 -1.057 6.377 1.00 . A A . 433 SER CA 1 1 16 7053 1 1 1 SER CB C 8.946 0.344 5.753 1.00 . A A . 433 SER CB 1 1 16 7054 1 1 1 SER H1 H 10.885 -1.523 5.929 1.00 . A A . 433 SER H1 1 1 16 7055 1 1 1 SER H2 H 10.237 -2.418 7.214 1.00 . A A . 433 SER H2 1 1 16 7056 1 1 1 SER H3 H 10.678 -0.794 7.447 1.00 . A A . 433 SER H3 1 1 16 7057 1 1 1 SER HA H 8.297 -1.036 7.263 1.00 . A A . 433 SER HA 1 1 16 7058 1 1 1 SER HB2 H 9.296 1.053 6.488 1.00 . A A . 433 SER HB2 1 1 16 7059 1 1 1 SER HB3 H 9.620 0.342 4.908 1.00 . A A . 433 SER HB3 1 1 16 7060 1 1 1 SER HG H 7.579 0.577 4.363 1.00 . A A . 433 SER HG 1 1 16 7061 1 1 1 SER N N 10.271 -1.477 6.771 1.00 . A A . 433 SER N 1 1 16 7062 1 1 1 SER O O 8.780 -2.193 4.265 1.00 . A A . 433 SER O 1 1 16 7063 1 1 1 SER OG O 7.659 0.749 5.309 1.00 . A A . 433 SER OG 1 1 16 7064 1 1 2 GLU C C 5.479 -3.356 4.341 1.00 . A A . 434 GLU C 1 1 16 7065 1 1 2 GLU CA C 6.732 -3.855 5.050 1.00 . A A . 434 GLU CA 1 1 16 7066 1 1 2 GLU CB C 6.400 -5.072 5.922 1.00 . A A . 434 GLU CB 1 1 16 7067 1 1 2 GLU CD C 8.356 -4.984 7.560 1.00 . A A . 434 GLU CD 1 1 16 7068 1 1 2 GLU CG C 7.619 -5.789 6.501 1.00 . A A . 434 GLU CG 1 1 16 7069 1 1 2 GLU H H 6.986 -2.644 6.761 1.00 . A A . 434 GLU H 1 1 16 7070 1 1 2 GLU HA H 7.459 -4.146 4.307 1.00 . A A . 434 GLU HA 1 1 16 7071 1 1 2 GLU HB2 H 5.779 -4.749 6.743 1.00 . A A . 434 GLU HB2 1 1 16 7072 1 1 2 GLU HB3 H 5.844 -5.782 5.326 1.00 . A A . 434 GLU HB3 1 1 16 7073 1 1 2 GLU HG2 H 7.291 -6.712 6.951 1.00 . A A . 434 GLU HG2 1 1 16 7074 1 1 2 GLU HG3 H 8.306 -6.008 5.696 1.00 . A A . 434 GLU HG3 1 1 16 7075 1 1 2 GLU N N 7.323 -2.801 5.856 1.00 . A A . 434 GLU N 1 1 16 7076 1 1 2 GLU O O 4.965 -4.007 3.430 1.00 . A A . 434 GLU O 1 1 16 7077 1 1 2 GLU OE1 O 7.929 -5.008 8.734 1.00 . A A . 434 GLU OE1 1 1 16 7078 1 1 2 GLU OE2 O 9.366 -4.323 7.228 1.00 . A A . 434 GLU OE2 1 1 16 7079 1 1 3 TRP C C 4.117 -0.268 3.560 1.00 . A A . 435 TRP C 1 1 16 7080 1 1 3 TRP CA C 3.792 -1.616 4.196 1.00 . A A . 435 TRP CA 1 1 16 7081 1 1 3 TRP CB C 2.723 -1.430 5.279 1.00 . A A . 435 TRP CB 1 1 16 7082 1 1 3 TRP CD1 C 2.382 -2.961 7.307 1.00 . A A . 435 TRP CD1 1 1 16 7083 1 1 3 TRP CD2 C 1.816 -3.885 5.350 1.00 . A A . 435 TRP CD2 1 1 16 7084 1 1 3 TRP CE2 C 1.579 -4.820 6.373 1.00 . A A . 435 TRP CE2 1 1 16 7085 1 1 3 TRP CE3 C 1.538 -4.245 4.029 1.00 . A A . 435 TRP CE3 1 1 16 7086 1 1 3 TRP CG C 2.323 -2.699 5.967 1.00 . A A . 435 TRP CG 1 1 16 7087 1 1 3 TRP CH2 C 0.811 -6.414 4.817 1.00 . A A . 435 TRP CH2 1 1 16 7088 1 1 3 TRP CZ2 C 1.074 -6.089 6.117 1.00 . A A . 435 TRP CZ2 1 1 16 7089 1 1 3 TRP CZ3 C 1.038 -5.505 3.779 1.00 . A A . 435 TRP CZ3 1 1 16 7090 1 1 3 TRP H H 5.465 -1.717 5.476 1.00 . A A . 435 TRP H 1 1 16 7091 1 1 3 TRP HA H 3.421 -2.294 3.443 1.00 . A A . 435 TRP HA 1 1 16 7092 1 1 3 TRP HB2 H 3.099 -0.751 6.029 1.00 . A A . 435 TRP HB2 1 1 16 7093 1 1 3 TRP HB3 H 1.839 -1.003 4.829 1.00 . A A . 435 TRP HB3 1 1 16 7094 1 1 3 TRP HD1 H 2.729 -2.260 8.051 1.00 . A A . 435 TRP HD1 1 1 16 7095 1 1 3 TRP HE1 H 1.870 -4.657 8.446 1.00 . A A . 435 TRP HE1 1 1 16 7096 1 1 3 TRP HE3 H 1.709 -3.558 3.213 1.00 . A A . 435 TRP HE3 1 1 16 7097 1 1 3 TRP HH2 H 0.419 -7.391 4.571 1.00 . A A . 435 TRP HH2 1 1 16 7098 1 1 3 TRP HZ2 H 0.892 -6.802 6.909 1.00 . A A . 435 TRP HZ2 1 1 16 7099 1 1 3 TRP HZ3 H 0.824 -5.805 2.764 1.00 . A A . 435 TRP HZ3 1 1 16 7100 1 1 3 TRP N N 4.996 -2.199 4.765 1.00 . A A . 435 TRP N 1 1 16 7101 1 1 3 TRP NE1 N 1.929 -4.234 7.558 1.00 . A A . 435 TRP NE1 1 1 16 7102 1 1 3 TRP O O 4.722 0.593 4.203 1.00 . A A . 435 TRP O 1 1 16 7103 1 1 4 THR C C 2.724 2.064 1.667 1.00 . A A . 436 THR C 1 1 16 7104 1 1 4 THR CA C 3.960 1.178 1.621 1.00 . A A . 436 THR CA 1 1 16 7105 1 1 4 THR CB C 4.362 0.951 0.147 1.00 . A A . 436 THR CB 1 1 16 7106 1 1 4 THR CG2 C 4.501 2.275 -0.600 1.00 . A A . 436 THR CG2 1 1 16 7107 1 1 4 THR H H 3.256 -0.799 1.826 1.00 . A A . 436 THR H 1 1 16 7108 1 1 4 THR HA H 4.772 1.684 2.120 1.00 . A A . 436 THR HA 1 1 16 7109 1 1 4 THR HB H 3.591 0.367 -0.333 1.00 . A A . 436 THR HB 1 1 16 7110 1 1 4 THR HG1 H 5.747 -0.215 0.927 1.00 . A A . 436 THR HG1 1 1 16 7111 1 1 4 THR HG21 H 4.819 2.086 -1.615 1.00 . A A . 436 THR HG21 1 1 16 7112 1 1 4 THR HG22 H 5.232 2.896 -0.102 1.00 . A A . 436 THR HG22 1 1 16 7113 1 1 4 THR HG23 H 3.546 2.784 -0.610 1.00 . A A . 436 THR HG23 1 1 16 7114 1 1 4 THR N N 3.725 -0.080 2.304 1.00 . A A . 436 THR N 1 1 16 7115 1 1 4 THR O O 1.714 1.759 1.034 1.00 . A A . 436 THR O 1 1 16 7116 1 1 4 THR OG1 O 5.596 0.227 0.086 1.00 . A A . 436 THR OG1 1 1 16 7117 1 1 5 GLU C C 2.095 5.172 1.330 1.00 . A A . 437 GLU C 1 1 16 7118 1 1 5 GLU CA C 1.761 4.158 2.415 1.00 . A A . 437 GLU CA 1 1 16 7119 1 1 5 GLU CB C 1.656 4.872 3.767 1.00 . A A . 437 GLU CB 1 1 16 7120 1 1 5 GLU CD C 0.499 3.171 5.267 1.00 . A A . 437 GLU CD 1 1 16 7121 1 1 5 GLU CG C 1.761 3.960 4.982 1.00 . A A . 437 GLU CG 1 1 16 7122 1 1 5 GLU H H 3.596 3.284 2.992 1.00 . A A . 437 GLU H 1 1 16 7123 1 1 5 GLU HA H 0.820 3.676 2.181 1.00 . A A . 437 GLU HA 1 1 16 7124 1 1 5 GLU HB2 H 2.447 5.606 3.831 1.00 . A A . 437 GLU HB2 1 1 16 7125 1 1 5 GLU HB3 H 0.705 5.386 3.814 1.00 . A A . 437 GLU HB3 1 1 16 7126 1 1 5 GLU HG2 H 2.568 3.262 4.820 1.00 . A A . 437 GLU HG2 1 1 16 7127 1 1 5 GLU HG3 H 1.987 4.567 5.847 1.00 . A A . 437 GLU HG3 1 1 16 7128 1 1 5 GLU N N 2.806 3.150 2.421 1.00 . A A . 437 GLU N 1 1 16 7129 1 1 5 GLU O O 2.878 6.100 1.554 1.00 . A A . 437 GLU O 1 1 16 7130 1 1 5 GLU OE1 O -0.513 3.784 5.668 1.00 . A A . 437 GLU OE1 1 1 16 7131 1 1 5 GLU OE2 O 0.530 1.931 5.154 1.00 . A A . 437 GLU OE2 1 1 16 7132 1 1 6 ARG C C 0.758 6.578 -1.532 1.00 . A A . 438 ARG C 1 1 16 7133 1 1 6 ARG CA C 1.953 5.776 -1.002 1.00 . A A . 438 ARG CA 1 1 16 7134 1 1 6 ARG CB C 2.522 4.880 -2.107 1.00 . A A . 438 ARG CB 1 1 16 7135 1 1 6 ARG CD C 3.511 4.727 -4.413 1.00 . A A . 438 ARG CD 1 1 16 7136 1 1 6 ARG CG C 2.783 5.609 -3.414 1.00 . A A . 438 ARG CG 1 1 16 7137 1 1 6 ARG CZ C 5.910 4.503 -4.920 1.00 . A A . 438 ARG CZ 1 1 16 7138 1 1 6 ARG H H 0.888 4.256 0.026 1.00 . A A . 438 ARG H 1 1 16 7139 1 1 6 ARG HA H 2.728 6.444 -0.657 1.00 . A A . 438 ARG HA 1 1 16 7140 1 1 6 ARG HB2 H 3.454 4.454 -1.764 1.00 . A A . 438 ARG HB2 1 1 16 7141 1 1 6 ARG HB3 H 1.822 4.081 -2.299 1.00 . A A . 438 ARG HB3 1 1 16 7142 1 1 6 ARG HD2 H 3.016 3.769 -4.455 1.00 . A A . 438 ARG HD2 1 1 16 7143 1 1 6 ARG HD3 H 3.469 5.196 -5.386 1.00 . A A . 438 ARG HD3 1 1 16 7144 1 1 6 ARG HE H 5.114 4.409 -3.092 1.00 . A A . 438 ARG HE 1 1 16 7145 1 1 6 ARG HG2 H 1.839 5.915 -3.840 1.00 . A A . 438 ARG HG2 1 1 16 7146 1 1 6 ARG HG3 H 3.387 6.482 -3.213 1.00 . A A . 438 ARG HG3 1 1 16 7147 1 1 6 ARG HH11 H 4.725 4.738 -6.559 1.00 . A A . 438 ARG HH11 1 1 16 7148 1 1 6 ARG HH12 H 6.434 4.607 -6.883 1.00 . A A . 438 ARG HH12 1 1 16 7149 1 1 6 ARG HH21 H 7.336 4.247 -3.505 1.00 . A A . 438 ARG HH21 1 1 16 7150 1 1 6 ARG HH22 H 7.917 4.377 -5.141 1.00 . A A . 438 ARG HH22 1 1 16 7151 1 1 6 ARG N N 1.564 4.964 0.139 1.00 . A A . 438 ARG N 1 1 16 7152 1 1 6 ARG NE N 4.908 4.522 -4.045 1.00 . A A . 438 ARG NE 1 1 16 7153 1 1 6 ARG NH1 N 5.670 4.627 -6.222 1.00 . A A . 438 ARG NH1 1 1 16 7154 1 1 6 ARG NH2 N 7.152 4.354 -4.490 1.00 . A A . 438 ARG NH2 1 1 16 7155 1 1 6 ARG O O -0.363 6.081 -1.518 1.00 . A A . 438 ARG O 1 1 16 7156 1 1 7 LYS C C -0.124 8.591 -4.056 1.00 . A A . 439 LYS C 1 1 16 7157 1 1 7 LYS CA C -0.084 8.624 -2.533 1.00 . A A . 439 LYS CA 1 1 16 7158 1 1 7 LYS CB C 0.087 10.061 -2.025 1.00 . A A . 439 LYS CB 1 1 16 7159 1 1 7 LYS CD C 1.600 12.054 -1.743 1.00 . A A . 439 LYS CD 1 1 16 7160 1 1 7 LYS CE C 2.922 12.697 -2.140 1.00 . A A . 439 LYS CE 1 1 16 7161 1 1 7 LYS CG C 1.433 10.681 -2.372 1.00 . A A . 439 LYS CG 1 1 16 7162 1 1 7 LYS H H 1.910 8.131 -2.106 1.00 . A A . 439 LYS H 1 1 16 7163 1 1 7 LYS HA H -1.010 8.225 -2.153 1.00 . A A . 439 LYS HA 1 1 16 7164 1 1 7 LYS HB2 H -0.691 10.678 -2.453 1.00 . A A . 439 LYS HB2 1 1 16 7165 1 1 7 LYS HB3 H -0.017 10.062 -0.951 1.00 . A A . 439 LYS HB3 1 1 16 7166 1 1 7 LYS HD2 H 0.792 12.691 -2.069 1.00 . A A . 439 LYS HD2 1 1 16 7167 1 1 7 LYS HD3 H 1.569 11.953 -0.669 1.00 . A A . 439 LYS HD3 1 1 16 7168 1 1 7 LYS HE2 H 2.924 12.851 -3.207 1.00 . A A . 439 LYS HE2 1 1 16 7169 1 1 7 LYS HE3 H 3.008 13.649 -1.638 1.00 . A A . 439 LYS HE3 1 1 16 7170 1 1 7 LYS HG2 H 2.218 10.034 -2.013 1.00 . A A . 439 LYS HG2 1 1 16 7171 1 1 7 LYS HG3 H 1.509 10.777 -3.446 1.00 . A A . 439 LYS HG3 1 1 16 7172 1 1 7 LYS HZ1 H 4.054 11.607 -0.758 1.00 . A A . 439 LYS HZ1 1 1 16 7173 1 1 7 LYS HZ2 H 4.978 12.364 -1.962 1.00 . A A . 439 LYS HZ2 1 1 16 7174 1 1 7 LYS HZ3 H 4.088 10.972 -2.334 1.00 . A A . 439 LYS HZ3 1 1 16 7175 1 1 7 LYS N N 0.994 7.793 -2.037 1.00 . A A . 439 LYS N 1 1 16 7176 1 1 7 LYS NZ N 4.089 11.850 -1.774 1.00 . A A . 439 LYS NZ 1 1 16 7177 1 1 7 LYS O O 0.865 8.897 -4.727 1.00 . A A . 439 LYS O 1 1 16 7178 1 1 8 THR C C -2.045 9.565 -6.445 1.00 . A A . 440 THR C 1 1 16 7179 1 1 8 THR CA C -1.454 8.220 -6.032 1.00 . A A . 440 THR CA 1 1 16 7180 1 1 8 THR CB C -2.360 7.064 -6.521 1.00 . A A . 440 THR CB 1 1 16 7181 1 1 8 THR CG2 C -3.766 7.173 -5.949 1.00 . A A . 440 THR CG2 1 1 16 7182 1 1 8 THR H H -1.975 7.851 -4.013 1.00 . A A . 440 THR H 1 1 16 7183 1 1 8 THR HA H -0.484 8.111 -6.499 1.00 . A A . 440 THR HA 1 1 16 7184 1 1 8 THR HB H -1.931 6.129 -6.195 1.00 . A A . 440 THR HB 1 1 16 7185 1 1 8 THR HG1 H -1.587 6.772 -8.320 1.00 . A A . 440 THR HG1 1 1 16 7186 1 1 8 THR HG21 H -4.355 6.334 -6.286 1.00 . A A . 440 THR HG21 1 1 16 7187 1 1 8 THR HG22 H -4.219 8.093 -6.289 1.00 . A A . 440 THR HG22 1 1 16 7188 1 1 8 THR HG23 H -3.716 7.173 -4.871 1.00 . A A . 440 THR HG23 1 1 16 7189 1 1 8 THR N N -1.256 8.186 -4.596 1.00 . A A . 440 THR N 1 1 16 7190 1 1 8 THR O O -2.783 10.191 -5.674 1.00 . A A . 440 THR O 1 1 16 7191 1 1 8 THR OG1 O -2.435 7.067 -7.952 1.00 . A A . 440 THR OG1 1 1 16 7192 1 1 9 ALA C C -3.662 11.382 -8.354 1.00 . A A . 441 ALA C 1 1 16 7193 1 1 9 ALA CA C -2.150 11.302 -8.168 1.00 . A A . 441 ALA CA 1 1 16 7194 1 1 9 ALA CB C -1.446 11.605 -9.480 1.00 . A A . 441 ALA CB 1 1 16 7195 1 1 9 ALA H H -1.183 9.422 -8.240 1.00 . A A . 441 ALA H 1 1 16 7196 1 1 9 ALA HA H -1.848 12.049 -7.450 1.00 . A A . 441 ALA HA 1 1 16 7197 1 1 9 ALA HB1 H -0.378 11.559 -9.331 1.00 . A A . 441 ALA HB1 1 1 16 7198 1 1 9 ALA HB2 H -1.720 12.595 -9.817 1.00 . A A . 441 ALA HB2 1 1 16 7199 1 1 9 ALA HB3 H -1.739 10.877 -10.222 1.00 . A A . 441 ALA HB3 1 1 16 7200 1 1 9 ALA N N -1.727 9.998 -7.662 1.00 . A A . 441 ALA N 1 1 16 7201 1 1 9 ALA O O -4.195 12.419 -8.744 1.00 . A A . 441 ALA O 1 1 16 7202 1 1 10 ASP C C -6.367 10.821 -6.824 1.00 . A A . 442 ASP C 1 1 16 7203 1 1 10 ASP CA C -5.804 10.250 -8.127 1.00 . A A . 442 ASP CA 1 1 16 7204 1 1 10 ASP CB C -6.301 8.816 -8.353 1.00 . A A . 442 ASP CB 1 1 16 7205 1 1 10 ASP CG C -7.794 8.742 -8.603 1.00 . A A . 442 ASP CG 1 1 16 7206 1 1 10 ASP H H -3.860 9.457 -7.863 1.00 . A A . 442 ASP H 1 1 16 7207 1 1 10 ASP HA H -6.126 10.871 -8.949 1.00 . A A . 442 ASP HA 1 1 16 7208 1 1 10 ASP HB2 H -5.793 8.400 -9.209 1.00 . A A . 442 ASP HB2 1 1 16 7209 1 1 10 ASP HB3 H -6.072 8.222 -7.480 1.00 . A A . 442 ASP HB3 1 1 16 7210 1 1 10 ASP N N -4.348 10.278 -8.087 1.00 . A A . 442 ASP N 1 1 16 7211 1 1 10 ASP O O -7.580 10.954 -6.650 1.00 . A A . 442 ASP O 1 1 16 7212 1 1 10 ASP OD1 O -8.251 9.228 -9.660 1.00 . A A . 442 ASP OD1 1 1 16 7213 1 1 10 ASP OD2 O -8.518 8.184 -7.754 1.00 . A A . 442 ASP OD2 1 1 16 7214 1 1 11 GLY C C -6.211 10.748 -3.596 1.00 . A A . 443 GLY C 1 1 16 7215 1 1 11 GLY CA C -5.866 11.772 -4.654 1.00 . A A . 443 GLY CA 1 1 16 7216 1 1 11 GLY H H -4.516 10.993 -6.086 1.00 . A A . 443 GLY H 1 1 16 7217 1 1 11 GLY HA2 H -5.056 12.387 -4.294 1.00 . A A . 443 GLY HA2 1 1 16 7218 1 1 11 GLY HA3 H -6.729 12.399 -4.829 1.00 . A A . 443 GLY HA3 1 1 16 7219 1 1 11 GLY N N -5.468 11.160 -5.907 1.00 . A A . 443 GLY N 1 1 16 7220 1 1 11 GLY O O -7.134 10.949 -2.807 1.00 . A A . 443 GLY O 1 1 16 7221 1 1 12 LYS C C -4.422 7.980 -2.114 1.00 . A A . 444 LYS C 1 1 16 7222 1 1 12 LYS CA C -5.726 8.575 -2.623 1.00 . A A . 444 LYS CA 1 1 16 7223 1 1 12 LYS CB C -6.563 7.462 -3.267 1.00 . A A . 444 LYS CB 1 1 16 7224 1 1 12 LYS CD C -8.683 6.787 -4.423 1.00 . A A . 444 LYS CD 1 1 16 7225 1 1 12 LYS CE C -10.073 7.225 -4.843 1.00 . A A . 444 LYS CE 1 1 16 7226 1 1 12 LYS CG C -7.947 7.903 -3.706 1.00 . A A . 444 LYS CG 1 1 16 7227 1 1 12 LYS H H -4.717 9.566 -4.204 1.00 . A A . 444 LYS H 1 1 16 7228 1 1 12 LYS HA H -6.270 8.991 -1.791 1.00 . A A . 444 LYS HA 1 1 16 7229 1 1 12 LYS HB2 H -6.042 7.081 -4.131 1.00 . A A . 444 LYS HB2 1 1 16 7230 1 1 12 LYS HB3 H -6.678 6.659 -2.551 1.00 . A A . 444 LYS HB3 1 1 16 7231 1 1 12 LYS HD2 H -8.124 6.505 -5.303 1.00 . A A . 444 LYS HD2 1 1 16 7232 1 1 12 LYS HD3 H -8.768 5.939 -3.761 1.00 . A A . 444 LYS HD3 1 1 16 7233 1 1 12 LYS HE2 H -10.522 6.438 -5.430 1.00 . A A . 444 LYS HE2 1 1 16 7234 1 1 12 LYS HE3 H -10.665 7.396 -3.956 1.00 . A A . 444 LYS HE3 1 1 16 7235 1 1 12 LYS HG2 H -8.516 8.194 -2.834 1.00 . A A . 444 LYS HG2 1 1 16 7236 1 1 12 LYS HG3 H -7.851 8.747 -4.375 1.00 . A A . 444 LYS HG3 1 1 16 7237 1 1 12 LYS HZ1 H -11.004 8.741 -5.941 1.00 . A A . 444 LYS HZ1 1 1 16 7238 1 1 12 LYS HZ2 H -9.454 8.331 -6.507 1.00 . A A . 444 LYS HZ2 1 1 16 7239 1 1 12 LYS HZ3 H -9.628 9.246 -5.092 1.00 . A A . 444 LYS HZ3 1 1 16 7240 1 1 12 LYS N N -5.469 9.650 -3.576 1.00 . A A . 444 LYS N 1 1 16 7241 1 1 12 LYS NZ N -10.037 8.472 -5.649 1.00 . A A . 444 LYS NZ 1 1 16 7242 1 1 12 LYS O O -3.502 7.717 -2.891 1.00 . A A . 444 LYS O 1 1 16 7243 1 1 13 THR C C -3.574 5.537 -0.227 1.00 . A A . 445 THR C 1 1 16 7244 1 1 13 THR CA C -3.236 7.029 -0.245 1.00 . A A . 445 THR CA 1 1 16 7245 1 1 13 THR CB C -2.879 7.534 1.175 1.00 . A A . 445 THR CB 1 1 16 7246 1 1 13 THR CG2 C -4.043 7.371 2.144 1.00 . A A . 445 THR CG2 1 1 16 7247 1 1 13 THR H H -5.066 8.075 -0.228 1.00 . A A . 445 THR H 1 1 16 7248 1 1 13 THR HA H -2.382 7.188 -0.887 1.00 . A A . 445 THR HA 1 1 16 7249 1 1 13 THR HB H -2.640 8.588 1.106 1.00 . A A . 445 THR HB 1 1 16 7250 1 1 13 THR HG1 H -1.307 7.371 2.355 1.00 . A A . 445 THR HG1 1 1 16 7251 1 1 13 THR HG21 H -3.749 7.717 3.123 1.00 . A A . 445 THR HG21 1 1 16 7252 1 1 13 THR HG22 H -4.320 6.327 2.201 1.00 . A A . 445 THR HG22 1 1 16 7253 1 1 13 THR HG23 H -4.887 7.949 1.797 1.00 . A A . 445 THR HG23 1 1 16 7254 1 1 13 THR N N -4.352 7.754 -0.815 1.00 . A A . 445 THR N 1 1 16 7255 1 1 13 THR O O -4.664 5.144 0.207 1.00 . A A . 445 THR O 1 1 16 7256 1 1 13 THR OG1 O -1.734 6.836 1.678 1.00 . A A . 445 THR OG1 1 1 16 7257 1 1 14 TYR C C -1.765 2.506 -0.283 1.00 . A A . 446 TYR C 1 1 16 7258 1 1 14 TYR CA C -2.927 3.291 -0.838 1.00 . A A . 446 TYR CA 1 1 16 7259 1 1 14 TYR CB C -3.196 2.890 -2.288 1.00 . A A . 446 TYR CB 1 1 16 7260 1 1 14 TYR CD1 C -1.587 4.188 -3.754 1.00 . A A . 446 TYR CD1 1 1 16 7261 1 1 14 TYR CD2 C -1.324 1.821 -3.602 1.00 . A A . 446 TYR CD2 1 1 16 7262 1 1 14 TYR CE1 C -0.520 4.253 -4.629 1.00 . A A . 446 TYR CE1 1 1 16 7263 1 1 14 TYR CE2 C -0.254 1.881 -4.472 1.00 . A A . 446 TYR CE2 1 1 16 7264 1 1 14 TYR CG C -2.008 2.972 -3.225 1.00 . A A . 446 TYR CG 1 1 16 7265 1 1 14 TYR CZ C 0.144 3.097 -4.984 1.00 . A A . 446 TYR CZ 1 1 16 7266 1 1 14 TYR H H -1.802 5.067 -1.040 1.00 . A A . 446 TYR H 1 1 16 7267 1 1 14 TYR HA H -3.804 3.073 -0.247 1.00 . A A . 446 TYR HA 1 1 16 7268 1 1 14 TYR HB2 H -3.547 1.869 -2.302 1.00 . A A . 446 TYR HB2 1 1 16 7269 1 1 14 TYR HB3 H -3.974 3.528 -2.686 1.00 . A A . 446 TYR HB3 1 1 16 7270 1 1 14 TYR HD1 H -2.109 5.091 -3.473 1.00 . A A . 446 TYR HD1 1 1 16 7271 1 1 14 TYR HD2 H -1.637 0.869 -3.198 1.00 . A A . 446 TYR HD2 1 1 16 7272 1 1 14 TYR HE1 H -0.207 5.206 -5.030 1.00 . A A . 446 TYR HE1 1 1 16 7273 1 1 14 TYR HE2 H 0.265 0.976 -4.750 1.00 . A A . 446 TYR HE2 1 1 16 7274 1 1 14 TYR HH H 1.181 2.377 -6.444 1.00 . A A . 446 TYR HH 1 1 16 7275 1 1 14 TYR N N -2.672 4.712 -0.737 1.00 . A A . 446 TYR N 1 1 16 7276 1 1 14 TYR O O -0.605 2.922 -0.390 1.00 . A A . 446 TYR O 1 1 16 7277 1 1 14 TYR OH O 1.204 3.156 -5.860 1.00 . A A . 446 TYR OH 1 1 16 7278 1 1 15 TYR C C -0.689 -0.627 0.065 1.00 . A A . 447 TYR C 1 1 16 7279 1 1 15 TYR CA C -1.073 0.558 0.942 1.00 . A A . 447 TYR CA 1 1 16 7280 1 1 15 TYR CB C -1.599 0.090 2.303 1.00 . A A . 447 TYR CB 1 1 16 7281 1 1 15 TYR CD1 C -2.201 2.350 3.279 1.00 . A A . 447 TYR CD1 1 1 16 7282 1 1 15 TYR CD2 C -3.908 0.695 3.126 1.00 . A A . 447 TYR CD2 1 1 16 7283 1 1 15 TYR CE1 C -3.110 3.238 3.821 1.00 . A A . 447 TYR CE1 1 1 16 7284 1 1 15 TYR CE2 C -4.819 1.576 3.670 1.00 . A A . 447 TYR CE2 1 1 16 7285 1 1 15 TYR CG C -2.586 1.061 2.922 1.00 . A A . 447 TYR CG 1 1 16 7286 1 1 15 TYR CZ C -4.416 2.847 4.015 1.00 . A A . 447 TYR CZ 1 1 16 7287 1 1 15 TYR H H -2.994 1.025 0.241 1.00 . A A . 447 TYR H 1 1 16 7288 1 1 15 TYR HA H -0.203 1.178 1.096 1.00 . A A . 447 TYR HA 1 1 16 7289 1 1 15 TYR HB2 H -2.098 -0.861 2.182 1.00 . A A . 447 TYR HB2 1 1 16 7290 1 1 15 TYR HB3 H -0.769 -0.026 2.984 1.00 . A A . 447 TYR HB3 1 1 16 7291 1 1 15 TYR HD1 H -1.176 2.653 3.128 1.00 . A A . 447 TYR HD1 1 1 16 7292 1 1 15 TYR HD2 H -4.224 -0.303 2.858 1.00 . A A . 447 TYR HD2 1 1 16 7293 1 1 15 TYR HE1 H -2.791 4.235 4.094 1.00 . A A . 447 TYR HE1 1 1 16 7294 1 1 15 TYR HE2 H -5.843 1.268 3.824 1.00 . A A . 447 TYR HE2 1 1 16 7295 1 1 15 TYR HH H -5.858 3.272 5.213 1.00 . A A . 447 TYR HH 1 1 16 7296 1 1 15 TYR N N -2.072 1.355 0.280 1.00 . A A . 447 TYR N 1 1 16 7297 1 1 15 TYR O O -1.414 -1.616 -0.037 1.00 . A A . 447 TYR O 1 1 16 7298 1 1 15 TYR OH O -5.323 3.729 4.559 1.00 . A A . 447 TYR OH 1 1 16 7299 1 1 16 TYR C C 1.811 -2.526 -0.599 1.00 . A A . 448 TYR C 1 1 16 7300 1 1 16 TYR CA C 0.916 -1.604 -1.426 1.00 . A A . 448 TYR CA 1 1 16 7301 1 1 16 TYR CB C 1.685 -1.072 -2.635 1.00 . A A . 448 TYR CB 1 1 16 7302 1 1 16 TYR CD1 C 1.389 -2.946 -4.306 1.00 . A A . 448 TYR CD1 1 1 16 7303 1 1 16 TYR CD2 C 3.600 -2.422 -3.587 1.00 . A A . 448 TYR CD2 1 1 16 7304 1 1 16 TYR CE1 C 1.885 -3.950 -5.115 1.00 . A A . 448 TYR CE1 1 1 16 7305 1 1 16 TYR CE2 C 4.104 -3.424 -4.395 1.00 . A A . 448 TYR CE2 1 1 16 7306 1 1 16 TYR CG C 2.235 -2.165 -3.529 1.00 . A A . 448 TYR CG 1 1 16 7307 1 1 16 TYR CZ C 3.243 -4.186 -5.155 1.00 . A A . 448 TYR CZ 1 1 16 7308 1 1 16 TYR H H 0.895 0.343 -0.624 1.00 . A A . 448 TYR H 1 1 16 7309 1 1 16 TYR HA H 0.056 -2.158 -1.775 1.00 . A A . 448 TYR HA 1 1 16 7310 1 1 16 TYR HB2 H 1.029 -0.452 -3.229 1.00 . A A . 448 TYR HB2 1 1 16 7311 1 1 16 TYR HB3 H 2.519 -0.478 -2.288 1.00 . A A . 448 TYR HB3 1 1 16 7312 1 1 16 TYR HD1 H 0.325 -2.759 -4.273 1.00 . A A . 448 TYR HD1 1 1 16 7313 1 1 16 TYR HD2 H 4.272 -1.824 -2.989 1.00 . A A . 448 TYR HD2 1 1 16 7314 1 1 16 TYR HE1 H 1.212 -4.546 -5.711 1.00 . A A . 448 TYR HE1 1 1 16 7315 1 1 16 TYR HE2 H 5.167 -3.609 -4.423 1.00 . A A . 448 TYR HE2 1 1 16 7316 1 1 16 TYR HH H 3.215 -5.241 -6.774 1.00 . A A . 448 TYR HH 1 1 16 7317 1 1 16 TYR N N 0.431 -0.512 -0.613 1.00 . A A . 448 TYR N 1 1 16 7318 1 1 16 TYR O O 2.729 -2.081 0.096 1.00 . A A . 448 TYR O 1 1 16 7319 1 1 16 TYR OH O 3.742 -5.185 -5.960 1.00 . A A . 448 TYR OH 1 1 16 7320 1 1 17 ASN C C 3.428 -5.330 -0.740 1.00 . A A . 449 ASN C 1 1 16 7321 1 1 17 ASN CA C 2.212 -4.851 0.040 1.00 . A A . 449 ASN CA 1 1 16 7322 1 1 17 ASN CB C 1.222 -6.005 0.260 1.00 . A A . 449 ASN CB 1 1 16 7323 1 1 17 ASN CG C 1.773 -7.192 1.033 1.00 . A A . 449 ASN CG 1 1 16 7324 1 1 17 ASN H H 0.835 -4.092 -1.346 1.00 . A A . 449 ASN H 1 1 16 7325 1 1 17 ASN HA H 2.521 -4.446 0.991 1.00 . A A . 449 ASN HA 1 1 16 7326 1 1 17 ASN HB2 H 0.369 -5.629 0.804 1.00 . A A . 449 ASN HB2 1 1 16 7327 1 1 17 ASN HB3 H 0.888 -6.359 -0.705 1.00 . A A . 449 ASN HB3 1 1 16 7328 1 1 17 ASN HD21 H -0.078 -7.701 1.560 1.00 . A A . 449 ASN HD21 1 1 16 7329 1 1 17 ASN HD22 H 1.186 -8.723 2.148 1.00 . A A . 449 ASN HD22 1 1 16 7330 1 1 17 ASN N N 1.536 -3.814 -0.713 1.00 . A A . 449 ASN N 1 1 16 7331 1 1 17 ASN ND2 N 0.876 -7.948 1.643 1.00 . A A . 449 ASN ND2 1 1 16 7332 1 1 17 ASN O O 3.298 -5.910 -1.817 1.00 . A A . 449 ASN O 1 1 16 7333 1 1 17 ASN OD1 O 2.972 -7.454 1.055 1.00 . A A . 449 ASN OD1 1 1 16 7334 1 1 18 ASN C C 6.367 -6.761 -0.417 1.00 . A A . 450 ASN C 1 1 16 7335 1 1 18 ASN CA C 5.850 -5.403 -0.880 1.00 . A A . 450 ASN CA 1 1 16 7336 1 1 18 ASN CB C 6.891 -4.305 -0.620 1.00 . A A . 450 ASN CB 1 1 16 7337 1 1 18 ASN CG C 8.108 -4.396 -1.528 1.00 . A A . 450 ASN CG 1 1 16 7338 1 1 18 ASN H H 4.645 -4.677 0.700 1.00 . A A . 450 ASN H 1 1 16 7339 1 1 18 ASN HA H 5.642 -5.452 -1.939 1.00 . A A . 450 ASN HA 1 1 16 7340 1 1 18 ASN HB2 H 6.429 -3.341 -0.773 1.00 . A A . 450 ASN HB2 1 1 16 7341 1 1 18 ASN HB3 H 7.226 -4.377 0.404 1.00 . A A . 450 ASN HB3 1 1 16 7342 1 1 18 ASN HD21 H 7.004 -5.109 -3.017 1.00 . A A . 450 ASN HD21 1 1 16 7343 1 1 18 ASN HD22 H 8.687 -4.922 -3.353 1.00 . A A . 450 ASN HD22 1 1 16 7344 1 1 18 ASN N N 4.607 -5.081 -0.193 1.00 . A A . 450 ASN N 1 1 16 7345 1 1 18 ASN ND2 N 7.912 -4.854 -2.757 1.00 . A A . 450 ASN ND2 1 1 16 7346 1 1 18 ASN O O 7.373 -7.260 -0.909 1.00 . A A . 450 ASN O 1 1 16 7347 1 1 18 ASN OD1 O 9.217 -4.036 -1.131 1.00 . A A . 450 ASN OD1 1 1 16 7348 1 1 19 ARG C C 5.702 -9.778 0.102 1.00 . A A . 451 ARG C 1 1 16 7349 1 1 19 ARG CA C 6.036 -8.656 1.079 1.00 . A A . 451 ARG CA 1 1 16 7350 1 1 19 ARG CB C 5.324 -8.928 2.409 1.00 . A A . 451 ARG CB 1 1 16 7351 1 1 19 ARG CD C 4.852 -8.215 4.772 1.00 . A A . 451 ARG CD 1 1 16 7352 1 1 19 ARG CG C 5.453 -7.810 3.433 1.00 . A A . 451 ARG CG 1 1 16 7353 1 1 19 ARG CZ C 2.821 -9.375 5.570 1.00 . A A . 451 ARG CZ 1 1 16 7354 1 1 19 ARG H H 4.834 -6.919 0.860 1.00 . A A . 451 ARG H 1 1 16 7355 1 1 19 ARG HA H 7.099 -8.637 1.246 1.00 . A A . 451 ARG HA 1 1 16 7356 1 1 19 ARG HB2 H 4.273 -9.082 2.214 1.00 . A A . 451 ARG HB2 1 1 16 7357 1 1 19 ARG HB3 H 5.733 -9.829 2.842 1.00 . A A . 451 ARG HB3 1 1 16 7358 1 1 19 ARG HD2 H 5.438 -9.024 5.184 1.00 . A A . 451 ARG HD2 1 1 16 7359 1 1 19 ARG HD3 H 4.892 -7.368 5.440 1.00 . A A . 451 ARG HD3 1 1 16 7360 1 1 19 ARG HE H 2.982 -8.399 3.826 1.00 . A A . 451 ARG HE 1 1 16 7361 1 1 19 ARG HG2 H 6.499 -7.580 3.570 1.00 . A A . 451 ARG HG2 1 1 16 7362 1 1 19 ARG HG3 H 4.937 -6.936 3.066 1.00 . A A . 451 ARG HG3 1 1 16 7363 1 1 19 ARG HH11 H 4.389 -9.422 6.863 1.00 . A A . 451 ARG HH11 1 1 16 7364 1 1 19 ARG HH12 H 2.964 -10.261 7.390 1.00 . A A . 451 ARG HH12 1 1 16 7365 1 1 19 ARG HH21 H 1.071 -9.490 4.532 1.00 . A A . 451 ARG HH21 1 1 16 7366 1 1 19 ARG HH22 H 1.072 -10.283 6.080 1.00 . A A . 451 ARG HH22 1 1 16 7367 1 1 19 ARG N N 5.650 -7.360 0.528 1.00 . A A . 451 ARG N 1 1 16 7368 1 1 19 ARG NE N 3.461 -8.653 4.644 1.00 . A A . 451 ARG NE 1 1 16 7369 1 1 19 ARG NH1 N 3.437 -9.712 6.699 1.00 . A A . 451 ARG NH1 1 1 16 7370 1 1 19 ARG NH2 N 1.557 -9.745 5.375 1.00 . A A . 451 ARG NH2 1 1 16 7371 1 1 19 ARG O O 6.538 -10.626 -0.202 1.00 . A A . 451 ARG O 1 1 16 7372 1 1 20 THR C C 3.528 -10.257 -2.599 1.00 . A A . 452 THR C 1 1 16 7373 1 1 20 THR CA C 3.991 -10.837 -1.263 1.00 . A A . 452 THR CA 1 1 16 7374 1 1 20 THR CB C 2.846 -11.658 -0.620 1.00 . A A . 452 THR CB 1 1 16 7375 1 1 20 THR CG2 C 1.651 -10.774 -0.288 1.00 . A A . 452 THR CG2 1 1 16 7376 1 1 20 THR H H 3.841 -9.080 -0.092 1.00 . A A . 452 THR H 1 1 16 7377 1 1 20 THR HA H 4.820 -11.506 -1.449 1.00 . A A . 452 THR HA 1 1 16 7378 1 1 20 THR HB H 3.215 -12.093 0.298 1.00 . A A . 452 THR HB 1 1 16 7379 1 1 20 THR HG1 H 2.218 -12.348 -2.368 1.00 . A A . 452 THR HG1 1 1 16 7380 1 1 20 THR HG21 H 0.877 -11.374 0.165 1.00 . A A . 452 THR HG21 1 1 16 7381 1 1 20 THR HG22 H 1.273 -10.321 -1.194 1.00 . A A . 452 THR HG22 1 1 16 7382 1 1 20 THR HG23 H 1.957 -9.999 0.400 1.00 . A A . 452 THR HG23 1 1 16 7383 1 1 20 THR N N 4.460 -9.790 -0.366 1.00 . A A . 452 THR N 1 1 16 7384 1 1 20 THR O O 3.108 -10.999 -3.484 1.00 . A A . 452 THR O 1 1 16 7385 1 1 20 THR OG1 O 2.431 -12.717 -1.496 1.00 . A A . 452 THR OG1 1 1 16 7386 1 1 21 LEU C C 1.591 -8.267 -3.923 1.00 . A A . 453 LEU C 1 1 16 7387 1 1 21 LEU CA C 3.115 -8.214 -3.902 1.00 . A A . 453 LEU CA 1 1 16 7388 1 1 21 LEU CB C 3.700 -8.754 -5.217 1.00 . A A . 453 LEU CB 1 1 16 7389 1 1 21 LEU CD1 C 5.682 -9.258 -6.664 1.00 . A A . 453 LEU CD1 1 1 16 7390 1 1 21 LEU CD2 C 5.849 -7.482 -4.907 1.00 . A A . 453 LEU CD2 1 1 16 7391 1 1 21 LEU CG C 5.230 -8.823 -5.279 1.00 . A A . 453 LEU CG 1 1 16 7392 1 1 21 LEU H H 4.052 -8.417 -2.016 1.00 . A A . 453 LEU H 1 1 16 7393 1 1 21 LEU HA H 3.408 -7.180 -3.794 1.00 . A A . 453 LEU HA 1 1 16 7394 1 1 21 LEU HB2 H 3.312 -9.750 -5.373 1.00 . A A . 453 LEU HB2 1 1 16 7395 1 1 21 LEU HB3 H 3.357 -8.122 -6.025 1.00 . A A . 453 LEU HB3 1 1 16 7396 1 1 21 LEU HD11 H 5.244 -10.217 -6.900 1.00 . A A . 453 LEU HD11 1 1 16 7397 1 1 21 LEU HD12 H 6.759 -9.341 -6.682 1.00 . A A . 453 LEU HD12 1 1 16 7398 1 1 21 LEU HD13 H 5.364 -8.528 -7.393 1.00 . A A . 453 LEU HD13 1 1 16 7399 1 1 21 LEU HD21 H 5.576 -7.227 -3.896 1.00 . A A . 453 LEU HD21 1 1 16 7400 1 1 21 LEU HD22 H 5.486 -6.719 -5.581 1.00 . A A . 453 LEU HD22 1 1 16 7401 1 1 21 LEU HD23 H 6.925 -7.547 -4.986 1.00 . A A . 453 LEU HD23 1 1 16 7402 1 1 21 LEU HG H 5.578 -9.561 -4.572 1.00 . A A . 453 LEU HG 1 1 16 7403 1 1 21 LEU N N 3.623 -8.932 -2.730 1.00 . A A . 453 LEU N 1 1 16 7404 1 1 21 LEU O O 0.984 -9.045 -4.657 1.00 . A A . 453 LEU O 1 1 16 7405 1 1 22 GLU C C -0.982 -6.065 -2.760 1.00 . A A . 454 GLU C 1 1 16 7406 1 1 22 GLU CA C -0.448 -7.495 -2.821 1.00 . A A . 454 GLU CA 1 1 16 7407 1 1 22 GLU CB C -0.711 -8.233 -1.500 1.00 . A A . 454 GLU CB 1 1 16 7408 1 1 22 GLU CD C -2.317 -8.900 0.322 1.00 . A A . 454 GLU CD 1 1 16 7409 1 1 22 GLU CG C -2.155 -8.230 -1.030 1.00 . A A . 454 GLU CG 1 1 16 7410 1 1 22 GLU H H 1.535 -6.824 -2.555 1.00 . A A . 454 GLU H 1 1 16 7411 1 1 22 GLU HA H -0.920 -8.025 -3.634 1.00 . A A . 454 GLU HA 1 1 16 7412 1 1 22 GLU HB2 H -0.404 -9.262 -1.616 1.00 . A A . 454 GLU HB2 1 1 16 7413 1 1 22 GLU HB3 H -0.107 -7.778 -0.729 1.00 . A A . 454 GLU HB3 1 1 16 7414 1 1 22 GLU HG2 H -2.499 -7.209 -0.952 1.00 . A A . 454 GLU HG2 1 1 16 7415 1 1 22 GLU HG3 H -2.758 -8.760 -1.750 1.00 . A A . 454 GLU HG3 1 1 16 7416 1 1 22 GLU N N 0.991 -7.469 -3.055 1.00 . A A . 454 GLU N 1 1 16 7417 1 1 22 GLU O O -0.268 -5.158 -2.355 1.00 . A A . 454 GLU O 1 1 16 7418 1 1 22 GLU OE1 O -1.868 -8.321 1.336 1.00 . A A . 454 GLU OE1 1 1 16 7419 1 1 22 GLU OE2 O -2.887 -10.009 0.376 1.00 . A A . 454 GLU OE2 1 1 16 7420 1 1 23 SER C C -3.765 -4.481 -1.883 1.00 . A A . 455 SER C 1 1 16 7421 1 1 23 SER CA C -2.825 -4.544 -3.091 1.00 . A A . 455 SER CA 1 1 16 7422 1 1 23 SER CB C -3.574 -4.235 -4.390 1.00 . A A . 455 SER CB 1 1 16 7423 1 1 23 SER H H -2.747 -6.619 -3.516 1.00 . A A . 455 SER H 1 1 16 7424 1 1 23 SER HA H -2.034 -3.821 -2.956 1.00 . A A . 455 SER HA 1 1 16 7425 1 1 23 SER HB2 H -2.966 -4.532 -5.231 1.00 . A A . 455 SER HB2 1 1 16 7426 1 1 23 SER HB3 H -4.503 -4.787 -4.408 1.00 . A A . 455 SER HB3 1 1 16 7427 1 1 23 SER HG H -3.296 -2.460 -5.189 1.00 . A A . 455 SER HG 1 1 16 7428 1 1 23 SER N N -2.221 -5.861 -3.165 1.00 . A A . 455 SER N 1 1 16 7429 1 1 23 SER O O -4.796 -5.158 -1.850 1.00 . A A . 455 SER O 1 1 16 7430 1 1 23 SER OG O -3.864 -2.851 -4.507 1.00 . A A . 455 SER OG 1 1 16 7431 1 1 24 THR C C -4.652 -2.218 0.626 1.00 . A A . 456 THR C 1 1 16 7432 1 1 24 THR CA C -4.139 -3.635 0.363 1.00 . A A . 456 THR CA 1 1 16 7433 1 1 24 THR CB C -3.256 -4.109 1.535 1.00 . A A . 456 THR CB 1 1 16 7434 1 1 24 THR CG2 C -4.089 -4.367 2.780 1.00 . A A . 456 THR CG2 1 1 16 7435 1 1 24 THR H H -2.582 -3.141 -0.979 1.00 . A A . 456 THR H 1 1 16 7436 1 1 24 THR HA H -4.981 -4.304 0.279 1.00 . A A . 456 THR HA 1 1 16 7437 1 1 24 THR HB H -2.530 -3.341 1.755 1.00 . A A . 456 THR HB 1 1 16 7438 1 1 24 THR HG1 H -2.557 -5.926 1.904 1.00 . A A . 456 THR HG1 1 1 16 7439 1 1 24 THR HG21 H -4.577 -3.453 3.083 1.00 . A A . 456 THR HG21 1 1 16 7440 1 1 24 THR HG22 H -3.448 -4.714 3.577 1.00 . A A . 456 THR HG22 1 1 16 7441 1 1 24 THR HG23 H -4.833 -5.119 2.565 1.00 . A A . 456 THR HG23 1 1 16 7442 1 1 24 THR N N -3.390 -3.695 -0.883 1.00 . A A . 456 THR N 1 1 16 7443 1 1 24 THR O O -3.881 -1.269 0.728 1.00 . A A . 456 THR O 1 1 16 7444 1 1 24 THR OG1 O -2.569 -5.316 1.161 1.00 . A A . 456 THR OG1 1 1 16 7445 1 1 25 TRP C C -7.291 -0.659 2.221 1.00 . A A . 457 TRP C 1 1 16 7446 1 1 25 TRP CA C -6.564 -0.751 0.882 1.00 . A A . 457 TRP CA 1 1 16 7447 1 1 25 TRP CB C -7.476 -0.432 -0.313 1.00 . A A . 457 TRP CB 1 1 16 7448 1 1 25 TRP CD1 C -6.004 -1.382 -2.176 1.00 . A A . 457 TRP CD1 1 1 16 7449 1 1 25 TRP CD2 C -6.442 0.802 -2.407 1.00 . A A . 457 TRP CD2 1 1 16 7450 1 1 25 TRP CE2 C -5.590 0.389 -3.453 1.00 . A A . 457 TRP CE2 1 1 16 7451 1 1 25 TRP CE3 C -6.852 2.141 -2.363 1.00 . A A . 457 TRP CE3 1 1 16 7452 1 1 25 TRP CG C -6.678 -0.353 -1.584 1.00 . A A . 457 TRP CG 1 1 16 7453 1 1 25 TRP CH2 C -5.556 2.561 -4.374 1.00 . A A . 457 TRP CH2 1 1 16 7454 1 1 25 TRP CZ2 C -5.139 1.257 -4.435 1.00 . A A . 457 TRP CZ2 1 1 16 7455 1 1 25 TRP CZ3 C -6.409 3.005 -3.354 1.00 . A A . 457 TRP CZ3 1 1 16 7456 1 1 25 TRP H H -6.548 -2.861 0.620 1.00 . A A . 457 TRP H 1 1 16 7457 1 1 25 TRP HA H -5.755 -0.034 0.894 1.00 . A A . 457 TRP HA 1 1 16 7458 1 1 25 TRP HB2 H -8.220 -1.211 -0.418 1.00 . A A . 457 TRP HB2 1 1 16 7459 1 1 25 TRP HB3 H -7.960 0.519 -0.155 1.00 . A A . 457 TRP HB3 1 1 16 7460 1 1 25 TRP HD1 H -5.988 -2.392 -1.798 1.00 . A A . 457 TRP HD1 1 1 16 7461 1 1 25 TRP HE1 H -4.764 -1.499 -3.864 1.00 . A A . 457 TRP HE1 1 1 16 7462 1 1 25 TRP HE3 H -7.509 2.500 -1.586 1.00 . A A . 457 TRP HE3 1 1 16 7463 1 1 25 TRP HH2 H -5.235 3.270 -5.123 1.00 . A A . 457 TRP HH2 1 1 16 7464 1 1 25 TRP HZ2 H -4.461 0.930 -5.211 1.00 . A A . 457 TRP HZ2 1 1 16 7465 1 1 25 TRP HZ3 H -6.710 4.045 -3.339 1.00 . A A . 457 TRP HZ3 1 1 16 7466 1 1 25 TRP N N -5.964 -2.068 0.705 1.00 . A A . 457 TRP N 1 1 16 7467 1 1 25 TRP NE1 N -5.333 -0.940 -3.279 1.00 . A A . 457 TRP NE1 1 1 16 7468 1 1 25 TRP O O -7.940 0.341 2.531 1.00 . A A . 457 TRP O 1 1 16 7469 1 1 26 GLU C C -6.333 -1.782 5.306 1.00 . A A . 458 GLU C 1 1 16 7470 1 1 26 GLU CA C -7.566 -1.699 4.413 1.00 . A A . 458 GLU CA 1 1 16 7471 1 1 26 GLU CB C -8.487 -2.889 4.720 1.00 . A A . 458 GLU CB 1 1 16 7472 1 1 26 GLU CD C -9.750 -3.261 2.547 1.00 . A A . 458 GLU CD 1 1 16 7473 1 1 26 GLU CG C -9.832 -2.863 4.007 1.00 . A A . 458 GLU CG 1 1 16 7474 1 1 26 GLU H H -6.707 -2.513 2.666 1.00 . A A . 458 GLU H 1 1 16 7475 1 1 26 GLU HA H -8.090 -0.775 4.607 1.00 . A A . 458 GLU HA 1 1 16 7476 1 1 26 GLU HB2 H -7.979 -3.799 4.437 1.00 . A A . 458 GLU HB2 1 1 16 7477 1 1 26 GLU HB3 H -8.673 -2.913 5.783 1.00 . A A . 458 GLU HB3 1 1 16 7478 1 1 26 GLU HG2 H -10.500 -3.547 4.508 1.00 . A A . 458 GLU HG2 1 1 16 7479 1 1 26 GLU HG3 H -10.234 -1.863 4.068 1.00 . A A . 458 GLU HG3 1 1 16 7480 1 1 26 GLU N N -7.135 -1.707 3.022 1.00 . A A . 458 GLU N 1 1 16 7481 1 1 26 GLU O O -5.472 -2.632 5.087 1.00 . A A . 458 GLU O 1 1 16 7482 1 1 26 GLU OE1 O -9.159 -4.321 2.249 1.00 . A A . 458 GLU OE1 1 1 16 7483 1 1 26 GLU OE2 O -10.310 -2.536 1.695 1.00 . A A . 458 GLU OE2 1 1 16 7484 1 1 27 LYS C C -5.212 -2.100 8.197 1.00 . A A . 459 LYS C 1 1 16 7485 1 1 27 LYS CA C -5.086 -0.952 7.203 1.00 . A A . 459 LYS CA 1 1 16 7486 1 1 27 LYS CB C -4.914 0.369 7.957 1.00 . A A . 459 LYS CB 1 1 16 7487 1 1 27 LYS CD C -3.938 2.689 7.825 1.00 . A A . 459 LYS CD 1 1 16 7488 1 1 27 LYS CE C -2.548 2.324 8.328 1.00 . A A . 459 LYS CE 1 1 16 7489 1 1 27 LYS CG C -4.575 1.542 7.056 1.00 . A A . 459 LYS CG 1 1 16 7490 1 1 27 LYS H H -6.949 -0.258 6.453 1.00 . A A . 459 LYS H 1 1 16 7491 1 1 27 LYS HA H -4.210 -1.120 6.594 1.00 . A A . 459 LYS HA 1 1 16 7492 1 1 27 LYS HB2 H -5.832 0.595 8.476 1.00 . A A . 459 LYS HB2 1 1 16 7493 1 1 27 LYS HB3 H -4.119 0.257 8.679 1.00 . A A . 459 LYS HB3 1 1 16 7494 1 1 27 LYS HD2 H -3.859 3.545 7.173 1.00 . A A . 459 LYS HD2 1 1 16 7495 1 1 27 LYS HD3 H -4.566 2.934 8.670 1.00 . A A . 459 LYS HD3 1 1 16 7496 1 1 27 LYS HE2 H -2.131 3.175 8.848 1.00 . A A . 459 LYS HE2 1 1 16 7497 1 1 27 LYS HE3 H -2.633 1.493 9.015 1.00 . A A . 459 LYS HE3 1 1 16 7498 1 1 27 LYS HG2 H -3.886 1.208 6.295 1.00 . A A . 459 LYS HG2 1 1 16 7499 1 1 27 LYS HG3 H -5.483 1.897 6.587 1.00 . A A . 459 LYS HG3 1 1 16 7500 1 1 27 LYS HZ1 H -1.371 2.777 6.644 1.00 . A A . 459 LYS HZ1 1 1 16 7501 1 1 27 LYS HZ2 H -2.088 1.246 6.595 1.00 . A A . 459 LYS HZ2 1 1 16 7502 1 1 27 LYS HZ3 H -0.757 1.512 7.599 1.00 . A A . 459 LYS HZ3 1 1 16 7503 1 1 27 LYS N N -6.236 -0.917 6.307 1.00 . A A . 459 LYS N 1 1 16 7504 1 1 27 LYS NZ N -1.631 1.939 7.215 1.00 . A A . 459 LYS NZ 1 1 16 7505 1 1 27 LYS O O -6.182 -2.170 8.952 1.00 . A A . 459 LYS O 1 1 16 7506 1 1 28 PRO C C -3.986 -3.650 10.574 1.00 . A A . 460 PRO C 1 1 16 7507 1 1 28 PRO CA C -4.193 -4.135 9.142 1.00 . A A . 460 PRO CA 1 1 16 7508 1 1 28 PRO CB C -2.996 -4.971 8.672 1.00 . A A . 460 PRO CB 1 1 16 7509 1 1 28 PRO CD C -3.091 -3.042 7.265 1.00 . A A . 460 PRO CD 1 1 16 7510 1 1 28 PRO CG C -2.146 -4.027 7.893 1.00 . A A . 460 PRO CG 1 1 16 7511 1 1 28 PRO HA H -5.094 -4.727 9.093 1.00 . A A . 460 PRO HA 1 1 16 7512 1 1 28 PRO HB2 H -2.470 -5.361 9.530 1.00 . A A . 460 PRO HB2 1 1 16 7513 1 1 28 PRO HB3 H -3.346 -5.786 8.056 1.00 . A A . 460 PRO HB3 1 1 16 7514 1 1 28 PRO HD2 H -2.629 -2.068 7.196 1.00 . A A . 460 PRO HD2 1 1 16 7515 1 1 28 PRO HD3 H -3.398 -3.385 6.288 1.00 . A A . 460 PRO HD3 1 1 16 7516 1 1 28 PRO HG2 H -1.460 -3.519 8.554 1.00 . A A . 460 PRO HG2 1 1 16 7517 1 1 28 PRO HG3 H -1.604 -4.565 7.129 1.00 . A A . 460 PRO HG3 1 1 16 7518 1 1 28 PRO N N -4.234 -3.019 8.196 1.00 . A A . 460 PRO N 1 1 16 7519 1 1 28 PRO O O -4.930 -3.764 11.384 1.00 . A A . 460 PRO O 1 1 16 7520 1 1 28 PRO OXT O -2.894 -3.120 10.875 1.00 . A A . 460 PRO OXT 1 1 17 7521 1 1 1 SER C C 7.685 -2.074 5.656 1.00 . A A . 433 SER C 1 1 17 7522 1 1 1 SER CA C 7.955 -1.403 7.003 1.00 . A A . 433 SER CA 1 1 17 7523 1 1 1 SER CB C 9.447 -1.134 7.173 1.00 . A A . 433 SER CB 1 1 17 7524 1 1 1 SER H1 H 7.921 -3.213 8.035 1.00 . A A . 433 SER H1 1 1 17 7525 1 1 1 SER H2 H 6.458 -2.353 8.100 1.00 . A A . 433 SER H2 1 1 17 7526 1 1 1 SER H3 H 7.781 -1.845 9.023 1.00 . A A . 433 SER H3 1 1 17 7527 1 1 1 SER HA H 7.415 -0.468 7.044 1.00 . A A . 433 SER HA 1 1 17 7528 1 1 1 SER HB2 H 10.000 -2.041 6.975 1.00 . A A . 433 SER HB2 1 1 17 7529 1 1 1 SER HB3 H 9.754 -0.365 6.481 1.00 . A A . 433 SER HB3 1 1 17 7530 1 1 1 SER HG H 9.611 0.260 8.555 1.00 . A A . 433 SER HG 1 1 17 7531 1 1 1 SER N N 7.494 -2.262 8.117 1.00 . A A . 433 SER N 1 1 17 7532 1 1 1 SER O O 8.181 -1.638 4.617 1.00 . A A . 433 SER O 1 1 17 7533 1 1 1 SER OG O 9.732 -0.701 8.496 1.00 . A A . 433 SER OG 1 1 17 7534 1 1 2 GLU C C 5.421 -3.307 3.699 1.00 . A A . 434 GLU C 1 1 17 7535 1 1 2 GLU CA C 6.574 -3.906 4.491 1.00 . A A . 434 GLU CA 1 1 17 7536 1 1 2 GLU CB C 6.243 -5.353 4.879 1.00 . A A . 434 GLU CB 1 1 17 7537 1 1 2 GLU CD C 5.221 -5.106 7.187 1.00 . A A . 434 GLU CD 1 1 17 7538 1 1 2 GLU CG C 4.998 -5.512 5.745 1.00 . A A . 434 GLU CG 1 1 17 7539 1 1 2 GLU H H 6.415 -3.358 6.525 1.00 . A A . 434 GLU H 1 1 17 7540 1 1 2 GLU HA H 7.458 -3.905 3.871 1.00 . A A . 434 GLU HA 1 1 17 7541 1 1 2 GLU HB2 H 6.102 -5.930 3.979 1.00 . A A . 434 GLU HB2 1 1 17 7542 1 1 2 GLU HB3 H 7.080 -5.759 5.425 1.00 . A A . 434 GLU HB3 1 1 17 7543 1 1 2 GLU HG2 H 4.211 -4.896 5.337 1.00 . A A . 434 GLU HG2 1 1 17 7544 1 1 2 GLU HG3 H 4.689 -6.547 5.722 1.00 . A A . 434 GLU HG3 1 1 17 7545 1 1 2 GLU N N 6.860 -3.115 5.678 1.00 . A A . 434 GLU N 1 1 17 7546 1 1 2 GLU O O 5.078 -3.791 2.617 1.00 . A A . 434 GLU O 1 1 17 7547 1 1 2 GLU OE1 O 5.135 -3.901 7.493 1.00 . A A . 434 GLU OE1 1 1 17 7548 1 1 2 GLU OE2 O 5.503 -5.989 8.021 1.00 . A A . 434 GLU OE2 1 1 17 7549 1 1 3 TRP C C 4.177 -0.272 3.002 1.00 . A A . 435 TRP C 1 1 17 7550 1 1 3 TRP CA C 3.707 -1.595 3.609 1.00 . A A . 435 TRP CA 1 1 17 7551 1 1 3 TRP CB C 2.590 -1.321 4.625 1.00 . A A . 435 TRP CB 1 1 17 7552 1 1 3 TRP CD1 C 2.107 -2.563 6.819 1.00 . A A . 435 TRP CD1 1 1 17 7553 1 1 3 TRP CD2 C 1.847 -3.823 4.988 1.00 . A A . 435 TRP CD2 1 1 17 7554 1 1 3 TRP CE2 C 1.542 -4.604 6.119 1.00 . A A . 435 TRP CE2 1 1 17 7555 1 1 3 TRP CE3 C 1.758 -4.409 3.726 1.00 . A A . 435 TRP CE3 1 1 17 7556 1 1 3 TRP CG C 2.195 -2.513 5.457 1.00 . A A . 435 TRP CG 1 1 17 7557 1 1 3 TRP CH2 C 1.080 -6.487 4.773 1.00 . A A . 435 TRP CH2 1 1 17 7558 1 1 3 TRP CZ2 C 1.152 -5.939 6.024 1.00 . A A . 435 TRP CZ2 1 1 17 7559 1 1 3 TRP CZ3 C 1.379 -5.736 3.635 1.00 . A A . 435 TRP CZ3 1 1 17 7560 1 1 3 TRP H H 5.141 -1.935 5.114 1.00 . A A . 435 TRP H 1 1 17 7561 1 1 3 TRP HA H 3.330 -2.239 2.830 1.00 . A A . 435 TRP HA 1 1 17 7562 1 1 3 TRP HB2 H 2.914 -0.544 5.299 1.00 . A A . 435 TRP HB2 1 1 17 7563 1 1 3 TRP HB3 H 1.713 -0.982 4.094 1.00 . A A . 435 TRP HB3 1 1 17 7564 1 1 3 TRP HD1 H 2.318 -1.730 7.472 1.00 . A A . 435 TRP HD1 1 1 17 7565 1 1 3 TRP HE1 H 1.556 -4.095 8.158 1.00 . A A . 435 TRP HE1 1 1 17 7566 1 1 3 TRP HE3 H 1.984 -3.848 2.831 1.00 . A A . 435 TRP HE3 1 1 17 7567 1 1 3 TRP HH2 H 0.786 -7.519 4.647 1.00 . A A . 435 TRP HH2 1 1 17 7568 1 1 3 TRP HZ2 H 0.920 -6.532 6.895 1.00 . A A . 435 TRP HZ2 1 1 17 7569 1 1 3 TRP HZ3 H 1.330 -6.213 2.662 1.00 . A A . 435 TRP HZ3 1 1 17 7570 1 1 3 TRP N N 4.821 -2.265 4.251 1.00 . A A . 435 TRP N 1 1 17 7571 1 1 3 TRP NE1 N 1.703 -3.813 7.222 1.00 . A A . 435 TRP NE1 1 1 17 7572 1 1 3 TRP O O 4.717 0.578 3.708 1.00 . A A . 435 TRP O 1 1 17 7573 1 1 4 THR C C 3.083 2.050 0.993 1.00 . A A . 436 THR C 1 1 17 7574 1 1 4 THR CA C 4.318 1.164 1.066 1.00 . A A . 436 THR CA 1 1 17 7575 1 1 4 THR CB C 4.889 0.961 -0.351 1.00 . A A . 436 THR CB 1 1 17 7576 1 1 4 THR CG2 C 5.109 2.299 -1.055 1.00 . A A . 436 THR CG2 1 1 17 7577 1 1 4 THR H H 3.658 -0.840 1.153 1.00 . A A . 436 THR H 1 1 17 7578 1 1 4 THR HA H 5.069 1.660 1.665 1.00 . A A . 436 THR HA 1 1 17 7579 1 1 4 THR HB H 4.183 0.381 -0.929 1.00 . A A . 436 THR HB 1 1 17 7580 1 1 4 THR HG1 H 6.549 0.417 0.578 1.00 . A A . 436 THR HG1 1 1 17 7581 1 1 4 THR HG21 H 5.814 2.890 -0.490 1.00 . A A . 436 THR HG21 1 1 17 7582 1 1 4 THR HG22 H 4.169 2.830 -1.125 1.00 . A A . 436 THR HG22 1 1 17 7583 1 1 4 THR HG23 H 5.499 2.127 -2.047 1.00 . A A . 436 THR HG23 1 1 17 7584 1 1 4 THR N N 4.002 -0.101 1.701 1.00 . A A . 436 THR N 1 1 17 7585 1 1 4 THR O O 2.202 1.825 0.162 1.00 . A A . 436 THR O 1 1 17 7586 1 1 4 THR OG1 O 6.130 0.243 -0.278 1.00 . A A . 436 THR OG1 1 1 17 7587 1 1 5 GLU C C 2.334 5.166 0.941 1.00 . A A . 437 GLU C 1 1 17 7588 1 1 5 GLU CA C 1.930 4.007 1.839 1.00 . A A . 437 GLU CA 1 1 17 7589 1 1 5 GLU CB C 1.599 4.542 3.240 1.00 . A A . 437 GLU CB 1 1 17 7590 1 1 5 GLU CD C 3.197 3.807 5.038 1.00 . A A . 437 GLU CD 1 1 17 7591 1 1 5 GLU CG C 1.861 3.557 4.366 1.00 . A A . 437 GLU CG 1 1 17 7592 1 1 5 GLU H H 3.708 3.122 2.565 1.00 . A A . 437 GLU H 1 1 17 7593 1 1 5 GLU HA H 1.060 3.522 1.423 1.00 . A A . 437 GLU HA 1 1 17 7594 1 1 5 GLU HB2 H 2.193 5.424 3.423 1.00 . A A . 437 GLU HB2 1 1 17 7595 1 1 5 GLU HB3 H 0.552 4.813 3.267 1.00 . A A . 437 GLU HB3 1 1 17 7596 1 1 5 GLU HG2 H 1.079 3.654 5.102 1.00 . A A . 437 GLU HG2 1 1 17 7597 1 1 5 GLU HG3 H 1.858 2.555 3.963 1.00 . A A . 437 GLU HG3 1 1 17 7598 1 1 5 GLU N N 3.017 3.044 1.872 1.00 . A A . 437 GLU N 1 1 17 7599 1 1 5 GLU O O 3.110 6.033 1.346 1.00 . A A . 437 GLU O 1 1 17 7600 1 1 5 GLU OE1 O 4.245 3.509 4.428 1.00 . A A . 437 GLU OE1 1 1 17 7601 1 1 5 GLU OE2 O 3.205 4.326 6.175 1.00 . A A . 437 GLU OE2 1 1 17 7602 1 1 6 ARG C C 1.040 7.109 -1.530 1.00 . A A . 438 ARG C 1 1 17 7603 1 1 6 ARG CA C 2.229 6.171 -1.249 1.00 . A A . 438 ARG CA 1 1 17 7604 1 1 6 ARG CB C 2.709 5.515 -2.548 1.00 . A A . 438 ARG CB 1 1 17 7605 1 1 6 ARG CD C 3.781 5.852 -4.802 1.00 . A A . 438 ARG CD 1 1 17 7606 1 1 6 ARG CG C 3.058 6.514 -3.644 1.00 . A A . 438 ARG CG 1 1 17 7607 1 1 6 ARG CZ C 5.748 4.369 -5.008 1.00 . A A . 438 ARG CZ 1 1 17 7608 1 1 6 ARG H H 1.220 4.445 -0.552 1.00 . A A . 438 ARG H 1 1 17 7609 1 1 6 ARG HA H 3.050 6.717 -0.809 1.00 . A A . 438 ARG HA 1 1 17 7610 1 1 6 ARG HB2 H 3.588 4.925 -2.335 1.00 . A A . 438 ARG HB2 1 1 17 7611 1 1 6 ARG HB3 H 1.929 4.867 -2.917 1.00 . A A . 438 ARG HB3 1 1 17 7612 1 1 6 ARG HD2 H 3.195 5.012 -5.144 1.00 . A A . 438 ARG HD2 1 1 17 7613 1 1 6 ARG HD3 H 3.883 6.570 -5.603 1.00 . A A . 438 ARG HD3 1 1 17 7614 1 1 6 ARG HE H 5.563 5.857 -3.684 1.00 . A A . 438 ARG HE 1 1 17 7615 1 1 6 ARG HG2 H 2.148 6.961 -4.013 1.00 . A A . 438 ARG HG2 1 1 17 7616 1 1 6 ARG HG3 H 3.694 7.283 -3.229 1.00 . A A . 438 ARG HG3 1 1 17 7617 1 1 6 ARG HH11 H 4.219 3.898 -6.253 1.00 . A A . 438 ARG HH11 1 1 17 7618 1 1 6 ARG HH12 H 5.642 2.906 -6.414 1.00 . A A . 438 ARG HH12 1 1 17 7619 1 1 6 ARG HH21 H 7.418 4.561 -3.871 1.00 . A A . 438 ARG HH21 1 1 17 7620 1 1 6 ARG HH22 H 7.466 3.285 -5.057 1.00 . A A . 438 ARG HH22 1 1 17 7621 1 1 6 ARG N N 1.850 5.153 -0.287 1.00 . A A . 438 ARG N 1 1 17 7622 1 1 6 ARG NE N 5.111 5.379 -4.417 1.00 . A A . 438 ARG NE 1 1 17 7623 1 1 6 ARG NH1 N 5.156 3.671 -5.970 1.00 . A A . 438 ARG NH1 1 1 17 7624 1 1 6 ARG NH2 N 6.973 4.044 -4.616 1.00 . A A . 438 ARG NH2 1 1 17 7625 1 1 6 ARG O O -0.093 6.635 -1.665 1.00 . A A . 438 ARG O 1 1 17 7626 1 1 7 LYS C C 0.007 9.540 -3.402 1.00 . A A . 439 LYS C 1 1 17 7627 1 1 7 LYS CA C 0.201 9.359 -1.902 1.00 . A A . 439 LYS CA 1 1 17 7628 1 1 7 LYS CB C 0.501 10.703 -1.231 1.00 . A A . 439 LYS CB 1 1 17 7629 1 1 7 LYS CD C -0.148 13.098 -0.849 1.00 . A A . 439 LYS CD 1 1 17 7630 1 1 7 LYS CE C -1.093 14.223 -1.245 1.00 . A A . 439 LYS CE 1 1 17 7631 1 1 7 LYS CG C -0.528 11.785 -1.515 1.00 . A A . 439 LYS CG 1 1 17 7632 1 1 7 LYS H H 2.189 8.774 -1.589 1.00 . A A . 439 LYS H 1 1 17 7633 1 1 7 LYS HA H -0.703 8.946 -1.481 1.00 . A A . 439 LYS HA 1 1 17 7634 1 1 7 LYS HB2 H 0.544 10.554 -0.162 1.00 . A A . 439 LYS HB2 1 1 17 7635 1 1 7 LYS HB3 H 1.463 11.055 -1.572 1.00 . A A . 439 LYS HB3 1 1 17 7636 1 1 7 LYS HD2 H -0.186 12.971 0.223 1.00 . A A . 439 LYS HD2 1 1 17 7637 1 1 7 LYS HD3 H 0.856 13.364 -1.144 1.00 . A A . 439 LYS HD3 1 1 17 7638 1 1 7 LYS HE2 H -0.770 15.134 -0.760 1.00 . A A . 439 LYS HE2 1 1 17 7639 1 1 7 LYS HE3 H -1.046 14.352 -2.316 1.00 . A A . 439 LYS HE3 1 1 17 7640 1 1 7 LYS HG2 H -0.590 11.938 -2.582 1.00 . A A . 439 LYS HG2 1 1 17 7641 1 1 7 LYS HG3 H -1.490 11.463 -1.139 1.00 . A A . 439 LYS HG3 1 1 17 7642 1 1 7 LYS HZ1 H -2.850 13.093 -1.347 1.00 . A A . 439 LYS HZ1 1 1 17 7643 1 1 7 LYS HZ2 H -3.109 14.750 -1.103 1.00 . A A . 439 LYS HZ2 1 1 17 7644 1 1 7 LYS HZ3 H -2.562 13.782 0.178 1.00 . A A . 439 LYS HZ3 1 1 17 7645 1 1 7 LYS N N 1.277 8.425 -1.647 1.00 . A A . 439 LYS N 1 1 17 7646 1 1 7 LYS NZ N -2.499 13.942 -0.851 1.00 . A A . 439 LYS NZ 1 1 17 7647 1 1 7 LYS O O 0.785 10.226 -4.063 1.00 . A A . 439 LYS O 1 1 17 7648 1 1 8 THR C C -2.348 10.158 -5.519 1.00 . A A . 440 THR C 1 1 17 7649 1 1 8 THR CA C -1.343 9.025 -5.342 1.00 . A A . 440 THR CA 1 1 17 7650 1 1 8 THR CB C -1.938 7.723 -5.910 1.00 . A A . 440 THR CB 1 1 17 7651 1 1 8 THR CG2 C -1.176 7.265 -7.144 1.00 . A A . 440 THR CG2 1 1 17 7652 1 1 8 THR H H -1.511 8.246 -3.387 1.00 . A A . 440 THR H 1 1 17 7653 1 1 8 THR HA H -0.441 9.260 -5.888 1.00 . A A . 440 THR HA 1 1 17 7654 1 1 8 THR HB H -2.966 7.907 -6.187 1.00 . A A . 440 THR HB 1 1 17 7655 1 1 8 THR HG1 H -2.590 6.860 -4.257 1.00 . A A . 440 THR HG1 1 1 17 7656 1 1 8 THR HG21 H -0.134 7.125 -6.895 1.00 . A A . 440 THR HG21 1 1 17 7657 1 1 8 THR HG22 H -1.264 8.010 -7.919 1.00 . A A . 440 THR HG22 1 1 17 7658 1 1 8 THR HG23 H -1.590 6.329 -7.493 1.00 . A A . 440 THR HG23 1 1 17 7659 1 1 8 THR N N -1.001 8.876 -3.940 1.00 . A A . 440 THR N 1 1 17 7660 1 1 8 THR O O -3.280 10.307 -4.719 1.00 . A A . 440 THR O 1 1 17 7661 1 1 8 THR OG1 O -1.898 6.696 -4.913 1.00 . A A . 440 THR OG1 1 1 17 7662 1 1 9 ALA C C -4.410 11.710 -7.262 1.00 . A A . 441 ALA C 1 1 17 7663 1 1 9 ALA CA C -3.008 12.114 -6.820 1.00 . A A . 441 ALA CA 1 1 17 7664 1 1 9 ALA CB C -2.358 13.012 -7.858 1.00 . A A . 441 ALA CB 1 1 17 7665 1 1 9 ALA H H -1.440 10.738 -7.207 1.00 . A A . 441 ALA H 1 1 17 7666 1 1 9 ALA HA H -3.082 12.670 -5.897 1.00 . A A . 441 ALA HA 1 1 17 7667 1 1 9 ALA HB1 H -2.955 13.902 -7.990 1.00 . A A . 441 ALA HB1 1 1 17 7668 1 1 9 ALA HB2 H -2.288 12.484 -8.798 1.00 . A A . 441 ALA HB2 1 1 17 7669 1 1 9 ALA HB3 H -1.369 13.289 -7.526 1.00 . A A . 441 ALA HB3 1 1 17 7670 1 1 9 ALA N N -2.167 10.948 -6.571 1.00 . A A . 441 ALA N 1 1 17 7671 1 1 9 ALA O O -5.282 12.555 -7.452 1.00 . A A . 441 ALA O 1 1 17 7672 1 1 10 ASP C C -6.894 9.999 -6.564 1.00 . A A . 442 ASP C 1 1 17 7673 1 1 10 ASP CA C -5.928 9.853 -7.749 1.00 . A A . 442 ASP CA 1 1 17 7674 1 1 10 ASP CB C -5.770 8.378 -8.139 1.00 . A A . 442 ASP CB 1 1 17 7675 1 1 10 ASP CG C -7.002 7.790 -8.804 1.00 . A A . 442 ASP CG 1 1 17 7676 1 1 10 ASP H H -3.861 9.797 -7.299 1.00 . A A . 442 ASP H 1 1 17 7677 1 1 10 ASP HA H -6.316 10.405 -8.592 1.00 . A A . 442 ASP HA 1 1 17 7678 1 1 10 ASP HB2 H -4.943 8.286 -8.826 1.00 . A A . 442 ASP HB2 1 1 17 7679 1 1 10 ASP HB3 H -5.554 7.800 -7.251 1.00 . A A . 442 ASP HB3 1 1 17 7680 1 1 10 ASP N N -4.618 10.407 -7.407 1.00 . A A . 442 ASP N 1 1 17 7681 1 1 10 ASP O O -8.065 9.631 -6.641 1.00 . A A . 442 ASP O 1 1 17 7682 1 1 10 ASP OD1 O -7.302 8.171 -9.951 1.00 . A A . 442 ASP OD1 1 1 17 7683 1 1 10 ASP OD2 O -7.644 6.908 -8.202 1.00 . A A . 442 ASP OD2 1 1 17 7684 1 1 11 GLY C C -7.151 9.556 -3.365 1.00 . A A . 443 GLY C 1 1 17 7685 1 1 11 GLY CA C -7.196 10.753 -4.284 1.00 . A A . 443 GLY CA 1 1 17 7686 1 1 11 GLY H H -5.443 10.816 -5.463 1.00 . A A . 443 GLY H 1 1 17 7687 1 1 11 GLY HA2 H -6.829 11.620 -3.754 1.00 . A A . 443 GLY HA2 1 1 17 7688 1 1 11 GLY HA3 H -8.217 10.928 -4.586 1.00 . A A . 443 GLY HA3 1 1 17 7689 1 1 11 GLY N N -6.384 10.547 -5.466 1.00 . A A . 443 GLY N 1 1 17 7690 1 1 11 GLY O O -8.068 9.331 -2.576 1.00 . A A . 443 GLY O 1 1 17 7691 1 1 12 LYS C C -4.520 7.351 -2.235 1.00 . A A . 444 LYS C 1 1 17 7692 1 1 12 LYS CA C -5.951 7.546 -2.714 1.00 . A A . 444 LYS CA 1 1 17 7693 1 1 12 LYS CB C -6.350 6.354 -3.591 1.00 . A A . 444 LYS CB 1 1 17 7694 1 1 12 LYS CD C -7.968 5.462 -5.288 1.00 . A A . 444 LYS CD 1 1 17 7695 1 1 12 LYS CE C -9.331 5.644 -5.936 1.00 . A A . 444 LYS CE 1 1 17 7696 1 1 12 LYS CG C -7.769 6.426 -4.135 1.00 . A A . 444 LYS CG 1 1 17 7697 1 1 12 LYS H H -5.344 9.060 -4.057 1.00 . A A . 444 LYS H 1 1 17 7698 1 1 12 LYS HA H -6.611 7.598 -1.862 1.00 . A A . 444 LYS HA 1 1 17 7699 1 1 12 LYS HB2 H -5.670 6.297 -4.429 1.00 . A A . 444 LYS HB2 1 1 17 7700 1 1 12 LYS HB3 H -6.258 5.451 -3.006 1.00 . A A . 444 LYS HB3 1 1 17 7701 1 1 12 LYS HD2 H -7.201 5.638 -6.028 1.00 . A A . 444 LYS HD2 1 1 17 7702 1 1 12 LYS HD3 H -7.887 4.450 -4.917 1.00 . A A . 444 LYS HD3 1 1 17 7703 1 1 12 LYS HE2 H -10.087 5.244 -5.277 1.00 . A A . 444 LYS HE2 1 1 17 7704 1 1 12 LYS HE3 H -9.505 6.699 -6.086 1.00 . A A . 444 LYS HE3 1 1 17 7705 1 1 12 LYS HG2 H -8.461 6.175 -3.345 1.00 . A A . 444 LYS HG2 1 1 17 7706 1 1 12 LYS HG3 H -7.961 7.431 -4.479 1.00 . A A . 444 LYS HG3 1 1 17 7707 1 1 12 LYS HZ1 H -10.338 5.129 -7.692 1.00 . A A . 444 LYS HZ1 1 1 17 7708 1 1 12 LYS HZ2 H -9.297 3.918 -7.120 1.00 . A A . 444 LYS HZ2 1 1 17 7709 1 1 12 LYS HZ3 H -8.663 5.295 -7.881 1.00 . A A . 444 LYS HZ3 1 1 17 7710 1 1 12 LYS N N -6.077 8.784 -3.468 1.00 . A A . 444 LYS N 1 1 17 7711 1 1 12 LYS NZ N -9.414 4.948 -7.245 1.00 . A A . 444 LYS NZ 1 1 17 7712 1 1 12 LYS O O -3.579 7.411 -3.026 1.00 . A A . 444 LYS O 1 1 17 7713 1 1 13 THR C C -3.047 5.202 -0.291 1.00 . A A . 445 THR C 1 1 17 7714 1 1 13 THR CA C -3.076 6.721 -0.400 1.00 . A A . 445 THR CA 1 1 17 7715 1 1 13 THR CB C -2.838 7.349 0.988 1.00 . A A . 445 THR CB 1 1 17 7716 1 1 13 THR CG2 C -1.420 7.083 1.480 1.00 . A A . 445 THR CG2 1 1 17 7717 1 1 13 THR H H -5.136 7.196 -0.342 1.00 . A A . 445 THR H 1 1 17 7718 1 1 13 THR HA H -2.299 7.049 -1.074 1.00 . A A . 445 THR HA 1 1 17 7719 1 1 13 THR HB H -3.535 6.911 1.687 1.00 . A A . 445 THR HB 1 1 17 7720 1 1 13 THR HG1 H -3.727 8.944 0.246 1.00 . A A . 445 THR HG1 1 1 17 7721 1 1 13 THR HG21 H -0.711 7.520 0.793 1.00 . A A . 445 THR HG21 1 1 17 7722 1 1 13 THR HG22 H -1.254 6.019 1.539 1.00 . A A . 445 THR HG22 1 1 17 7723 1 1 13 THR HG23 H -1.291 7.521 2.458 1.00 . A A . 445 THR HG23 1 1 17 7724 1 1 13 THR N N -4.360 7.118 -0.948 1.00 . A A . 445 THR N 1 1 17 7725 1 1 13 THR O O -3.614 4.631 0.643 1.00 . A A . 445 THR O 1 1 17 7726 1 1 13 THR OG1 O -3.067 8.763 0.924 1.00 . A A . 445 THR OG1 1 1 17 7727 1 1 14 TYR C C -1.326 2.477 -0.558 1.00 . A A . 446 TYR C 1 1 17 7728 1 1 14 TYR CA C -2.472 3.096 -1.331 1.00 . A A . 446 TYR CA 1 1 17 7729 1 1 14 TYR CB C -2.461 2.605 -2.785 1.00 . A A . 446 TYR CB 1 1 17 7730 1 1 14 TYR CD1 C -0.151 1.818 -3.454 1.00 . A A . 446 TYR CD1 1 1 17 7731 1 1 14 TYR CD2 C -0.937 3.880 -4.353 1.00 . A A . 446 TYR CD2 1 1 17 7732 1 1 14 TYR CE1 C 1.029 1.956 -4.157 1.00 . A A . 446 TYR CE1 1 1 17 7733 1 1 14 TYR CE2 C 0.242 4.021 -5.064 1.00 . A A . 446 TYR CE2 1 1 17 7734 1 1 14 TYR CG C -1.155 2.778 -3.538 1.00 . A A . 446 TYR CG 1 1 17 7735 1 1 14 TYR CZ C 1.220 3.057 -4.960 1.00 . A A . 446 TYR CZ 1 1 17 7736 1 1 14 TYR H H -1.901 5.047 -1.926 1.00 . A A . 446 TYR H 1 1 17 7737 1 1 14 TYR HA H -3.401 2.783 -0.873 1.00 . A A . 446 TYR HA 1 1 17 7738 1 1 14 TYR HB2 H -2.693 1.552 -2.792 1.00 . A A . 446 TYR HB2 1 1 17 7739 1 1 14 TYR HB3 H -3.227 3.134 -3.333 1.00 . A A . 446 TYR HB3 1 1 17 7740 1 1 14 TYR HD1 H -0.304 0.955 -2.826 1.00 . A A . 446 TYR HD1 1 1 17 7741 1 1 14 TYR HD2 H -1.703 4.636 -4.432 1.00 . A A . 446 TYR HD2 1 1 17 7742 1 1 14 TYR HE1 H 1.797 1.203 -4.075 1.00 . A A . 446 TYR HE1 1 1 17 7743 1 1 14 TYR HE2 H 0.391 4.885 -5.695 1.00 . A A . 446 TYR HE2 1 1 17 7744 1 1 14 TYR HH H 2.645 2.317 -6.020 1.00 . A A . 446 TYR HH 1 1 17 7745 1 1 14 TYR N N -2.422 4.547 -1.261 1.00 . A A . 446 TYR N 1 1 17 7746 1 1 14 TYR O O -0.250 3.068 -0.444 1.00 . A A . 446 TYR O 1 1 17 7747 1 1 14 TYR OH O 2.391 3.186 -5.670 1.00 . A A . 446 TYR OH 1 1 17 7748 1 1 15 TYR C C -0.204 -0.721 -0.009 1.00 . A A . 447 TYR C 1 1 17 7749 1 1 15 TYR CA C -0.563 0.569 0.727 1.00 . A A . 447 TYR CA 1 1 17 7750 1 1 15 TYR CB C -1.082 0.279 2.144 1.00 . A A . 447 TYR CB 1 1 17 7751 1 1 15 TYR CD1 C -1.388 2.589 3.139 1.00 . A A . 447 TYR CD1 1 1 17 7752 1 1 15 TYR CD2 C -3.333 1.275 2.720 1.00 . A A . 447 TYR CD2 1 1 17 7753 1 1 15 TYR CE1 C -2.180 3.624 3.596 1.00 . A A . 447 TYR CE1 1 1 17 7754 1 1 15 TYR CE2 C -4.130 2.301 3.185 1.00 . A A . 447 TYR CE2 1 1 17 7755 1 1 15 TYR CG C -1.949 1.399 2.690 1.00 . A A . 447 TYR CG 1 1 17 7756 1 1 15 TYR CZ C -3.548 3.476 3.619 1.00 . A A . 447 TYR CZ 1 1 17 7757 1 1 15 TYR H H -2.448 0.874 -0.161 1.00 . A A . 447 TYR H 1 1 17 7758 1 1 15 TYR HA H 0.315 1.193 0.794 1.00 . A A . 447 TYR HA 1 1 17 7759 1 1 15 TYR HB2 H -1.674 -0.625 2.129 1.00 . A A . 447 TYR HB2 1 1 17 7760 1 1 15 TYR HB3 H -0.244 0.147 2.812 1.00 . A A . 447 TYR HB3 1 1 17 7761 1 1 15 TYR HD1 H -0.317 2.704 3.124 1.00 . A A . 447 TYR HD1 1 1 17 7762 1 1 15 TYR HD2 H -3.784 0.354 2.381 1.00 . A A . 447 TYR HD2 1 1 17 7763 1 1 15 TYR HE1 H -1.724 4.541 3.940 1.00 . A A . 447 TYR HE1 1 1 17 7764 1 1 15 TYR HE2 H -5.203 2.182 3.207 1.00 . A A . 447 TYR HE2 1 1 17 7765 1 1 15 TYR HH H -3.994 5.344 3.718 1.00 . A A . 447 TYR HH 1 1 17 7766 1 1 15 TYR N N -1.567 1.287 -0.032 1.00 . A A . 447 TYR N 1 1 17 7767 1 1 15 TYR O O -0.910 -1.723 0.076 1.00 . A A . 447 TYR O 1 1 17 7768 1 1 15 TYR OH O -4.341 4.513 4.060 1.00 . A A . 447 TYR OH 1 1 17 7769 1 1 16 TYR C C 2.283 -2.667 -0.757 1.00 . A A . 448 TYR C 1 1 17 7770 1 1 16 TYR CA C 1.299 -1.814 -1.561 1.00 . A A . 448 TYR CA 1 1 17 7771 1 1 16 TYR CB C 1.951 -1.327 -2.861 1.00 . A A . 448 TYR CB 1 1 17 7772 1 1 16 TYR CD1 C 1.789 -3.258 -4.489 1.00 . A A . 448 TYR CD1 1 1 17 7773 1 1 16 TYR CD2 C 3.950 -2.599 -3.730 1.00 . A A . 448 TYR CD2 1 1 17 7774 1 1 16 TYR CE1 C 2.360 -4.245 -5.269 1.00 . A A . 448 TYR CE1 1 1 17 7775 1 1 16 TYR CE2 C 4.528 -3.586 -4.508 1.00 . A A . 448 TYR CE2 1 1 17 7776 1 1 16 TYR CG C 2.573 -2.419 -3.706 1.00 . A A . 448 TYR CG 1 1 17 7777 1 1 16 TYR CZ C 3.728 -4.404 -5.275 1.00 . A A . 448 TYR CZ 1 1 17 7778 1 1 16 TYR H H 1.333 0.186 -0.883 1.00 . A A . 448 TYR H 1 1 17 7779 1 1 16 TYR HA H 0.431 -2.401 -1.804 1.00 . A A . 448 TYR HA 1 1 17 7780 1 1 16 TYR HB2 H 1.202 -0.841 -3.461 1.00 . A A . 448 TYR HB2 1 1 17 7781 1 1 16 TYR HB3 H 2.726 -0.615 -2.617 1.00 . A A . 448 TYR HB3 1 1 17 7782 1 1 16 TYR HD1 H 0.717 -3.132 -4.484 1.00 . A A . 448 TYR HD1 1 1 17 7783 1 1 16 TYR HD2 H 4.573 -1.958 -3.127 1.00 . A A . 448 TYR HD2 1 1 17 7784 1 1 16 TYR HE1 H 1.735 -4.888 -5.870 1.00 . A A . 448 TYR HE1 1 1 17 7785 1 1 16 TYR HE2 H 5.602 -3.709 -4.509 1.00 . A A . 448 TYR HE2 1 1 17 7786 1 1 16 TYR HH H 4.967 -5.850 -5.540 1.00 . A A . 448 TYR HH 1 1 17 7787 1 1 16 TYR N N 0.860 -0.664 -0.787 1.00 . A A . 448 TYR N 1 1 17 7788 1 1 16 TYR O O 3.252 -2.161 -0.191 1.00 . A A . 448 TYR O 1 1 17 7789 1 1 16 TYR OH O 4.300 -5.385 -6.054 1.00 . A A . 448 TYR OH 1 1 17 7790 1 1 17 ASN C C 3.905 -5.492 -0.951 1.00 . A A . 449 ASN C 1 1 17 7791 1 1 17 ASN CA C 2.840 -4.932 -0.019 1.00 . A A . 449 ASN CA 1 1 17 7792 1 1 17 ASN CB C 1.966 -6.074 0.503 1.00 . A A . 449 ASN CB 1 1 17 7793 1 1 17 ASN CG C 2.765 -7.311 0.874 1.00 . A A . 449 ASN CG 1 1 17 7794 1 1 17 ASN H H 1.199 -4.293 -1.169 1.00 . A A . 449 ASN H 1 1 17 7795 1 1 17 ASN HA H 3.316 -4.436 0.810 1.00 . A A . 449 ASN HA 1 1 17 7796 1 1 17 ASN HB2 H 1.436 -5.737 1.382 1.00 . A A . 449 ASN HB2 1 1 17 7797 1 1 17 ASN HB3 H 1.250 -6.347 -0.259 1.00 . A A . 449 ASN HB3 1 1 17 7798 1 1 17 ASN HD21 H 2.996 -6.668 2.736 1.00 . A A . 449 ASN HD21 1 1 17 7799 1 1 17 ASN HD22 H 3.679 -8.219 2.388 1.00 . A A . 449 ASN HD22 1 1 17 7800 1 1 17 ASN N N 2.007 -3.965 -0.714 1.00 . A A . 449 ASN N 1 1 17 7801 1 1 17 ASN ND2 N 3.202 -7.403 2.119 1.00 . A A . 449 ASN ND2 1 1 17 7802 1 1 17 ASN O O 3.608 -5.915 -2.070 1.00 . A A . 449 ASN O 1 1 17 7803 1 1 17 ASN OD1 O 2.998 -8.176 0.041 1.00 . A A . 449 ASN OD1 1 1 17 7804 1 1 18 ASN C C 6.697 -7.394 -0.741 1.00 . A A . 450 ASN C 1 1 17 7805 1 1 18 ASN CA C 6.248 -6.032 -1.256 1.00 . A A . 450 ASN CA 1 1 17 7806 1 1 18 ASN CB C 7.424 -5.042 -1.233 1.00 . A A . 450 ASN CB 1 1 17 7807 1 1 18 ASN CG C 7.932 -4.729 0.170 1.00 . A A . 450 ASN CG 1 1 17 7808 1 1 18 ASN H H 5.302 -5.198 0.441 1.00 . A A . 450 ASN H 1 1 17 7809 1 1 18 ASN HA H 5.906 -6.144 -2.274 1.00 . A A . 450 ASN HA 1 1 17 7810 1 1 18 ASN HB2 H 8.241 -5.457 -1.802 1.00 . A A . 450 ASN HB2 1 1 17 7811 1 1 18 ASN HB3 H 7.110 -4.116 -1.694 1.00 . A A . 450 ASN HB3 1 1 17 7812 1 1 18 ASN HD21 H 8.472 -2.903 -0.410 1.00 . A A . 450 ASN HD21 1 1 17 7813 1 1 18 ASN HD22 H 8.785 -3.296 1.249 1.00 . A A . 450 ASN HD22 1 1 17 7814 1 1 18 ASN N N 5.135 -5.525 -0.469 1.00 . A A . 450 ASN N 1 1 17 7815 1 1 18 ASN ND2 N 8.447 -3.524 0.357 1.00 . A A . 450 ASN ND2 1 1 17 7816 1 1 18 ASN O O 7.671 -7.961 -1.230 1.00 . A A . 450 ASN O 1 1 17 7817 1 1 18 ASN OD1 O 7.864 -5.559 1.077 1.00 . A A . 450 ASN OD1 1 1 17 7818 1 1 19 ARG C C 5.792 -10.388 0.106 1.00 . A A . 451 ARG C 1 1 17 7819 1 1 19 ARG CA C 6.369 -9.191 0.858 1.00 . A A . 451 ARG CA 1 1 17 7820 1 1 19 ARG CB C 5.975 -9.246 2.336 1.00 . A A . 451 ARG CB 1 1 17 7821 1 1 19 ARG CD C 8.242 -8.534 3.228 1.00 . A A . 451 ARG CD 1 1 17 7822 1 1 19 ARG CG C 6.739 -8.270 3.226 1.00 . A A . 451 ARG CG 1 1 17 7823 1 1 19 ARG CZ C 10.014 -8.671 1.503 1.00 . A A . 451 ARG CZ 1 1 17 7824 1 1 19 ARG H H 5.187 -7.447 0.574 1.00 . A A . 451 ARG H 1 1 17 7825 1 1 19 ARG HA H 7.435 -9.244 0.797 1.00 . A A . 451 ARG HA 1 1 17 7826 1 1 19 ARG HB2 H 4.920 -9.025 2.422 1.00 . A A . 451 ARG HB2 1 1 17 7827 1 1 19 ARG HB3 H 6.151 -10.245 2.704 1.00 . A A . 451 ARG HB3 1 1 17 7828 1 1 19 ARG HD2 H 8.692 -7.971 4.030 1.00 . A A . 451 ARG HD2 1 1 17 7829 1 1 19 ARG HD3 H 8.408 -9.589 3.391 1.00 . A A . 451 ARG HD3 1 1 17 7830 1 1 19 ARG HE H 8.411 -7.466 1.422 1.00 . A A . 451 ARG HE 1 1 17 7831 1 1 19 ARG HG2 H 6.564 -7.265 2.870 1.00 . A A . 451 ARG HG2 1 1 17 7832 1 1 19 ARG HG3 H 6.368 -8.360 4.237 1.00 . A A . 451 ARG HG3 1 1 17 7833 1 1 19 ARG HH11 H 10.372 -9.812 3.153 1.00 . A A . 451 ARG HH11 1 1 17 7834 1 1 19 ARG HH12 H 11.551 -9.949 1.875 1.00 . A A . 451 ARG HH12 1 1 17 7835 1 1 19 ARG HH21 H 9.974 -7.638 -0.242 1.00 . A A . 451 ARG HH21 1 1 17 7836 1 1 19 ARG HH22 H 11.335 -8.695 -0.036 1.00 . A A . 451 ARG HH22 1 1 17 7837 1 1 19 ARG N N 5.982 -7.922 0.250 1.00 . A A . 451 ARG N 1 1 17 7838 1 1 19 ARG NE N 8.874 -8.148 1.965 1.00 . A A . 451 ARG NE 1 1 17 7839 1 1 19 ARG NH1 N 10.698 -9.544 2.234 1.00 . A A . 451 ARG NH1 1 1 17 7840 1 1 19 ARG NH2 N 10.475 -8.307 0.315 1.00 . A A . 451 ARG NH2 1 1 17 7841 1 1 19 ARG O O 6.506 -11.342 -0.199 1.00 . A A . 451 ARG O 1 1 17 7842 1 1 20 THR C C 3.219 -10.864 -2.190 1.00 . A A . 452 THR C 1 1 17 7843 1 1 20 THR CA C 3.827 -11.403 -0.904 1.00 . A A . 452 THR CA 1 1 17 7844 1 1 20 THR CB C 2.729 -12.056 -0.047 1.00 . A A . 452 THR CB 1 1 17 7845 1 1 20 THR CG2 C 3.314 -13.125 0.862 1.00 . A A . 452 THR CG2 1 1 17 7846 1 1 20 THR H H 3.973 -9.574 0.140 1.00 . A A . 452 THR H 1 1 17 7847 1 1 20 THR HA H 4.562 -12.157 -1.152 1.00 . A A . 452 THR HA 1 1 17 7848 1 1 20 THR HB H 2.008 -12.519 -0.704 1.00 . A A . 452 THR HB 1 1 17 7849 1 1 20 THR HG1 H 1.104 -11.190 0.699 1.00 . A A . 452 THR HG1 1 1 17 7850 1 1 20 THR HG21 H 3.787 -13.889 0.262 1.00 . A A . 452 THR HG21 1 1 17 7851 1 1 20 THR HG22 H 2.524 -13.567 1.452 1.00 . A A . 452 THR HG22 1 1 17 7852 1 1 20 THR HG23 H 4.045 -12.678 1.518 1.00 . A A . 452 THR HG23 1 1 17 7853 1 1 20 THR N N 4.503 -10.342 -0.170 1.00 . A A . 452 THR N 1 1 17 7854 1 1 20 THR O O 2.597 -11.604 -2.953 1.00 . A A . 452 THR O 1 1 17 7855 1 1 20 THR OG1 O 2.068 -11.059 0.746 1.00 . A A . 452 THR OG1 1 1 17 7856 1 1 21 LEU C C 1.355 -8.772 -3.478 1.00 . A A . 453 LEU C 1 1 17 7857 1 1 21 LEU CA C 2.871 -8.864 -3.571 1.00 . A A . 453 LEU CA 1 1 17 7858 1 1 21 LEU CB C 3.298 -9.521 -4.892 1.00 . A A . 453 LEU CB 1 1 17 7859 1 1 21 LEU CD1 C 5.116 -10.333 -6.416 1.00 . A A . 453 LEU CD1 1 1 17 7860 1 1 21 LEU CD2 C 5.486 -8.291 -5.016 1.00 . A A . 453 LEU CD2 1 1 17 7861 1 1 21 LEU CG C 4.811 -9.654 -5.091 1.00 . A A . 453 LEU CG 1 1 17 7862 1 1 21 LEU H H 3.923 -9.052 -1.751 1.00 . A A . 453 LEU H 1 1 17 7863 1 1 21 LEU HA H 3.267 -7.859 -3.545 1.00 . A A . 453 LEU HA 1 1 17 7864 1 1 21 LEU HB2 H 2.861 -10.509 -4.934 1.00 . A A . 453 LEU HB2 1 1 17 7865 1 1 21 LEU HB3 H 2.902 -8.936 -5.705 1.00 . A A . 453 LEU HB3 1 1 17 7866 1 1 21 LEU HD11 H 4.671 -11.317 -6.428 1.00 . A A . 453 LEU HD11 1 1 17 7867 1 1 21 LEU HD12 H 6.187 -10.421 -6.540 1.00 . A A . 453 LEU HD12 1 1 17 7868 1 1 21 LEU HD13 H 4.708 -9.744 -7.225 1.00 . A A . 453 LEU HD13 1 1 17 7869 1 1 21 LEU HD21 H 6.548 -8.404 -5.171 1.00 . A A . 453 LEU HD21 1 1 17 7870 1 1 21 LEU HD22 H 5.309 -7.856 -4.044 1.00 . A A . 453 LEU HD22 1 1 17 7871 1 1 21 LEU HD23 H 5.079 -7.646 -5.780 1.00 . A A . 453 LEU HD23 1 1 17 7872 1 1 21 LEU HG H 5.218 -10.272 -4.303 1.00 . A A . 453 LEU HG 1 1 17 7873 1 1 21 LEU N N 3.409 -9.563 -2.409 1.00 . A A . 453 LEU N 1 1 17 7874 1 1 21 LEU O O 0.622 -9.525 -4.120 1.00 . A A . 453 LEU O 1 1 17 7875 1 1 22 GLU C C -0.851 -6.206 -2.378 1.00 . A A . 454 GLU C 1 1 17 7876 1 1 22 GLU CA C -0.520 -7.692 -2.375 1.00 . A A . 454 GLU CA 1 1 17 7877 1 1 22 GLU CB C -0.910 -8.301 -1.023 1.00 . A A . 454 GLU CB 1 1 17 7878 1 1 22 GLU CD C -2.741 -8.586 0.702 1.00 . A A . 454 GLU CD 1 1 17 7879 1 1 22 GLU CG C -2.391 -8.168 -0.707 1.00 . A A . 454 GLU CG 1 1 17 7880 1 1 22 GLU H H 1.540 -7.322 -2.126 1.00 . A A . 454 GLU H 1 1 17 7881 1 1 22 GLU HA H -1.068 -8.184 -3.164 1.00 . A A . 454 GLU HA 1 1 17 7882 1 1 22 GLU HB2 H -0.655 -9.351 -1.029 1.00 . A A . 454 GLU HB2 1 1 17 7883 1 1 22 GLU HB3 H -0.349 -7.805 -0.244 1.00 . A A . 454 GLU HB3 1 1 17 7884 1 1 22 GLU HG2 H -2.684 -7.137 -0.838 1.00 . A A . 454 GLU HG2 1 1 17 7885 1 1 22 GLU HG3 H -2.946 -8.785 -1.393 1.00 . A A . 454 GLU HG3 1 1 17 7886 1 1 22 GLU N N 0.899 -7.880 -2.615 1.00 . A A . 454 GLU N 1 1 17 7887 1 1 22 GLU O O -0.099 -5.399 -1.845 1.00 . A A . 454 GLU O 1 1 17 7888 1 1 22 GLU OE1 O -2.870 -9.806 0.949 1.00 . A A . 454 GLU OE1 1 1 17 7889 1 1 22 GLU OE2 O -2.919 -7.698 1.563 1.00 . A A . 454 GLU OE2 1 1 17 7890 1 1 23 SER C C -3.415 -4.273 -1.795 1.00 . A A . 455 SER C 1 1 17 7891 1 1 23 SER CA C -2.413 -4.461 -2.933 1.00 . A A . 455 SER CA 1 1 17 7892 1 1 23 SER CB C -3.026 -4.064 -4.274 1.00 . A A . 455 SER CB 1 1 17 7893 1 1 23 SER H H -2.504 -6.504 -3.453 1.00 . A A . 455 SER H 1 1 17 7894 1 1 23 SER HA H -1.549 -3.840 -2.742 1.00 . A A . 455 SER HA 1 1 17 7895 1 1 23 SER HB2 H -3.445 -3.071 -4.196 1.00 . A A . 455 SER HB2 1 1 17 7896 1 1 23 SER HB3 H -2.260 -4.075 -5.033 1.00 . A A . 455 SER HB3 1 1 17 7897 1 1 23 SER HG H -4.630 -5.120 -3.890 1.00 . A A . 455 SER HG 1 1 17 7898 1 1 23 SER N N -1.967 -5.839 -2.976 1.00 . A A . 455 SER N 1 1 17 7899 1 1 23 SER O O -4.570 -4.691 -1.896 1.00 . A A . 455 SER O 1 1 17 7900 1 1 23 SER OG O -4.051 -4.968 -4.646 1.00 . A A . 455 SER OG 1 1 17 7901 1 1 24 THR C C -4.303 -2.043 0.514 1.00 . A A . 456 THR C 1 1 17 7902 1 1 24 THR CA C -3.794 -3.484 0.469 1.00 . A A . 456 THR CA 1 1 17 7903 1 1 24 THR CB C -3.008 -3.803 1.755 1.00 . A A . 456 THR CB 1 1 17 7904 1 1 24 THR CG2 C -3.952 -4.064 2.918 1.00 . A A . 456 THR CG2 1 1 17 7905 1 1 24 THR H H -2.024 -3.374 -0.673 1.00 . A A . 456 THR H 1 1 17 7906 1 1 24 THR HA H -4.637 -4.155 0.402 1.00 . A A . 456 THR HA 1 1 17 7907 1 1 24 THR HB H -2.383 -2.957 1.999 1.00 . A A . 456 THR HB 1 1 17 7908 1 1 24 THR HG1 H -2.706 -5.767 1.630 1.00 . A A . 456 THR HG1 1 1 17 7909 1 1 24 THR HG21 H -4.566 -3.192 3.082 1.00 . A A . 456 THR HG21 1 1 17 7910 1 1 24 THR HG22 H -3.380 -4.272 3.810 1.00 . A A . 456 THR HG22 1 1 17 7911 1 1 24 THR HG23 H -4.583 -4.909 2.688 1.00 . A A . 456 THR HG23 1 1 17 7912 1 1 24 THR N N -2.956 -3.683 -0.701 1.00 . A A . 456 THR N 1 1 17 7913 1 1 24 THR O O -3.528 -1.099 0.636 1.00 . A A . 456 THR O 1 1 17 7914 1 1 24 THR OG1 O -2.178 -4.959 1.543 1.00 . A A . 456 THR OG1 1 1 17 7915 1 1 25 TRP C C -7.005 -0.227 1.582 1.00 . A A . 457 TRP C 1 1 17 7916 1 1 25 TRP CA C -6.186 -0.533 0.329 1.00 . A A . 457 TRP CA 1 1 17 7917 1 1 25 TRP CB C -7.019 -0.391 -0.951 1.00 . A A . 457 TRP CB 1 1 17 7918 1 1 25 TRP CD1 C -5.556 -1.627 -2.651 1.00 . A A . 457 TRP CD1 1 1 17 7919 1 1 25 TRP CD2 C -5.798 0.554 -3.080 1.00 . A A . 457 TRP CD2 1 1 17 7920 1 1 25 TRP CE2 C -4.950 -0.010 -4.054 1.00 . A A . 457 TRP CE2 1 1 17 7921 1 1 25 TRP CE3 C -6.095 1.917 -3.158 1.00 . A A . 457 TRP CE3 1 1 17 7922 1 1 25 TRP CG C -6.162 -0.500 -2.180 1.00 . A A . 457 TRP CG 1 1 17 7923 1 1 25 TRP CH2 C -4.707 2.068 -5.138 1.00 . A A . 457 TRP CH2 1 1 17 7924 1 1 25 TRP CZ2 C -4.396 0.738 -5.085 1.00 . A A . 457 TRP CZ2 1 1 17 7925 1 1 25 TRP CZ3 C -5.551 2.659 -4.189 1.00 . A A . 457 TRP CZ3 1 1 17 7926 1 1 25 TRP H H -6.197 -2.652 0.339 1.00 . A A . 457 TRP H 1 1 17 7927 1 1 25 TRP HA H -5.364 0.168 0.284 1.00 . A A . 457 TRP HA 1 1 17 7928 1 1 25 TRP HB2 H -7.761 -1.175 -0.983 1.00 . A A . 457 TRP HB2 1 1 17 7929 1 1 25 TRP HB3 H -7.506 0.572 -0.961 1.00 . A A . 457 TRP HB3 1 1 17 7930 1 1 25 TRP HD1 H -5.640 -2.600 -2.189 1.00 . A A . 457 TRP HD1 1 1 17 7931 1 1 25 TRP HE1 H -4.286 -1.982 -4.281 1.00 . A A . 457 TRP HE1 1 1 17 7932 1 1 25 TRP HE3 H -6.744 2.389 -2.435 1.00 . A A . 457 TRP HE3 1 1 17 7933 1 1 25 TRP HH2 H -4.303 2.689 -5.927 1.00 . A A . 457 TRP HH2 1 1 17 7934 1 1 25 TRP HZ2 H -3.728 0.300 -5.811 1.00 . A A . 457 TRP HZ2 1 1 17 7935 1 1 25 TRP HZ3 H -5.772 3.711 -4.266 1.00 . A A . 457 TRP HZ3 1 1 17 7936 1 1 25 TRP N N -5.610 -1.870 0.394 1.00 . A A . 457 TRP N 1 1 17 7937 1 1 25 TRP NE1 N -4.815 -1.338 -3.768 1.00 . A A . 457 TRP NE1 1 1 17 7938 1 1 25 TRP O O -7.655 0.811 1.683 1.00 . A A . 457 TRP O 1 1 17 7939 1 1 26 GLU C C -6.489 -0.991 4.929 1.00 . A A . 458 GLU C 1 1 17 7940 1 1 26 GLU CA C -7.556 -0.955 3.840 1.00 . A A . 458 GLU CA 1 1 17 7941 1 1 26 GLU CB C -8.615 -2.040 4.076 1.00 . A A . 458 GLU CB 1 1 17 7942 1 1 26 GLU CD C -9.214 -4.490 4.021 1.00 . A A . 458 GLU CD 1 1 17 7943 1 1 26 GLU CG C -8.120 -3.461 3.839 1.00 . A A . 458 GLU CG 1 1 17 7944 1 1 26 GLU H H -6.418 -1.954 2.378 1.00 . A A . 458 GLU H 1 1 17 7945 1 1 26 GLU HA H -8.032 0.015 3.848 1.00 . A A . 458 GLU HA 1 1 17 7946 1 1 26 GLU HB2 H -8.958 -1.972 5.098 1.00 . A A . 458 GLU HB2 1 1 17 7947 1 1 26 GLU HB3 H -9.450 -1.859 3.417 1.00 . A A . 458 GLU HB3 1 1 17 7948 1 1 26 GLU HG2 H -7.742 -3.533 2.831 1.00 . A A . 458 GLU HG2 1 1 17 7949 1 1 26 GLU HG3 H -7.325 -3.674 4.538 1.00 . A A . 458 GLU HG3 1 1 17 7950 1 1 26 GLU N N -6.927 -1.137 2.541 1.00 . A A . 458 GLU N 1 1 17 7951 1 1 26 GLU O O -5.617 -1.860 4.920 1.00 . A A . 458 GLU O 1 1 17 7952 1 1 26 GLU OE1 O -10.112 -4.563 3.159 1.00 . A A . 458 GLU OE1 1 1 17 7953 1 1 26 GLU OE2 O -9.186 -5.227 5.028 1.00 . A A . 458 GLU OE2 1 1 17 7954 1 1 27 LYS C C -5.738 -0.973 8.000 1.00 . A A . 459 LYS C 1 1 17 7955 1 1 27 LYS CA C -5.529 0.057 6.892 1.00 . A A . 459 LYS CA 1 1 17 7956 1 1 27 LYS CB C -5.512 1.461 7.498 1.00 . A A . 459 LYS CB 1 1 17 7957 1 1 27 LYS CD C -4.630 3.807 7.242 1.00 . A A . 459 LYS CD 1 1 17 7958 1 1 27 LYS CE C -3.524 3.542 8.253 1.00 . A A . 459 LYS CE 1 1 17 7959 1 1 27 LYS CG C -5.045 2.528 6.528 1.00 . A A . 459 LYS CG 1 1 17 7960 1 1 27 LYS H H -7.306 0.581 5.861 1.00 . A A . 459 LYS H 1 1 17 7961 1 1 27 LYS HA H -4.574 -0.120 6.423 1.00 . A A . 459 LYS HA 1 1 17 7962 1 1 27 LYS HB2 H -6.510 1.712 7.825 1.00 . A A . 459 LYS HB2 1 1 17 7963 1 1 27 LYS HB3 H -4.850 1.465 8.352 1.00 . A A . 459 LYS HB3 1 1 17 7964 1 1 27 LYS HD2 H -4.266 4.511 6.506 1.00 . A A . 459 LYS HD2 1 1 17 7965 1 1 27 LYS HD3 H -5.486 4.221 7.752 1.00 . A A . 459 LYS HD3 1 1 17 7966 1 1 27 LYS HE2 H -3.907 2.887 9.020 1.00 . A A . 459 LYS HE2 1 1 17 7967 1 1 27 LYS HE3 H -2.702 3.059 7.746 1.00 . A A . 459 LYS HE3 1 1 17 7968 1 1 27 LYS HG2 H -4.200 2.151 5.974 1.00 . A A . 459 LYS HG2 1 1 17 7969 1 1 27 LYS HG3 H -5.852 2.754 5.846 1.00 . A A . 459 LYS HG3 1 1 17 7970 1 1 27 LYS HZ1 H -2.696 5.459 8.161 1.00 . A A . 459 LYS HZ1 1 1 17 7971 1 1 27 LYS HZ2 H -2.242 4.573 9.530 1.00 . A A . 459 LYS HZ2 1 1 17 7972 1 1 27 LYS HZ3 H -3.793 5.244 9.440 1.00 . A A . 459 LYS HZ3 1 1 17 7973 1 1 27 LYS N N -6.551 -0.049 5.858 1.00 . A A . 459 LYS N 1 1 17 7974 1 1 27 LYS NZ N -3.032 4.791 8.889 1.00 . A A . 459 LYS NZ 1 1 17 7975 1 1 27 LYS O O -6.801 -1.003 8.623 1.00 . A A . 459 LYS O 1 1 17 7976 1 1 28 PRO C C -4.937 -1.974 10.709 1.00 . A A . 460 PRO C 1 1 17 7977 1 1 28 PRO CA C -4.745 -2.742 9.403 1.00 . A A . 460 PRO CA 1 1 17 7978 1 1 28 PRO CB C -3.359 -3.391 9.372 1.00 . A A . 460 PRO CB 1 1 17 7979 1 1 28 PRO CD C -3.556 -2.057 7.387 1.00 . A A . 460 PRO CD 1 1 17 7980 1 1 28 PRO CG C -2.910 -3.291 7.957 1.00 . A A . 460 PRO CG 1 1 17 7981 1 1 28 PRO HA H -5.509 -3.502 9.315 1.00 . A A . 460 PRO HA 1 1 17 7982 1 1 28 PRO HB2 H -2.696 -2.856 10.034 1.00 . A A . 460 PRO HB2 1 1 17 7983 1 1 28 PRO HB3 H -3.437 -4.421 9.688 1.00 . A A . 460 PRO HB3 1 1 17 7984 1 1 28 PRO HD2 H -2.882 -1.214 7.450 1.00 . A A . 460 PRO HD2 1 1 17 7985 1 1 28 PRO HD3 H -3.846 -2.236 6.362 1.00 . A A . 460 PRO HD3 1 1 17 7986 1 1 28 PRO HG2 H -1.835 -3.197 7.921 1.00 . A A . 460 PRO HG2 1 1 17 7987 1 1 28 PRO HG3 H -3.228 -4.167 7.409 1.00 . A A . 460 PRO HG3 1 1 17 7988 1 1 28 PRO N N -4.743 -1.847 8.242 1.00 . A A . 460 PRO N 1 1 17 7989 1 1 28 PRO O O -3.996 -1.270 11.128 1.00 . A A . 460 PRO O 1 1 17 7990 1 1 28 PRO OXT O -6.026 -2.076 11.309 1.00 . A A . 460 PRO OXT 1 1 stop_ save_
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