NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
614481 | 1orl | 5767 | cing | 4-filtered-FRED | STAR | entry | full | 212 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1orl # This FRED archive file contains, for PDB entry <1orl>: # # - 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_1orl _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1orl _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4948.65 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 $Viscotoxin_C1 A . 1 1 stop_ save_ save_Viscotoxin_C1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Viscotoxin C1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KSCCPNTTGRNIYNTCRFAGGSRERCAKLSGCKIISASTCPSDYPK _Entity.Number_of_monomers 46 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 LYS . 1 1 2 SER . 1 1 3 CYS . 1 1 4 CYS . 1 1 5 PRO . 1 1 6 ASN . 1 1 7 THR . 1 1 8 THR . 1 1 9 GLY . 1 1 10 ARG . 1 1 11 ASN . 1 1 12 ILE . 1 1 13 TYR . 1 1 14 ASN . 1 1 15 THR . 1 1 16 CYS . 1 1 17 ARG . 1 1 18 PHE . 1 1 19 ALA . 1 1 20 GLY . 1 1 21 GLY . 1 1 22 SER . 1 1 23 ARG . 1 1 24 GLU . 1 1 25 ARG . 1 1 26 CYS . 1 1 27 ALA . 1 1 28 LYS . 1 1 29 LEU . 1 1 30 SER . 1 1 31 GLY . 1 1 32 CYS . 1 1 33 LYS . 1 1 34 ILE . 1 1 35 ILE . 1 1 36 SER . 1 1 37 ALA . 1 1 38 SER . 1 1 39 THR . 1 1 40 CYS . 1 1 41 PRO . 1 1 42 SER . 1 1 43 ASP . 1 1 44 TYR . 1 1 45 PRO . 1 1 46 LYS . 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 LYS 1 1 1 1 SER 2 2 1 1 CYS 3 3 1 1 CYS 4 4 1 1 PRO 5 5 1 1 ASN 6 6 1 1 THR 7 7 1 1 THR 8 8 1 1 GLY 9 9 1 1 ARG 10 10 1 1 ASN 11 11 1 1 ILE 12 12 1 1 TYR 13 13 1 1 ASN 14 14 1 1 THR 15 15 1 1 CYS 16 16 1 1 ARG 17 17 1 1 PHE 18 18 1 1 ALA 19 19 1 1 GLY 20 20 1 1 GLY 21 21 1 1 SER 22 22 1 1 ARG 23 23 1 1 GLU 24 24 1 1 ARG 25 25 1 1 CYS 26 26 1 1 ALA 27 27 1 1 LYS 28 28 1 1 LEU 29 29 1 1 SER 30 30 1 1 GLY 31 31 1 1 CYS 32 32 1 1 LYS 33 33 1 1 ILE 34 34 1 1 ILE 35 35 1 1 SER 36 36 1 1 ALA 37 37 1 1 SER 38 38 1 1 THR 39 39 1 1 CYS 40 40 1 1 PRO 41 41 1 1 SER 42 42 1 1 ASP 43 43 1 1 TYR 44 44 1 1 PRO 45 45 1 1 LYS 46 46 1 1 stop_ save_ save_Discover_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 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 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 LYS HA 1 1 LY+N HA 1 1 1 1 2 1 1 1 LYS QG 1 1 LY+N HG* 1 1 2 1 1 1 1 3 CYS H 1 3 CYS HN 1 1 2 1 2 1 1 3 CYS HB2 1 3 CYS HB2 1 1 3 1 1 1 1 3 CYS H 1 3 CYS HN 1 1 3 1 2 1 1 3 CYS QB 1 3 CYS HB* 1 1 4 1 1 1 1 3 CYS H 1 3 CYS HN 1 1 4 1 2 1 1 3 CYS HB3 1 3 CYS HB1 1 1 5 1 1 1 1 4 CYS H 1 4 CYS HN 1 1 5 1 2 1 1 4 CYS HB2 1 4 CYS HB1 1 1 6 1 1 1 1 4 CYS H 1 4 CYS HN 1 1 6 1 2 1 1 4 CYS HB3 1 4 CYS HB2 1 1 7 1 1 1 1 7 THR H 1 7 THR HN 1 1 7 1 2 1 1 7 THR HB 1 7 THR HB 1 1 8 1 1 1 1 7 THR HA 1 7 THR HA 1 1 8 1 2 1 1 7 THR HB 1 7 THR HB 1 1 9 1 1 1 1 8 THR H 1 8 THR HN 1 1 9 1 2 1 1 8 THR HA 1 8 THR HA 1 1 10 1 1 1 1 8 THR H 1 8 THR HN 1 1 10 1 2 1 1 8 THR HB 1 8 THR HB 1 1 11 1 1 1 1 8 THR HA 1 8 THR HA 1 1 11 1 2 1 1 8 THR HB 1 8 THR HB 1 1 12 1 1 1 1 9 GLY H 1 9 GLY HN 1 1 12 1 2 1 1 9 GLY HA2 1 9 GLY HA2 1 1 13 1 1 1 1 9 GLY H 1 9 GLY HN 1 1 13 1 2 1 1 9 GLY HA3 1 9 GLY HA1 1 1 14 1 1 1 1 10 ARG H 1 10 ARG HN 1 1 14 1 2 1 1 10 ARG HG2 1 10 ARG HG2 1 1 15 1 1 1 1 10 ARG H 1 10 ARG HN 1 1 15 1 2 1 1 10 ARG QG 1 10 ARG HG* 1 1 16 1 1 1 1 10 ARG H 1 10 ARG HN 1 1 16 1 2 1 1 10 ARG HG3 1 10 ARG HG1 1 1 17 1 1 1 1 10 ARG HA 1 10 ARG HA 1 1 17 1 2 1 1 10 ARG HD2 1 10 ARG HD2 1 1 18 1 1 1 1 10 ARG HA 1 10 ARG HA 1 1 18 1 2 1 1 10 ARG HD3 1 10 ARG HD1 1 1 19 1 1 1 1 10 ARG HA 1 10 ARG HA 1 1 19 1 2 1 1 10 ARG HG2 1 10 ARG HG2 1 1 20 1 1 1 1 10 ARG HA 1 10 ARG HA 1 1 20 1 2 1 1 10 ARG QG 1 10 ARG HG* 1 1 21 1 1 1 1 10 ARG HA 1 10 ARG HA 1 1 21 1 2 1 1 10 ARG HG3 1 10 ARG HG1 1 1 22 1 1 1 1 10 ARG HE 1 10 ARG HE 1 1 22 1 2 1 1 10 ARG HG2 1 10 ARG HG2 1 1 23 1 1 1 1 10 ARG HE 1 10 ARG HE 1 1 23 1 2 1 1 10 ARG HG3 1 10 ARG HG1 1 1 24 1 1 1 1 11 ASN H 1 11 ASN HN 1 1 24 1 2 1 1 11 ASN HB2 1 11 ASN HB2 1 1 25 1 1 1 1 11 ASN H 1 11 ASN HN 1 1 25 1 2 1 1 11 ASN QB 1 11 ASN HB* 1 1 26 1 1 1 1 11 ASN H 1 11 ASN HN 1 1 26 1 2 1 1 11 ASN HB3 1 11 ASN HB1 1 1 27 1 1 1 1 11 ASN HB2 1 11 ASN HB2 1 1 27 1 2 1 1 11 ASN HD22 1 11 ASN HD22 1 1 28 1 1 1 1 11 ASN HB3 1 11 ASN HB1 1 1 28 1 2 1 1 11 ASN HD22 1 11 ASN HD22 1 1 29 1 1 1 1 12 ILE H 1 12 ILE HN 1 1 29 1 2 1 1 12 ILE HB 1 12 ILE HB 1 1 30 1 1 1 1 12 ILE H 1 12 ILE HN 1 1 30 1 2 1 1 12 ILE MD 1 12 ILE HD1* 1 1 31 1 1 1 1 12 ILE H 1 12 ILE HN 1 1 31 1 2 1 1 12 ILE HG12 1 12 ILE HG12 1 1 32 1 1 1 1 12 ILE H 1 12 ILE HN 1 1 32 1 2 1 1 12 ILE QG 1 12 ILE HG1* 1 1 33 1 1 1 1 12 ILE H 1 12 ILE HN 1 1 33 1 2 1 1 12 ILE HG13 1 12 ILE HG11 1 1 34 1 1 1 1 12 ILE HA 1 12 ILE HA 1 1 34 1 2 1 1 12 ILE HG12 1 12 ILE HG12 1 1 35 1 1 1 1 12 ILE HA 1 12 ILE HA 1 1 35 1 2 1 1 12 ILE HG13 1 12 ILE HG11 1 1 36 1 1 1 1 12 ILE HB 1 12 ILE HB 1 1 36 1 2 1 1 12 ILE QG 1 12 ILE HG1* 1 1 37 1 1 1 1 13 TYR H 1 13 TYR HN 1 1 37 1 2 1 1 13 TYR HA 1 13 TYR HA 1 1 38 1 1 1 1 13 TYR H 1 13 TYR HN 1 1 38 1 2 1 1 13 TYR QE 1 13 TYR HE* 1 1 39 1 1 1 1 13 TYR HA 1 13 TYR HA 1 1 39 1 2 1 1 13 TYR QE 1 13 TYR HE* 1 1 40 1 1 1 1 14 ASN H 1 14 ASN HN 1 1 40 1 2 1 1 14 ASN HB2 1 14 ASN HB1 1 1 41 1 1 1 1 14 ASN H 1 14 ASN HN 1 1 41 1 2 1 1 14 ASN QB 1 14 ASN HB* 1 1 42 1 1 1 1 14 ASN H 1 14 ASN HN 1 1 42 1 2 1 1 14 ASN HB3 1 14 ASN HB2 1 1 43 1 1 1 1 14 ASN H 1 14 ASN HN 1 1 43 1 2 1 1 14 ASN QD 1 14 ASN HD2* 1 1 44 1 1 1 1 14 ASN HA 1 14 ASN HA 1 1 44 1 2 1 1 14 ASN HD21 1 14 ASN HD21 1 1 45 1 1 1 1 14 ASN HA 1 14 ASN HA 1 1 45 1 2 1 1 14 ASN QD 1 14 ASN HD2* 1 1 46 1 1 1 1 14 ASN HA 1 14 ASN HA 1 1 46 1 2 1 1 14 ASN HD22 1 14 ASN HD22 1 1 47 1 1 1 1 14 ASN HB2 1 14 ASN HB1 1 1 47 1 2 1 1 14 ASN HD22 1 14 ASN HD22 1 1 48 1 1 1 1 14 ASN HB3 1 14 ASN HB2 1 1 48 1 2 1 1 14 ASN HD22 1 14 ASN HD22 1 1 49 1 1 1 1 15 THR H 1 15 THR HN 1 1 49 1 2 1 1 15 THR HB 1 15 THR HB 1 1 50 1 1 1 1 16 CYS H 1 16 CYS HN 1 1 50 1 2 1 1 16 CYS HB2 1 16 CYS HB2 1 1 51 1 1 1 1 16 CYS H 1 16 CYS HN 1 1 51 1 2 1 1 16 CYS HB3 1 16 CYS HB1 1 1 52 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 52 1 2 1 1 17 ARG HB2 1 17 ARG HB1 1 1 53 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 53 1 2 1 1 17 ARG QB 1 17 ARG HB* 1 1 54 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 54 1 2 1 1 17 ARG HB3 1 17 ARG HB2 1 1 55 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 55 1 2 1 1 17 ARG QD 1 17 ARG HD* 1 1 56 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 56 1 2 1 1 17 ARG HG2 1 17 ARG HG2 1 1 57 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 57 1 2 1 1 17 ARG QG 1 17 ARG HG* 1 1 58 1 1 1 1 17 ARG H 1 17 ARG HN 1 1 58 1 2 1 1 17 ARG HG3 1 17 ARG HG1 1 1 59 1 1 1 1 17 ARG HA 1 17 ARG HA 1 1 59 1 2 1 1 17 ARG HE 1 17 ARG HE 1 1 60 1 1 1 1 17 ARG HA 1 17 ARG HA 1 1 60 1 2 1 1 17 ARG HG2 1 17 ARG HG2 1 1 61 1 1 1 1 17 ARG HA 1 17 ARG HA 1 1 61 1 2 1 1 17 ARG QG 1 17 ARG HG* 1 1 62 1 1 1 1 17 ARG HA 1 17 ARG HA 1 1 62 1 2 1 1 17 ARG HG3 1 17 ARG HG1 1 1 63 1 1 1 1 17 ARG QB 1 17 ARG HB* 1 1 63 1 2 1 1 17 ARG HE 1 17 ARG HE 1 1 64 1 1 1 1 17 ARG HB2 1 17 ARG HB1 1 1 64 1 2 1 1 17 ARG HE 1 17 ARG HE 1 1 65 1 1 1 1 17 ARG HB3 1 17 ARG HB2 1 1 65 1 2 1 1 17 ARG HE 1 17 ARG HE 1 1 66 1 1 1 1 17 ARG HE 1 17 ARG HE 1 1 66 1 2 1 1 17 ARG HG2 1 17 ARG HG2 1 1 67 1 1 1 1 17 ARG HE 1 17 ARG HE 1 1 67 1 2 1 1 17 ARG QG 1 17 ARG HG* 1 1 68 1 1 1 1 17 ARG HE 1 17 ARG HE 1 1 68 1 2 1 1 17 ARG HG3 1 17 ARG HG1 1 1 69 1 1 1 1 17 ARG QH1 1 17 ARG HH11 1 1 69 1 2 1 1 23 ARG H 1 23 ARG HN 1 1 70 1 1 1 1 18 PHE H 1 18 PHE HN 1 1 70 1 2 1 1 18 PHE QB 1 18 PHE HB* 1 1 71 1 1 1 1 19 ALA H 1 19 ALA HN 1 1 71 1 2 1 1 19 ALA HA 1 19 ALA HA 1 1 72 1 1 1 1 20 GLY H 1 20 GLY HN 1 1 72 1 2 1 1 20 GLY HA2 1 20 GLY HA2 1 1 73 1 1 1 1 20 GLY H 1 20 GLY HN 1 1 73 1 2 1 1 20 GLY HA3 1 20 GLY HA1 1 1 74 1 1 1 1 21 GLY H 1 21 GLY HN 1 1 74 1 2 1 1 21 GLY HA2 1 21 GLY HA2 1 1 75 1 1 1 1 21 GLY H 1 21 GLY HN 1 1 75 1 2 1 1 21 GLY HA3 1 21 GLY HA1 1 1 76 1 1 1 1 22 SER H 1 22 SER HN 1 1 76 1 2 1 1 22 SER HB2 1 22 SER HB2 1 1 77 1 1 1 1 22 SER H 1 22 SER HN 1 1 77 1 2 1 1 22 SER QB 1 22 SER HB* 1 1 78 1 1 1 1 22 SER H 1 22 SER HN 1 1 78 1 2 1 1 22 SER HB3 1 22 SER HB1 1 1 79 1 1 1 1 22 SER H 1 22 SER HN 1 1 79 1 2 1 1 25 ARG QB 1 25 ARG HB1 1 1 80 1 1 1 1 22 SER HA 1 22 SER HA 1 1 80 1 2 1 1 22 SER QB 1 22 SER HB* 1 1 81 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 81 1 2 1 1 23 ARG HB2 1 23 ARG HB1 1 1 82 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 82 1 2 1 1 23 ARG HB3 1 23 ARG HB2 1 1 83 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 83 1 2 1 1 23 ARG HD2 1 23 ARG HD2 1 1 84 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 84 1 2 1 1 23 ARG QD 1 23 ARG HD* 1 1 85 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 85 1 2 1 1 23 ARG HD3 1 23 ARG HD1 1 1 86 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 86 1 2 1 1 23 ARG HG2 1 23 ARG HG2 1 1 87 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 87 1 2 1 1 23 ARG QG 1 23 ARG HG* 1 1 88 1 1 1 1 23 ARG H 1 23 ARG HN 1 1 88 1 2 1 1 23 ARG HG3 1 23 ARG HG1 1 1 89 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 89 1 2 1 1 23 ARG HE 1 23 ARG HE 1 1 90 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 90 1 2 1 1 23 ARG HG2 1 23 ARG HG2 1 1 91 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 91 1 2 1 1 23 ARG QG 1 23 ARG HG* 1 1 92 1 1 1 1 23 ARG HA 1 23 ARG HA 1 1 92 1 2 1 1 23 ARG HG3 1 23 ARG HG1 1 1 93 1 1 1 1 23 ARG QB 1 23 ARG HB* 1 1 93 1 2 1 1 23 ARG HE 1 23 ARG HE 1 1 94 1 1 1 1 23 ARG QB 1 23 ARG HB* 1 1 94 1 2 1 1 23 ARG QG 1 23 ARG HG* 1 1 95 1 1 1 1 23 ARG HB2 1 23 ARG HB1 1 1 95 1 2 1 1 23 ARG HE 1 23 ARG HE 1 1 96 1 1 1 1 23 ARG HB2 1 23 ARG HB1 1 1 96 1 2 1 1 23 ARG HG2 1 23 ARG HG2 1 1 97 1 1 1 1 23 ARG HB2 1 23 ARG HB1 1 1 97 1 2 1 1 23 ARG HG3 1 23 ARG HG1 1 1 98 1 1 1 1 23 ARG HB3 1 23 ARG HB2 1 1 98 1 2 1 1 23 ARG HE 1 23 ARG HE 1 1 99 1 1 1 1 23 ARG HB3 1 23 ARG HB2 1 1 99 1 2 1 1 23 ARG HG2 1 23 ARG HG2 1 1 100 1 1 1 1 23 ARG HB3 1 23 ARG HB2 1 1 100 1 2 1 1 23 ARG HG3 1 23 ARG HG1 1 1 101 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 101 1 2 1 1 24 GLU HB2 1 24 GLU HB1 1 1 102 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 102 1 2 1 1 24 GLU HB3 1 24 GLU HB2 1 1 103 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 103 1 2 1 1 24 GLU HG2 1 24 GLU HG2 1 1 104 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 104 1 2 1 1 24 GLU QG 1 24 GLU HG* 1 1 105 1 1 1 1 24 GLU H 1 24 GLU HN 1 1 105 1 2 1 1 24 GLU HG3 1 24 GLU HG1 1 1 106 1 1 1 1 24 GLU HA 1 24 GLU HA 1 1 106 1 2 1 1 24 GLU HG2 1 24 GLU HG2 1 1 107 1 1 1 1 24 GLU HA 1 24 GLU HA 1 1 107 1 2 1 1 24 GLU QG 1 24 GLU HG* 1 1 108 1 1 1 1 24 GLU HA 1 24 GLU HA 1 1 108 1 2 1 1 24 GLU HG3 1 24 GLU HG1 1 1 109 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 109 1 2 1 1 25 ARG QB 1 25 ARG HB1 1 1 110 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 110 1 2 1 1 25 ARG HD2 1 25 ARG HD2 1 1 111 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 111 1 2 1 1 25 ARG HD3 1 25 ARG HD1 1 1 112 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 112 1 2 1 1 25 ARG HG2 1 25 ARG HG2 1 1 113 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 113 1 2 1 1 25 ARG QG 1 25 ARG HG* 1 1 114 1 1 1 1 25 ARG H 1 25 ARG HN 1 1 114 1 2 1 1 25 ARG HG3 1 25 ARG HG1 1 1 115 1 1 1 1 25 ARG HA 1 25 ARG HA 1 1 115 1 2 1 1 25 ARG HE 1 25 ARG HE 1 1 116 1 1 1 1 25 ARG HA 1 25 ARG HA 1 1 116 1 2 1 1 25 ARG HG2 1 25 ARG HG2 1 1 117 1 1 1 1 25 ARG HA 1 25 ARG HA 1 1 117 1 2 1 1 25 ARG QG 1 25 ARG HG* 1 1 118 1 1 1 1 25 ARG HA 1 25 ARG HA 1 1 118 1 2 1 1 25 ARG HG3 1 25 ARG HG1 1 1 119 1 1 1 1 25 ARG QB 1 25 ARG HB1 1 1 119 1 2 1 1 25 ARG HE 1 25 ARG HE 1 1 120 1 1 1 1 25 ARG QB 1 25 ARG HB1 1 1 120 1 2 1 1 26 CYS H 1 26 CYS HN 1 1 121 1 1 1 1 26 CYS H 1 26 CYS HN 1 1 121 1 2 1 1 26 CYS HB2 1 26 CYS HB2 1 1 122 1 1 1 1 26 CYS H 1 26 CYS HN 1 1 122 1 2 1 1 26 CYS QB 1 26 CYS HB* 1 1 123 1 1 1 1 26 CYS H 1 26 CYS HN 1 1 123 1 2 1 1 26 CYS HB3 1 26 CYS HB1 1 1 124 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 124 1 2 1 1 28 LYS HB2 1 28 LYS HB1 1 1 125 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 125 1 2 1 1 28 LYS HB3 1 28 LYS HB2 1 1 126 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 126 1 2 1 1 28 LYS QD 1 28 LYS HD* 1 1 127 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 127 1 2 1 1 28 LYS QE 1 28 LYS HE* 1 1 128 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 128 1 2 1 1 28 LYS HG2 1 28 LYS HG2 1 1 129 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 129 1 2 1 1 28 LYS QG 1 28 LYS HG* 1 1 130 1 1 1 1 28 LYS H 1 28 LYS HN 1 1 130 1 2 1 1 28 LYS HG3 1 28 LYS HG1 1 1 131 1 1 1 1 28 LYS HA 1 28 LYS HA 1 1 131 1 2 1 1 28 LYS QD 1 28 LYS HD* 1 1 132 1 1 1 1 28 LYS HA 1 28 LYS HA 1 1 132 1 2 1 1 28 LYS HG2 1 28 LYS HG2 1 1 133 1 1 1 1 28 LYS HA 1 28 LYS HA 1 1 133 1 2 1 1 28 LYS QG 1 28 LYS HG* 1 1 134 1 1 1 1 28 LYS HA 1 28 LYS HA 1 1 134 1 2 1 1 28 LYS HG3 1 28 LYS HG1 1 1 135 1 1 1 1 29 LEU H 1 29 LEU HN 1 1 135 1 2 1 1 29 LEU HB2 1 29 LEU HB2 1 1 136 1 1 1 1 29 LEU H 1 29 LEU HN 1 1 136 1 2 1 1 29 LEU QB 1 29 LEU HB* 1 1 137 1 1 1 1 29 LEU H 1 29 LEU HN 1 1 137 1 2 1 1 29 LEU HB3 1 29 LEU HB1 1 1 138 1 1 1 1 29 LEU H 1 29 LEU HN 1 1 138 1 2 1 1 29 LEU HG 1 29 LEU HG 1 1 139 1 1 1 1 30 SER H 1 30 SER HN 1 1 139 1 2 1 1 30 SER HB2 1 30 SER HB2 1 1 140 1 1 1 1 30 SER H 1 30 SER HN 1 1 140 1 2 1 1 30 SER QB 1 30 SER HB* 1 1 141 1 1 1 1 30 SER H 1 30 SER HN 1 1 141 1 2 1 1 30 SER HB3 1 30 SER HB1 1 1 142 1 1 1 1 30 SER H 1 30 SER HN 1 1 142 1 2 1 1 30 SER HG 1 30 SER HG 1 1 143 1 1 1 1 32 CYS H 1 32 CYS HN 1 1 143 1 2 1 1 32 CYS HB2 1 32 CYS HB2 1 1 144 1 1 1 1 32 CYS H 1 32 CYS HN 1 1 144 1 2 1 1 32 CYS QB 1 32 CYS HB* 1 1 145 1 1 1 1 32 CYS H 1 32 CYS HN 1 1 145 1 2 1 1 32 CYS HB3 1 32 CYS HB1 1 1 146 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 146 1 2 1 1 33 LYS QD 1 33 LYS HD* 1 1 147 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 147 1 2 1 1 33 LYS HE2 1 33 LYS HE2 1 1 148 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 148 1 2 1 1 33 LYS QE 1 33 LYS HE* 1 1 149 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 149 1 2 1 1 33 LYS HE3 1 33 LYS HE1 1 1 150 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 150 1 2 1 1 33 LYS HG2 1 33 LYS HG2 1 1 151 1 1 1 1 33 LYS H 1 33 LYS HN 1 1 151 1 2 1 1 33 LYS HG3 1 33 LYS HG1 1 1 152 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 152 1 2 1 1 34 ILE HA 1 34 ILE HA 1 1 153 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 153 1 2 1 1 34 ILE HB 1 34 ILE HB 1 1 154 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 154 1 2 1 1 34 ILE MD 1 34 ILE HD1* 1 1 155 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 155 1 2 1 1 34 ILE HG12 1 34 ILE HG12 1 1 156 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 156 1 2 1 1 34 ILE QG 1 34 ILE HG1* 1 1 157 1 1 1 1 34 ILE H 1 34 ILE HN 1 1 157 1 2 1 1 34 ILE HG13 1 34 ILE HG11 1 1 158 1 1 1 1 34 ILE HA 1 34 ILE HA 1 1 158 1 2 1 1 34 ILE MD 1 34 ILE HD1* 1 1 159 1 1 1 1 34 ILE HB 1 34 ILE HB 1 1 159 1 2 1 1 34 ILE HG12 1 34 ILE HG12 1 1 160 1 1 1 1 34 ILE HB 1 34 ILE HB 1 1 160 1 2 1 1 34 ILE QG 1 34 ILE HG1* 1 1 161 1 1 1 1 34 ILE HB 1 34 ILE HB 1 1 161 1 2 1 1 34 ILE HG13 1 34 ILE HG11 1 1 162 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 162 1 2 1 1 35 ILE HA 1 35 ILE HA 1 1 163 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 163 1 2 1 1 35 ILE HB 1 35 ILE HB 1 1 164 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 164 1 2 1 1 35 ILE MD 1 35 ILE HD1* 1 1 165 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 165 1 2 1 1 35 ILE HG12 1 35 ILE HG12 1 1 166 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 166 1 2 1 1 35 ILE QG 1 35 ILE HG1* 1 1 167 1 1 1 1 35 ILE H 1 35 ILE HN 1 1 167 1 2 1 1 35 ILE HG13 1 35 ILE HG11 1 1 168 1 1 1 1 35 ILE HA 1 35 ILE HA 1 1 168 1 2 1 1 35 ILE HB 1 35 ILE HB 1 1 169 1 1 1 1 38 SER H 1 38 SER HN 1 1 169 1 2 1 1 38 SER HB2 1 38 SER HB2 1 1 170 1 1 1 1 38 SER H 1 38 SER HN 1 1 170 1 2 1 1 38 SER HB3 1 38 SER HB1 1 1 171 1 1 1 1 38 SER HA 1 38 SER HA 1 1 171 1 2 1 1 38 SER HB2 1 38 SER HB2 1 1 172 1 1 1 1 38 SER HA 1 38 SER HA 1 1 172 1 2 1 1 38 SER QB 1 38 SER HB* 1 1 173 1 1 1 1 38 SER HA 1 38 SER HA 1 1 173 1 2 1 1 38 SER HB3 1 38 SER HB1 1 1 174 1 1 1 1 39 THR H 1 39 THR HN 1 1 174 1 2 1 1 39 THR HB 1 39 THR HB 1 1 175 1 1 1 1 39 THR HA 1 39 THR HA 1 1 175 1 2 1 1 39 THR HB 1 39 THR HB 1 1 176 1 1 1 1 40 CYS H 1 40 CYS HN 1 1 176 1 2 1 1 40 CYS HB2 1 40 CYS HB1 1 1 177 1 1 1 1 40 CYS H 1 40 CYS HN 1 1 177 1 2 1 1 40 CYS QB 1 40 CYS HB* 1 1 178 1 1 1 1 40 CYS H 1 40 CYS HN 1 1 178 1 2 1 1 40 CYS HB3 1 40 CYS HB2 1 1 179 1 1 1 1 42 SER H 1 42 SER HN 1 1 179 1 2 1 1 42 SER HA 1 42 SER HA 1 1 180 1 1 1 1 42 SER H 1 42 SER HN 1 1 180 1 2 1 1 42 SER QB 1 42 SER HB* 1 1 181 1 1 1 1 44 TYR H 1 44 TYR HN 1 1 181 1 2 1 1 44 TYR HB2 1 44 TYR HB2 1 1 182 1 1 1 1 44 TYR H 1 44 TYR HN 1 1 182 1 2 1 1 44 TYR QB 1 44 TYR HB* 1 1 183 1 1 1 1 44 TYR H 1 44 TYR HN 1 1 183 1 2 1 1 44 TYR HB3 1 44 TYR HB1 1 1 184 1 1 1 1 44 TYR H 1 44 TYR HN 1 1 184 1 2 1 1 44 TYR QE 1 44 TYR HE* 1 1 185 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 185 1 2 1 1 46 LYS HD2 1 46 LYSC HD2 1 1 186 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 186 1 2 1 1 46 LYS QD 1 46 LYSC HD* 1 1 187 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 187 1 2 1 1 46 LYS HD3 1 46 LYSC HD1 1 1 188 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 188 1 2 1 1 46 LYS HE2 1 46 LYSC HE2 1 1 189 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 189 1 2 1 1 46 LYS HE3 1 46 LYSC HE1 1 1 190 1 1 1 1 46 LYS H 1 46 LYSC HN 1 1 190 1 2 1 1 46 LYS QG 1 46 LYSC HG* 1 1 191 1 1 1 1 46 LYS HA 1 46 LYSC HA 1 1 191 1 2 1 1 46 LYS HD2 1 46 LYSC HD2 1 1 192 1 1 1 1 46 LYS HA 1 46 LYSC HA 1 1 192 1 2 1 1 46 LYS QD 1 46 LYSC HD* 1 1 193 1 1 1 1 46 LYS HA 1 46 LYSC HA 1 1 193 1 2 1 1 46 LYS HD3 1 46 LYSC HD1 1 1 194 1 1 1 1 46 LYS HA 1 46 LYSC HA 1 1 194 1 2 1 1 46 LYS QE 1 46 LYSC HE* 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 . . . . . 10.0 1.8 3.78 1 1 2 1 . . . . . 10.0 1.8 3.94 1 1 3 1 . . . . . 10.0 1.8 3.49 1 1 4 1 . . . . . 10.0 1.8 3.94 1 1 5 1 . . . . . 10.0 1.8 3.3 1 1 6 1 . . . . . 10.0 1.8 4.02 1 1 7 1 . . . . . 10.0 1.8 2.94 1 1 8 1 . . . . . 10.0 1.8 3.02 1 1 9 1 . . . . . 10.0 1.8 2.86 1 1 10 1 . . . . . 10.0 1.8 2.78 1 1 11 1 . . . . . 10.0 1.8 3.06 1 1 12 1 . . . . . 10.0 1.8 2.9 1 1 13 1 . . . . . 10.0 1.8 2.9 1 1 14 1 . . . . . 10.0 1.8 4.22 1 1 15 1 . . . . . 10.0 1.8 3.53 1 1 16 1 . . . . . 10.0 1.8 4.22 1 1 17 1 . . . . . 10.0 1.8 3.54 1 1 18 1 . . . . . 10.0 1.8 3.54 1 1 19 1 . . . . . 10.0 1.8 4.02 1 1 20 1 . . . . . 10.0 1.8 3.46 1 1 21 1 . . . . . 10.0 1.8 4.02 1 1 22 1 . . . . . 10.0 1.8 3.06 1 1 23 1 . . . . . 10.0 1.8 3.06 1 1 24 1 . . . . . 10.0 1.8 3.06 1 1 25 1 . . . . . 10.0 1.8 2.81 1 1 26 1 . . . . . 10.0 1.8 3.06 1 1 27 1 . . . . . 10.0 1.8 3.86 1 1 28 1 . . . . . 10.0 1.8 3.86 1 1 29 1 . . . . . 10.0 1.8 2.9 1 1 30 1 . . . . . 10.0 1.8 5.29 1 1 31 1 . . . . . 10.0 1.8 3.42 1 1 32 1 . . . . . 10.0 1.8 3.05 1 1 33 1 . . . . . 10.0 1.8 3.42 1 1 34 1 . . . . . 10.0 1.8 3.38 1 1 35 1 . . . . . 10.0 1.8 3.38 1 1 36 1 . . . . . 10.0 1.8 2.71 1 1 37 1 . . . . . 10.0 1.8 2.7 1 1 38 1 . . . . . 10.0 1.8 6.83 1 1 39 1 . . . . . 10.0 1.8 5.91 1 1 40 1 . . . . . 10.0 1.8 3.46 1 1 41 1 . . . . . 10.0 1.8 3.03 1 1 42 1 . . . . . 10.0 1.8 3.46 1 1 43 1 . . . . . 10.0 1.8 5.45 1 1 44 1 . . . . . 10.0 1.8 4.5 1 1 45 1 . . . . . 10.0 1.8 4.26 1 1 46 1 . . . . . 10.0 1.8 4.5 1 1 47 1 . . . . . 10.0 1.8 3.78 1 1 48 1 . . . . . 10.0 1.8 4.1 1 1 49 1 . . . . . 10.0 1.8 2.78 1 1 50 1 . . . . . 10.0 1.8 2.86 1 1 51 1 . . . . . 10.0 1.8 2.86 1 1 52 1 . . . . . 10.0 1.8 3.5 1 1 53 1 . . . . . 10.0 1.8 3.15 1 1 54 1 . . . . . 10.0 1.8 3.5 1 1 55 1 . . . . . 10.0 1.8 5.42 1 1 56 1 . . . . . 10.0 1.8 3.62 1 1 57 1 . . . . . 10.0 1.8 3.22 1 1 58 1 . . . . . 10.0 1.8 3.62 1 1 59 1 . . . . . 10.0 1.8 4.86 1 1 60 1 . . . . . 10.0 1.8 4.06 1 1 61 1 . . . . . 10.0 1.8 3.8 1 1 62 1 . . . . . 10.0 1.8 4.06 1 1 63 1 . . . . . 10.0 1.8 3.77 1 1 64 1 . . . . . 10.0 1.8 4.14 1 1 65 1 . . . . . 10.0 1.8 4.14 1 1 66 1 . . . . . 10.0 1.8 4.14 1 1 67 1 . . . . . 10.0 1.8 3.68 1 1 68 1 . . . . . 10.0 1.8 4.14 1 1 69 1 . . . . . . 1.8 4.19 1 1 70 1 . . . . . 10.0 1.8 3.7 1 1 71 1 . . . . . 10.0 1.8 2.94 1 1 72 1 . . . . . 10.0 1.8 2.94 1 1 73 1 . . . . . 10.0 1.8 2.94 1 1 74 1 . . . . . 10.0 1.8 2.74 1 1 75 1 . . . . . 10.0 1.8 2.74 1 1 76 1 . . . . . 10.0 1.8 3.46 1 1 77 1 . . . . . 10.0 1.8 3.16 1 1 78 1 . . . . . 10.0 1.8 3.46 1 1 79 1 . . . . . . 1.8 3.47 1 1 80 1 . . . . . 10.0 1.8 2.71 1 1 81 1 . . . . . 10.0 1.8 2.98 1 1 82 1 . . . . . 10.0 1.8 3.58 1 1 83 1 . . . . . 10.0 1.8 4.5 1 1 84 1 . . . . . 10.0 1.8 4.6 1 1 85 1 . . . . . 10.0 1.8 4.5 1 1 86 1 . . . . . 10.0 1.8 3.42 1 1 87 1 . . . . . 10.0 1.8 3.09 1 1 88 1 . . . . . 10.0 1.8 3.42 1 1 89 1 . . . . . 10.0 1.8 4.94 1 1 90 1 . . . . . 10.0 1.8 3.7 1 1 91 1 . . . . . 10.0 1.8 3.47 1 1 92 1 . . . . . 10.0 1.8 3.7 1 1 93 1 . . . . . 10.0 1.8 3.99 1 1 94 1 . . . . . 10.0 1.8 2.5 1 1 95 1 . . . . . 10.0 1.8 4.14 1 1 96 1 . . . . . 10.0 1.8 3.05 1 1 97 1 . . . . . 10.0 1.8 3.05 1 1 98 1 . . . . . 10.0 1.8 4.14 1 1 99 1 . . . . . 10.0 1.8 3.06 1 1 100 1 . . . . . 10.0 1.8 2.62 1 1 101 1 . . . . . 10.0 1.8 3.06 1 1 102 1 . . . . . 10.0 1.8 3.55 1 1 103 1 . . . . . 10.0 1.8 4.02 1 1 104 1 . . . . . 10.0 1.8 4.2 1 1 105 1 . . . . . 10.0 1.8 4.02 1 1 106 1 . . . . . 10.0 1.8 3.54 1 1 107 1 . . . . . 10.0 1.8 3.37 1 1 108 1 . . . . . 10.0 1.8 3.54 1 1 109 1 . . . . . . 1.8 2.9 1 1 110 1 . . . . . 10.0 1.8 5.5 1 1 111 1 . . . . . 10.0 1.8 5.5 1 1 112 1 . . . . . 10.0 1.8 4.58 1 1 113 1 . . . . . 10.0 1.8 4.26 1 1 114 1 . . . . . 10.0 1.8 4.58 1 1 115 1 . . . . . 10.0 1.8 5.06 1 1 116 1 . . . . . 10.0 1.8 3.82 1 1 117 1 . . . . . 10.0 1.8 3.5 1 1 118 1 . . . . . 10.0 1.8 3.82 1 1 119 1 . . . . . . 1.8 4.19 1 1 120 1 . . . . . . 1.8 2.99 1 1 121 1 . . . . . 10.0 1.8 3.42 1 1 122 1 . . . . . 10.0 1.8 3.1 1 1 123 1 . . . . . 10.0 1.8 3.42 1 1 124 1 . . . . . 10.0 1.8 2.9 1 1 125 1 . . . . . 10.0 1.8 3.48 1 1 126 1 . . . . . 10.0 1.8 5.9 1 1 127 1 . . . . . 10.0 1.8 6.38 1 1 128 1 . . . . . 10.0 1.8 3.7 1 1 129 1 . . . . . 10.0 1.8 4.1 1 1 130 1 . . . . . 10.0 1.8 3.96 1 1 131 1 . . . . . 10.0 1.8 5.1 1 1 132 1 . . . . . 10.0 1.8 3.66 1 1 133 1 . . . . . 10.0 1.8 3.49 1 1 134 1 . . . . . 10.0 1.8 3.66 1 1 135 1 . . . . . 10.0 1.8 2.86 1 1 136 1 . . . . . 10.0 1.8 2.58 1 1 137 1 . . . . . 10.0 1.8 3.31 1 1 138 1 . . . . . 10.0 1.8 4.5 1 1 139 1 . . . . . 10.0 1.8 3.78 1 1 140 1 . . . . . 10.0 1.8 3.48 1 1 141 1 . . . . . 10.0 1.8 3.78 1 1 142 1 . . . . . 10.0 1.8 2.82 1 1 143 1 . . . . . 10.0 1.8 3.58 1 1 144 1 . . . . . 10.0 1.8 3.16 1 1 145 1 . . . . . 10.0 1.8 3.58 1 1 146 1 . . . . . 10.0 1.8 4.62 1 1 147 1 . . . . . 10.0 1.8 4.02 1 1 148 1 . . . . . 10.0 1.8 3.8 1 1 149 1 . . . . . 10.0 1.8 4.02 1 1 150 1 . . . . . 10.0 1.8 4.22 1 1 151 1 . . . . . 10.0 1.8 3.78 1 1 152 1 . . . . . 10.0 1.8 3.0 1 1 153 1 . . . . . 10.0 1.8 2.94 1 1 154 1 . . . . . 10.0 1.8 5.61 1 1 155 1 . . . . . 10.0 1.8 3.58 1 1 156 1 . . . . . 10.0 1.8 3.25 1 1 157 1 . . . . . 10.0 1.8 3.58 1 1 158 1 . . . . . 10.0 1.8 4.45 1 1 159 1 . . . . . 10.0 1.8 2.94 1 1 160 1 . . . . . 10.0 1.8 2.58 1 1 161 1 . . . . . 10.0 1.8 2.94 1 1 162 1 . . . . . 10.0 1.8 2.78 1 1 163 1 . . . . . 10.0 1.8 3.87 1 1 164 1 . . . . . 10.0 1.8 4.73 1 1 165 1 . . . . . 10.0 1.8 3.58 1 1 166 1 . . . . . 10.0 1.8 3.29 1 1 167 1 . . . . . 10.0 1.8 3.58 1 1 168 1 . . . . . 10.0 1.8 2.98 1 1 169 1 . . . . . 10.0 1.8 3.1 1 1 170 1 . . . . . 10.0 1.8 3.1 1 1 171 1 . . . . . 10.0 1.8 2.94 1 1 172 1 . . . . . 10.0 1.8 2.64 1 1 173 1 . . . . . 10.0 1.8 2.94 1 1 174 1 . . . . . 10.0 1.8 3.18 1 1 175 1 . . . . . 10.0 1.8 3.02 1 1 176 1 . . . . . 10.0 1.8 3.1 1 1 177 1 . . . . . 10.0 1.8 3.39 1 1 178 1 . . . . . 10.0 1.8 3.64 1 1 179 1 . . . . . 10.0 1.8 2.86 1 1 180 1 . . . . . 10.0 1.8 3.82 1 1 181 1 . . . . . 10.0 1.8 4.06 1 1 182 1 . . . . . 10.0 1.8 3.61 1 1 183 1 . . . . . 10.0 1.8 4.06 1 1 184 1 . . . . . 10.0 1.8 6.83 1 1 185 1 . . . . . 10.0 1.8 5.5 1 1 186 1 . . . . . 10.0 1.8 5.1 1 1 187 1 . . . . . 10.0 1.8 5.5 1 1 188 1 . . . . . 10.0 1.8 5.5 1 1 189 1 . . . . . 10.0 1.8 5.5 1 1 190 1 . . . . . 10.0 1.8 5.14 1 1 191 1 . . . . . 10.0 1.8 3.66 1 1 192 1 . . . . . 10.0 1.8 3.28 1 1 193 1 . . . . . 10.0 1.8 3.66 1 1 194 1 . . . . . 10.0 1.8 5.9 1 1 stop_ save_ save_Discover_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 CYS C 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS C -162.99998 -103.0 1 3 CYS C 1 4 CYS N 1 4 CYS CA 1 4 CYS C 1 1 2 . 1 1 6 ASN C 1 1 7 THR N 1 1 7 THR CA 1 1 7 THR C -85.0 -25.0 1 6 ASN C 1 7 THR N 1 7 THR CA 1 7 THR C 1 1 3 . 1 1 10 ARG C 1 1 11 ASN N 1 1 11 ASN CA 1 1 11 ASN C -85.0 -25.0 1 10 ARG C 1 11 ASN N 1 11 ASN CA 1 11 ASN C 1 1 4 . 1 1 11 ASN C 1 1 12 ILE N 1 1 12 ILE CA 1 1 12 ILE C -85.0 -25.0 1 11 ASN C 1 12 ILE N 1 12 ILE CA 1 12 ILE C 1 1 5 . 1 1 13 TYR C 1 1 14 ASN N 1 1 14 ASN CA 1 1 14 ASN C -85.0 -25.0 1 13 TYR C 1 14 ASN N 1 14 ASN CA 1 14 ASN C 1 1 6 . 1 1 14 ASN C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -85.0 -25.0 1 14 ASN C 1 15 THR N 1 15 THR CA 1 15 THR C 1 1 7 . 1 1 16 CYS C 1 1 17 ARG N 1 1 17 ARG CA 1 1 17 ARG C -85.0 -25.0 1 16 CYS C 1 17 ARG N 1 17 ARG CA 1 17 ARG C 1 1 8 . 1 1 23 ARG C 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU C -85.0 -25.0 1 23 ARG C 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 1 9 . 1 1 24 GLU C 1 1 25 ARG N 1 1 25 ARG CA 1 1 25 ARG C -85.0 -25.0 1 24 GLU C 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 1 10 . 1 1 25 ARG C 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS C -85.0 -25.0 1 25 ARG C 1 26 CYS N 1 26 CYS CA 1 26 CYS C 1 1 11 . 1 1 26 CYS C 1 1 27 ALA N 1 1 27 ALA CA 1 1 27 ALA C -85.0 -25.0 1 26 CYS C 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 1 12 . 1 1 27 ALA C 1 1 28 LYS N 1 1 28 LYS CA 1 1 28 LYS C -85.0 -25.0 1 27 ALA C 1 28 LYS N 1 28 LYS CA 1 28 LYS C 1 1 13 . 1 1 32 CYS C 1 1 33 LYS N 1 1 33 LYS CA 1 1 33 LYS C -162.99998 -103.0 1 32 CYS C 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 1 14 . 1 1 33 LYS C 1 1 34 ILE N 1 1 34 ILE CA 1 1 34 ILE C -168.0 -107.99999 1 33 LYS C 1 34 ILE N 1 34 ILE CA 1 34 ILE C 1 1 15 . 1 1 34 ILE C 1 1 35 ILE N 1 1 35 ILE CA 1 1 35 ILE C -168.0 -107.99999 1 34 ILE C 1 35 ILE N 1 35 ILE CA 1 35 ILE C 1 1 16 . 1 1 38 SER C 1 1 39 THR N 1 1 39 THR CA 1 1 39 THR C -162.99998 -103.0 1 38 SER C 1 39 THR N 1 39 THR CA 1 39 THR C 1 1 17 . 1 1 41 PRO C 1 1 42 SER N 1 1 42 SER CA 1 1 42 SER C -73.0 -23.0 1 41 PRO C 1 42 SER N 1 42 SER CA 1 42 SER C 1 1 18 . 1 1 45 PRO C 1 1 46 LYS N 1 1 46 LYS CA 1 1 46 LYS C -162.99998 -103.0 1 45 PRO C 1 46 LYSC N 1 46 LYSC CA 1 46 LYSC C 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 LYS C C -1.519 3.303 -6.503 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C -1.455 3.535 -8.014 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C -0.234 4.381 -8.412 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C 0.931 6.620 -8.189 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C 1.226 7.763 -7.209 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C -0.095 5.660 -7.575 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H -2.655 4.246 -9.525 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H -3.487 3.559 -8.274 1.00 . A A . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H -2.838 5.041 -8.084 1.00 . A A . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H -1.361 2.564 -8.502 1.00 . A A . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H 0.672 3.785 -8.281 1.00 . A A . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H -0.319 4.645 -9.468 1.00 . A A . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H 1.858 6.086 -8.406 1.00 . A A . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H 0.524 7.015 -9.121 1.00 . A A . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H 0.296 8.111 -6.761 1.00 . A A . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H 1.885 7.397 -6.420 1.00 . A A . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H -1.055 6.173 -7.507 1.00 . A A . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H 0.233 5.392 -6.572 1.00 . A A . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H 2.688 8.620 -8.372 1.00 . A A . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H 1.194 9.319 -8.524 1.00 . A A . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H 2.111 9.605 -7.182 1.00 . A A . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N -2.697 4.140 -8.522 1.00 . A A . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N 1.859 8.915 -7.875 1.00 . A A . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O -2.363 3.888 -5.824 1.00 . A A . 1 LYS O 1 1 1 25 1 1 2 SER C C 0.409 3.405 -3.984 1.00 . A A . 2 SER C 1 1 1 26 1 1 2 SER CA C -0.422 2.258 -4.559 1.00 . A A . 2 SER CA 1 1 1 27 1 1 2 SER CB C 0.259 0.909 -4.312 1.00 . A A . 2 SER CB 1 1 1 28 1 1 2 SER H H 0.051 2.024 -6.610 1.00 . A A . 2 SER H 1 1 1 29 1 1 2 SER HA H -1.394 2.242 -4.070 1.00 . A A . 2 SER HA 1 1 1 30 1 1 2 SER HB2 H 1.251 0.900 -4.764 1.00 . A A . 2 SER HB2 1 1 1 31 1 1 2 SER HB3 H 0.359 0.747 -3.237 1.00 . A A . 2 SER HB3 1 1 1 32 1 1 2 SER HG H -0.205 -0.970 -4.496 1.00 . A A . 2 SER HG 1 1 1 33 1 1 2 SER N N -0.609 2.467 -5.988 1.00 . A A . 2 SER N 1 1 1 34 1 1 2 SER O O 1.295 3.913 -4.669 1.00 . A A . 2 SER O 1 1 1 35 1 1 2 SER OG O -0.509 -0.139 -4.870 1.00 . A A . 2 SER OG 1 1 1 36 1 1 3 CYS C C 0.880 4.619 -0.580 1.00 . A A . 3 CYS C 1 1 1 37 1 1 3 CYS CA C 0.755 4.937 -2.068 1.00 . A A . 3 CYS CA 1 1 1 38 1 1 3 CYS CB C -0.058 6.216 -2.305 1.00 . A A . 3 CYS CB 1 1 1 39 1 1 3 CYS H H -0.631 3.342 -2.240 1.00 . A A . 3 CYS H 1 1 1 40 1 1 3 CYS HA H 1.757 5.091 -2.471 1.00 . A A . 3 CYS HA 1 1 1 41 1 1 3 CYS HB2 H -1.107 6.022 -2.078 1.00 . A A . 3 CYS HB2 1 1 1 42 1 1 3 CYS HB3 H 0.303 7.001 -1.641 1.00 . A A . 3 CYS HB3 1 1 1 43 1 1 3 CYS N N 0.111 3.815 -2.744 1.00 . A A . 3 CYS N 1 1 1 44 1 1 3 CYS O O -0.125 4.351 0.073 1.00 . A A . 3 CYS O 1 1 1 45 1 1 3 CYS SG S 0.076 6.838 -3.998 1.00 . A A . 3 CYS SG 1 1 1 46 1 1 4 CYS C C 3.098 5.402 2.060 1.00 . A A . 4 CYS C 1 1 1 47 1 1 4 CYS CA C 2.497 4.228 1.279 1.00 . A A . 4 CYS CA 1 1 1 48 1 1 4 CYS CB C 3.542 3.108 1.180 1.00 . A A . 4 CYS CB 1 1 1 49 1 1 4 CYS H H 2.876 4.928 -0.670 1.00 . A A . 4 CYS H 1 1 1 50 1 1 4 CYS HA H 1.622 3.847 1.796 1.00 . A A . 4 CYS HA 1 1 1 51 1 1 4 CYS HB2 H 4.341 3.437 0.520 1.00 . A A . 4 CYS HB2 1 1 1 52 1 1 4 CYS HB3 H 3.989 2.940 2.159 1.00 . A A . 4 CYS HB3 1 1 1 53 1 1 4 CYS N N 2.116 4.641 -0.066 1.00 . A A . 4 CYS N 1 1 1 54 1 1 4 CYS O O 3.669 6.311 1.457 1.00 . A A . 4 CYS O 1 1 1 55 1 1 4 CYS SG S 2.937 1.507 0.593 1.00 . A A . 4 CYS SG 1 1 1 56 1 1 5 PRO C C 5.163 6.316 4.173 1.00 . A A . 5 PRO C 1 1 1 57 1 1 5 PRO CA C 3.637 6.355 4.277 1.00 . A A . 5 PRO CA 1 1 1 58 1 1 5 PRO CB C 3.164 6.009 5.693 1.00 . A A . 5 PRO CB 1 1 1 59 1 1 5 PRO CD C 2.315 4.370 4.192 1.00 . A A . 5 PRO CD 1 1 1 60 1 1 5 PRO CG C 2.837 4.519 5.618 1.00 . A A . 5 PRO CG 1 1 1 61 1 1 5 PRO HA H 3.293 7.358 4.038 1.00 . A A . 5 PRO HA 1 1 1 62 1 1 5 PRO HB2 H 3.909 6.232 6.458 1.00 . A A . 5 PRO HB2 1 1 1 63 1 1 5 PRO HB3 H 2.246 6.555 5.908 1.00 . A A . 5 PRO HB3 1 1 1 64 1 1 5 PRO HD2 H 2.481 3.352 3.847 1.00 . A A . 5 PRO HD2 1 1 1 65 1 1 5 PRO HD3 H 1.253 4.605 4.171 1.00 . A A . 5 PRO HD3 1 1 1 66 1 1 5 PRO HG2 H 3.746 3.931 5.740 1.00 . A A . 5 PRO HG2 1 1 1 67 1 1 5 PRO HG3 H 2.094 4.220 6.359 1.00 . A A . 5 PRO HG3 1 1 1 68 1 1 5 PRO N N 3.014 5.373 3.402 1.00 . A A . 5 PRO N 1 1 1 69 1 1 5 PRO O O 5.807 7.362 4.230 1.00 . A A . 5 PRO O 1 1 1 70 1 1 6 ASN C C 7.605 3.592 3.537 1.00 . A A . 6 ASN C 1 1 1 71 1 1 6 ASN CA C 7.180 4.914 4.174 1.00 . A A . 6 ASN CA 1 1 1 72 1 1 6 ASN CB C 7.587 5.001 5.653 1.00 . A A . 6 ASN CB 1 1 1 73 1 1 6 ASN CG C 6.774 4.045 6.523 1.00 . A A . 6 ASN CG 1 1 1 74 1 1 6 ASN H H 5.168 4.290 3.974 1.00 . A A . 6 ASN H 1 1 1 75 1 1 6 ASN HA H 7.701 5.706 3.639 1.00 . A A . 6 ASN HA 1 1 1 76 1 1 6 ASN HB2 H 8.647 4.770 5.769 1.00 . A A . 6 ASN HB2 1 1 1 77 1 1 6 ASN HB3 H 7.435 6.024 5.999 1.00 . A A . 6 ASN HB3 1 1 1 78 1 1 6 ASN HD21 H 5.975 5.592 7.580 1.00 . A A . 6 ASN HD21 1 1 1 79 1 1 6 ASN HD22 H 5.411 4.000 8.034 1.00 . A A . 6 ASN HD22 1 1 1 80 1 1 6 ASN N N 5.744 5.116 4.054 1.00 . A A . 6 ASN N 1 1 1 81 1 1 6 ASN ND2 N 5.995 4.589 7.460 1.00 . A A . 6 ASN ND2 1 1 1 82 1 1 6 ASN O O 6.778 2.800 3.084 1.00 . A A . 6 ASN O 1 1 1 83 1 1 6 ASN OD1 O 6.835 2.835 6.340 1.00 . A A . 6 ASN OD1 1 1 1 84 1 1 7 THR C C 9.151 0.922 3.611 1.00 . A A . 7 THR C 1 1 1 85 1 1 7 THR CA C 9.579 2.220 2.920 1.00 . A A . 7 THR CA 1 1 1 86 1 1 7 THR CB C 11.100 2.425 2.990 1.00 . A A . 7 THR CB 1 1 1 87 1 1 7 THR CG2 C 11.855 1.379 2.161 1.00 . A A . 7 THR CG2 1 1 1 88 1 1 7 THR H H 9.534 4.086 3.889 1.00 . A A . 7 THR H 1 1 1 89 1 1 7 THR HA H 9.287 2.172 1.871 1.00 . A A . 7 THR HA 1 1 1 90 1 1 7 THR HB H 11.425 2.354 4.030 1.00 . A A . 7 THR HB 1 1 1 91 1 1 7 THR HG1 H 12.374 3.835 2.573 1.00 . A A . 7 THR HG1 1 1 1 92 1 1 7 THR HG21 H 12.928 1.560 2.237 1.00 . A A . 7 THR HG21 1 1 1 93 1 1 7 THR HG22 H 11.646 0.375 2.529 1.00 . A A . 7 THR HG22 1 1 1 94 1 1 7 THR HG23 H 11.556 1.448 1.113 1.00 . A A . 7 THR HG23 1 1 1 95 1 1 7 THR N N 8.924 3.377 3.508 1.00 . A A . 7 THR N 1 1 1 96 1 1 7 THR O O 9.021 -0.101 2.945 1.00 . A A . 7 THR O 1 1 1 97 1 1 7 THR OG1 O 11.423 3.714 2.507 1.00 . A A . 7 THR OG1 1 1 1 98 1 1 8 THR C C 7.034 -0.597 5.185 1.00 . A A . 8 THR C 1 1 1 99 1 1 8 THR CA C 8.439 -0.215 5.660 1.00 . A A . 8 THR CA 1 1 1 100 1 1 8 THR CB C 8.477 0.029 7.176 1.00 . A A . 8 THR CB 1 1 1 101 1 1 8 THR CG2 C 8.313 -1.294 7.933 1.00 . A A . 8 THR CG2 1 1 1 102 1 1 8 THR H H 9.036 1.814 5.443 1.00 . A A . 8 THR H 1 1 1 103 1 1 8 THR HA H 9.121 -1.038 5.445 1.00 . A A . 8 THR HA 1 1 1 104 1 1 8 THR HB H 7.675 0.705 7.469 1.00 . A A . 8 THR HB 1 1 1 105 1 1 8 THR HG1 H 9.722 0.756 8.484 1.00 . A A . 8 THR HG1 1 1 1 106 1 1 8 THR HG21 H 9.098 -1.995 7.640 1.00 . A A . 8 THR HG21 1 1 1 107 1 1 8 THR HG22 H 8.379 -1.118 9.006 1.00 . A A . 8 THR HG22 1 1 1 108 1 1 8 THR HG23 H 7.342 -1.737 7.709 1.00 . A A . 8 THR HG23 1 1 1 109 1 1 8 THR N N 8.918 0.951 4.930 1.00 . A A . 8 THR N 1 1 1 110 1 1 8 THR O O 6.737 -1.778 5.025 1.00 . A A . 8 THR O 1 1 1 111 1 1 8 THR OG1 O 9.714 0.614 7.535 1.00 . A A . 8 THR OG1 1 1 1 112 1 1 9 GLY C C 4.989 -0.545 3.002 1.00 . A A . 9 GLY C 1 1 1 113 1 1 9 GLY CA C 4.870 0.195 4.332 1.00 . A A . 9 GLY CA 1 1 1 114 1 1 9 GLY H H 6.479 1.354 5.085 1.00 . A A . 9 GLY H 1 1 1 115 1 1 9 GLY HA2 H 4.253 -0.380 5.023 1.00 . A A . 9 GLY HA2 1 1 1 116 1 1 9 GLY HA3 H 4.400 1.161 4.161 1.00 . A A . 9 GLY HA3 1 1 1 117 1 1 9 GLY N N 6.181 0.401 4.923 1.00 . A A . 9 GLY N 1 1 1 118 1 1 9 GLY O O 4.333 -1.566 2.805 1.00 . A A . 9 GLY O 1 1 1 119 1 1 10 ARG C C 6.613 -2.151 1.061 1.00 . A A . 10 ARG C 1 1 1 120 1 1 10 ARG CA C 6.136 -0.717 0.839 1.00 . A A . 10 ARG CA 1 1 1 121 1 1 10 ARG CB C 7.167 0.071 0.017 1.00 . A A . 10 ARG CB 1 1 1 122 1 1 10 ARG CD C 5.670 1.042 -1.778 1.00 . A A . 10 ARG CD 1 1 1 123 1 1 10 ARG CG C 6.589 1.353 -0.591 1.00 . A A . 10 ARG CG 1 1 1 124 1 1 10 ARG CZ C 4.378 2.318 -3.480 1.00 . A A . 10 ARG CZ 1 1 1 125 1 1 10 ARG H H 6.352 0.799 2.326 1.00 . A A . 10 ARG H 1 1 1 126 1 1 10 ARG HA H 5.204 -0.785 0.282 1.00 . A A . 10 ARG HA 1 1 1 127 1 1 10 ARG HB2 H 8.010 0.332 0.654 1.00 . A A . 10 ARG HB2 1 1 1 128 1 1 10 ARG HB3 H 7.541 -0.557 -0.793 1.00 . A A . 10 ARG HB3 1 1 1 129 1 1 10 ARG HD2 H 6.249 0.517 -2.540 1.00 . A A . 10 ARG HD2 1 1 1 130 1 1 10 ARG HD3 H 4.839 0.409 -1.471 1.00 . A A . 10 ARG HD3 1 1 1 131 1 1 10 ARG HE H 5.242 3.133 -1.840 1.00 . A A . 10 ARG HE 1 1 1 132 1 1 10 ARG HG2 H 6.055 1.912 0.174 1.00 . A A . 10 ARG HG2 1 1 1 133 1 1 10 ARG HG3 H 7.417 1.963 -0.953 1.00 . A A . 10 ARG HG3 1 1 1 134 1 1 10 ARG HH11 H 4.419 0.306 -3.833 1.00 . A A . 10 ARG HH11 1 1 1 135 1 1 10 ARG HH12 H 3.562 1.256 -5.023 1.00 . A A . 10 ARG HH12 1 1 1 136 1 1 10 ARG HH21 H 4.158 4.344 -3.417 1.00 . A A . 10 ARG HH21 1 1 1 137 1 1 10 ARG HH22 H 3.296 3.554 -4.711 1.00 . A A . 10 ARG HH22 1 1 1 138 1 1 10 ARG N N 5.850 -0.050 2.104 1.00 . A A . 10 ARG N 1 1 1 139 1 1 10 ARG NE N 5.110 2.268 -2.353 1.00 . A A . 10 ARG NE 1 1 1 140 1 1 10 ARG NH1 N 4.088 1.202 -4.163 1.00 . A A . 10 ARG NH1 1 1 1 141 1 1 10 ARG NH2 N 3.930 3.496 -3.924 1.00 . A A . 10 ARG NH2 1 1 1 142 1 1 10 ARG O O 6.118 -3.058 0.402 1.00 . A A . 10 ARG O 1 1 1 143 1 1 11 ASN C C 6.983 -4.659 2.672 1.00 . A A . 11 ASN C 1 1 1 144 1 1 11 ASN CA C 8.097 -3.682 2.284 1.00 . A A . 11 ASN CA 1 1 1 145 1 1 11 ASN CB C 9.171 -3.555 3.373 1.00 . A A . 11 ASN CB 1 1 1 146 1 1 11 ASN CG C 9.667 -4.909 3.871 1.00 . A A . 11 ASN CG 1 1 1 147 1 1 11 ASN H H 7.924 -1.574 2.493 1.00 . A A . 11 ASN H 1 1 1 148 1 1 11 ASN HA H 8.579 -4.068 1.382 1.00 . A A . 11 ASN HA 1 1 1 149 1 1 11 ASN HB2 H 10.019 -3.000 2.973 1.00 . A A . 11 ASN HB2 1 1 1 150 1 1 11 ASN HB3 H 8.776 -3.003 4.221 1.00 . A A . 11 ASN HB3 1 1 1 151 1 1 11 ASN HD21 H 8.254 -4.939 5.340 1.00 . A A . 11 ASN HD21 1 1 1 152 1 1 11 ASN HD22 H 9.349 -6.303 5.314 1.00 . A A . 11 ASN HD22 1 1 1 153 1 1 11 ASN N N 7.558 -2.364 1.980 1.00 . A A . 11 ASN N 1 1 1 154 1 1 11 ASN ND2 N 9.035 -5.427 4.926 1.00 . A A . 11 ASN ND2 1 1 1 155 1 1 11 ASN O O 6.902 -5.742 2.096 1.00 . A A . 11 ASN O 1 1 1 156 1 1 11 ASN OD1 O 10.615 -5.468 3.327 1.00 . A A . 11 ASN OD1 1 1 1 157 1 1 12 ILE C C 4.057 -5.429 2.978 1.00 . A A . 12 ILE C 1 1 1 158 1 1 12 ILE CA C 5.058 -5.158 4.108 1.00 . A A . 12 ILE CA 1 1 1 159 1 1 12 ILE CB C 4.393 -4.566 5.367 1.00 . A A . 12 ILE CB 1 1 1 160 1 1 12 ILE CD1 C 4.906 -3.629 7.692 1.00 . A A . 12 ILE CD1 1 1 1 161 1 1 12 ILE CG1 C 5.417 -4.466 6.515 1.00 . A A . 12 ILE CG1 1 1 1 162 1 1 12 ILE CG2 C 3.212 -5.444 5.815 1.00 . A A . 12 ILE CG2 1 1 1 163 1 1 12 ILE H H 6.204 -3.360 4.039 1.00 . A A . 12 ILE H 1 1 1 164 1 1 12 ILE HA H 5.506 -6.111 4.395 1.00 . A A . 12 ILE HA 1 1 1 165 1 1 12 ILE HB H 4.030 -3.567 5.128 1.00 . A A . 12 ILE HB 1 1 1 166 1 1 12 ILE HD11 H 4.078 -4.126 8.195 1.00 . A A . 12 ILE HD11 1 1 1 167 1 1 12 ILE HD12 H 5.713 -3.497 8.413 1.00 . A A . 12 ILE HD12 1 1 1 168 1 1 12 ILE HD13 H 4.582 -2.649 7.340 1.00 . A A . 12 ILE HD13 1 1 1 169 1 1 12 ILE HG12 H 5.670 -5.467 6.866 1.00 . A A . 12 ILE HG12 1 1 1 170 1 1 12 ILE HG13 H 6.334 -3.997 6.164 1.00 . A A . 12 ILE HG13 1 1 1 171 1 1 12 ILE HG21 H 3.572 -6.441 6.072 1.00 . A A . 12 ILE HG21 1 1 1 172 1 1 12 ILE HG22 H 2.720 -5.012 6.684 1.00 . A A . 12 ILE HG22 1 1 1 173 1 1 12 ILE HG23 H 2.464 -5.535 5.028 1.00 . A A . 12 ILE HG23 1 1 1 174 1 1 12 ILE N N 6.123 -4.284 3.628 1.00 . A A . 12 ILE N 1 1 1 175 1 1 12 ILE O O 3.701 -6.583 2.746 1.00 . A A . 12 ILE O 1 1 1 176 1 1 13 TYR C C 3.241 -5.467 0.097 1.00 . A A . 13 TYR C 1 1 1 177 1 1 13 TYR CA C 2.725 -4.461 1.129 1.00 . A A . 13 TYR CA 1 1 1 178 1 1 13 TYR CB C 2.557 -3.065 0.508 1.00 . A A . 13 TYR CB 1 1 1 179 1 1 13 TYR CD1 C 0.463 -3.463 -0.863 1.00 . A A . 13 TYR CD1 1 1 1 180 1 1 13 TYR CD2 C 2.428 -2.557 -1.975 1.00 . A A . 13 TYR CD2 1 1 1 181 1 1 13 TYR CE1 C -0.232 -3.457 -2.084 1.00 . A A . 13 TYR CE1 1 1 1 182 1 1 13 TYR CE2 C 1.729 -2.541 -3.194 1.00 . A A . 13 TYR CE2 1 1 1 183 1 1 13 TYR CG C 1.799 -3.027 -0.805 1.00 . A A . 13 TYR CG 1 1 1 184 1 1 13 TYR CZ C 0.402 -3.002 -3.252 1.00 . A A . 13 TYR CZ 1 1 1 185 1 1 13 TYR H H 3.959 -3.457 2.530 1.00 . A A . 13 TYR H 1 1 1 186 1 1 13 TYR HA H 1.756 -4.802 1.490 1.00 . A A . 13 TYR HA 1 1 1 187 1 1 13 TYR HB2 H 2.035 -2.427 1.221 1.00 . A A . 13 TYR HB2 1 1 1 188 1 1 13 TYR HB3 H 3.546 -2.637 0.349 1.00 . A A . 13 TYR HB3 1 1 1 189 1 1 13 TYR HD1 H -0.029 -3.805 0.033 1.00 . A A . 13 TYR HD1 1 1 1 190 1 1 13 TYR HD2 H 3.449 -2.205 -1.942 1.00 . A A . 13 TYR HD2 1 1 1 191 1 1 13 TYR HE1 H -1.251 -3.809 -2.121 1.00 . A A . 13 TYR HE1 1 1 1 192 1 1 13 TYR HE2 H 2.218 -2.170 -4.083 1.00 . A A . 13 TYR HE2 1 1 1 193 1 1 13 TYR HH H 0.290 -2.764 -5.186 1.00 . A A . 13 TYR HH 1 1 1 194 1 1 13 TYR N N 3.626 -4.375 2.272 1.00 . A A . 13 TYR N 1 1 1 195 1 1 13 TYR O O 2.516 -6.380 -0.289 1.00 . A A . 13 TYR O 1 1 1 196 1 1 13 TYR OH O -0.271 -3.000 -4.442 1.00 . A A . 13 TYR OH 1 1 1 197 1 1 14 ASN C C 5.231 -7.609 -0.812 1.00 . A A . 14 ASN C 1 1 1 198 1 1 14 ASN CA C 5.145 -6.165 -1.311 1.00 . A A . 14 ASN CA 1 1 1 199 1 1 14 ASN CB C 6.533 -5.620 -1.670 1.00 . A A . 14 ASN CB 1 1 1 200 1 1 14 ASN CG C 6.457 -4.578 -2.786 1.00 . A A . 14 ASN CG 1 1 1 201 1 1 14 ASN H H 5.034 -4.534 0.039 1.00 . A A . 14 ASN H 1 1 1 202 1 1 14 ASN HA H 4.540 -6.174 -2.219 1.00 . A A . 14 ASN HA 1 1 1 203 1 1 14 ASN HB2 H 7.027 -5.211 -0.789 1.00 . A A . 14 ASN HB2 1 1 1 204 1 1 14 ASN HB3 H 7.150 -6.436 -2.043 1.00 . A A . 14 ASN HB3 1 1 1 205 1 1 14 ASN HD21 H 6.021 -3.085 -1.472 1.00 . A A . 14 ASN HD21 1 1 1 206 1 1 14 ASN HD22 H 6.123 -2.618 -3.161 1.00 . A A . 14 ASN HD22 1 1 1 207 1 1 14 ASN N N 4.494 -5.302 -0.337 1.00 . A A . 14 ASN N 1 1 1 208 1 1 14 ASN ND2 N 6.170 -3.323 -2.443 1.00 . A A . 14 ASN ND2 1 1 1 209 1 1 14 ASN O O 4.943 -8.523 -1.578 1.00 . A A . 14 ASN O 1 1 1 210 1 1 14 ASN OD1 O 6.653 -4.906 -3.953 1.00 . A A . 14 ASN OD1 1 1 1 211 1 1 15 THR C C 4.363 -9.872 1.000 1.00 . A A . 15 THR C 1 1 1 212 1 1 15 THR CA C 5.724 -9.167 1.020 1.00 . A A . 15 THR CA 1 1 1 213 1 1 15 THR CB C 6.312 -9.093 2.439 1.00 . A A . 15 THR CB 1 1 1 214 1 1 15 THR CG2 C 6.493 -10.485 3.053 1.00 . A A . 15 THR CG2 1 1 1 215 1 1 15 THR H H 5.835 -7.036 1.046 1.00 . A A . 15 THR H 1 1 1 216 1 1 15 THR HA H 6.416 -9.741 0.400 1.00 . A A . 15 THR HA 1 1 1 217 1 1 15 THR HB H 5.654 -8.508 3.082 1.00 . A A . 15 THR HB 1 1 1 218 1 1 15 THR HG1 H 7.466 -7.556 2.117 1.00 . A A . 15 THR HG1 1 1 1 219 1 1 15 THR HG21 H 6.961 -10.389 4.033 1.00 . A A . 15 THR HG21 1 1 1 220 1 1 15 THR HG22 H 5.531 -10.982 3.175 1.00 . A A . 15 THR HG22 1 1 1 221 1 1 15 THR HG23 H 7.134 -11.094 2.414 1.00 . A A . 15 THR HG23 1 1 1 222 1 1 15 THR N N 5.615 -7.825 0.453 1.00 . A A . 15 THR N 1 1 1 223 1 1 15 THR O O 4.263 -11.023 0.578 1.00 . A A . 15 THR O 1 1 1 224 1 1 15 THR OG1 O 7.578 -8.469 2.397 1.00 . A A . 15 THR OG1 1 1 1 225 1 1 16 CYS C C 1.447 -9.979 0.049 1.00 . A A . 16 CYS C 1 1 1 226 1 1 16 CYS CA C 1.946 -9.656 1.462 1.00 . A A . 16 CYS CA 1 1 1 227 1 1 16 CYS CB C 1.078 -8.612 2.173 1.00 . A A . 16 CYS CB 1 1 1 228 1 1 16 CYS H H 3.476 -8.219 1.757 1.00 . A A . 16 CYS H 1 1 1 229 1 1 16 CYS HA H 1.916 -10.574 2.052 1.00 . A A . 16 CYS HA 1 1 1 230 1 1 16 CYS HB2 H 1.418 -8.554 3.207 1.00 . A A . 16 CYS HB2 1 1 1 231 1 1 16 CYS HB3 H 1.242 -7.637 1.717 1.00 . A A . 16 CYS HB3 1 1 1 232 1 1 16 CYS N N 3.316 -9.167 1.439 1.00 . A A . 16 CYS N 1 1 1 233 1 1 16 CYS O O 0.823 -11.017 -0.162 1.00 . A A . 16 CYS O 1 1 1 234 1 1 16 CYS SG S -0.704 -8.926 2.202 1.00 . A A . 16 CYS SG 1 1 1 235 1 1 17 ARG C C 2.127 -10.570 -2.854 1.00 . A A . 17 ARG C 1 1 1 236 1 1 17 ARG CA C 1.416 -9.324 -2.322 1.00 . A A . 17 ARG CA 1 1 1 237 1 1 17 ARG CB C 1.807 -8.087 -3.145 1.00 . A A . 17 ARG CB 1 1 1 238 1 1 17 ARG CD C -0.203 -6.743 -3.920 1.00 . A A . 17 ARG CD 1 1 1 239 1 1 17 ARG CG C 0.903 -6.877 -2.870 1.00 . A A . 17 ARG CG 1 1 1 240 1 1 17 ARG CZ C -1.440 -8.638 -5.035 1.00 . A A . 17 ARG CZ 1 1 1 241 1 1 17 ARG H H 2.237 -8.257 -0.677 1.00 . A A . 17 ARG H 1 1 1 242 1 1 17 ARG HA H 0.343 -9.489 -2.410 1.00 . A A . 17 ARG HA 1 1 1 243 1 1 17 ARG HB2 H 2.831 -7.817 -2.897 1.00 . A A . 17 ARG HB2 1 1 1 244 1 1 17 ARG HB3 H 1.775 -8.327 -4.208 1.00 . A A . 17 ARG HB3 1 1 1 245 1 1 17 ARG HD2 H -0.798 -5.871 -3.661 1.00 . A A . 17 ARG HD2 1 1 1 246 1 1 17 ARG HD3 H 0.269 -6.551 -4.883 1.00 . A A . 17 ARG HD3 1 1 1 247 1 1 17 ARG HE H -1.450 -8.223 -3.055 1.00 . A A . 17 ARG HE 1 1 1 248 1 1 17 ARG HG2 H 0.462 -6.938 -1.874 1.00 . A A . 17 ARG HG2 1 1 1 249 1 1 17 ARG HG3 H 1.512 -5.973 -2.919 1.00 . A A . 17 ARG HG3 1 1 1 250 1 1 17 ARG HH11 H -0.326 -7.589 -6.398 1.00 . A A . 17 ARG HH11 1 1 1 251 1 1 17 ARG HH12 H -1.256 -8.908 -7.052 1.00 . A A . 17 ARG HH12 1 1 1 252 1 1 17 ARG HH21 H -2.624 -9.908 -3.968 1.00 . A A . 17 ARG HH21 1 1 1 253 1 1 17 ARG HH22 H -2.569 -10.218 -5.686 1.00 . A A . 17 ARG HH22 1 1 1 254 1 1 17 ARG N N 1.736 -9.103 -0.918 1.00 . A A . 17 ARG N 1 1 1 255 1 1 17 ARG NE N -1.084 -7.923 -3.951 1.00 . A A . 17 ARG NE 1 1 1 256 1 1 17 ARG NH1 N -0.976 -8.348 -6.259 1.00 . A A . 17 ARG NH1 1 1 1 257 1 1 17 ARG NH2 N -2.284 -9.667 -4.890 1.00 . A A . 17 ARG NH2 1 1 1 258 1 1 17 ARG O O 1.519 -11.357 -3.576 1.00 . A A . 17 ARG O 1 1 1 259 1 1 18 PHE C C 3.629 -13.193 -2.370 1.00 . A A . 18 PHE C 1 1 1 260 1 1 18 PHE CA C 4.217 -11.885 -2.909 1.00 . A A . 18 PHE CA 1 1 1 261 1 1 18 PHE CB C 5.674 -11.688 -2.460 1.00 . A A . 18 PHE CB 1 1 1 262 1 1 18 PHE CD1 C 6.891 -13.815 -3.131 1.00 . A A . 18 PHE CD1 1 1 1 263 1 1 18 PHE CD2 C 7.460 -11.731 -4.254 1.00 . A A . 18 PHE CD2 1 1 1 264 1 1 18 PHE CE1 C 7.838 -14.495 -3.919 1.00 . A A . 18 PHE CE1 1 1 1 265 1 1 18 PHE CE2 C 8.416 -12.409 -5.031 1.00 . A A . 18 PHE CE2 1 1 1 266 1 1 18 PHE CG C 6.697 -12.430 -3.300 1.00 . A A . 18 PHE CG 1 1 1 267 1 1 18 PHE CZ C 8.605 -13.790 -4.864 1.00 . A A . 18 PHE CZ 1 1 1 268 1 1 18 PHE H H 3.840 -10.059 -1.895 1.00 . A A . 18 PHE H 1 1 1 269 1 1 18 PHE HA H 4.203 -11.915 -4.001 1.00 . A A . 18 PHE HA 1 1 1 270 1 1 18 PHE HB2 H 5.918 -10.629 -2.525 1.00 . A A . 18 PHE HB2 1 1 1 271 1 1 18 PHE HB3 H 5.783 -11.984 -1.416 1.00 . A A . 18 PHE HB3 1 1 1 272 1 1 18 PHE HD1 H 6.316 -14.363 -2.400 1.00 . A A . 18 PHE HD1 1 1 1 273 1 1 18 PHE HD2 H 7.321 -10.669 -4.396 1.00 . A A . 18 PHE HD2 1 1 1 274 1 1 18 PHE HE1 H 7.976 -15.559 -3.800 1.00 . A A . 18 PHE HE1 1 1 1 275 1 1 18 PHE HE2 H 9.002 -11.867 -5.760 1.00 . A A . 18 PHE HE2 1 1 1 276 1 1 18 PHE HZ H 9.340 -14.311 -5.461 1.00 . A A . 18 PHE HZ 1 1 1 277 1 1 18 PHE N N 3.405 -10.750 -2.491 1.00 . A A . 18 PHE N 1 1 1 278 1 1 18 PHE O O 3.542 -14.175 -3.104 1.00 . A A . 18 PHE O 1 1 1 279 1 1 19 ALA C C 1.212 -14.636 -1.211 1.00 . A A . 19 ALA C 1 1 1 280 1 1 19 ALA CA C 2.517 -14.318 -0.476 1.00 . A A . 19 ALA CA 1 1 1 281 1 1 19 ALA CB C 2.264 -14.023 1.005 1.00 . A A . 19 ALA CB 1 1 1 282 1 1 19 ALA H H 3.324 -12.352 -0.547 1.00 . A A . 19 ALA H 1 1 1 283 1 1 19 ALA HA H 3.167 -15.192 -0.533 1.00 . A A . 19 ALA HA 1 1 1 284 1 1 19 ALA HB1 H 3.216 -13.899 1.523 1.00 . A A . 19 ALA HB1 1 1 1 285 1 1 19 ALA HB2 H 1.675 -13.113 1.120 1.00 . A A . 19 ALA HB2 1 1 1 286 1 1 19 ALA HB3 H 1.721 -14.855 1.456 1.00 . A A . 19 ALA HB3 1 1 1 287 1 1 19 ALA N N 3.203 -13.192 -1.099 1.00 . A A . 19 ALA N 1 1 1 288 1 1 19 ALA O O 0.946 -15.800 -1.504 1.00 . A A . 19 ALA O 1 1 1 289 1 1 20 GLY C C -2.008 -13.098 -1.719 1.00 . A A . 20 GLY C 1 1 1 290 1 1 20 GLY CA C -0.763 -13.699 -2.369 1.00 . A A . 20 GLY CA 1 1 1 291 1 1 20 GLY H H 0.707 -12.676 -1.235 1.00 . A A . 20 GLY H 1 1 1 292 1 1 20 GLY HA2 H -0.569 -13.153 -3.293 1.00 . A A . 20 GLY HA2 1 1 1 293 1 1 20 GLY HA3 H -0.977 -14.736 -2.630 1.00 . A A . 20 GLY HA3 1 1 1 294 1 1 20 GLY N N 0.420 -13.601 -1.524 1.00 . A A . 20 GLY N 1 1 1 295 1 1 20 GLY O O -3.119 -13.533 -2.021 1.00 . A A . 20 GLY O 1 1 1 296 1 1 21 GLY C C -3.456 -10.298 -1.279 1.00 . A A . 21 GLY C 1 1 1 297 1 1 21 GLY CA C -2.964 -11.353 -0.289 1.00 . A A . 21 GLY CA 1 1 1 298 1 1 21 GLY H H -0.914 -11.764 -0.633 1.00 . A A . 21 GLY H 1 1 1 299 1 1 21 GLY HA2 H -3.768 -12.048 -0.053 1.00 . A A . 21 GLY HA2 1 1 1 300 1 1 21 GLY HA3 H -2.648 -10.867 0.632 1.00 . A A . 21 GLY HA3 1 1 1 301 1 1 21 GLY N N -1.846 -12.088 -0.855 1.00 . A A . 21 GLY N 1 1 1 302 1 1 21 GLY O O -2.677 -9.802 -2.092 1.00 . A A . 21 GLY O 1 1 1 303 1 1 22 SER C C -4.714 -7.617 -1.961 1.00 . A A . 22 SER C 1 1 1 304 1 1 22 SER CA C -5.371 -8.989 -2.114 1.00 . A A . 22 SER CA 1 1 1 305 1 1 22 SER CB C -6.870 -8.902 -1.813 1.00 . A A . 22 SER CB 1 1 1 306 1 1 22 SER H H -5.350 -10.393 -0.533 1.00 . A A . 22 SER H 1 1 1 307 1 1 22 SER HA H -5.244 -9.336 -3.141 1.00 . A A . 22 SER HA 1 1 1 308 1 1 22 SER HB2 H -7.022 -8.361 -0.880 1.00 . A A . 22 SER HB2 1 1 1 309 1 1 22 SER HB3 H -7.375 -8.364 -2.615 1.00 . A A . 22 SER HB3 1 1 1 310 1 1 22 SER HG H -7.353 -10.646 -2.533 1.00 . A A . 22 SER HG 1 1 1 311 1 1 22 SER N N -4.750 -9.958 -1.218 1.00 . A A . 22 SER N 1 1 1 312 1 1 22 SER O O -4.204 -7.297 -0.890 1.00 . A A . 22 SER O 1 1 1 313 1 1 22 SER OG O -7.427 -10.195 -1.687 1.00 . A A . 22 SER OG 1 1 1 314 1 1 23 ARG C C -4.463 -4.618 -1.906 1.00 . A A . 23 ARG C 1 1 1 315 1 1 23 ARG CA C -4.030 -5.529 -3.057 1.00 . A A . 23 ARG CA 1 1 1 316 1 1 23 ARG CB C -4.240 -4.823 -4.400 1.00 . A A . 23 ARG CB 1 1 1 317 1 1 23 ARG CD C -3.503 -4.589 -6.791 1.00 . A A . 23 ARG CD 1 1 1 318 1 1 23 ARG CG C -3.511 -5.503 -5.562 1.00 . A A . 23 ARG CG 1 1 1 319 1 1 23 ARG CZ C -2.557 -2.383 -7.457 1.00 . A A . 23 ARG CZ 1 1 1 320 1 1 23 ARG H H -5.164 -7.130 -3.880 1.00 . A A . 23 ARG H 1 1 1 321 1 1 23 ARG HA H -2.965 -5.719 -2.935 1.00 . A A . 23 ARG HA 1 1 1 322 1 1 23 ARG HB2 H -5.305 -4.743 -4.626 1.00 . A A . 23 ARG HB2 1 1 1 323 1 1 23 ARG HB3 H -3.834 -3.824 -4.293 1.00 . A A . 23 ARG HB3 1 1 1 324 1 1 23 ARG HD2 H -3.085 -5.146 -7.629 1.00 . A A . 23 ARG HD2 1 1 1 325 1 1 23 ARG HD3 H -4.530 -4.308 -7.031 1.00 . A A . 23 ARG HD3 1 1 1 326 1 1 23 ARG HE H -2.208 -3.310 -5.684 1.00 . A A . 23 ARG HE 1 1 1 327 1 1 23 ARG HG2 H -2.481 -5.720 -5.287 1.00 . A A . 23 ARG HG2 1 1 1 328 1 1 23 ARG HG3 H -4.014 -6.437 -5.812 1.00 . A A . 23 ARG HG3 1 1 1 329 1 1 23 ARG HH11 H -3.699 -3.264 -8.902 1.00 . A A . 23 ARG HH11 1 1 1 330 1 1 23 ARG HH12 H -3.042 -1.707 -9.329 1.00 . A A . 23 ARG HH12 1 1 1 331 1 1 23 ARG HH21 H -1.416 -1.208 -6.222 1.00 . A A . 23 ARG HH21 1 1 1 332 1 1 23 ARG HH22 H -1.713 -0.560 -7.812 1.00 . A A . 23 ARG HH22 1 1 1 333 1 1 23 ARG N N -4.718 -6.813 -3.032 1.00 . A A . 23 ARG N 1 1 1 334 1 1 23 ARG NE N -2.690 -3.383 -6.570 1.00 . A A . 23 ARG NE 1 1 1 335 1 1 23 ARG NH1 N -3.146 -2.455 -8.658 1.00 . A A . 23 ARG NH1 1 1 1 336 1 1 23 ARG NH2 N -1.831 -1.304 -7.141 1.00 . A A . 23 ARG NH2 1 1 1 337 1 1 23 ARG O O -3.619 -4.187 -1.124 1.00 . A A . 23 ARG O 1 1 1 338 1 1 24 GLU C C -6.060 -4.033 0.643 1.00 . A A . 24 GLU C 1 1 1 339 1 1 24 GLU CA C -6.278 -3.448 -0.752 1.00 . A A . 24 GLU CA 1 1 1 340 1 1 24 GLU CB C -7.759 -3.108 -0.984 1.00 . A A . 24 GLU CB 1 1 1 341 1 1 24 GLU CD C -7.531 -0.587 -0.715 1.00 . A A . 24 GLU CD 1 1 1 342 1 1 24 GLU CG C -7.915 -1.735 -1.653 1.00 . A A . 24 GLU CG 1 1 1 343 1 1 24 GLU H H -6.411 -4.721 -2.464 1.00 . A A . 24 GLU H 1 1 1 344 1 1 24 GLU HA H -5.701 -2.525 -0.794 1.00 . A A . 24 GLU HA 1 1 1 345 1 1 24 GLU HB2 H -8.227 -3.873 -1.607 1.00 . A A . 24 GLU HB2 1 1 1 346 1 1 24 GLU HB3 H -8.289 -3.080 -0.031 1.00 . A A . 24 GLU HB3 1 1 1 347 1 1 24 GLU HE2 H -8.107 0.386 0.869 1.00 . A A . 24 GLU HE2 1 1 1 348 1 1 24 GLU HG2 H -7.300 -1.699 -2.554 1.00 . A A . 24 GLU HG2 1 1 1 349 1 1 24 GLU HG3 H -8.958 -1.606 -1.940 1.00 . A A . 24 GLU HG3 1 1 1 350 1 1 24 GLU N N -5.763 -4.326 -1.797 1.00 . A A . 24 GLU N 1 1 1 351 1 1 24 GLU O O -5.780 -3.281 1.571 1.00 . A A . 24 GLU O 1 1 1 352 1 1 24 GLU OE1 O -6.504 0.056 -0.929 1.00 . A A . 24 GLU OE1 1 1 1 353 1 1 24 GLU OE2 O -8.384 -0.352 0.322 1.00 . A A . 24 GLU OE2 1 1 1 354 1 1 25 ARG C C -4.507 -5.793 2.539 1.00 . A A . 25 ARG C 1 1 1 355 1 1 25 ARG CA C -5.948 -6.012 2.080 1.00 . A A . 25 ARG CA 1 1 1 356 1 1 25 ARG CB C -6.288 -7.503 1.964 1.00 . A A . 25 ARG CB 1 1 1 357 1 1 25 ARG CD C -7.161 -9.463 3.297 1.00 . A A . 25 ARG CD 1 1 1 358 1 1 25 ARG CG C -6.377 -8.149 3.351 1.00 . A A . 25 ARG CG 1 1 1 359 1 1 25 ARG CZ C -7.044 -11.328 1.611 1.00 . A A . 25 ARG CZ 1 1 1 360 1 1 25 ARG H H -6.422 -5.938 0.014 1.00 . A A . 25 ARG H 1 1 1 361 1 1 25 ARG HA H -6.623 -5.557 2.806 1.00 . A A . 25 ARG HA 1 1 1 362 1 1 25 ARG HB2 H -7.252 -7.592 1.466 1.00 . A A . 25 ARG HB2 1 1 1 363 1 1 25 ARG HB3 H -5.541 -8.022 1.362 1.00 . A A . 25 ARG HB3 1 1 1 364 1 1 25 ARG HD2 H -7.250 -9.845 4.311 1.00 . A A . 25 ARG HD2 1 1 1 365 1 1 25 ARG HD3 H -8.162 -9.244 2.927 1.00 . A A . 25 ARG HD3 1 1 1 366 1 1 25 ARG HE H -5.478 -10.550 2.631 1.00 . A A . 25 ARG HE 1 1 1 367 1 1 25 ARG HG2 H -5.375 -8.320 3.746 1.00 . A A . 25 ARG HG2 1 1 1 368 1 1 25 ARG HG3 H -6.909 -7.479 4.028 1.00 . A A . 25 ARG HG3 1 1 1 369 1 1 25 ARG HH11 H -8.961 -10.631 1.805 1.00 . A A . 25 ARG HH11 1 1 1 370 1 1 25 ARG HH12 H -8.755 -11.934 0.670 1.00 . A A . 25 ARG HH12 1 1 1 371 1 1 25 ARG HH21 H -5.302 -12.320 1.236 1.00 . A A . 25 ARG HH21 1 1 1 372 1 1 25 ARG HH22 H -6.682 -12.880 0.327 1.00 . A A . 25 ARG HH22 1 1 1 373 1 1 25 ARG N N -6.179 -5.358 0.802 1.00 . A A . 25 ARG N 1 1 1 374 1 1 25 ARG NE N -6.474 -10.477 2.483 1.00 . A A . 25 ARG NE 1 1 1 375 1 1 25 ARG NH1 N -8.357 -11.292 1.341 1.00 . A A . 25 ARG NH1 1 1 1 376 1 1 25 ARG NH2 N -6.280 -12.240 0.998 1.00 . A A . 25 ARG NH2 1 1 1 377 1 1 25 ARG O O -4.276 -5.355 3.662 1.00 . A A . 25 ARG O 1 1 1 378 1 1 26 CYS C C -1.818 -4.384 2.142 1.00 . A A . 26 CYS C 1 1 1 379 1 1 26 CYS CA C -2.130 -5.857 1.881 1.00 . A A . 26 CYS CA 1 1 1 380 1 1 26 CYS CB C -1.326 -6.370 0.681 1.00 . A A . 26 CYS CB 1 1 1 381 1 1 26 CYS H H -3.832 -6.431 0.748 1.00 . A A . 26 CYS H 1 1 1 382 1 1 26 CYS HA H -1.838 -6.414 2.770 1.00 . A A . 26 CYS HA 1 1 1 383 1 1 26 CYS HB2 H -1.688 -5.890 -0.231 1.00 . A A . 26 CYS HB2 1 1 1 384 1 1 26 CYS HB3 H -0.285 -6.084 0.819 1.00 . A A . 26 CYS HB3 1 1 1 385 1 1 26 CYS N N -3.549 -6.072 1.650 1.00 . A A . 26 CYS N 1 1 1 386 1 1 26 CYS O O -0.996 -4.075 3.004 1.00 . A A . 26 CYS O 1 1 1 387 1 1 26 CYS SG S -1.358 -8.162 0.428 1.00 . A A . 26 CYS SG 1 1 1 388 1 1 27 ALA C C -2.708 -1.644 2.989 1.00 . A A . 27 ALA C 1 1 1 389 1 1 27 ALA CA C -2.277 -2.047 1.580 1.00 . A A . 27 ALA CA 1 1 1 390 1 1 27 ALA CB C -3.030 -1.274 0.496 1.00 . A A . 27 ALA CB 1 1 1 391 1 1 27 ALA H H -3.121 -3.786 0.700 1.00 . A A . 27 ALA H 1 1 1 392 1 1 27 ALA HA H -1.215 -1.826 1.469 1.00 . A A . 27 ALA HA 1 1 1 393 1 1 27 ALA HB1 H -4.106 -1.398 0.611 1.00 . A A . 27 ALA HB1 1 1 1 394 1 1 27 ALA HB2 H -2.787 -0.214 0.560 1.00 . A A . 27 ALA HB2 1 1 1 395 1 1 27 ALA HB3 H -2.727 -1.641 -0.484 1.00 . A A . 27 ALA HB3 1 1 1 396 1 1 27 ALA N N -2.464 -3.475 1.404 1.00 . A A . 27 ALA N 1 1 1 397 1 1 27 ALA O O -1.904 -1.103 3.738 1.00 . A A . 27 ALA O 1 1 1 398 1 1 28 LYS C C -3.606 -2.234 5.797 1.00 . A A . 28 LYS C 1 1 1 399 1 1 28 LYS CA C -4.494 -1.672 4.686 1.00 . A A . 28 LYS CA 1 1 1 400 1 1 28 LYS CB C -5.892 -2.290 4.740 1.00 . A A . 28 LYS CB 1 1 1 401 1 1 28 LYS CD C -8.098 -2.297 5.931 1.00 . A A . 28 LYS CD 1 1 1 402 1 1 28 LYS CE C -8.840 -1.875 7.203 1.00 . A A . 28 LYS CE 1 1 1 403 1 1 28 LYS CG C -6.650 -1.800 5.970 1.00 . A A . 28 LYS CG 1 1 1 404 1 1 28 LYS H H -4.567 -2.424 2.732 1.00 . A A . 28 LYS H 1 1 1 405 1 1 28 LYS HA H -4.573 -0.589 4.794 1.00 . A A . 28 LYS HA 1 1 1 406 1 1 28 LYS HB2 H -6.427 -1.989 3.843 1.00 . A A . 28 LYS HB2 1 1 1 407 1 1 28 LYS HB3 H -5.823 -3.377 4.755 1.00 . A A . 28 LYS HB3 1 1 1 408 1 1 28 LYS HD2 H -8.595 -1.871 5.058 1.00 . A A . 28 LYS HD2 1 1 1 409 1 1 28 LYS HD3 H -8.101 -3.385 5.849 1.00 . A A . 28 LYS HD3 1 1 1 410 1 1 28 LYS HE2 H -8.335 -2.299 8.073 1.00 . A A . 28 LYS HE2 1 1 1 411 1 1 28 LYS HE3 H -8.827 -0.786 7.285 1.00 . A A . 28 LYS HE3 1 1 1 412 1 1 28 LYS HG2 H -6.150 -2.175 6.862 1.00 . A A . 28 LYS HG2 1 1 1 413 1 1 28 LYS HG3 H -6.636 -0.711 5.974 1.00 . A A . 28 LYS HG3 1 1 1 414 1 1 28 LYS HZ1 H -10.263 -3.344 7.122 1.00 . A A . 28 LYS HZ1 1 1 1 415 1 1 28 LYS HZ2 H -10.695 -2.049 8.046 1.00 . A A . 28 LYS HZ2 1 1 1 416 1 1 28 LYS HZ3 H -10.724 -1.933 6.403 1.00 . A A . 28 LYS HZ3 1 1 1 417 1 1 28 LYS N N -3.948 -1.953 3.373 1.00 . A A . 28 LYS N 1 1 1 418 1 1 28 LYS NZ N -10.239 -2.336 7.192 1.00 . A A . 28 LYS NZ 1 1 1 419 1 1 28 LYS O O -3.244 -1.513 6.725 1.00 . A A . 28 LYS O 1 1 1 420 1 1 29 LEU C C -1.079 -3.500 6.816 1.00 . A A . 29 LEU C 1 1 1 421 1 1 29 LEU CA C -2.394 -4.251 6.591 1.00 . A A . 29 LEU CA 1 1 1 422 1 1 29 LEU CB C -2.137 -5.646 6.000 1.00 . A A . 29 LEU CB 1 1 1 423 1 1 29 LEU CD1 C -1.829 -6.925 8.168 1.00 . A A . 29 LEU CD1 1 1 1 424 1 1 29 LEU CD2 C -0.894 -7.806 6.016 1.00 . A A . 29 LEU CD2 1 1 1 425 1 1 29 LEU CG C -1.200 -6.541 6.826 1.00 . A A . 29 LEU CG 1 1 1 426 1 1 29 LEU H H -3.629 -4.027 4.882 1.00 . A A . 29 LEU H 1 1 1 427 1 1 29 LEU HA H -2.916 -4.351 7.543 1.00 . A A . 29 LEU HA 1 1 1 428 1 1 29 LEU HB2 H -3.093 -6.157 5.881 1.00 . A A . 29 LEU HB2 1 1 1 429 1 1 29 LEU HB3 H -1.692 -5.520 5.015 1.00 . A A . 29 LEU HB3 1 1 1 430 1 1 29 LEU HD11 H -1.971 -6.040 8.787 1.00 . A A . 29 LEU HD11 1 1 1 431 1 1 29 LEU HD12 H -2.793 -7.410 8.005 1.00 . A A . 29 LEU HD12 1 1 1 432 1 1 29 LEU HD13 H -1.170 -7.613 8.698 1.00 . A A . 29 LEU HD13 1 1 1 433 1 1 29 LEU HD21 H -0.354 -7.538 5.107 1.00 . A A . 29 LEU HD21 1 1 1 434 1 1 29 LEU HD22 H -0.275 -8.484 6.603 1.00 . A A . 29 LEU HD22 1 1 1 435 1 1 29 LEU HD23 H -1.822 -8.311 5.744 1.00 . A A . 29 LEU HD23 1 1 1 436 1 1 29 LEU HG H -0.254 -6.030 7.011 1.00 . A A . 29 LEU HG 1 1 1 437 1 1 29 LEU N N -3.262 -3.520 5.677 1.00 . A A . 29 LEU N 1 1 1 438 1 1 29 LEU O O -0.643 -3.345 7.955 1.00 . A A . 29 LEU O 1 1 1 439 1 1 30 SER C C 0.699 -0.904 6.229 1.00 . A A . 30 SER C 1 1 1 440 1 1 30 SER CA C 0.831 -2.359 5.768 1.00 . A A . 30 SER CA 1 1 1 441 1 1 30 SER CB C 1.505 -2.444 4.399 1.00 . A A . 30 SER CB 1 1 1 442 1 1 30 SER H H -0.906 -3.165 4.827 1.00 . A A . 30 SER H 1 1 1 443 1 1 30 SER HA H 1.480 -2.873 6.479 1.00 . A A . 30 SER HA 1 1 1 444 1 1 30 SER HB2 H 2.467 -1.938 4.452 1.00 . A A . 30 SER HB2 1 1 1 445 1 1 30 SER HB3 H 1.659 -3.487 4.132 1.00 . A A . 30 SER HB3 1 1 1 446 1 1 30 SER HG H -0.078 -2.347 3.273 1.00 . A A . 30 SER HG 1 1 1 447 1 1 30 SER N N -0.454 -3.044 5.726 1.00 . A A . 30 SER N 1 1 1 448 1 1 30 SER O O 1.653 -0.343 6.764 1.00 . A A . 30 SER O 1 1 1 449 1 1 30 SER OG O 0.725 -1.832 3.397 1.00 . A A . 30 SER OG 1 1 1 450 1 1 31 GLY C C -0.658 1.996 5.097 1.00 . A A . 31 GLY C 1 1 1 451 1 1 31 GLY CA C -0.766 1.091 6.326 1.00 . A A . 31 GLY CA 1 1 1 452 1 1 31 GLY H H -1.196 -0.821 5.530 1.00 . A A . 31 GLY H 1 1 1 453 1 1 31 GLY HA2 H -1.788 1.146 6.701 1.00 . A A . 31 GLY HA2 1 1 1 454 1 1 31 GLY HA3 H -0.098 1.461 7.105 1.00 . A A . 31 GLY HA3 1 1 1 455 1 1 31 GLY N N -0.473 -0.298 6.010 1.00 . A A . 31 GLY N 1 1 1 456 1 1 31 GLY O O -0.535 3.207 5.254 1.00 . A A . 31 GLY O 1 1 1 457 1 1 32 CYS C C -2.229 2.200 2.132 1.00 . A A . 32 CYS C 1 1 1 458 1 1 32 CYS CA C -0.776 2.114 2.612 1.00 . A A . 32 CYS CA 1 1 1 459 1 1 32 CYS CB C 0.061 1.334 1.589 1.00 . A A . 32 CYS CB 1 1 1 460 1 1 32 CYS H H -0.817 0.414 3.846 1.00 . A A . 32 CYS H 1 1 1 461 1 1 32 CYS HA H -0.365 3.118 2.715 1.00 . A A . 32 CYS HA 1 1 1 462 1 1 32 CYS HB2 H -0.455 0.404 1.355 1.00 . A A . 32 CYS HB2 1 1 1 463 1 1 32 CYS HB3 H 0.127 1.905 0.666 1.00 . A A . 32 CYS HB3 1 1 1 464 1 1 32 CYS N N -0.722 1.418 3.890 1.00 . A A . 32 CYS N 1 1 1 465 1 1 32 CYS O O -3.090 1.474 2.628 1.00 . A A . 32 CYS O 1 1 1 466 1 1 32 CYS SG S 1.736 0.878 2.110 1.00 . A A . 32 CYS SG 1 1 1 467 1 1 33 LYS C C -3.430 2.677 -1.096 1.00 . A A . 33 LYS C 1 1 1 468 1 1 33 LYS CA C -3.722 3.054 0.355 1.00 . A A . 33 LYS CA 1 1 1 469 1 1 33 LYS CB C -4.389 4.434 0.437 1.00 . A A . 33 LYS CB 1 1 1 470 1 1 33 LYS CD C -4.298 6.888 -0.228 1.00 . A A . 33 LYS CD 1 1 1 471 1 1 33 LYS CE C -4.237 7.412 1.207 1.00 . A A . 33 LYS CE 1 1 1 472 1 1 33 LYS CG C -3.615 5.520 -0.331 1.00 . A A . 33 LYS CG 1 1 1 473 1 1 33 LYS H H -1.761 3.678 0.816 1.00 . A A . 33 LYS H 1 1 1 474 1 1 33 LYS HA H -4.426 2.323 0.759 1.00 . A A . 33 LYS HA 1 1 1 475 1 1 33 LYS HB2 H -5.397 4.367 0.026 1.00 . A A . 33 LYS HB2 1 1 1 476 1 1 33 LYS HB3 H -4.465 4.687 1.495 1.00 . A A . 33 LYS HB3 1 1 1 477 1 1 33 LYS HD2 H -3.767 7.581 -0.883 1.00 . A A . 33 LYS HD2 1 1 1 478 1 1 33 LYS HD3 H -5.335 6.812 -0.557 1.00 . A A . 33 LYS HD3 1 1 1 479 1 1 33 LYS HE2 H -4.823 6.774 1.868 1.00 . A A . 33 LYS HE2 1 1 1 480 1 1 33 LYS HE3 H -3.199 7.384 1.523 1.00 . A A . 33 LYS HE3 1 1 1 481 1 1 33 LYS HG2 H -2.597 5.595 0.052 1.00 . A A . 33 LYS HG2 1 1 1 482 1 1 33 LYS HG3 H -3.569 5.264 -1.390 1.00 . A A . 33 LYS HG3 1 1 1 483 1 1 33 LYS HZ1 H -5.708 8.822 1.006 1.00 . A A . 33 LYS HZ1 1 1 1 484 1 1 33 LYS HZ2 H -4.685 9.102 2.267 1.00 . A A . 33 LYS HZ2 1 1 1 485 1 1 33 LYS HZ3 H -4.189 9.400 0.724 1.00 . A A . 33 LYS HZ3 1 1 1 486 1 1 33 LYS N N -2.489 3.054 1.133 1.00 . A A . 33 LYS N 1 1 1 487 1 1 33 LYS NZ N -4.744 8.791 1.307 1.00 . A A . 33 LYS NZ 1 1 1 488 1 1 33 LYS O O -2.271 2.635 -1.512 1.00 . A A . 33 LYS O 1 1 1 489 1 1 34 ILE C C -5.669 3.156 -3.844 1.00 . A A . 34 ILE C 1 1 1 490 1 1 34 ILE CA C -4.473 2.365 -3.321 1.00 . A A . 34 ILE CA 1 1 1 491 1 1 34 ILE CB C -4.526 0.898 -3.786 1.00 . A A . 34 ILE CB 1 1 1 492 1 1 34 ILE CD1 C -3.399 -1.370 -3.531 1.00 . A A . 34 ILE CD1 1 1 1 493 1 1 34 ILE CG1 C -3.492 0.060 -3.019 1.00 . A A . 34 ILE CG1 1 1 1 494 1 1 34 ILE CG2 C -4.292 0.822 -5.305 1.00 . A A . 34 ILE CG2 1 1 1 495 1 1 34 ILE H H -5.413 2.474 -1.441 1.00 . A A . 34 ILE H 1 1 1 496 1 1 34 ILE HA H -3.558 2.825 -3.694 1.00 . A A . 34 ILE HA 1 1 1 497 1 1 34 ILE HB H -5.516 0.495 -3.569 1.00 . A A . 34 ILE HB 1 1 1 498 1 1 34 ILE HD11 H -4.395 -1.812 -3.505 1.00 . A A . 34 ILE HD11 1 1 1 499 1 1 34 ILE HD12 H -3.004 -1.388 -4.544 1.00 . A A . 34 ILE HD12 1 1 1 500 1 1 34 ILE HD13 H -2.726 -1.936 -2.891 1.00 . A A . 34 ILE HD13 1 1 1 501 1 1 34 ILE HG12 H -2.512 0.524 -3.089 1.00 . A A . 34 ILE HG12 1 1 1 502 1 1 34 ILE HG13 H -3.781 0.005 -1.971 1.00 . A A . 34 ILE HG13 1 1 1 503 1 1 34 ILE HG21 H -4.960 1.500 -5.835 1.00 . A A . 34 ILE HG21 1 1 1 504 1 1 34 ILE HG22 H -3.261 1.087 -5.538 1.00 . A A . 34 ILE HG22 1 1 1 505 1 1 34 ILE HG23 H -4.496 -0.182 -5.673 1.00 . A A . 34 ILE HG23 1 1 1 506 1 1 34 ILE N N -4.500 2.462 -1.870 1.00 . A A . 34 ILE N 1 1 1 507 1 1 34 ILE O O -6.770 3.022 -3.310 1.00 . A A . 34 ILE O 1 1 1 508 1 1 35 ILE C C -6.254 4.958 -6.955 1.00 . A A . 35 ILE C 1 1 1 509 1 1 35 ILE CA C -6.456 4.870 -5.440 1.00 . A A . 35 ILE CA 1 1 1 510 1 1 35 ILE CB C -6.414 6.266 -4.781 1.00 . A A . 35 ILE CB 1 1 1 511 1 1 35 ILE CD1 C -5.032 8.362 -4.369 1.00 . A A . 35 ILE CD1 1 1 1 512 1 1 35 ILE CG1 C -5.078 6.987 -5.038 1.00 . A A . 35 ILE CG1 1 1 1 513 1 1 35 ILE CG2 C -6.706 6.188 -3.275 1.00 . A A . 35 ILE CG2 1 1 1 514 1 1 35 ILE H H -4.518 4.023 -5.270 1.00 . A A . 35 ILE H 1 1 1 515 1 1 35 ILE HA H -7.444 4.439 -5.269 1.00 . A A . 35 ILE HA 1 1 1 516 1 1 35 ILE HB H -7.210 6.862 -5.232 1.00 . A A . 35 ILE HB 1 1 1 517 1 1 35 ILE HD11 H -4.890 8.259 -3.293 1.00 . A A . 35 ILE HD11 1 1 1 518 1 1 35 ILE HD12 H -4.199 8.929 -4.779 1.00 . A A . 35 ILE HD12 1 1 1 519 1 1 35 ILE HD13 H -5.958 8.905 -4.561 1.00 . A A . 35 ILE HD13 1 1 1 520 1 1 35 ILE HG12 H -4.242 6.390 -4.671 1.00 . A A . 35 ILE HG12 1 1 1 521 1 1 35 ILE HG13 H -4.951 7.141 -6.109 1.00 . A A . 35 ILE HG13 1 1 1 522 1 1 35 ILE HG21 H -7.604 5.596 -3.100 1.00 . A A . 35 ILE HG21 1 1 1 523 1 1 35 ILE HG22 H -5.865 5.737 -2.747 1.00 . A A . 35 ILE HG22 1 1 1 524 1 1 35 ILE HG23 H -6.879 7.184 -2.871 1.00 . A A . 35 ILE HG23 1 1 1 525 1 1 35 ILE N N -5.443 3.995 -4.861 1.00 . A A . 35 ILE N 1 1 1 526 1 1 35 ILE O O -5.130 4.826 -7.435 1.00 . A A . 35 ILE O 1 1 1 527 1 1 36 SER C C -7.166 6.890 -9.512 1.00 . A A . 36 SER C 1 1 1 528 1 1 36 SER CA C -7.311 5.406 -9.147 1.00 . A A . 36 SER CA 1 1 1 529 1 1 36 SER CB C -8.588 4.808 -9.750 1.00 . A A . 36 SER CB 1 1 1 530 1 1 36 SER H H -8.238 5.296 -7.248 1.00 . A A . 36 SER H 1 1 1 531 1 1 36 SER HA H -6.463 4.878 -9.582 1.00 . A A . 36 SER HA 1 1 1 532 1 1 36 SER HB2 H -8.613 4.968 -10.829 1.00 . A A . 36 SER HB2 1 1 1 533 1 1 36 SER HB3 H -8.605 3.733 -9.561 1.00 . A A . 36 SER HB3 1 1 1 534 1 1 36 SER HG H -9.754 6.324 -9.384 1.00 . A A . 36 SER HG 1 1 1 535 1 1 36 SER N N -7.339 5.205 -7.701 1.00 . A A . 36 SER N 1 1 1 536 1 1 36 SER O O -7.426 7.269 -10.652 1.00 . A A . 36 SER O 1 1 1 537 1 1 36 SER OG O -9.730 5.391 -9.156 1.00 . A A . 36 SER OG 1 1 1 538 1 1 37 ALA C C -5.221 9.466 -9.439 1.00 . A A . 37 ALA C 1 1 1 539 1 1 37 ALA CA C -6.563 9.159 -8.766 1.00 . A A . 37 ALA CA 1 1 1 540 1 1 37 ALA CB C -6.674 9.880 -7.421 1.00 . A A . 37 ALA CB 1 1 1 541 1 1 37 ALA H H -6.539 7.368 -7.639 1.00 . A A . 37 ALA H 1 1 1 542 1 1 37 ALA HA H -7.367 9.534 -9.403 1.00 . A A . 37 ALA HA 1 1 1 543 1 1 37 ALA HB1 H -7.608 9.608 -6.929 1.00 . A A . 37 ALA HB1 1 1 1 544 1 1 37 ALA HB2 H -5.836 9.599 -6.786 1.00 . A A . 37 ALA HB2 1 1 1 545 1 1 37 ALA HB3 H -6.655 10.959 -7.576 1.00 . A A . 37 ALA HB3 1 1 1 546 1 1 37 ALA N N -6.748 7.730 -8.558 1.00 . A A . 37 ALA N 1 1 1 547 1 1 37 ALA O O -5.070 10.542 -10.010 1.00 . A A . 37 ALA O 1 1 1 548 1 1 38 SER C C -1.998 9.592 -9.057 1.00 . A A . 38 SER C 1 1 1 549 1 1 38 SER CA C -2.885 8.639 -9.867 1.00 . A A . 38 SER CA 1 1 1 550 1 1 38 SER CB C -2.892 8.973 -11.361 1.00 . A A . 38 SER CB 1 1 1 551 1 1 38 SER H H -4.455 7.702 -8.838 1.00 . A A . 38 SER H 1 1 1 552 1 1 38 SER HA H -2.454 7.642 -9.767 1.00 . A A . 38 SER HA 1 1 1 553 1 1 38 SER HB2 H -3.585 8.312 -11.883 1.00 . A A . 38 SER HB2 1 1 1 554 1 1 38 SER HB3 H -3.199 10.005 -11.510 1.00 . A A . 38 SER HB3 1 1 1 555 1 1 38 SER HG H -1.347 7.881 -11.831 1.00 . A A . 38 SER HG 1 1 1 556 1 1 38 SER N N -4.244 8.548 -9.335 1.00 . A A . 38 SER N 1 1 1 557 1 1 38 SER O O -0.810 9.328 -8.885 1.00 . A A . 38 SER O 1 1 1 558 1 1 38 SER OG O -1.599 8.805 -11.906 1.00 . A A . 38 SER OG 1 1 1 559 1 1 39 THR C C -2.410 11.351 -6.235 1.00 . A A . 39 THR C 1 1 1 560 1 1 39 THR CA C -1.937 11.638 -7.659 1.00 . A A . 39 THR CA 1 1 1 561 1 1 39 THR CB C -2.313 13.055 -8.109 1.00 . A A . 39 THR CB 1 1 1 562 1 1 39 THR CG2 C -1.584 14.129 -7.298 1.00 . A A . 39 THR CG2 1 1 1 563 1 1 39 THR H H -3.554 10.841 -8.746 1.00 . A A . 39 THR H 1 1 1 564 1 1 39 THR HA H -0.852 11.536 -7.720 1.00 . A A . 39 THR HA 1 1 1 565 1 1 39 THR HB H -3.388 13.193 -7.991 1.00 . A A . 39 THR HB 1 1 1 566 1 1 39 THR HG1 H -1.054 13.023 -9.594 1.00 . A A . 39 THR HG1 1 1 1 567 1 1 39 THR HG21 H -1.869 15.113 -7.669 1.00 . A A . 39 THR HG21 1 1 1 568 1 1 39 THR HG22 H -1.855 14.061 -6.244 1.00 . A A . 39 THR HG22 1 1 1 569 1 1 39 THR HG23 H -0.504 14.010 -7.400 1.00 . A A . 39 THR HG23 1 1 1 570 1 1 39 THR N N -2.579 10.679 -8.541 1.00 . A A . 39 THR N 1 1 1 571 1 1 39 THR O O -3.609 11.222 -5.994 1.00 . A A . 39 THR O 1 1 1 572 1 1 39 THR OG1 O -1.987 13.213 -9.476 1.00 . A A . 39 THR OG1 1 1 1 573 1 1 40 CYS C C -1.309 12.165 -3.064 1.00 . A A . 40 CYS C 1 1 1 574 1 1 40 CYS CA C -1.671 10.933 -3.899 1.00 . A A . 40 CYS CA 1 1 1 575 1 1 40 CYS CB C -0.810 9.721 -3.525 1.00 . A A . 40 CYS CB 1 1 1 576 1 1 40 CYS H H -0.500 11.402 -5.588 1.00 . A A . 40 CYS H 1 1 1 577 1 1 40 CYS HA H -2.718 10.677 -3.734 1.00 . A A . 40 CYS HA 1 1 1 578 1 1 40 CYS HB2 H 0.203 9.881 -3.898 1.00 . A A . 40 CYS HB2 1 1 1 579 1 1 40 CYS HB3 H -0.758 9.616 -2.441 1.00 . A A . 40 CYS HB3 1 1 1 580 1 1 40 CYS N N -1.453 11.233 -5.308 1.00 . A A . 40 CYS N 1 1 1 581 1 1 40 CYS O O -0.462 12.953 -3.485 1.00 . A A . 40 CYS O 1 1 1 582 1 1 40 CYS SG S -1.448 8.169 -4.207 1.00 . A A . 40 CYS SG 1 1 1 583 1 1 41 PRO C C -0.322 13.485 -0.420 1.00 . A A . 41 PRO C 1 1 1 584 1 1 41 PRO CA C -1.716 13.519 -1.052 1.00 . A A . 41 PRO CA 1 1 1 585 1 1 41 PRO CB C -2.822 13.468 0.007 1.00 . A A . 41 PRO CB 1 1 1 586 1 1 41 PRO CD C -2.936 11.472 -1.301 1.00 . A A . 41 PRO CD 1 1 1 587 1 1 41 PRO CG C -3.122 11.975 0.130 1.00 . A A . 41 PRO CG 1 1 1 588 1 1 41 PRO HA H -1.822 14.433 -1.639 1.00 . A A . 41 PRO HA 1 1 1 589 1 1 41 PRO HB2 H -2.525 13.910 0.958 1.00 . A A . 41 PRO HB2 1 1 1 590 1 1 41 PRO HB3 H -3.709 13.977 -0.378 1.00 . A A . 41 PRO HB3 1 1 1 591 1 1 41 PRO HD2 H -2.616 10.430 -1.292 1.00 . A A . 41 PRO HD2 1 1 1 592 1 1 41 PRO HD3 H -3.877 11.566 -1.847 1.00 . A A . 41 PRO HD3 1 1 1 593 1 1 41 PRO HG2 H -2.378 11.509 0.776 1.00 . A A . 41 PRO HG2 1 1 1 594 1 1 41 PRO HG3 H -4.126 11.786 0.509 1.00 . A A . 41 PRO HG3 1 1 1 595 1 1 41 PRO N N -1.940 12.355 -1.894 1.00 . A A . 41 PRO N 1 1 1 596 1 1 41 PRO O O 0.300 12.425 -0.338 1.00 . A A . 41 PRO O 1 1 1 597 1 1 42 SER C C 1.403 14.301 2.111 1.00 . A A . 42 SER C 1 1 1 598 1 1 42 SER CA C 1.450 14.843 0.679 1.00 . A A . 42 SER CA 1 1 1 599 1 1 42 SER CB C 1.838 16.327 0.638 1.00 . A A . 42 SER CB 1 1 1 600 1 1 42 SER H H -0.409 15.483 -0.102 1.00 . A A . 42 SER H 1 1 1 601 1 1 42 SER HA H 2.210 14.288 0.125 1.00 . A A . 42 SER HA 1 1 1 602 1 1 42 SER HB2 H 1.114 16.919 1.199 1.00 . A A . 42 SER HB2 1 1 1 603 1 1 42 SER HB3 H 2.826 16.457 1.082 1.00 . A A . 42 SER HB3 1 1 1 604 1 1 42 SER HG H 2.472 16.232 -1.200 1.00 . A A . 42 SER HG 1 1 1 605 1 1 42 SER N N 0.158 14.657 0.023 1.00 . A A . 42 SER N 1 1 1 606 1 1 42 SER O O 1.490 15.049 3.083 1.00 . A A . 42 SER O 1 1 1 607 1 1 42 SER OG O 1.865 16.783 -0.698 1.00 . A A . 42 SER OG 1 1 1 608 1 1 43 ASP C C 1.511 10.767 3.196 1.00 . A A . 43 ASP C 1 1 1 609 1 1 43 ASP CA C 1.035 12.203 3.422 1.00 . A A . 43 ASP CA 1 1 1 610 1 1 43 ASP CB C -0.454 12.209 3.796 1.00 . A A . 43 ASP CB 1 1 1 611 1 1 43 ASP CG C -0.938 13.576 4.270 1.00 . A A . 43 ASP CG 1 1 1 612 1 1 43 ASP H H 1.211 12.486 1.330 1.00 . A A . 43 ASP H 1 1 1 613 1 1 43 ASP HA H 1.618 12.630 4.239 1.00 . A A . 43 ASP HA 1 1 1 614 1 1 43 ASP HB2 H -1.046 11.911 2.931 1.00 . A A . 43 ASP HB2 1 1 1 615 1 1 43 ASP HB3 H -0.625 11.489 4.598 1.00 . A A . 43 ASP HB3 1 1 1 616 1 1 43 ASP HD2 H 0.067 13.321 5.924 1.00 . A A . 43 ASP HD2 1 1 1 617 1 1 43 ASP N N 1.249 12.979 2.209 1.00 . A A . 43 ASP N 1 1 1 618 1 1 43 ASP O O 2.035 10.148 4.120 1.00 . A A . 43 ASP O 1 1 1 619 1 1 43 ASP OD1 O -1.678 14.236 3.547 1.00 . A A . 43 ASP OD1 1 1 1 620 1 1 43 ASP OD2 O -0.504 13.968 5.502 1.00 . A A . 43 ASP OD2 1 1 1 621 1 1 44 TYR C C 2.853 9.153 0.412 1.00 . A A . 44 TYR C 1 1 1 622 1 1 44 TYR CA C 1.828 8.947 1.538 1.00 . A A . 44 TYR CA 1 1 1 623 1 1 44 TYR CB C 0.634 8.085 1.095 1.00 . A A . 44 TYR CB 1 1 1 624 1 1 44 TYR CD1 C -1.204 8.724 2.739 1.00 . A A . 44 TYR CD1 1 1 1 625 1 1 44 TYR CD2 C -0.472 6.411 2.647 1.00 . A A . 44 TYR CD2 1 1 1 626 1 1 44 TYR CE1 C -2.098 8.403 3.775 1.00 . A A . 44 TYR CE1 1 1 1 627 1 1 44 TYR CE2 C -1.433 6.071 3.613 1.00 . A A . 44 TYR CE2 1 1 1 628 1 1 44 TYR CG C -0.354 7.738 2.199 1.00 . A A . 44 TYR CG 1 1 1 629 1 1 44 TYR CZ C -2.228 7.069 4.197 1.00 . A A . 44 TYR CZ 1 1 1 630 1 1 44 TYR H H 0.860 10.792 1.269 1.00 . A A . 44 TYR H 1 1 1 631 1 1 44 TYR HA H 2.304 8.416 2.357 1.00 . A A . 44 TYR HA 1 1 1 632 1 1 44 TYR HB2 H 0.097 8.588 0.292 1.00 . A A . 44 TYR HB2 1 1 1 633 1 1 44 TYR HB3 H 1.033 7.157 0.689 1.00 . A A . 44 TYR HB3 1 1 1 634 1 1 44 TYR HD1 H -1.195 9.725 2.339 1.00 . A A . 44 TYR HD1 1 1 1 635 1 1 44 TYR HD2 H 0.162 5.642 2.243 1.00 . A A . 44 TYR HD2 1 1 1 636 1 1 44 TYR HE1 H -2.710 9.175 4.214 1.00 . A A . 44 TYR HE1 1 1 1 637 1 1 44 TYR HE2 H -1.566 5.041 3.901 1.00 . A A . 44 TYR HE2 1 1 1 638 1 1 44 TYR HH H -3.635 7.483 5.495 1.00 . A A . 44 TYR HH 1 1 1 639 1 1 44 TYR N N 1.343 10.249 1.969 1.00 . A A . 44 TYR N 1 1 1 640 1 1 44 TYR O O 2.527 8.928 -0.754 1.00 . A A . 44 TYR O 1 1 1 641 1 1 44 TYR OH O -3.141 6.734 5.154 1.00 . A A . 44 TYR OH 1 1 1 642 1 1 45 PRO C C 5.796 8.873 -0.955 1.00 . A A . 45 PRO C 1 1 1 643 1 1 45 PRO CA C 5.071 10.028 -0.254 1.00 . A A . 45 PRO CA 1 1 1 644 1 1 45 PRO CB C 6.058 10.909 0.518 1.00 . A A . 45 PRO CB 1 1 1 645 1 1 45 PRO CD C 4.548 9.935 2.071 1.00 . A A . 45 PRO CD 1 1 1 646 1 1 45 PRO CG C 6.017 10.321 1.926 1.00 . A A . 45 PRO CG 1 1 1 647 1 1 45 PRO HA H 4.594 10.641 -1.020 1.00 . A A . 45 PRO HA 1 1 1 648 1 1 45 PRO HB2 H 7.065 10.898 0.097 1.00 . A A . 45 PRO HB2 1 1 1 649 1 1 45 PRO HB3 H 5.679 11.931 0.550 1.00 . A A . 45 PRO HB3 1 1 1 650 1 1 45 PRO HD2 H 4.444 9.101 2.762 1.00 . A A . 45 PRO HD2 1 1 1 651 1 1 45 PRO HD3 H 4.017 10.810 2.439 1.00 . A A . 45 PRO HD3 1 1 1 652 1 1 45 PRO HG2 H 6.639 9.429 1.975 1.00 . A A . 45 PRO HG2 1 1 1 653 1 1 45 PRO HG3 H 6.328 11.041 2.683 1.00 . A A . 45 PRO HG3 1 1 1 654 1 1 45 PRO N N 4.080 9.609 0.731 1.00 . A A . 45 PRO N 1 1 1 655 1 1 45 PRO O O 6.520 9.135 -1.913 1.00 . A A . 45 PRO O 1 1 1 656 1 1 46 LYS C C 5.158 5.791 -2.021 1.00 . A A . 46 LYS C 1 1 1 657 1 1 46 LYS CA C 6.228 6.458 -1.157 1.00 . A A . 46 LYS CA 1 1 1 658 1 1 46 LYS CB C 6.798 5.477 -0.117 1.00 . A A . 46 LYS CB 1 1 1 659 1 1 46 LYS CD C 8.237 7.172 1.140 1.00 . A A . 46 LYS CD 1 1 1 660 1 1 46 LYS CE C 9.552 7.359 1.905 1.00 . A A . 46 LYS CE 1 1 1 661 1 1 46 LYS CG C 8.205 5.844 0.374 1.00 . A A . 46 LYS CG 1 1 1 662 1 1 46 LYS H H 5.006 7.440 0.273 1.00 . A A . 46 LYS H 1 1 1 663 1 1 46 LYS HA H 7.047 6.749 -1.816 1.00 . A A . 46 LYS HA 1 1 1 664 1 1 46 LYS HB2 H 6.119 5.382 0.730 1.00 . A A . 46 LYS HB2 1 1 1 665 1 1 46 LYS HB3 H 6.891 4.496 -0.586 1.00 . A A . 46 LYS HB3 1 1 1 666 1 1 46 LYS HD2 H 8.108 8.001 0.444 1.00 . A A . 46 LYS HD2 1 1 1 667 1 1 46 LYS HD3 H 7.413 7.181 1.854 1.00 . A A . 46 LYS HD3 1 1 1 668 1 1 46 LYS HE2 H 9.476 8.259 2.515 1.00 . A A . 46 LYS HE2 1 1 1 669 1 1 46 LYS HE3 H 9.723 6.506 2.562 1.00 . A A . 46 LYS HE3 1 1 1 670 1 1 46 LYS HG2 H 8.540 5.043 1.035 1.00 . A A . 46 LYS HG2 1 1 1 671 1 1 46 LYS HG3 H 8.881 5.890 -0.481 1.00 . A A . 46 LYS HG3 1 1 1 672 1 1 46 LYS HZ1 H 10.800 6.671 0.432 1.00 . A A . 46 LYS HZ1 1 1 1 673 1 1 46 LYS HZ2 H 10.566 8.303 0.396 1.00 . A A . 46 LYS HZ2 1 1 1 674 1 1 46 LYS HZ3 H 11.546 7.635 1.541 1.00 . A A . 46 LYS HZ3 1 1 1 675 1 1 46 LYS N N 5.621 7.618 -0.510 1.00 . A A . 46 LYS N 1 1 1 676 1 1 46 LYS NZ N 10.704 7.503 0.997 1.00 . A A . 46 LYS NZ 1 1 1 677 1 1 46 LYS O O 5.041 6.168 -3.205 1.00 . A A . 46 LYS O 1 1 1 678 1 1 46 LYS OXT O 4.471 4.888 -1.500 1.00 . A A . 46 LYS OXT 1 1 2 679 1 1 1 LYS C C -0.099 5.281 -6.886 1.00 . A A . 1 LYS C 1 1 2 680 1 1 1 LYS CA C -0.972 6.087 -7.857 1.00 . A A . 1 LYS CA 1 1 2 681 1 1 1 LYS CB C -0.219 7.292 -8.450 1.00 . A A . 1 LYS CB 1 1 2 682 1 1 1 LYS CD C 0.764 9.579 -8.108 1.00 . A A . 1 LYS CD 1 1 2 683 1 1 1 LYS CE C 1.039 10.723 -7.124 1.00 . A A . 1 LYS CE 1 1 2 684 1 1 1 LYS CG C 0.150 8.358 -7.411 1.00 . A A . 1 LYS CG 1 1 2 685 1 1 1 LYS H1 H -2.795 6.997 -8.008 1.00 . A A . 1 LYS H1 1 1 2 686 1 1 1 LYS H2 H -2.825 5.663 -7.061 1.00 . A A . 1 LYS H2 1 1 2 687 1 1 1 LYS H3 H -2.176 7.072 -6.490 1.00 . A A . 1 LYS H3 1 1 2 688 1 1 1 LYS HA H -1.193 5.417 -8.688 1.00 . A A . 1 LYS HA 1 1 2 689 1 1 1 LYS HB2 H 0.694 6.945 -8.936 1.00 . A A . 1 LYS HB2 1 1 2 690 1 1 1 LYS HB3 H -0.842 7.752 -9.214 1.00 . A A . 1 LYS HB3 1 1 2 691 1 1 1 LYS HD2 H 1.689 9.292 -8.613 1.00 . A A . 1 LYS HD2 1 1 2 692 1 1 1 LYS HD3 H 0.061 9.943 -8.858 1.00 . A A . 1 LYS HD3 1 1 2 693 1 1 1 LYS HE2 H 1.357 11.600 -7.691 1.00 . A A . 1 LYS HE2 1 1 2 694 1 1 1 LYS HE3 H 0.123 10.971 -6.587 1.00 . A A . 1 LYS HE3 1 1 2 695 1 1 1 LYS HG2 H -0.745 8.678 -6.882 1.00 . A A . 1 LYS HG2 1 1 2 696 1 1 1 LYS HG3 H 0.863 7.940 -6.702 1.00 . A A . 1 LYS HG3 1 1 2 697 1 1 1 LYS HZ1 H 1.838 9.565 -5.632 1.00 . A A . 1 LYS HZ1 1 1 2 698 1 1 1 LYS HZ2 H 2.965 10.211 -6.646 1.00 . A A . 1 LYS HZ2 1 1 2 699 1 1 1 LYS HZ3 H 2.228 11.159 -5.518 1.00 . A A . 1 LYS HZ3 1 1 2 700 1 1 1 LYS N N -2.284 6.483 -7.305 1.00 . A A . 1 LYS N 1 1 2 701 1 1 1 LYS NZ N 2.098 10.387 -6.156 1.00 . A A . 1 LYS NZ 1 1 2 702 1 1 1 LYS O O 1.112 5.219 -7.081 1.00 . A A . 1 LYS O 1 1 2 703 1 1 2 SER C C 1.071 4.364 -4.150 1.00 . A A . 2 SER C 1 1 2 704 1 1 2 SER CA C -0.064 3.714 -4.947 1.00 . A A . 2 SER CA 1 1 2 705 1 1 2 SER CB C 0.409 2.452 -5.681 1.00 . A A . 2 SER CB 1 1 2 706 1 1 2 SER H H -1.708 4.738 -5.782 1.00 . A A . 2 SER H 1 1 2 707 1 1 2 SER HA H -0.835 3.401 -4.248 1.00 . A A . 2 SER HA 1 1 2 708 1 1 2 SER HB2 H 1.219 2.695 -6.367 1.00 . A A . 2 SER HB2 1 1 2 709 1 1 2 SER HB3 H 0.777 1.732 -4.948 1.00 . A A . 2 SER HB3 1 1 2 710 1 1 2 SER HG H -1.422 1.823 -5.810 1.00 . A A . 2 SER HG 1 1 2 711 1 1 2 SER N N -0.708 4.643 -5.874 1.00 . A A . 2 SER N 1 1 2 712 1 1 2 SER O O 2.193 4.464 -4.644 1.00 . A A . 2 SER O 1 1 2 713 1 1 2 SER OG O -0.665 1.877 -6.398 1.00 . A A . 2 SER OG 1 1 2 714 1 1 3 CYS C C 1.800 4.987 -0.688 1.00 . A A . 3 CYS C 1 1 2 715 1 1 3 CYS CA C 1.704 5.572 -2.093 1.00 . A A . 3 CYS CA 1 1 2 716 1 1 3 CYS CB C 1.234 7.025 -2.034 1.00 . A A . 3 CYS CB 1 1 2 717 1 1 3 CYS H H -0.128 4.578 -2.527 1.00 . A A . 3 CYS H 1 1 2 718 1 1 3 CYS HA H 2.699 5.580 -2.534 1.00 . A A . 3 CYS HA 1 1 2 719 1 1 3 CYS HB2 H 0.270 7.087 -1.527 1.00 . A A . 3 CYS HB2 1 1 2 720 1 1 3 CYS HB3 H 1.965 7.582 -1.452 1.00 . A A . 3 CYS HB3 1 1 2 721 1 1 3 CYS N N 0.785 4.787 -2.912 1.00 . A A . 3 CYS N 1 1 2 722 1 1 3 CYS O O 0.774 4.704 -0.081 1.00 . A A . 3 CYS O 1 1 2 723 1 1 3 CYS SG S 1.117 7.826 -3.652 1.00 . A A . 3 CYS SG 1 1 2 724 1 1 4 CYS C C 3.944 5.277 2.055 1.00 . A A . 4 CYS C 1 1 2 725 1 1 4 CYS CA C 3.315 4.237 1.128 1.00 . A A . 4 CYS CA 1 1 2 726 1 1 4 CYS CB C 4.260 3.047 0.949 1.00 . A A . 4 CYS CB 1 1 2 727 1 1 4 CYS H H 3.816 5.169 -0.707 1.00 . A A . 4 CYS H 1 1 2 728 1 1 4 CYS HA H 2.395 3.885 1.582 1.00 . A A . 4 CYS HA 1 1 2 729 1 1 4 CYS HB2 H 5.095 3.372 0.329 1.00 . A A . 4 CYS HB2 1 1 2 730 1 1 4 CYS HB3 H 4.673 2.747 1.911 1.00 . A A . 4 CYS HB3 1 1 2 731 1 1 4 CYS N N 3.025 4.821 -0.176 1.00 . A A . 4 CYS N 1 1 2 732 1 1 4 CYS O O 4.533 6.247 1.580 1.00 . A A . 4 CYS O 1 1 2 733 1 1 4 CYS SG S 3.504 1.572 0.213 1.00 . A A . 4 CYS SG 1 1 2 734 1 1 5 PRO C C 5.982 5.903 4.277 1.00 . A A . 5 PRO C 1 1 2 735 1 1 5 PRO CA C 4.455 5.978 4.351 1.00 . A A . 5 PRO CA 1 1 2 736 1 1 5 PRO CB C 3.920 5.530 5.715 1.00 . A A . 5 PRO CB 1 1 2 737 1 1 5 PRO CD C 3.093 4.032 4.056 1.00 . A A . 5 PRO CD 1 1 2 738 1 1 5 PRO CG C 3.560 4.058 5.509 1.00 . A A . 5 PRO CG 1 1 2 739 1 1 5 PRO HA H 4.144 7.007 4.174 1.00 . A A . 5 PRO HA 1 1 2 740 1 1 5 PRO HB2 H 4.638 5.677 6.522 1.00 . A A . 5 PRO HB2 1 1 2 741 1 1 5 PRO HB3 H 3.007 6.080 5.941 1.00 . A A . 5 PRO HB3 1 1 2 742 1 1 5 PRO HD2 H 3.260 3.047 3.631 1.00 . A A . 5 PRO HD2 1 1 2 743 1 1 5 PRO HD3 H 2.026 4.252 4.022 1.00 . A A . 5 PRO HD3 1 1 2 744 1 1 5 PRO HG2 H 4.449 3.437 5.620 1.00 . A A . 5 PRO HG2 1 1 2 745 1 1 5 PRO HG3 H 2.781 3.723 6.195 1.00 . A A . 5 PRO HG3 1 1 2 746 1 1 5 PRO N N 3.838 5.089 3.381 1.00 . A A . 5 PRO N 1 1 2 747 1 1 5 PRO O O 6.656 6.932 4.304 1.00 . A A . 5 PRO O 1 1 2 748 1 1 6 ASN C C 8.353 3.081 3.801 1.00 . A A . 6 ASN C 1 1 2 749 1 1 6 ASN CA C 7.954 4.443 4.368 1.00 . A A . 6 ASN CA 1 1 2 750 1 1 6 ASN CB C 8.331 4.590 5.853 1.00 . A A . 6 ASN CB 1 1 2 751 1 1 6 ASN CG C 7.584 3.590 6.732 1.00 . A A . 6 ASN CG 1 1 2 752 1 1 6 ASN H H 5.935 3.875 4.092 1.00 . A A . 6 ASN H 1 1 2 753 1 1 6 ASN HA H 8.509 5.192 3.806 1.00 . A A . 6 ASN HA 1 1 2 754 1 1 6 ASN HB2 H 9.401 4.434 5.982 1.00 . A A . 6 ASN HB2 1 1 2 755 1 1 6 ASN HB3 H 8.106 5.604 6.184 1.00 . A A . 6 ASN HB3 1 1 2 756 1 1 6 ASN HD21 H 6.467 5.064 7.585 1.00 . A A . 6 ASN HD21 1 1 2 757 1 1 6 ASN HD22 H 6.117 3.442 8.137 1.00 . A A . 6 ASN HD22 1 1 2 758 1 1 6 ASN N N 6.530 4.684 4.201 1.00 . A A . 6 ASN N 1 1 2 759 1 1 6 ASN ND2 N 6.648 4.072 7.552 1.00 . A A . 6 ASN ND2 1 1 2 760 1 1 6 ASN O O 7.512 2.327 3.309 1.00 . A A . 6 ASN O 1 1 2 761 1 1 6 ASN OD1 O 7.847 2.393 6.667 1.00 . A A . 6 ASN OD1 1 1 2 762 1 1 7 THR C C 9.707 0.318 4.004 1.00 . A A . 7 THR C 1 1 2 763 1 1 7 THR CA C 10.277 1.580 3.351 1.00 . A A . 7 THR CA 1 1 2 764 1 1 7 THR CB C 11.795 1.674 3.562 1.00 . A A . 7 THR CB 1 1 2 765 1 1 7 THR CG2 C 12.549 0.578 2.801 1.00 . A A . 7 THR CG2 1 1 2 766 1 1 7 THR H H 10.282 3.473 4.267 1.00 . A A . 7 THR H 1 1 2 767 1 1 7 THR HA H 10.082 1.544 2.279 1.00 . A A . 7 THR HA 1 1 2 768 1 1 7 THR HB H 12.020 1.586 4.626 1.00 . A A . 7 THR HB 1 1 2 769 1 1 7 THR HG1 H 13.197 2.988 3.254 1.00 . A A . 7 THR HG1 1 1 2 770 1 1 7 THR HG21 H 13.621 0.696 2.958 1.00 . A A . 7 THR HG21 1 1 2 771 1 1 7 THR HG22 H 12.254 -0.409 3.159 1.00 . A A . 7 THR HG22 1 1 2 772 1 1 7 THR HG23 H 12.337 0.651 1.733 1.00 . A A . 7 THR HG23 1 1 2 773 1 1 7 THR N N 9.655 2.787 3.872 1.00 . A A . 7 THR N 1 1 2 774 1 1 7 THR O O 9.549 -0.696 3.329 1.00 . A A . 7 THR O 1 1 2 775 1 1 7 THR OG1 O 12.249 2.937 3.115 1.00 . A A . 7 THR OG1 1 1 2 776 1 1 8 THR C C 7.354 -0.970 5.510 1.00 . A A . 8 THR C 1 1 2 777 1 1 8 THR CA C 8.786 -0.753 6.009 1.00 . A A . 8 THR CA 1 1 2 778 1 1 8 THR CB C 8.843 -0.555 7.532 1.00 . A A . 8 THR CB 1 1 2 779 1 1 8 THR CG2 C 8.504 -1.856 8.266 1.00 . A A . 8 THR CG2 1 1 2 780 1 1 8 THR H H 9.483 1.246 5.802 1.00 . A A . 8 THR H 1 1 2 781 1 1 8 THR HA H 9.377 -1.639 5.779 1.00 . A A . 8 THR HA 1 1 2 782 1 1 8 THR HB H 8.132 0.211 7.841 1.00 . A A . 8 THR HB 1 1 2 783 1 1 8 THR HG1 H 10.324 0.710 7.541 1.00 . A A . 8 THR HG1 1 1 2 784 1 1 8 THR HG21 H 9.214 -2.638 7.994 1.00 . A A . 8 THR HG21 1 1 2 785 1 1 8 THR HG22 H 8.555 -1.690 9.342 1.00 . A A . 8 THR HG22 1 1 2 786 1 1 8 THR HG23 H 7.497 -2.183 8.011 1.00 . A A . 8 THR HG23 1 1 2 787 1 1 8 THR N N 9.389 0.372 5.304 1.00 . A A . 8 THR N 1 1 2 788 1 1 8 THR O O 6.931 -2.109 5.338 1.00 . A A . 8 THR O 1 1 2 789 1 1 8 THR OG1 O 10.142 -0.153 7.918 1.00 . A A . 8 THR OG1 1 1 2 790 1 1 9 GLY C C 5.399 -0.650 3.247 1.00 . A A . 9 GLY C 1 1 2 791 1 1 9 GLY CA C 5.319 0.064 4.596 1.00 . A A . 9 GLY CA 1 1 2 792 1 1 9 GLY H H 7.022 1.031 5.418 1.00 . A A . 9 GLY H 1 1 2 793 1 1 9 GLY HA2 H 4.617 -0.457 5.247 1.00 . A A . 9 GLY HA2 1 1 2 794 1 1 9 GLY HA3 H 4.960 1.078 4.435 1.00 . A A . 9 GLY HA3 1 1 2 795 1 1 9 GLY N N 6.623 0.118 5.236 1.00 . A A . 9 GLY N 1 1 2 796 1 1 9 GLY O O 4.655 -1.599 3.011 1.00 . A A . 9 GLY O 1 1 2 797 1 1 10 ARG C C 6.895 -2.344 1.288 1.00 . A A . 10 ARG C 1 1 2 798 1 1 10 ARG CA C 6.573 -0.863 1.094 1.00 . A A . 10 ARG CA 1 1 2 799 1 1 10 ARG CB C 7.714 -0.166 0.336 1.00 . A A . 10 ARG CB 1 1 2 800 1 1 10 ARG CD C 6.465 1.004 -1.545 1.00 . A A . 10 ARG CD 1 1 2 801 1 1 10 ARG CG C 7.295 1.180 -0.267 1.00 . A A . 10 ARG CG 1 1 2 802 1 1 10 ARG CZ C 4.919 2.497 -2.833 1.00 . A A . 10 ARG CZ 1 1 2 803 1 1 10 ARG H H 6.895 0.579 2.631 1.00 . A A . 10 ARG H 1 1 2 804 1 1 10 ARG HA H 5.661 -0.811 0.505 1.00 . A A . 10 ARG HA 1 1 2 805 1 1 10 ARG HB2 H 8.545 0.000 1.021 1.00 . A A . 10 ARG HB2 1 1 2 806 1 1 10 ARG HB3 H 8.064 -0.811 -0.471 1.00 . A A . 10 ARG HB3 1 1 2 807 1 1 10 ARG HD2 H 7.084 0.542 -2.316 1.00 . A A . 10 ARG HD2 1 1 2 808 1 1 10 ARG HD3 H 5.618 0.349 -1.347 1.00 . A A . 10 ARG HD3 1 1 2 809 1 1 10 ARG HE H 6.498 3.124 -1.740 1.00 . A A . 10 ARG HE 1 1 2 810 1 1 10 ARG HG2 H 6.736 1.743 0.478 1.00 . A A . 10 ARG HG2 1 1 2 811 1 1 10 ARG HG3 H 8.194 1.744 -0.521 1.00 . A A . 10 ARG HG3 1 1 2 812 1 1 10 ARG HH11 H 4.502 0.519 -3.120 1.00 . A A . 10 ARG HH11 1 1 2 813 1 1 10 ARG HH12 H 3.417 1.632 -3.915 1.00 . A A . 10 ARG HH12 1 1 2 814 1 1 10 ARG HH21 H 5.055 4.530 -2.733 1.00 . A A . 10 ARG HH21 1 1 2 815 1 1 10 ARG HH22 H 3.759 3.924 -3.737 1.00 . A A . 10 ARG HH22 1 1 2 816 1 1 10 ARG N N 6.320 -0.214 2.376 1.00 . A A . 10 ARG N 1 1 2 817 1 1 10 ARG NE N 5.984 2.301 -2.038 1.00 . A A . 10 ARG NE 1 1 2 818 1 1 10 ARG NH1 N 4.220 1.466 -3.326 1.00 . A A . 10 ARG NH1 1 1 2 819 1 1 10 ARG NH2 N 4.549 3.746 -3.133 1.00 . A A . 10 ARG NH2 1 1 2 820 1 1 10 ARG O O 6.317 -3.180 0.602 1.00 . A A . 10 ARG O 1 1 2 821 1 1 11 ASN C C 6.952 -4.897 2.851 1.00 . A A . 11 ASN C 1 1 2 822 1 1 11 ASN CA C 8.178 -4.049 2.504 1.00 . A A . 11 ASN CA 1 1 2 823 1 1 11 ASN CB C 9.231 -4.068 3.618 1.00 . A A . 11 ASN CB 1 1 2 824 1 1 11 ASN CG C 9.502 -5.479 4.127 1.00 . A A . 11 ASN CG 1 1 2 825 1 1 11 ASN H H 8.238 -1.938 2.750 1.00 . A A . 11 ASN H 1 1 2 826 1 1 11 ASN HA H 8.631 -4.472 1.604 1.00 . A A . 11 ASN HA 1 1 2 827 1 1 11 ASN HB2 H 10.161 -3.644 3.239 1.00 . A A . 11 ASN HB2 1 1 2 828 1 1 11 ASN HB3 H 8.893 -3.456 4.450 1.00 . A A . 11 ASN HB3 1 1 2 829 1 1 11 ASN HD21 H 8.390 -5.139 5.799 1.00 . A A . 11 ASN HD21 1 1 2 830 1 1 11 ASN HD22 H 9.115 -6.726 5.682 1.00 . A A . 11 ASN HD22 1 1 2 831 1 1 11 ASN N N 7.796 -2.674 2.215 1.00 . A A . 11 ASN N 1 1 2 832 1 1 11 ASN ND2 N 8.957 -5.808 5.298 1.00 . A A . 11 ASN ND2 1 1 2 833 1 1 11 ASN O O 6.742 -5.935 2.231 1.00 . A A . 11 ASN O 1 1 2 834 1 1 11 ASN OD1 O 10.196 -6.257 3.476 1.00 . A A . 11 ASN OD1 1 1 2 835 1 1 12 ILE C C 3.995 -5.353 3.025 1.00 . A A . 12 ILE C 1 1 2 836 1 1 12 ILE CA C 4.927 -5.162 4.225 1.00 . A A . 12 ILE CA 1 1 2 837 1 1 12 ILE CB C 4.239 -4.421 5.390 1.00 . A A . 12 ILE CB 1 1 2 838 1 1 12 ILE CD1 C 4.742 -3.434 7.694 1.00 . A A . 12 ILE CD1 1 1 2 839 1 1 12 ILE CG1 C 5.129 -4.482 6.645 1.00 . A A . 12 ILE CG1 1 1 2 840 1 1 12 ILE CG2 C 2.870 -5.049 5.700 1.00 . A A . 12 ILE CG2 1 1 2 841 1 1 12 ILE H H 6.335 -3.568 4.266 1.00 . A A . 12 ILE H 1 1 2 842 1 1 12 ILE HA H 5.222 -6.150 4.582 1.00 . A A . 12 ILE HA 1 1 2 843 1 1 12 ILE HB H 4.089 -3.379 5.103 1.00 . A A . 12 ILE HB 1 1 2 844 1 1 12 ILE HD11 H 4.799 -2.435 7.262 1.00 . A A . 12 ILE HD11 1 1 2 845 1 1 12 ILE HD12 H 3.735 -3.607 8.070 1.00 . A A . 12 ILE HD12 1 1 2 846 1 1 12 ILE HD13 H 5.438 -3.497 8.531 1.00 . A A . 12 ILE HD13 1 1 2 847 1 1 12 ILE HG12 H 5.069 -5.477 7.084 1.00 . A A . 12 ILE HG12 1 1 2 848 1 1 12 ILE HG13 H 6.170 -4.302 6.382 1.00 . A A . 12 ILE HG13 1 1 2 849 1 1 12 ILE HG21 H 2.182 -4.914 4.866 1.00 . A A . 12 ILE HG21 1 1 2 850 1 1 12 ILE HG22 H 2.985 -6.116 5.896 1.00 . A A . 12 ILE HG22 1 1 2 851 1 1 12 ILE HG23 H 2.421 -4.581 6.574 1.00 . A A . 12 ILE HG23 1 1 2 852 1 1 12 ILE N N 6.132 -4.450 3.812 1.00 . A A . 12 ILE N 1 1 2 853 1 1 12 ILE O O 3.494 -6.455 2.808 1.00 . A A . 12 ILE O 1 1 2 854 1 1 13 TYR C C 3.350 -5.345 0.062 1.00 . A A . 13 TYR C 1 1 2 855 1 1 13 TYR CA C 2.903 -4.298 1.085 1.00 . A A . 13 TYR CA 1 1 2 856 1 1 13 TYR CB C 2.853 -2.897 0.464 1.00 . A A . 13 TYR CB 1 1 2 857 1 1 13 TYR CD1 C 0.485 -2.677 -0.362 1.00 . A A . 13 TYR CD1 1 1 2 858 1 1 13 TYR CD2 C 2.268 -2.868 -2.007 1.00 . A A . 13 TYR CD2 1 1 2 859 1 1 13 TYR CE1 C -0.465 -2.667 -1.394 1.00 . A A . 13 TYR CE1 1 1 2 860 1 1 13 TYR CE2 C 1.316 -2.841 -3.041 1.00 . A A . 13 TYR CE2 1 1 2 861 1 1 13 TYR CG C 1.852 -2.777 -0.665 1.00 . A A . 13 TYR CG 1 1 2 862 1 1 13 TYR CZ C -0.053 -2.751 -2.734 1.00 . A A . 13 TYR CZ 1 1 2 863 1 1 13 TYR H H 4.230 -3.413 2.482 1.00 . A A . 13 TYR H 1 1 2 864 1 1 13 TYR HA H 1.901 -4.558 1.428 1.00 . A A . 13 TYR HA 1 1 2 865 1 1 13 TYR HB2 H 2.577 -2.180 1.237 1.00 . A A . 13 TYR HB2 1 1 2 866 1 1 13 TYR HB3 H 3.841 -2.621 0.097 1.00 . A A . 13 TYR HB3 1 1 2 867 1 1 13 TYR HD1 H 0.162 -2.620 0.666 1.00 . A A . 13 TYR HD1 1 1 2 868 1 1 13 TYR HD2 H 3.315 -2.975 -2.246 1.00 . A A . 13 TYR HD2 1 1 2 869 1 1 13 TYR HE1 H -1.510 -2.590 -1.146 1.00 . A A . 13 TYR HE1 1 1 2 870 1 1 13 TYR HE2 H 1.638 -2.913 -4.070 1.00 . A A . 13 TYR HE2 1 1 2 871 1 1 13 TYR HH H -1.877 -2.692 -3.400 1.00 . A A . 13 TYR HH 1 1 2 872 1 1 13 TYR N N 3.776 -4.286 2.248 1.00 . A A . 13 TYR N 1 1 2 873 1 1 13 TYR O O 2.550 -6.175 -0.361 1.00 . A A . 13 TYR O 1 1 2 874 1 1 13 TYR OH O -0.979 -2.742 -3.737 1.00 . A A . 13 TYR OH 1 1 2 875 1 1 14 ASN C C 5.160 -7.667 -0.792 1.00 . A A . 14 ASN C 1 1 2 876 1 1 14 ASN CA C 5.229 -6.221 -1.284 1.00 . A A . 14 ASN CA 1 1 2 877 1 1 14 ASN CB C 6.678 -5.805 -1.571 1.00 . A A . 14 ASN CB 1 1 2 878 1 1 14 ASN CG C 6.755 -4.709 -2.631 1.00 . A A . 14 ASN CG 1 1 2 879 1 1 14 ASN H H 5.228 -4.600 0.079 1.00 . A A . 14 ASN H 1 1 2 880 1 1 14 ASN HA H 4.664 -6.165 -2.217 1.00 . A A . 14 ASN HA 1 1 2 881 1 1 14 ASN HB2 H 7.172 -5.484 -0.652 1.00 . A A . 14 ASN HB2 1 1 2 882 1 1 14 ASN HB3 H 7.227 -6.663 -1.958 1.00 . A A . 14 ASN HB3 1 1 2 883 1 1 14 ASN HD21 H 6.361 -3.253 -1.264 1.00 . A A . 14 ASN HD21 1 1 2 884 1 1 14 ASN HD22 H 6.613 -2.708 -2.913 1.00 . A A . 14 ASN HD22 1 1 2 885 1 1 14 ASN N N 4.629 -5.304 -0.325 1.00 . A A . 14 ASN N 1 1 2 886 1 1 14 ASN ND2 N 6.554 -3.452 -2.235 1.00 . A A . 14 ASN ND2 1 1 2 887 1 1 14 ASN O O 4.800 -8.552 -1.565 1.00 . A A . 14 ASN O 1 1 2 888 1 1 14 ASN OD1 O 6.997 -4.993 -3.801 1.00 . A A . 14 ASN OD1 1 1 2 889 1 1 15 THR C C 4.020 -9.807 1.014 1.00 . A A . 15 THR C 1 1 2 890 1 1 15 THR CA C 5.444 -9.250 1.068 1.00 . A A . 15 THR CA 1 1 2 891 1 1 15 THR CB C 5.989 -9.206 2.505 1.00 . A A . 15 THR CB 1 1 2 892 1 1 15 THR CG2 C 5.969 -10.587 3.169 1.00 . A A . 15 THR CG2 1 1 2 893 1 1 15 THR H H 5.784 -7.149 1.075 1.00 . A A . 15 THR H 1 1 2 894 1 1 15 THR HA H 6.087 -9.905 0.478 1.00 . A A . 15 THR HA 1 1 2 895 1 1 15 THR HB H 5.391 -8.520 3.105 1.00 . A A . 15 THR HB 1 1 2 896 1 1 15 THR HG1 H 7.844 -9.330 1.933 1.00 . A A . 15 THR HG1 1 1 2 897 1 1 15 THR HG21 H 6.520 -11.303 2.559 1.00 . A A . 15 THR HG21 1 1 2 898 1 1 15 THR HG22 H 6.438 -10.521 4.152 1.00 . A A . 15 THR HG22 1 1 2 899 1 1 15 THR HG23 H 4.945 -10.937 3.300 1.00 . A A . 15 THR HG23 1 1 2 900 1 1 15 THR N N 5.493 -7.915 0.481 1.00 . A A . 15 THR N 1 1 2 901 1 1 15 THR O O 3.819 -10.943 0.593 1.00 . A A . 15 THR O 1 1 2 902 1 1 15 THR OG1 O 7.323 -8.743 2.487 1.00 . A A . 15 THR OG1 1 1 2 903 1 1 16 CYS C C 1.149 -9.682 0.004 1.00 . A A . 16 CYS C 1 1 2 904 1 1 16 CYS CA C 1.629 -9.356 1.421 1.00 . A A . 16 CYS CA 1 1 2 905 1 1 16 CYS CB C 0.836 -8.214 2.066 1.00 . A A . 16 CYS CB 1 1 2 906 1 1 16 CYS H H 3.286 -8.072 1.754 1.00 . A A . 16 CYS H 1 1 2 907 1 1 16 CYS HA H 1.500 -10.248 2.034 1.00 . A A . 16 CYS HA 1 1 2 908 1 1 16 CYS HB2 H 1.152 -8.149 3.107 1.00 . A A . 16 CYS HB2 1 1 2 909 1 1 16 CYS HB3 H 1.088 -7.272 1.582 1.00 . A A . 16 CYS HB3 1 1 2 910 1 1 16 CYS N N 3.040 -8.998 1.426 1.00 . A A . 16 CYS N 1 1 2 911 1 1 16 CYS O O 0.500 -10.705 -0.211 1.00 . A A . 16 CYS O 1 1 2 912 1 1 16 CYS SG S -0.968 -8.380 2.052 1.00 . A A . 16 CYS SG 1 1 2 913 1 1 17 ARG C C 1.732 -10.298 -2.915 1.00 . A A . 17 ARG C 1 1 2 914 1 1 17 ARG CA C 1.140 -9.002 -2.365 1.00 . A A . 17 ARG CA 1 1 2 915 1 1 17 ARG CB C 1.634 -7.796 -3.178 1.00 . A A . 17 ARG CB 1 1 2 916 1 1 17 ARG CD C -0.280 -6.310 -3.946 1.00 . A A . 17 ARG CD 1 1 2 917 1 1 17 ARG CG C 0.817 -6.526 -2.899 1.00 . A A . 17 ARG CG 1 1 2 918 1 1 17 ARG CZ C -1.609 -8.111 -5.105 1.00 . A A . 17 ARG CZ 1 1 2 919 1 1 17 ARG H H 2.020 -7.998 -0.714 1.00 . A A . 17 ARG H 1 1 2 920 1 1 17 ARG HA H 0.056 -9.077 -2.443 1.00 . A A . 17 ARG HA 1 1 2 921 1 1 17 ARG HB2 H 2.674 -7.607 -2.917 1.00 . A A . 17 ARG HB2 1 1 2 922 1 1 17 ARG HB3 H 1.595 -8.024 -4.243 1.00 . A A . 17 ARG HB3 1 1 2 923 1 1 17 ARG HD2 H -0.834 -5.416 -3.670 1.00 . A A . 17 ARG HD2 1 1 2 924 1 1 17 ARG HD3 H 0.206 -6.125 -4.903 1.00 . A A . 17 ARG HD3 1 1 2 925 1 1 17 ARG HE H -1.566 -7.776 -3.112 1.00 . A A . 17 ARG HE 1 1 2 926 1 1 17 ARG HG2 H 0.377 -6.558 -1.903 1.00 . A A . 17 ARG HG2 1 1 2 927 1 1 17 ARG HG3 H 1.493 -5.672 -2.946 1.00 . A A . 17 ARG HG3 1 1 2 928 1 1 17 ARG HH11 H -0.604 -6.951 -6.463 1.00 . A A . 17 ARG HH11 1 1 2 929 1 1 17 ARG HH12 H -1.515 -8.271 -7.140 1.00 . A A . 17 ARG HH12 1 1 2 930 1 1 17 ARG HH21 H -2.699 -9.471 -4.051 1.00 . A A . 17 ARG HH21 1 1 2 931 1 1 17 ARG HH22 H -2.719 -9.695 -5.783 1.00 . A A . 17 ARG HH22 1 1 2 932 1 1 17 ARG N N 1.486 -8.821 -0.963 1.00 . A A . 17 ARG N 1 1 2 933 1 1 17 ARG NE N -1.218 -7.444 -4.004 1.00 . A A . 17 ARG NE 1 1 2 934 1 1 17 ARG NH1 N -1.214 -7.744 -6.333 1.00 . A A . 17 ARG NH1 1 1 2 935 1 1 17 ARG NH2 N -2.417 -9.170 -4.975 1.00 . A A . 17 ARG NH2 1 1 2 936 1 1 17 ARG O O 1.036 -11.051 -3.595 1.00 . A A . 17 ARG O 1 1 2 937 1 1 18 PHE C C 3.097 -13.008 -2.486 1.00 . A A . 18 PHE C 1 1 2 938 1 1 18 PHE CA C 3.723 -11.742 -3.071 1.00 . A A . 18 PHE CA 1 1 2 939 1 1 18 PHE CB C 5.206 -11.629 -2.702 1.00 . A A . 18 PHE CB 1 1 2 940 1 1 18 PHE CD1 C 6.201 -13.243 -4.379 1.00 . A A . 18 PHE CD1 1 1 2 941 1 1 18 PHE CD2 C 6.490 -13.702 -2.005 1.00 . A A . 18 PHE CD2 1 1 2 942 1 1 18 PHE CE1 C 6.867 -14.440 -4.691 1.00 . A A . 18 PHE CE1 1 1 2 943 1 1 18 PHE CE2 C 7.164 -14.896 -2.319 1.00 . A A . 18 PHE CE2 1 1 2 944 1 1 18 PHE CG C 6.015 -12.868 -3.035 1.00 . A A . 18 PHE CG 1 1 2 945 1 1 18 PHE CZ C 7.352 -15.265 -3.662 1.00 . A A . 18 PHE CZ 1 1 2 946 1 1 18 PHE H H 3.519 -9.898 -2.040 1.00 . A A . 18 PHE H 1 1 2 947 1 1 18 PHE HA H 3.645 -11.791 -4.159 1.00 . A A . 18 PHE HA 1 1 2 948 1 1 18 PHE HB2 H 5.637 -10.782 -3.238 1.00 . A A . 18 PHE HB2 1 1 2 949 1 1 18 PHE HB3 H 5.290 -11.424 -1.634 1.00 . A A . 18 PHE HB3 1 1 2 950 1 1 18 PHE HD1 H 5.819 -12.621 -5.175 1.00 . A A . 18 PHE HD1 1 1 2 951 1 1 18 PHE HD2 H 6.331 -13.438 -0.969 1.00 . A A . 18 PHE HD2 1 1 2 952 1 1 18 PHE HE1 H 7.002 -14.729 -5.724 1.00 . A A . 18 PHE HE1 1 1 2 953 1 1 18 PHE HE2 H 7.531 -15.532 -1.527 1.00 . A A . 18 PHE HE2 1 1 2 954 1 1 18 PHE HZ H 7.862 -16.186 -3.902 1.00 . A A . 18 PHE HZ 1 1 2 955 1 1 18 PHE N N 3.012 -10.555 -2.620 1.00 . A A . 18 PHE N 1 1 2 956 1 1 18 PHE O O 2.887 -13.978 -3.211 1.00 . A A . 18 PHE O 1 1 2 957 1 1 19 ALA C C 0.772 -14.394 -1.185 1.00 . A A . 19 ALA C 1 1 2 958 1 1 19 ALA CA C 2.104 -14.080 -0.501 1.00 . A A . 19 ALA CA 1 1 2 959 1 1 19 ALA CB C 1.907 -13.732 0.979 1.00 . A A . 19 ALA CB 1 1 2 960 1 1 19 ALA H H 3.002 -12.161 -0.644 1.00 . A A . 19 ALA H 1 1 2 961 1 1 19 ALA HA H 2.739 -14.967 -0.551 1.00 . A A . 19 ALA HA 1 1 2 962 1 1 19 ALA HB1 H 2.875 -13.539 1.444 1.00 . A A . 19 ALA HB1 1 1 2 963 1 1 19 ALA HB2 H 1.278 -12.849 1.083 1.00 . A A . 19 ALA HB2 1 1 2 964 1 1 19 ALA HB3 H 1.432 -14.570 1.490 1.00 . A A . 19 ALA HB3 1 1 2 965 1 1 19 ALA N N 2.787 -12.989 -1.182 1.00 . A A . 19 ALA N 1 1 2 966 1 1 19 ALA O O 0.466 -15.562 -1.415 1.00 . A A . 19 ALA O 1 1 2 967 1 1 20 GLY C C -2.312 -12.520 -1.973 1.00 . A A . 20 GLY C 1 1 2 968 1 1 20 GLY CA C -1.185 -13.473 -2.373 1.00 . A A . 20 GLY CA 1 1 2 969 1 1 20 GLY H H 0.325 -12.418 -1.311 1.00 . A A . 20 GLY H 1 1 2 970 1 1 20 GLY HA2 H -0.902 -13.264 -3.405 1.00 . A A . 20 GLY HA2 1 1 2 971 1 1 20 GLY HA3 H -1.583 -14.486 -2.324 1.00 . A A . 20 GLY HA3 1 1 2 972 1 1 20 GLY N N 0.007 -13.351 -1.541 1.00 . A A . 20 GLY N 1 1 2 973 1 1 20 GLY O O -3.360 -12.532 -2.617 1.00 . A A . 20 GLY O 1 1 2 974 1 1 21 GLY C C -3.528 -9.760 -1.459 1.00 . A A . 21 GLY C 1 1 2 975 1 1 21 GLY CA C -3.162 -10.821 -0.422 1.00 . A A . 21 GLY CA 1 1 2 976 1 1 21 GLY H H -1.232 -11.691 -0.454 1.00 . A A . 21 GLY H 1 1 2 977 1 1 21 GLY HA2 H -4.039 -11.414 -0.162 1.00 . A A . 21 GLY HA2 1 1 2 978 1 1 21 GLY HA3 H -2.799 -10.328 0.480 1.00 . A A . 21 GLY HA3 1 1 2 979 1 1 21 GLY N N -2.126 -11.707 -0.926 1.00 . A A . 21 GLY N 1 1 2 980 1 1 21 GLY O O -2.656 -9.252 -2.160 1.00 . A A . 21 GLY O 1 1 2 981 1 1 22 SER C C -4.751 -7.070 -2.237 1.00 . A A . 22 SER C 1 1 2 982 1 1 22 SER CA C -5.338 -8.454 -2.506 1.00 . A A . 22 SER CA 1 1 2 983 1 1 22 SER CB C -6.865 -8.411 -2.422 1.00 . A A . 22 SER CB 1 1 2 984 1 1 22 SER H H -5.497 -9.905 -0.974 1.00 . A A . 22 SER H 1 1 2 985 1 1 22 SER HA H -5.060 -8.766 -3.514 1.00 . A A . 22 SER HA 1 1 2 986 1 1 22 SER HB2 H -7.168 -8.032 -1.446 1.00 . A A . 22 SER HB2 1 1 2 987 1 1 22 SER HB3 H -7.256 -7.747 -3.194 1.00 . A A . 22 SER HB3 1 1 2 988 1 1 22 SER HG H -8.354 -9.656 -2.576 1.00 . A A . 22 SER HG 1 1 2 989 1 1 22 SER N N -4.823 -9.434 -1.560 1.00 . A A . 22 SER N 1 1 2 990 1 1 22 SER O O -4.340 -6.774 -1.117 1.00 . A A . 22 SER O 1 1 2 991 1 1 22 SER OG O -7.395 -9.705 -2.610 1.00 . A A . 22 SER OG 1 1 2 992 1 1 23 ARG C C -4.584 -4.077 -2.051 1.00 . A A . 23 ARG C 1 1 2 993 1 1 23 ARG CA C -4.080 -4.918 -3.222 1.00 . A A . 23 ARG CA 1 1 2 994 1 1 23 ARG CB C -4.273 -4.170 -4.543 1.00 . A A . 23 ARG CB 1 1 2 995 1 1 23 ARG CD C -3.228 -3.844 -6.810 1.00 . A A . 23 ARG CD 1 1 2 996 1 1 23 ARG CG C -3.545 -4.856 -5.707 1.00 . A A . 23 ARG CG 1 1 2 997 1 1 23 ARG CZ C -1.918 -1.712 -6.902 1.00 . A A . 23 ARG CZ 1 1 2 998 1 1 23 ARG H H -5.091 -6.530 -4.161 1.00 . A A . 23 ARG H 1 1 2 999 1 1 23 ARG HA H -3.012 -5.071 -3.068 1.00 . A A . 23 ARG HA 1 1 2 1000 1 1 23 ARG HB2 H -5.333 -4.076 -4.782 1.00 . A A . 23 ARG HB2 1 1 2 1001 1 1 23 ARG HB3 H -3.868 -3.171 -4.401 1.00 . A A . 23 ARG HB3 1 1 2 1002 1 1 23 ARG HD2 H -2.872 -4.381 -7.688 1.00 . A A . 23 ARG HD2 1 1 2 1003 1 1 23 ARG HD3 H -4.141 -3.301 -7.062 1.00 . A A . 23 ARG HD3 1 1 2 1004 1 1 23 ARG HE H -1.633 -3.198 -5.563 1.00 . A A . 23 ARG HE 1 1 2 1005 1 1 23 ARG HG2 H -2.609 -5.292 -5.365 1.00 . A A . 23 ARG HG2 1 1 2 1006 1 1 23 ARG HG3 H -4.175 -5.649 -6.110 1.00 . A A . 23 ARG HG3 1 1 2 1007 1 1 23 ARG HH11 H -3.331 -1.823 -8.374 1.00 . A A . 23 ARG HH11 1 1 2 1008 1 1 23 ARG HH12 H -2.416 -0.338 -8.335 1.00 . A A . 23 ARG HH12 1 1 2 1009 1 1 23 ARG HH21 H -0.448 -1.307 -5.555 1.00 . A A . 23 ARG HH21 1 1 2 1010 1 1 23 ARG HH22 H -0.767 -0.026 -6.703 1.00 . A A . 23 ARG HH22 1 1 2 1011 1 1 23 ARG N N -4.713 -6.227 -3.275 1.00 . A A . 23 ARG N 1 1 2 1012 1 1 23 ARG NE N -2.176 -2.918 -6.371 1.00 . A A . 23 ARG NE 1 1 2 1013 1 1 23 ARG NH1 N -2.612 -1.253 -7.954 1.00 . A A . 23 ARG NH1 1 1 2 1014 1 1 23 ARG NH2 N -0.956 -0.960 -6.356 1.00 . A A . 23 ARG NH2 1 1 2 1015 1 1 23 ARG O O -3.781 -3.619 -1.247 1.00 . A A . 23 ARG O 1 1 2 1016 1 1 24 GLU C C -6.339 -3.629 0.476 1.00 . A A . 24 GLU C 1 1 2 1017 1 1 24 GLU CA C -6.499 -3.028 -0.926 1.00 . A A . 24 GLU CA 1 1 2 1018 1 1 24 GLU CB C -7.974 -2.774 -1.253 1.00 . A A . 24 GLU CB 1 1 2 1019 1 1 24 GLU CD C -9.567 -1.548 -2.788 1.00 . A A . 24 GLU CD 1 1 2 1020 1 1 24 GLU CG C -8.114 -1.937 -2.532 1.00 . A A . 24 GLU CG 1 1 2 1021 1 1 24 GLU H H -6.507 -4.284 -2.648 1.00 . A A . 24 GLU H 1 1 2 1022 1 1 24 GLU HA H -5.986 -2.064 -0.933 1.00 . A A . 24 GLU HA 1 1 2 1023 1 1 24 GLU HB2 H -8.499 -3.724 -1.367 1.00 . A A . 24 GLU HB2 1 1 2 1024 1 1 24 GLU HB3 H -8.420 -2.227 -0.423 1.00 . A A . 24 GLU HB3 1 1 2 1025 1 1 24 GLU HE2 H -11.321 -2.274 -3.202 1.00 . A A . 24 GLU HE2 1 1 2 1026 1 1 24 GLU HG2 H -7.518 -1.029 -2.434 1.00 . A A . 24 GLU HG2 1 1 2 1027 1 1 24 GLU HG3 H -7.750 -2.502 -3.391 1.00 . A A . 24 GLU HG3 1 1 2 1028 1 1 24 GLU N N -5.900 -3.869 -1.956 1.00 . A A . 24 GLU N 1 1 2 1029 1 1 24 GLU O O -6.168 -2.896 1.448 1.00 . A A . 24 GLU O 1 1 2 1030 1 1 24 GLU OE1 O -9.893 -0.363 -2.746 1.00 . A A . 24 GLU OE1 1 1 2 1031 1 1 24 GLU OE2 O -10.421 -2.575 -3.056 1.00 . A A . 24 GLU OE2 1 1 2 1032 1 1 25 ARG C C -4.743 -5.355 2.354 1.00 . A A . 25 ARG C 1 1 2 1033 1 1 25 ARG CA C -6.161 -5.654 1.852 1.00 . A A . 25 ARG CA 1 1 2 1034 1 1 25 ARG CB C -6.413 -7.157 1.645 1.00 . A A . 25 ARG CB 1 1 2 1035 1 1 25 ARG CD C -5.736 -8.065 3.944 1.00 . A A . 25 ARG CD 1 1 2 1036 1 1 25 ARG CG C -6.854 -7.896 2.913 1.00 . A A . 25 ARG CG 1 1 2 1037 1 1 25 ARG CZ C -5.407 -9.358 6.053 1.00 . A A . 25 ARG CZ 1 1 2 1038 1 1 25 ARG H H -6.530 -5.513 -0.242 1.00 . A A . 25 ARG H 1 1 2 1039 1 1 25 ARG HA H -6.887 -5.273 2.571 1.00 . A A . 25 ARG HA 1 1 2 1040 1 1 25 ARG HB2 H -7.233 -7.263 0.935 1.00 . A A . 25 ARG HB2 1 1 2 1041 1 1 25 ARG HB3 H -5.536 -7.644 1.217 1.00 . A A . 25 ARG HB3 1 1 2 1042 1 1 25 ARG HD2 H -4.848 -8.465 3.453 1.00 . A A . 25 ARG HD2 1 1 2 1043 1 1 25 ARG HD3 H -5.504 -7.100 4.393 1.00 . A A . 25 ARG HD3 1 1 2 1044 1 1 25 ARG HE H -7.091 -9.367 4.917 1.00 . A A . 25 ARG HE 1 1 2 1045 1 1 25 ARG HG2 H -7.696 -7.375 3.371 1.00 . A A . 25 ARG HG2 1 1 2 1046 1 1 25 ARG HG3 H -7.189 -8.889 2.609 1.00 . A A . 25 ARG HG3 1 1 2 1047 1 1 25 ARG HH11 H -3.787 -8.229 5.533 1.00 . A A . 25 ARG HH11 1 1 2 1048 1 1 25 ARG HH12 H -3.600 -9.165 6.994 1.00 . A A . 25 ARG HH12 1 1 2 1049 1 1 25 ARG HH21 H -6.839 -10.583 6.842 1.00 . A A . 25 ARG HH21 1 1 2 1050 1 1 25 ARG HH22 H -5.348 -10.508 7.744 1.00 . A A . 25 ARG HH22 1 1 2 1051 1 1 25 ARG N N -6.379 -4.961 0.589 1.00 . A A . 25 ARG N 1 1 2 1052 1 1 25 ARG NE N -6.160 -8.986 5.005 1.00 . A A . 25 ARG NE 1 1 2 1053 1 1 25 ARG NH1 N -4.165 -8.879 6.207 1.00 . A A . 25 ARG NH1 1 1 2 1054 1 1 25 ARG NH2 N -5.904 -10.218 6.952 1.00 . A A . 25 ARG NH2 1 1 2 1055 1 1 25 ARG O O -4.558 -4.899 3.483 1.00 . A A . 25 ARG O 1 1 2 1056 1 1 26 CYS C C -2.132 -3.784 2.016 1.00 . A A . 26 CYS C 1 1 2 1057 1 1 26 CYS CA C -2.352 -5.274 1.750 1.00 . A A . 26 CYS CA 1 1 2 1058 1 1 26 CYS CB C -1.479 -5.754 0.587 1.00 . A A . 26 CYS CB 1 1 2 1059 1 1 26 CYS H H -3.985 -5.945 0.573 1.00 . A A . 26 CYS H 1 1 2 1060 1 1 26 CYS HA H -2.053 -5.818 2.645 1.00 . A A . 26 CYS HA 1 1 2 1061 1 1 26 CYS HB2 H -1.782 -5.244 -0.327 1.00 . A A . 26 CYS HB2 1 1 2 1062 1 1 26 CYS HB3 H -0.448 -5.477 0.799 1.00 . A A . 26 CYS HB3 1 1 2 1063 1 1 26 CYS N N -3.751 -5.575 1.485 1.00 . A A . 26 CYS N 1 1 2 1064 1 1 26 CYS O O -1.307 -3.439 2.855 1.00 . A A . 26 CYS O 1 1 2 1065 1 1 26 CYS SG S -1.517 -7.539 0.279 1.00 . A A . 26 CYS SG 1 1 2 1066 1 1 27 ALA C C -3.119 -1.132 2.981 1.00 . A A . 27 ALA C 1 1 2 1067 1 1 27 ALA CA C -2.824 -1.463 1.523 1.00 . A A . 27 ALA CA 1 1 2 1068 1 1 27 ALA CB C -3.845 -0.773 0.612 1.00 . A A . 27 ALA CB 1 1 2 1069 1 1 27 ALA H H -3.502 -3.262 0.619 1.00 . A A . 27 ALA H 1 1 2 1070 1 1 27 ALA HA H -1.828 -1.099 1.265 1.00 . A A . 27 ALA HA 1 1 2 1071 1 1 27 ALA HB1 H -4.859 -0.937 0.964 1.00 . A A . 27 ALA HB1 1 1 2 1072 1 1 27 ALA HB2 H -3.671 0.299 0.607 1.00 . A A . 27 ALA HB2 1 1 2 1073 1 1 27 ALA HB3 H -3.759 -1.157 -0.402 1.00 . A A . 27 ALA HB3 1 1 2 1074 1 1 27 ALA N N -2.866 -2.907 1.320 1.00 . A A . 27 ALA N 1 1 2 1075 1 1 27 ALA O O -2.343 -0.432 3.626 1.00 . A A . 27 ALA O 1 1 2 1076 1 1 28 LYS C C -3.570 -2.014 5.836 1.00 . A A . 28 LYS C 1 1 2 1077 1 1 28 LYS CA C -4.645 -1.484 4.881 1.00 . A A . 28 LYS CA 1 1 2 1078 1 1 28 LYS CB C -5.987 -2.202 5.082 1.00 . A A . 28 LYS CB 1 1 2 1079 1 1 28 LYS CD C -6.556 -1.205 7.359 1.00 . A A . 28 LYS CD 1 1 2 1080 1 1 28 LYS CE C -7.652 -0.471 8.142 1.00 . A A . 28 LYS CE 1 1 2 1081 1 1 28 LYS CG C -6.987 -1.380 5.899 1.00 . A A . 28 LYS CG 1 1 2 1082 1 1 28 LYS H H -4.836 -2.214 2.906 1.00 . A A . 28 LYS H 1 1 2 1083 1 1 28 LYS HA H -4.777 -0.413 5.046 1.00 . A A . 28 LYS HA 1 1 2 1084 1 1 28 LYS HB2 H -6.448 -2.370 4.110 1.00 . A A . 28 LYS HB2 1 1 2 1085 1 1 28 LYS HB3 H -5.837 -3.178 5.546 1.00 . A A . 28 LYS HB3 1 1 2 1086 1 1 28 LYS HD2 H -6.382 -2.186 7.803 1.00 . A A . 28 LYS HD2 1 1 2 1087 1 1 28 LYS HD3 H -5.636 -0.623 7.405 1.00 . A A . 28 LYS HD3 1 1 2 1088 1 1 28 LYS HE2 H -7.808 0.517 7.707 1.00 . A A . 28 LYS HE2 1 1 2 1089 1 1 28 LYS HE3 H -8.583 -1.034 8.079 1.00 . A A . 28 LYS HE3 1 1 2 1090 1 1 28 LYS HG2 H -7.124 -0.403 5.430 1.00 . A A . 28 LYS HG2 1 1 2 1091 1 1 28 LYS HG3 H -7.935 -1.913 5.863 1.00 . A A . 28 LYS HG3 1 1 2 1092 1 1 28 LYS HZ1 H -6.426 0.205 9.641 1.00 . A A . 28 LYS HZ1 1 1 2 1093 1 1 28 LYS HZ2 H -8.024 0.192 10.041 1.00 . A A . 28 LYS HZ2 1 1 2 1094 1 1 28 LYS HZ3 H -7.178 -1.221 9.988 1.00 . A A . 28 LYS HZ3 1 1 2 1095 1 1 28 LYS N N -4.231 -1.661 3.500 1.00 . A A . 28 LYS N 1 1 2 1096 1 1 28 LYS NZ N -7.291 -0.312 9.562 1.00 . A A . 28 LYS NZ 1 1 2 1097 1 1 28 LYS O O -3.133 -1.295 6.733 1.00 . A A . 28 LYS O 1 1 2 1098 1 1 29 LEU C C -0.844 -3.155 6.536 1.00 . A A . 29 LEU C 1 1 2 1099 1 1 29 LEU CA C -2.148 -3.956 6.440 1.00 . A A . 29 LEU CA 1 1 2 1100 1 1 29 LEU CB C -1.898 -5.347 5.837 1.00 . A A . 29 LEU CB 1 1 2 1101 1 1 29 LEU CD1 C -1.353 -6.545 8.016 1.00 . A A . 29 LEU CD1 1 1 2 1102 1 1 29 LEU CD2 C -0.603 -7.493 5.827 1.00 . A A . 29 LEU CD2 1 1 2 1103 1 1 29 LEU CG C -0.871 -6.200 6.603 1.00 . A A . 29 LEU CG 1 1 2 1104 1 1 29 LEU H H -3.560 -3.785 4.860 1.00 . A A . 29 LEU H 1 1 2 1105 1 1 29 LEU HA H -2.563 -4.072 7.440 1.00 . A A . 29 LEU HA 1 1 2 1106 1 1 29 LEU HB2 H -2.843 -5.889 5.786 1.00 . A A . 29 LEU HB2 1 1 2 1107 1 1 29 LEU HB3 H -1.529 -5.213 4.822 1.00 . A A . 29 LEU HB3 1 1 2 1108 1 1 29 LEU HD11 H -1.384 -5.646 8.631 1.00 . A A . 29 LEU HD11 1 1 2 1109 1 1 29 LEU HD12 H -2.347 -6.991 7.974 1.00 . A A . 29 LEU HD12 1 1 2 1110 1 1 29 LEU HD13 H -0.664 -7.253 8.476 1.00 . A A . 29 LEU HD13 1 1 2 1111 1 1 29 LEU HD21 H -1.507 -8.101 5.775 1.00 . A A . 29 LEU HD21 1 1 2 1112 1 1 29 LEU HD22 H -0.276 -7.251 4.816 1.00 . A A . 29 LEU HD22 1 1 2 1113 1 1 29 LEU HD23 H 0.183 -8.066 6.321 1.00 . A A . 29 LEU HD23 1 1 2 1114 1 1 29 LEU HG H 0.076 -5.665 6.673 1.00 . A A . 29 LEU HG 1 1 2 1115 1 1 29 LEU N N -3.145 -3.267 5.625 1.00 . A A . 29 LEU N 1 1 2 1116 1 1 29 LEU O O -0.257 -3.054 7.611 1.00 . A A . 29 LEU O 1 1 2 1117 1 1 30 SER C C 0.746 -0.460 5.860 1.00 . A A . 30 SER C 1 1 2 1118 1 1 30 SER CA C 0.869 -1.877 5.302 1.00 . A A . 30 SER CA 1 1 2 1119 1 1 30 SER CB C 1.318 -1.837 3.840 1.00 . A A . 30 SER CB 1 1 2 1120 1 1 30 SER H H -0.957 -2.691 4.573 1.00 . A A . 30 SER H 1 1 2 1121 1 1 30 SER HA H 1.637 -2.401 5.872 1.00 . A A . 30 SER HA 1 1 2 1122 1 1 30 SER HB2 H 2.257 -1.289 3.776 1.00 . A A . 30 SER HB2 1 1 2 1123 1 1 30 SER HB3 H 1.472 -2.852 3.472 1.00 . A A . 30 SER HB3 1 1 2 1124 1 1 30 SER HG H -0.452 -1.703 3.040 1.00 . A A . 30 SER HG 1 1 2 1125 1 1 30 SER N N -0.390 -2.604 5.406 1.00 . A A . 30 SER N 1 1 2 1126 1 1 30 SER O O 1.682 0.048 6.474 1.00 . A A . 30 SER O 1 1 2 1127 1 1 30 SER OG O 0.360 -1.186 3.033 1.00 . A A . 30 SER OG 1 1 2 1128 1 1 31 GLY C C -0.545 2.409 4.543 1.00 . A A . 31 GLY C 1 1 2 1129 1 1 31 GLY CA C -0.626 1.595 5.837 1.00 . A A . 31 GLY CA 1 1 2 1130 1 1 31 GLY H H -1.108 -0.307 5.069 1.00 . A A . 31 GLY H 1 1 2 1131 1 1 31 GLY HA2 H -1.627 1.711 6.254 1.00 . A A . 31 GLY HA2 1 1 2 1132 1 1 31 GLY HA3 H 0.092 1.995 6.554 1.00 . A A . 31 GLY HA3 1 1 2 1133 1 1 31 GLY N N -0.396 0.182 5.595 1.00 . A A . 31 GLY N 1 1 2 1134 1 1 31 GLY O O -0.769 3.615 4.593 1.00 . A A . 31 GLY O 1 1 2 1135 1 1 32 CYS C C -1.614 2.752 1.601 1.00 . A A . 32 CYS C 1 1 2 1136 1 1 32 CYS CA C -0.198 2.462 2.104 1.00 . A A . 32 CYS CA 1 1 2 1137 1 1 32 CYS CB C 0.561 1.610 1.075 1.00 . A A . 32 CYS CB 1 1 2 1138 1 1 32 CYS H H -0.082 0.782 3.397 1.00 . A A . 32 CYS H 1 1 2 1139 1 1 32 CYS HA H 0.326 3.408 2.237 1.00 . A A . 32 CYS HA 1 1 2 1140 1 1 32 CYS HB2 H -0.066 0.770 0.784 1.00 . A A . 32 CYS HB2 1 1 2 1141 1 1 32 CYS HB3 H 0.716 2.201 0.174 1.00 . A A . 32 CYS HB3 1 1 2 1142 1 1 32 CYS N N -0.243 1.782 3.394 1.00 . A A . 32 CYS N 1 1 2 1143 1 1 32 CYS O O -2.554 2.046 1.956 1.00 . A A . 32 CYS O 1 1 2 1144 1 1 32 CYS SG S 2.164 0.946 1.612 1.00 . A A . 32 CYS SG 1 1 2 1145 1 1 33 LYS C C -2.885 3.681 -1.356 1.00 . A A . 33 LYS C 1 1 2 1146 1 1 33 LYS CA C -2.987 4.161 0.089 1.00 . A A . 33 LYS CA 1 1 2 1147 1 1 33 LYS CB C -3.188 5.683 0.088 1.00 . A A . 33 LYS CB 1 1 2 1148 1 1 33 LYS CD C -4.090 5.964 2.514 1.00 . A A . 33 LYS CD 1 1 2 1149 1 1 33 LYS CE C -3.634 4.739 3.315 1.00 . A A . 33 LYS CE 1 1 2 1150 1 1 33 LYS CG C -3.069 6.380 1.444 1.00 . A A . 33 LYS CG 1 1 2 1151 1 1 33 LYS H H -0.930 4.316 0.523 1.00 . A A . 33 LYS H 1 1 2 1152 1 1 33 LYS HA H -3.850 3.701 0.572 1.00 . A A . 33 LYS HA 1 1 2 1153 1 1 33 LYS HB2 H -2.431 6.139 -0.554 1.00 . A A . 33 LYS HB2 1 1 2 1154 1 1 33 LYS HB3 H -4.167 5.905 -0.340 1.00 . A A . 33 LYS HB3 1 1 2 1155 1 1 33 LYS HD2 H -4.188 6.807 3.200 1.00 . A A . 33 LYS HD2 1 1 2 1156 1 1 33 LYS HD3 H -5.063 5.778 2.059 1.00 . A A . 33 LYS HD3 1 1 2 1157 1 1 33 LYS HE2 H -4.081 3.840 2.896 1.00 . A A . 33 LYS HE2 1 1 2 1158 1 1 33 LYS HE3 H -2.551 4.666 3.274 1.00 . A A . 33 LYS HE3 1 1 2 1159 1 1 33 LYS HG2 H -2.052 6.260 1.813 1.00 . A A . 33 LYS HG2 1 1 2 1160 1 1 33 LYS HG3 H -3.227 7.439 1.245 1.00 . A A . 33 LYS HG3 1 1 2 1161 1 1 33 LYS HZ1 H -3.548 5.635 5.153 1.00 . A A . 33 LYS HZ1 1 1 2 1162 1 1 33 LYS HZ2 H -4.999 4.898 4.839 1.00 . A A . 33 LYS HZ2 1 1 2 1163 1 1 33 LYS HZ3 H -3.670 3.994 5.213 1.00 . A A . 33 LYS HZ3 1 1 2 1164 1 1 33 LYS N N -1.755 3.790 0.769 1.00 . A A . 33 LYS N 1 1 2 1165 1 1 33 LYS NZ N -3.996 4.825 4.741 1.00 . A A . 33 LYS NZ 1 1 2 1166 1 1 33 LYS O O -2.033 4.164 -2.102 1.00 . A A . 33 LYS O 1 1 2 1167 1 1 34 ILE C C -5.174 2.701 -3.695 1.00 . A A . 34 ILE C 1 1 2 1168 1 1 34 ILE CA C -3.849 2.234 -3.098 1.00 . A A . 34 ILE CA 1 1 2 1169 1 1 34 ILE CB C -3.736 0.703 -3.099 1.00 . A A . 34 ILE CB 1 1 2 1170 1 1 34 ILE CD1 C -1.140 0.646 -2.920 1.00 . A A . 34 ILE CD1 1 1 2 1171 1 1 34 ILE CG1 C -2.487 0.199 -2.355 1.00 . A A . 34 ILE CG1 1 1 2 1172 1 1 34 ILE CG2 C -3.771 0.172 -4.539 1.00 . A A . 34 ILE CG2 1 1 2 1173 1 1 34 ILE H H -4.405 2.377 -1.061 1.00 . A A . 34 ILE H 1 1 2 1174 1 1 34 ILE HA H -3.039 2.623 -3.714 1.00 . A A . 34 ILE HA 1 1 2 1175 1 1 34 ILE HB H -4.598 0.288 -2.571 1.00 . A A . 34 ILE HB 1 1 2 1176 1 1 34 ILE HD11 H -1.027 1.719 -2.798 1.00 . A A . 34 ILE HD11 1 1 2 1177 1 1 34 ILE HD12 H -0.345 0.154 -2.361 1.00 . A A . 34 ILE HD12 1 1 2 1178 1 1 34 ILE HD13 H -1.052 0.373 -3.968 1.00 . A A . 34 ILE HD13 1 1 2 1179 1 1 34 ILE HG12 H -2.513 0.532 -1.320 1.00 . A A . 34 ILE HG12 1 1 2 1180 1 1 34 ILE HG13 H -2.524 -0.885 -2.361 1.00 . A A . 34 ILE HG13 1 1 2 1181 1 1 34 ILE HG21 H -2.999 0.647 -5.139 1.00 . A A . 34 ILE HG21 1 1 2 1182 1 1 34 ILE HG22 H -3.613 -0.904 -4.535 1.00 . A A . 34 ILE HG22 1 1 2 1183 1 1 34 ILE HG23 H -4.739 0.375 -4.997 1.00 . A A . 34 ILE HG23 1 1 2 1184 1 1 34 ILE N N -3.757 2.744 -1.742 1.00 . A A . 34 ILE N 1 1 2 1185 1 1 34 ILE O O -6.229 2.161 -3.363 1.00 . A A . 34 ILE O 1 1 2 1186 1 1 35 ILE C C -5.762 4.363 -6.818 1.00 . A A . 35 ILE C 1 1 2 1187 1 1 35 ILE CA C -6.227 4.180 -5.372 1.00 . A A . 35 ILE CA 1 1 2 1188 1 1 35 ILE CB C -6.817 5.472 -4.771 1.00 . A A . 35 ILE CB 1 1 2 1189 1 1 35 ILE CD1 C -6.393 7.908 -4.147 1.00 . A A . 35 ILE CD1 1 1 2 1190 1 1 35 ILE CG1 C -5.783 6.611 -4.687 1.00 . A A . 35 ILE CG1 1 1 2 1191 1 1 35 ILE CG2 C -7.431 5.175 -3.394 1.00 . A A . 35 ILE CG2 1 1 2 1192 1 1 35 ILE H H -4.203 4.100 -4.796 1.00 . A A . 35 ILE H 1 1 2 1193 1 1 35 ILE HA H -7.011 3.420 -5.381 1.00 . A A . 35 ILE HA 1 1 2 1194 1 1 35 ILE HB H -7.627 5.797 -5.426 1.00 . A A . 35 ILE HB 1 1 2 1195 1 1 35 ILE HD11 H -6.656 7.798 -3.095 1.00 . A A . 35 ILE HD11 1 1 2 1196 1 1 35 ILE HD12 H -5.668 8.715 -4.234 1.00 . A A . 35 ILE HD12 1 1 2 1197 1 1 35 ILE HD13 H -7.281 8.166 -4.723 1.00 . A A . 35 ILE HD13 1 1 2 1198 1 1 35 ILE HG12 H -4.948 6.325 -4.047 1.00 . A A . 35 ILE HG12 1 1 2 1199 1 1 35 ILE HG13 H -5.405 6.821 -5.686 1.00 . A A . 35 ILE HG13 1 1 2 1200 1 1 35 ILE HG21 H -8.062 4.289 -3.453 1.00 . A A . 35 ILE HG21 1 1 2 1201 1 1 35 ILE HG22 H -6.648 5.007 -2.653 1.00 . A A . 35 ILE HG22 1 1 2 1202 1 1 35 ILE HG23 H -8.054 6.007 -3.069 1.00 . A A . 35 ILE HG23 1 1 2 1203 1 1 35 ILE N N -5.105 3.699 -4.585 1.00 . A A . 35 ILE N 1 1 2 1204 1 1 35 ILE O O -4.622 4.765 -7.062 1.00 . A A . 35 ILE O 1 1 2 1205 1 1 36 SER C C -6.817 5.493 -9.771 1.00 . A A . 36 SER C 1 1 2 1206 1 1 36 SER CA C -6.385 4.135 -9.203 1.00 . A A . 36 SER CA 1 1 2 1207 1 1 36 SER CB C -7.102 2.967 -9.891 1.00 . A A . 36 SER CB 1 1 2 1208 1 1 36 SER H H -7.564 3.719 -7.501 1.00 . A A . 36 SER H 1 1 2 1209 1 1 36 SER HA H -5.316 4.018 -9.392 1.00 . A A . 36 SER HA 1 1 2 1210 1 1 36 SER HB2 H -6.925 2.992 -10.968 1.00 . A A . 36 SER HB2 1 1 2 1211 1 1 36 SER HB3 H -6.716 2.026 -9.499 1.00 . A A . 36 SER HB3 1 1 2 1212 1 1 36 SER HG H -8.845 3.820 -10.049 1.00 . A A . 36 SER HG 1 1 2 1213 1 1 36 SER N N -6.648 4.054 -7.772 1.00 . A A . 36 SER N 1 1 2 1214 1 1 36 SER O O -7.185 5.581 -10.941 1.00 . A A . 36 SER O 1 1 2 1215 1 1 36 SER OG O -8.491 3.029 -9.637 1.00 . A A . 36 SER OG 1 1 2 1216 1 1 37 ALA C C -5.864 8.649 -9.945 1.00 . A A . 37 ALA C 1 1 2 1217 1 1 37 ALA CA C -7.078 7.919 -9.358 1.00 . A A . 37 ALA CA 1 1 2 1218 1 1 37 ALA CB C -7.615 8.664 -8.131 1.00 . A A . 37 ALA CB 1 1 2 1219 1 1 37 ALA H H -6.441 6.419 -8.006 1.00 . A A . 37 ALA H 1 1 2 1220 1 1 37 ALA HA H -7.869 7.906 -10.108 1.00 . A A . 37 ALA HA 1 1 2 1221 1 1 37 ALA HB1 H -6.841 8.729 -7.365 1.00 . A A . 37 ALA HB1 1 1 2 1222 1 1 37 ALA HB2 H -7.928 9.670 -8.408 1.00 . A A . 37 ALA HB2 1 1 2 1223 1 1 37 ALA HB3 H -8.476 8.132 -7.725 1.00 . A A . 37 ALA HB3 1 1 2 1224 1 1 37 ALA N N -6.752 6.555 -8.957 1.00 . A A . 37 ALA N 1 1 2 1225 1 1 37 ALA O O -5.921 9.862 -10.143 1.00 . A A . 37 ALA O 1 1 2 1226 1 1 38 SER C C -3.025 9.618 -9.620 1.00 . A A . 38 SER C 1 1 2 1227 1 1 38 SER CA C -3.460 8.483 -10.562 1.00 . A A . 38 SER CA 1 1 2 1228 1 1 38 SER CB C -3.490 8.894 -12.038 1.00 . A A . 38 SER CB 1 1 2 1229 1 1 38 SER H H -4.792 6.933 -10.064 1.00 . A A . 38 SER H 1 1 2 1230 1 1 38 SER HA H -2.737 7.674 -10.469 1.00 . A A . 38 SER HA 1 1 2 1231 1 1 38 SER HB2 H -3.861 8.062 -12.638 1.00 . A A . 38 SER HB2 1 1 2 1232 1 1 38 SER HB3 H -4.155 9.747 -12.168 1.00 . A A . 38 SER HB3 1 1 2 1233 1 1 38 SER HG H -1.856 9.932 -11.928 1.00 . A A . 38 SER HG 1 1 2 1234 1 1 38 SER N N -4.754 7.932 -10.183 1.00 . A A . 38 SER N 1 1 2 1235 1 1 38 SER O O -2.352 10.557 -10.041 1.00 . A A . 38 SER O 1 1 2 1236 1 1 38 SER OG O -2.193 9.224 -12.485 1.00 . A A . 38 SER OG 1 1 2 1237 1 1 39 THR C C -3.163 9.836 -5.963 1.00 . A A . 39 THR C 1 1 2 1238 1 1 39 THR CA C -3.253 10.547 -7.319 1.00 . A A . 39 THR CA 1 1 2 1239 1 1 39 THR CB C -4.445 11.529 -7.373 1.00 . A A . 39 THR CB 1 1 2 1240 1 1 39 THR CG2 C -4.274 12.736 -6.443 1.00 . A A . 39 THR CG2 1 1 2 1241 1 1 39 THR H H -3.968 8.720 -8.069 1.00 . A A . 39 THR H 1 1 2 1242 1 1 39 THR HA H -2.325 11.092 -7.498 1.00 . A A . 39 THR HA 1 1 2 1243 1 1 39 THR HB H -5.358 11.004 -7.092 1.00 . A A . 39 THR HB 1 1 2 1244 1 1 39 THR HG1 H -4.951 11.320 -9.244 1.00 . A A . 39 THR HG1 1 1 2 1245 1 1 39 THR HG21 H -5.024 13.490 -6.686 1.00 . A A . 39 THR HG21 1 1 2 1246 1 1 39 THR HG22 H -4.415 12.445 -5.402 1.00 . A A . 39 THR HG22 1 1 2 1247 1 1 39 THR HG23 H -3.283 13.175 -6.570 1.00 . A A . 39 THR HG23 1 1 2 1248 1 1 39 THR N N -3.426 9.526 -8.344 1.00 . A A . 39 THR N 1 1 2 1249 1 1 39 THR O O -3.497 8.655 -5.866 1.00 . A A . 39 THR O 1 1 2 1250 1 1 39 THR OG1 O -4.617 12.027 -8.684 1.00 . A A . 39 THR OG1 1 1 2 1251 1 1 40 CYS C C -2.958 11.311 -2.640 1.00 . A A . 40 CYS C 1 1 2 1252 1 1 40 CYS CA C -2.701 10.095 -3.540 1.00 . A A . 40 CYS CA 1 1 2 1253 1 1 40 CYS CB C -1.331 9.499 -3.191 1.00 . A A . 40 CYS CB 1 1 2 1254 1 1 40 CYS H H -2.419 11.502 -5.078 1.00 . A A . 40 CYS H 1 1 2 1255 1 1 40 CYS HA H -3.478 9.346 -3.397 1.00 . A A . 40 CYS HA 1 1 2 1256 1 1 40 CYS HB2 H -0.567 10.241 -3.427 1.00 . A A . 40 CYS HB2 1 1 2 1257 1 1 40 CYS HB3 H -1.292 9.312 -2.118 1.00 . A A . 40 CYS HB3 1 1 2 1258 1 1 40 CYS N N -2.701 10.544 -4.927 1.00 . A A . 40 CYS N 1 1 2 1259 1 1 40 CYS O O -2.596 12.423 -3.026 1.00 . A A . 40 CYS O 1 1 2 1260 1 1 40 CYS SG S -0.882 7.953 -4.022 1.00 . A A . 40 CYS SG 1 1 2 1261 1 1 41 PRO C C -2.034 12.372 0.021 1.00 . A A . 41 PRO C 1 1 2 1262 1 1 41 PRO CA C -3.492 12.151 -0.397 1.00 . A A . 41 PRO CA 1 1 2 1263 1 1 41 PRO CB C -4.349 11.604 0.747 1.00 . A A . 41 PRO CB 1 1 2 1264 1 1 41 PRO CD C -4.091 9.892 -0.919 1.00 . A A . 41 PRO CD 1 1 2 1265 1 1 41 PRO CG C -4.216 10.091 0.592 1.00 . A A . 41 PRO CG 1 1 2 1266 1 1 41 PRO HA H -3.930 13.082 -0.762 1.00 . A A . 41 PRO HA 1 1 2 1267 1 1 41 PRO HB2 H -4.015 11.949 1.726 1.00 . A A . 41 PRO HB2 1 1 2 1268 1 1 41 PRO HB3 H -5.391 11.886 0.586 1.00 . A A . 41 PRO HB3 1 1 2 1269 1 1 41 PRO HD2 H -3.464 9.025 -1.123 1.00 . A A . 41 PRO HD2 1 1 2 1270 1 1 41 PRO HD3 H -5.081 9.751 -1.355 1.00 . A A . 41 PRO HD3 1 1 2 1271 1 1 41 PRO HG2 H -3.294 9.772 1.076 1.00 . A A . 41 PRO HG2 1 1 2 1272 1 1 41 PRO HG3 H -5.067 9.553 1.012 1.00 . A A . 41 PRO HG3 1 1 2 1273 1 1 41 PRO N N -3.522 11.129 -1.433 1.00 . A A . 41 PRO N 1 1 2 1274 1 1 41 PRO O O -1.284 11.409 0.175 1.00 . A A . 41 PRO O 1 1 2 1275 1 1 42 SER C C 0.194 13.776 1.824 1.00 . A A . 42 SER C 1 1 2 1276 1 1 42 SER CA C -0.230 14.025 0.369 1.00 . A A . 42 SER CA 1 1 2 1277 1 1 42 SER CB C -0.025 15.483 -0.066 1.00 . A A . 42 SER CB 1 1 2 1278 1 1 42 SER H H -2.291 14.382 0.002 1.00 . A A . 42 SER H 1 1 2 1279 1 1 42 SER HA H 0.401 13.411 -0.276 1.00 . A A . 42 SER HA 1 1 2 1280 1 1 42 SER HB2 H -0.418 15.620 -1.074 1.00 . A A . 42 SER HB2 1 1 2 1281 1 1 42 SER HB3 H -0.546 16.160 0.612 1.00 . A A . 42 SER HB3 1 1 2 1282 1 1 42 SER HG H 1.457 16.705 -0.384 1.00 . A A . 42 SER HG 1 1 2 1283 1 1 42 SER N N -1.619 13.641 0.138 1.00 . A A . 42 SER N 1 1 2 1284 1 1 42 SER O O 0.432 14.720 2.575 1.00 . A A . 42 SER O 1 1 2 1285 1 1 42 SER OG O 1.353 15.798 -0.086 1.00 . A A . 42 SER OG 1 1 2 1286 1 1 43 ASP C C 1.464 10.742 3.486 1.00 . A A . 43 ASP C 1 1 2 1287 1 1 43 ASP CA C 0.690 12.066 3.554 1.00 . A A . 43 ASP CA 1 1 2 1288 1 1 43 ASP CB C -0.563 11.901 4.432 1.00 . A A . 43 ASP CB 1 1 2 1289 1 1 43 ASP CG C -1.382 13.180 4.542 1.00 . A A . 43 ASP CG 1 1 2 1290 1 1 43 ASP H H 0.031 11.780 1.555 1.00 . A A . 43 ASP H 1 1 2 1291 1 1 43 ASP HA H 1.348 12.811 4.006 1.00 . A A . 43 ASP HA 1 1 2 1292 1 1 43 ASP HB2 H -1.195 11.121 4.004 1.00 . A A . 43 ASP HB2 1 1 2 1293 1 1 43 ASP HB3 H -0.271 11.595 5.438 1.00 . A A . 43 ASP HB3 1 1 2 1294 1 1 43 ASP HD2 H -1.459 14.906 5.431 1.00 . A A . 43 ASP HD2 1 1 2 1295 1 1 43 ASP N N 0.289 12.500 2.218 1.00 . A A . 43 ASP N 1 1 2 1296 1 1 43 ASP O O 1.551 10.035 4.489 1.00 . A A . 43 ASP O 1 1 2 1297 1 1 43 ASP OD1 O -2.393 13.311 3.854 1.00 . A A . 43 ASP OD1 1 1 2 1298 1 1 43 ASP OD2 O -0.918 14.113 5.420 1.00 . A A . 43 ASP OD2 1 1 2 1299 1 1 44 TYR C C 3.775 9.250 1.085 1.00 . A A . 44 TYR C 1 1 2 1300 1 1 44 TYR CA C 2.593 9.082 2.041 1.00 . A A . 44 TYR CA 1 1 2 1301 1 1 44 TYR CB C 1.514 8.152 1.473 1.00 . A A . 44 TYR CB 1 1 2 1302 1 1 44 TYR CD1 C 0.665 6.909 3.496 1.00 . A A . 44 TYR CD1 1 1 2 1303 1 1 44 TYR CD2 C -0.762 8.603 2.501 1.00 . A A . 44 TYR CD2 1 1 2 1304 1 1 44 TYR CE1 C -0.283 6.696 4.509 1.00 . A A . 44 TYR CE1 1 1 2 1305 1 1 44 TYR CE2 C -1.701 8.411 3.531 1.00 . A A . 44 TYR CE2 1 1 2 1306 1 1 44 TYR CG C 0.417 7.837 2.472 1.00 . A A . 44 TYR CG 1 1 2 1307 1 1 44 TYR CZ C -1.474 7.440 4.522 1.00 . A A . 44 TYR CZ 1 1 2 1308 1 1 44 TYR H H 1.933 11.025 1.529 1.00 . A A . 44 TYR H 1 1 2 1309 1 1 44 TYR HA H 2.956 8.631 2.963 1.00 . A A . 44 TYR HA 1 1 2 1310 1 1 44 TYR HB2 H 1.076 8.601 0.582 1.00 . A A . 44 TYR HB2 1 1 2 1311 1 1 44 TYR HB3 H 1.979 7.213 1.174 1.00 . A A . 44 TYR HB3 1 1 2 1312 1 1 44 TYR HD1 H 1.603 6.388 3.521 1.00 . A A . 44 TYR HD1 1 1 2 1313 1 1 44 TYR HD2 H -0.939 9.351 1.744 1.00 . A A . 44 TYR HD2 1 1 2 1314 1 1 44 TYR HE1 H -0.078 5.974 5.287 1.00 . A A . 44 TYR HE1 1 1 2 1315 1 1 44 TYR HE2 H -2.606 8.997 3.544 1.00 . A A . 44 TYR HE2 1 1 2 1316 1 1 44 TYR HH H -3.098 7.882 5.504 1.00 . A A . 44 TYR HH 1 1 2 1317 1 1 44 TYR N N 1.999 10.386 2.309 1.00 . A A . 44 TYR N 1 1 2 1318 1 1 44 TYR O O 3.633 9.012 -0.113 1.00 . A A . 44 TYR O 1 1 2 1319 1 1 44 TYR OH O -2.410 7.213 5.488 1.00 . A A . 44 TYR OH 1 1 2 1320 1 1 45 PRO C C 7.003 8.954 0.399 1.00 . A A . 45 PRO C 1 1 2 1321 1 1 45 PRO CA C 6.061 10.113 0.766 1.00 . A A . 45 PRO CA 1 1 2 1322 1 1 45 PRO CB C 6.754 11.183 1.620 1.00 . A A . 45 PRO CB 1 1 2 1323 1 1 45 PRO CD C 5.163 10.056 2.985 1.00 . A A . 45 PRO CD 1 1 2 1324 1 1 45 PRO CG C 6.572 10.641 3.037 1.00 . A A . 45 PRO CG 1 1 2 1325 1 1 45 PRO HA H 5.704 10.574 -0.157 1.00 . A A . 45 PRO HA 1 1 2 1326 1 1 45 PRO HB2 H 7.800 11.354 1.368 1.00 . A A . 45 PRO HB2 1 1 2 1327 1 1 45 PRO HB3 H 6.201 12.120 1.529 1.00 . A A . 45 PRO HB3 1 1 2 1328 1 1 45 PRO HD2 H 5.086 9.199 3.655 1.00 . A A . 45 PRO HD2 1 1 2 1329 1 1 45 PRO HD3 H 4.455 10.828 3.283 1.00 . A A . 45 PRO HD3 1 1 2 1330 1 1 45 PRO HG2 H 7.291 9.844 3.224 1.00 . A A . 45 PRO HG2 1 1 2 1331 1 1 45 PRO HG3 H 6.668 11.420 3.795 1.00 . A A . 45 PRO HG3 1 1 2 1332 1 1 45 PRO N N 4.941 9.684 1.593 1.00 . A A . 45 PRO N 1 1 2 1333 1 1 45 PRO O O 8.219 9.136 0.396 1.00 . A A . 45 PRO O 1 1 2 1334 1 1 46 LYS C C 6.406 5.803 -1.392 1.00 . A A . 46 LYS C 1 1 2 1335 1 1 46 LYS CA C 7.218 6.615 -0.384 1.00 . A A . 46 LYS CA 1 1 2 1336 1 1 46 LYS CB C 7.629 5.740 0.814 1.00 . A A . 46 LYS CB 1 1 2 1337 1 1 46 LYS CD C 10.130 6.422 0.892 1.00 . A A . 46 LYS CD 1 1 2 1338 1 1 46 LYS CE C 10.311 6.977 2.312 1.00 . A A . 46 LYS CE 1 1 2 1339 1 1 46 LYS CG C 9.094 5.296 0.734 1.00 . A A . 46 LYS CG 1 1 2 1340 1 1 46 LYS H H 5.469 7.640 0.155 1.00 . A A . 46 LYS H 1 1 2 1341 1 1 46 LYS HA H 8.096 6.962 -0.929 1.00 . A A . 46 LYS HA 1 1 2 1342 1 1 46 LYS HB2 H 7.445 6.261 1.748 1.00 . A A . 46 LYS HB2 1 1 2 1343 1 1 46 LYS HB3 H 7.009 4.844 0.833 1.00 . A A . 46 LYS HB3 1 1 2 1344 1 1 46 LYS HD2 H 11.087 5.985 0.603 1.00 . A A . 46 LYS HD2 1 1 2 1345 1 1 46 LYS HD3 H 9.940 7.241 0.202 1.00 . A A . 46 LYS HD3 1 1 2 1346 1 1 46 LYS HE2 H 10.470 6.162 3.017 1.00 . A A . 46 LYS HE2 1 1 2 1347 1 1 46 LYS HE3 H 11.199 7.605 2.292 1.00 . A A . 46 LYS HE3 1 1 2 1348 1 1 46 LYS HG2 H 9.282 4.534 1.489 1.00 . A A . 46 LYS HG2 1 1 2 1349 1 1 46 LYS HG3 H 9.245 4.830 -0.243 1.00 . A A . 46 LYS HG3 1 1 2 1350 1 1 46 LYS HZ1 H 8.954 8.483 2.039 1.00 . A A . 46 LYS HZ1 1 1 2 1351 1 1 46 LYS HZ2 H 8.395 7.281 3.026 1.00 . A A . 46 LYS HZ2 1 1 2 1352 1 1 46 LYS HZ3 H 9.501 8.351 3.588 1.00 . A A . 46 LYS HZ3 1 1 2 1353 1 1 46 LYS N N 6.463 7.772 0.079 1.00 . A A . 46 LYS N 1 1 2 1354 1 1 46 LYS NZ N 9.203 7.833 2.774 1.00 . A A . 46 LYS NZ 1 1 2 1355 1 1 46 LYS O O 5.190 6.066 -1.533 1.00 . A A . 46 LYS O 1 1 2 1356 1 1 46 LYS OXT O 7.011 4.901 -2.006 1.00 . A A . 46 LYS OXT 1 1 3 1357 1 1 1 LYS C C -1.529 3.257 -6.265 1.00 . A A . 1 LYS C 1 1 3 1358 1 1 1 LYS CA C -1.758 3.466 -7.761 1.00 . A A . 1 LYS CA 1 1 3 1359 1 1 1 LYS CB C -1.393 4.888 -8.207 1.00 . A A . 1 LYS CB 1 1 3 1360 1 1 1 LYS CD C 0.570 6.367 -8.862 1.00 . A A . 1 LYS CD 1 1 3 1361 1 1 1 LYS CE C -0.048 7.713 -8.470 1.00 . A A . 1 LYS CE 1 1 3 1362 1 1 1 LYS CG C 0.090 5.210 -7.973 1.00 . A A . 1 LYS CG 1 1 3 1363 1 1 1 LYS H1 H -3.297 3.294 -9.107 1.00 . A A . 1 LYS H1 1 1 3 1364 1 1 1 LYS H2 H -3.362 2.199 -7.870 1.00 . A A . 1 LYS H2 1 1 3 1365 1 1 1 LYS H3 H -3.763 3.773 -7.597 1.00 . A A . 1 LYS H3 1 1 3 1366 1 1 1 LYS HA H -1.131 2.767 -8.318 1.00 . A A . 1 LYS HA 1 1 3 1367 1 1 1 LYS HB2 H -1.604 4.962 -9.274 1.00 . A A . 1 LYS HB2 1 1 3 1368 1 1 1 LYS HB3 H -2.017 5.609 -7.676 1.00 . A A . 1 LYS HB3 1 1 3 1369 1 1 1 LYS HD2 H 1.655 6.446 -8.775 1.00 . A A . 1 LYS HD2 1 1 3 1370 1 1 1 LYS HD3 H 0.329 6.139 -9.901 1.00 . A A . 1 LYS HD3 1 1 3 1371 1 1 1 LYS HE2 H -1.136 7.639 -8.455 1.00 . A A . 1 LYS HE2 1 1 3 1372 1 1 1 LYS HE3 H 0.301 7.990 -7.474 1.00 . A A . 1 LYS HE3 1 1 3 1373 1 1 1 LYS HG2 H 0.258 5.451 -6.923 1.00 . A A . 1 LYS HG2 1 1 3 1374 1 1 1 LYS HG3 H 0.690 4.334 -8.224 1.00 . A A . 1 LYS HG3 1 1 3 1375 1 1 1 LYS HZ1 H -0.061 8.579 -10.329 1.00 . A A . 1 LYS HZ1 1 1 3 1376 1 1 1 LYS HZ2 H -0.022 9.665 -9.101 1.00 . A A . 1 LYS HZ2 1 1 3 1377 1 1 1 LYS HZ3 H 1.340 8.826 -9.496 1.00 . A A . 1 LYS HZ3 1 1 3 1378 1 1 1 LYS N N -3.152 3.156 -8.117 1.00 . A A . 1 LYS N 1 1 3 1379 1 1 1 LYS NZ N 0.335 8.775 -9.420 1.00 . A A . 1 LYS NZ 1 1 3 1380 1 1 1 LYS O O -2.325 3.728 -5.452 1.00 . A A . 1 LYS O 1 1 3 1381 1 1 2 SER C C 0.838 3.255 -3.997 1.00 . A A . 2 SER C 1 1 3 1382 1 1 2 SER CA C -0.108 2.189 -4.550 1.00 . A A . 2 SER CA 1 1 3 1383 1 1 2 SER CB C 0.573 0.816 -4.521 1.00 . A A . 2 SER CB 1 1 3 1384 1 1 2 SER H H 0.157 2.195 -6.647 1.00 . A A . 2 SER H 1 1 3 1385 1 1 2 SER HA H -1.019 2.138 -3.954 1.00 . A A . 2 SER HA 1 1 3 1386 1 1 2 SER HB2 H 1.511 0.858 -5.074 1.00 . A A . 2 SER HB2 1 1 3 1387 1 1 2 SER HB3 H 0.784 0.539 -3.486 1.00 . A A . 2 SER HB3 1 1 3 1388 1 1 2 SER HG H -0.419 0.065 -6.020 1.00 . A A . 2 SER HG 1 1 3 1389 1 1 2 SER N N -0.460 2.529 -5.920 1.00 . A A . 2 SER N 1 1 3 1390 1 1 2 SER O O 1.845 3.554 -4.638 1.00 . A A . 2 SER O 1 1 3 1391 1 1 2 SER OG O -0.255 -0.168 -5.104 1.00 . A A . 2 SER OG 1 1 3 1392 1 1 3 CYS C C 1.375 4.699 -0.713 1.00 . A A . 3 CYS C 1 1 3 1393 1 1 3 CYS CA C 1.271 4.919 -2.219 1.00 . A A . 3 CYS CA 1 1 3 1394 1 1 3 CYS CB C 0.586 6.241 -2.549 1.00 . A A . 3 CYS CB 1 1 3 1395 1 1 3 CYS H H -0.331 3.523 -2.360 1.00 . A A . 3 CYS H 1 1 3 1396 1 1 3 CYS HA H 2.281 4.962 -2.626 1.00 . A A . 3 CYS HA 1 1 3 1397 1 1 3 CYS HB2 H -0.468 6.168 -2.279 1.00 . A A . 3 CYS HB2 1 1 3 1398 1 1 3 CYS HB3 H 1.039 7.040 -1.962 1.00 . A A . 3 CYS HB3 1 1 3 1399 1 1 3 CYS N N 0.518 3.823 -2.828 1.00 . A A . 3 CYS N 1 1 3 1400 1 1 3 CYS O O 0.361 4.502 -0.053 1.00 . A A . 3 CYS O 1 1 3 1401 1 1 3 CYS SG S 0.722 6.696 -4.296 1.00 . A A . 3 CYS SG 1 1 3 1402 1 1 4 CYS C C 3.497 5.244 2.063 1.00 . A A . 4 CYS C 1 1 3 1403 1 1 4 CYS CA C 2.936 4.166 1.132 1.00 . A A . 4 CYS CA 1 1 3 1404 1 1 4 CYS CB C 3.943 3.029 0.944 1.00 . A A . 4 CYS CB 1 1 3 1405 1 1 4 CYS H H 3.376 5.019 -0.755 1.00 . A A . 4 CYS H 1 1 3 1406 1 1 4 CYS HA H 2.040 3.751 1.582 1.00 . A A . 4 CYS HA 1 1 3 1407 1 1 4 CYS HB2 H 4.750 3.396 0.312 1.00 . A A . 4 CYS HB2 1 1 3 1408 1 1 4 CYS HB3 H 4.383 2.751 1.901 1.00 . A A . 4 CYS HB3 1 1 3 1409 1 1 4 CYS N N 2.602 4.701 -0.183 1.00 . A A . 4 CYS N 1 1 3 1410 1 1 4 CYS O O 4.061 6.233 1.595 1.00 . A A . 4 CYS O 1 1 3 1411 1 1 4 CYS SG S 3.254 1.521 0.208 1.00 . A A . 4 CYS SG 1 1 3 1412 1 1 5 PRO C C 5.346 6.051 4.453 1.00 . A A . 5 PRO C 1 1 3 1413 1 1 5 PRO CA C 3.816 6.008 4.388 1.00 . A A . 5 PRO CA 1 1 3 1414 1 1 5 PRO CB C 3.209 5.530 5.712 1.00 . A A . 5 PRO CB 1 1 3 1415 1 1 5 PRO CD C 2.682 3.937 4.036 1.00 . A A . 5 PRO CD 1 1 3 1416 1 1 5 PRO CG C 3.058 4.024 5.511 1.00 . A A . 5 PRO CG 1 1 3 1417 1 1 5 PRO HA H 3.439 7.008 4.177 1.00 . A A . 5 PRO HA 1 1 3 1418 1 1 5 PRO HB2 H 3.821 5.784 6.576 1.00 . A A . 5 PRO HB2 1 1 3 1419 1 1 5 PRO HB3 H 2.215 5.964 5.829 1.00 . A A . 5 PRO HB3 1 1 3 1420 1 1 5 PRO HD2 H 2.983 2.973 3.634 1.00 . A A . 5 PRO HD2 1 1 3 1421 1 1 5 PRO HD3 H 1.603 4.043 3.947 1.00 . A A . 5 PRO HD3 1 1 3 1422 1 1 5 PRO HG2 H 4.015 3.526 5.674 1.00 . A A . 5 PRO HG2 1 1 3 1423 1 1 5 PRO HG3 H 2.296 3.589 6.159 1.00 . A A . 5 PRO HG3 1 1 3 1424 1 1 5 PRO N N 3.347 5.062 3.388 1.00 . A A . 5 PRO N 1 1 3 1425 1 1 5 PRO O O 5.916 7.115 4.685 1.00 . A A . 5 PRO O 1 1 3 1426 1 1 6 ASN C C 7.941 3.428 3.936 1.00 . A A . 6 ASN C 1 1 3 1427 1 1 6 ASN CA C 7.434 4.743 4.531 1.00 . A A . 6 ASN CA 1 1 3 1428 1 1 6 ASN CB C 7.721 4.835 6.039 1.00 . A A . 6 ASN CB 1 1 3 1429 1 1 6 ASN CG C 6.940 3.793 6.837 1.00 . A A . 6 ASN CG 1 1 3 1430 1 1 6 ASN H H 5.494 4.066 4.029 1.00 . A A . 6 ASN H 1 1 3 1431 1 1 6 ASN HA H 7.970 5.553 4.036 1.00 . A A . 6 ASN HA 1 1 3 1432 1 1 6 ASN HB2 H 8.786 4.685 6.224 1.00 . A A . 6 ASN HB2 1 1 3 1433 1 1 6 ASN HB3 H 7.467 5.832 6.400 1.00 . A A . 6 ASN HB3 1 1 3 1434 1 1 6 ASN HD21 H 5.640 5.202 7.517 1.00 . A A . 6 ASN HD21 1 1 3 1435 1 1 6 ASN HD22 H 5.317 3.566 8.045 1.00 . A A . 6 ASN HD22 1 1 3 1436 1 1 6 ASN N N 6.007 4.899 4.283 1.00 . A A . 6 ASN N 1 1 3 1437 1 1 6 ASN ND2 N 5.883 4.222 7.528 1.00 . A A . 6 ASN ND2 1 1 3 1438 1 1 6 ASN O O 7.171 2.645 3.381 1.00 . A A . 6 ASN O 1 1 3 1439 1 1 6 ASN OD1 O 7.287 2.617 6.824 1.00 . A A . 6 ASN OD1 1 1 3 1440 1 1 7 THR C C 9.480 0.741 4.120 1.00 . A A . 7 THR C 1 1 3 1441 1 1 7 THR CA C 9.960 2.057 3.498 1.00 . A A . 7 THR CA 1 1 3 1442 1 1 7 THR CB C 11.471 2.255 3.693 1.00 . A A . 7 THR CB 1 1 3 1443 1 1 7 THR CG2 C 12.278 1.197 2.933 1.00 . A A . 7 THR CG2 1 1 3 1444 1 1 7 THR H H 9.825 3.894 4.518 1.00 . A A . 7 THR H 1 1 3 1445 1 1 7 THR HA H 9.760 2.026 2.425 1.00 . A A . 7 THR HA 1 1 3 1446 1 1 7 THR HB H 11.709 2.190 4.755 1.00 . A A . 7 THR HB 1 1 3 1447 1 1 7 THR HG1 H 12.777 3.661 3.398 1.00 . A A . 7 THR HG1 1 1 3 1448 1 1 7 THR HG21 H 12.029 1.229 1.872 1.00 . A A . 7 THR HG21 1 1 3 1449 1 1 7 THR HG22 H 13.344 1.394 3.054 1.00 . A A . 7 THR HG22 1 1 3 1450 1 1 7 THR HG23 H 12.066 0.201 3.321 1.00 . A A . 7 THR HG23 1 1 3 1451 1 1 7 THR N N 9.256 3.205 4.049 1.00 . A A . 7 THR N 1 1 3 1452 1 1 7 THR O O 9.380 -0.262 3.418 1.00 . A A . 7 THR O 1 1 3 1453 1 1 7 THR OG1 O 11.840 3.540 3.227 1.00 . A A . 7 THR OG1 1 1 3 1454 1 1 8 THR C C 7.234 -0.754 5.570 1.00 . A A . 8 THR C 1 1 3 1455 1 1 8 THR CA C 8.645 -0.457 6.084 1.00 . A A . 8 THR CA 1 1 3 1456 1 1 8 THR CB C 8.684 -0.301 7.611 1.00 . A A . 8 THR CB 1 1 3 1457 1 1 8 THR CG2 C 8.465 -1.655 8.295 1.00 . A A . 8 THR CG2 1 1 3 1458 1 1 8 THR H H 9.251 1.580 5.967 1.00 . A A . 8 THR H 1 1 3 1459 1 1 8 THR HA H 9.295 -1.295 5.829 1.00 . A A . 8 THR HA 1 1 3 1460 1 1 8 THR HB H 7.906 0.390 7.936 1.00 . A A . 8 THR HB 1 1 3 1461 1 1 8 THR HG1 H 10.623 -0.403 7.729 1.00 . A A . 8 THR HG1 1 1 3 1462 1 1 8 THR HG21 H 8.514 -1.530 9.378 1.00 . A A . 8 THR HG21 1 1 3 1463 1 1 8 THR HG22 H 7.487 -2.056 8.033 1.00 . A A . 8 THR HG22 1 1 3 1464 1 1 8 THR HG23 H 9.233 -2.365 7.986 1.00 . A A . 8 THR HG23 1 1 3 1465 1 1 8 THR N N 9.175 0.731 5.424 1.00 . A A . 8 THR N 1 1 3 1466 1 1 8 THR O O 6.891 -1.912 5.353 1.00 . A A . 8 THR O 1 1 3 1467 1 1 8 THR OG1 O 9.939 0.211 8.007 1.00 . A A . 8 THR OG1 1 1 3 1468 1 1 9 GLY C C 5.280 -0.495 3.319 1.00 . A A . 9 GLY C 1 1 3 1469 1 1 9 GLY CA C 5.140 0.183 4.680 1.00 . A A . 9 GLY CA 1 1 3 1470 1 1 9 GLY H H 6.770 1.221 5.555 1.00 . A A . 9 GLY H 1 1 3 1471 1 1 9 GLY HA2 H 4.462 -0.391 5.311 1.00 . A A . 9 GLY HA2 1 1 3 1472 1 1 9 GLY HA3 H 4.730 1.180 4.537 1.00 . A A . 9 GLY HA3 1 1 3 1473 1 1 9 GLY N N 6.433 0.293 5.333 1.00 . A A . 9 GLY N 1 1 3 1474 1 1 9 GLY O O 4.610 -1.492 3.059 1.00 . A A . 9 GLY O 1 1 3 1475 1 1 10 ARG C C 6.865 -2.071 1.352 1.00 . A A . 10 ARG C 1 1 3 1476 1 1 10 ARG CA C 6.491 -0.600 1.185 1.00 . A A . 10 ARG CA 1 1 3 1477 1 1 10 ARG CB C 7.629 0.151 0.479 1.00 . A A . 10 ARG CB 1 1 3 1478 1 1 10 ARG CD C 6.418 1.159 -1.496 1.00 . A A . 10 ARG CD 1 1 3 1479 1 1 10 ARG CG C 7.165 1.446 -0.189 1.00 . A A . 10 ARG CG 1 1 3 1480 1 1 10 ARG CZ C 4.855 2.443 -2.961 1.00 . A A . 10 ARG CZ 1 1 3 1481 1 1 10 ARG H H 6.683 0.852 2.736 1.00 . A A . 10 ARG H 1 1 3 1482 1 1 10 ARG HA H 5.592 -0.570 0.575 1.00 . A A . 10 ARG HA 1 1 3 1483 1 1 10 ARG HB2 H 8.404 0.394 1.204 1.00 . A A . 10 ARG HB2 1 1 3 1484 1 1 10 ARG HB3 H 8.074 -0.487 -0.286 1.00 . A A . 10 ARG HB3 1 1 3 1485 1 1 10 ARG HD2 H 7.110 0.709 -2.210 1.00 . A A . 10 ARG HD2 1 1 3 1486 1 1 10 ARG HD3 H 5.608 0.458 -1.309 1.00 . A A . 10 ARG HD3 1 1 3 1487 1 1 10 ARG HE H 6.304 3.265 -1.817 1.00 . A A . 10 ARG HE 1 1 3 1488 1 1 10 ARG HG2 H 6.544 2.007 0.507 1.00 . A A . 10 ARG HG2 1 1 3 1489 1 1 10 ARG HG3 H 8.051 2.034 -0.425 1.00 . A A . 10 ARG HG3 1 1 3 1490 1 1 10 ARG HH11 H 4.599 0.423 -3.121 1.00 . A A . 10 ARG HH11 1 1 3 1491 1 1 10 ARG HH12 H 3.505 1.394 -4.074 1.00 . A A . 10 ARG HH12 1 1 3 1492 1 1 10 ARG HH21 H 4.854 4.477 -3.027 1.00 . A A . 10 ARG HH21 1 1 3 1493 1 1 10 ARG HH22 H 3.656 3.704 -4.045 1.00 . A A . 10 ARG HH22 1 1 3 1494 1 1 10 ARG N N 6.175 0.019 2.466 1.00 . A A . 10 ARG N 1 1 3 1495 1 1 10 ARG NE N 5.870 2.389 -2.081 1.00 . A A . 10 ARG NE 1 1 3 1496 1 1 10 ARG NH1 N 4.267 1.328 -3.415 1.00 . A A . 10 ARG NH1 1 1 3 1497 1 1 10 ARG NH2 N 4.426 3.632 -3.392 1.00 . A A . 10 ARG NH2 1 1 3 1498 1 1 10 ARG O O 6.326 -2.917 0.646 1.00 . A A . 10 ARG O 1 1 3 1499 1 1 11 ASN C C 7.060 -4.664 2.851 1.00 . A A . 11 ASN C 1 1 3 1500 1 1 11 ASN CA C 8.234 -3.737 2.522 1.00 . A A . 11 ASN CA 1 1 3 1501 1 1 11 ASN CB C 9.296 -3.731 3.628 1.00 . A A . 11 ASN CB 1 1 3 1502 1 1 11 ASN CG C 9.710 -5.141 4.036 1.00 . A A . 11 ASN CG 1 1 3 1503 1 1 11 ASN H H 8.181 -1.634 2.832 1.00 . A A . 11 ASN H 1 1 3 1504 1 1 11 ASN HA H 8.702 -4.107 1.606 1.00 . A A . 11 ASN HA 1 1 3 1505 1 1 11 ASN HB2 H 10.179 -3.201 3.273 1.00 . A A . 11 ASN HB2 1 1 3 1506 1 1 11 ASN HB3 H 8.915 -3.210 4.504 1.00 . A A . 11 ASN HB3 1 1 3 1507 1 1 11 ASN HD21 H 8.559 -5.048 5.716 1.00 . A A . 11 ASN HD21 1 1 3 1508 1 1 11 ASN HD22 H 9.464 -6.530 5.499 1.00 . A A . 11 ASN HD22 1 1 3 1509 1 1 11 ASN N N 7.777 -2.378 2.279 1.00 . A A . 11 ASN N 1 1 3 1510 1 1 11 ASN ND2 N 9.197 -5.612 5.175 1.00 . A A . 11 ASN ND2 1 1 3 1511 1 1 11 ASN O O 6.914 -5.702 2.210 1.00 . A A . 11 ASN O 1 1 3 1512 1 1 11 ASN OD1 O 10.486 -5.791 3.341 1.00 . A A . 11 ASN OD1 1 1 3 1513 1 1 12 ILE C C 4.101 -5.287 3.068 1.00 . A A . 12 ILE C 1 1 3 1514 1 1 12 ILE CA C 5.071 -5.095 4.239 1.00 . A A . 12 ILE CA 1 1 3 1515 1 1 12 ILE CB C 4.385 -4.463 5.467 1.00 . A A . 12 ILE CB 1 1 3 1516 1 1 12 ILE CD1 C 4.903 -3.532 7.790 1.00 . A A . 12 ILE CD1 1 1 3 1517 1 1 12 ILE CG1 C 5.344 -4.484 6.673 1.00 . A A . 12 ILE CG1 1 1 3 1518 1 1 12 ILE CG2 C 3.099 -5.230 5.822 1.00 . A A . 12 ILE CG2 1 1 3 1519 1 1 12 ILE H H 6.359 -3.402 4.287 1.00 . A A . 12 ILE H 1 1 3 1520 1 1 12 ILE HA H 5.441 -6.080 4.534 1.00 . A A . 12 ILE HA 1 1 3 1521 1 1 12 ILE HB H 4.128 -3.430 5.231 1.00 . A A . 12 ILE HB 1 1 3 1522 1 1 12 ILE HD11 H 3.946 -3.836 8.212 1.00 . A A . 12 ILE HD11 1 1 3 1523 1 1 12 ILE HD12 H 5.649 -3.549 8.586 1.00 . A A . 12 ILE HD12 1 1 3 1524 1 1 12 ILE HD13 H 4.822 -2.516 7.403 1.00 . A A . 12 ILE HD13 1 1 3 1525 1 1 12 ILE HG12 H 5.414 -5.498 7.064 1.00 . A A . 12 ILE HG12 1 1 3 1526 1 1 12 ILE HG13 H 6.346 -4.178 6.371 1.00 . A A . 12 ILE HG13 1 1 3 1527 1 1 12 ILE HG21 H 2.360 -5.136 5.028 1.00 . A A . 12 ILE HG21 1 1 3 1528 1 1 12 ILE HG22 H 3.323 -6.285 5.974 1.00 . A A . 12 ILE HG22 1 1 3 1529 1 1 12 ILE HG23 H 2.653 -4.832 6.732 1.00 . A A . 12 ILE HG23 1 1 3 1530 1 1 12 ILE N N 6.214 -4.289 3.820 1.00 . A A . 12 ILE N 1 1 3 1531 1 1 12 ILE O O 3.633 -6.401 2.831 1.00 . A A . 12 ILE O 1 1 3 1532 1 1 13 TYR C C 3.405 -5.229 0.140 1.00 . A A . 13 TYR C 1 1 3 1533 1 1 13 TYR CA C 2.916 -4.228 1.188 1.00 . A A . 13 TYR CA 1 1 3 1534 1 1 13 TYR CB C 2.803 -2.816 0.600 1.00 . A A . 13 TYR CB 1 1 3 1535 1 1 13 TYR CD1 C 0.509 -2.969 -0.440 1.00 . A A . 13 TYR CD1 1 1 3 1536 1 1 13 TYR CD2 C 2.403 -2.455 -1.881 1.00 . A A . 13 TYR CD2 1 1 3 1537 1 1 13 TYR CE1 C -0.343 -2.963 -1.554 1.00 . A A . 13 TYR CE1 1 1 3 1538 1 1 13 TYR CE2 C 1.545 -2.415 -2.993 1.00 . A A . 13 TYR CE2 1 1 3 1539 1 1 13 TYR CG C 1.885 -2.723 -0.600 1.00 . A A . 13 TYR CG 1 1 3 1540 1 1 13 TYR CZ C 0.172 -2.675 -2.830 1.00 . A A . 13 TYR CZ 1 1 3 1541 1 1 13 TYR H H 4.229 -3.320 2.582 1.00 . A A . 13 TYR H 1 1 3 1542 1 1 13 TYR HA H 1.930 -4.540 1.535 1.00 . A A . 13 TYR HA 1 1 3 1543 1 1 13 TYR HB2 H 2.412 -2.152 1.370 1.00 . A A . 13 TYR HB2 1 1 3 1544 1 1 13 TYR HB3 H 3.792 -2.455 0.324 1.00 . A A . 13 TYR HB3 1 1 3 1545 1 1 13 TYR HD1 H 0.111 -3.175 0.540 1.00 . A A . 13 TYR HD1 1 1 3 1546 1 1 13 TYR HD2 H 3.461 -2.292 -2.024 1.00 . A A . 13 TYR HD2 1 1 3 1547 1 1 13 TYR HE1 H -1.394 -3.171 -1.427 1.00 . A A . 13 TYR HE1 1 1 3 1548 1 1 13 TYR HE2 H 1.942 -2.208 -3.976 1.00 . A A . 13 TYR HE2 1 1 3 1549 1 1 13 TYR HH H -0.281 -2.196 -4.661 1.00 . A A . 13 TYR HH 1 1 3 1550 1 1 13 TYR N N 3.806 -4.206 2.337 1.00 . A A . 13 TYR N 1 1 3 1551 1 1 13 TYR O O 2.648 -6.101 -0.278 1.00 . A A . 13 TYR O 1 1 3 1552 1 1 13 TYR OH O -0.662 -2.657 -3.907 1.00 . A A . 13 TYR OH 1 1 3 1553 1 1 14 ASN C C 5.356 -7.419 -0.793 1.00 . A A . 14 ASN C 1 1 3 1554 1 1 14 ASN CA C 5.295 -5.963 -1.262 1.00 . A A . 14 ASN CA 1 1 3 1555 1 1 14 ASN CB C 6.681 -5.419 -1.629 1.00 . A A . 14 ASN CB 1 1 3 1556 1 1 14 ASN CG C 6.587 -4.295 -2.660 1.00 . A A . 14 ASN CG 1 1 3 1557 1 1 14 ASN H H 5.238 -4.376 0.144 1.00 . A A . 14 ASN H 1 1 3 1558 1 1 14 ASN HA H 4.681 -5.939 -2.163 1.00 . A A . 14 ASN HA 1 1 3 1559 1 1 14 ASN HB2 H 7.209 -5.079 -0.737 1.00 . A A . 14 ASN HB2 1 1 3 1560 1 1 14 ASN HB3 H 7.271 -6.216 -2.076 1.00 . A A . 14 ASN HB3 1 1 3 1561 1 1 14 ASN HD21 H 6.181 -2.906 -1.228 1.00 . A A . 14 ASN HD21 1 1 3 1562 1 1 14 ASN HD22 H 6.244 -2.312 -2.878 1.00 . A A . 14 ASN HD22 1 1 3 1563 1 1 14 ASN N N 4.671 -5.105 -0.267 1.00 . A A . 14 ASN N 1 1 3 1564 1 1 14 ASN ND2 N 6.309 -3.070 -2.217 1.00 . A A . 14 ASN ND2 1 1 3 1565 1 1 14 ASN O O 5.128 -8.321 -1.596 1.00 . A A . 14 ASN O 1 1 3 1566 1 1 14 ASN OD1 O 6.756 -4.532 -3.853 1.00 . A A . 14 ASN OD1 1 1 3 1567 1 1 15 THR C C 4.245 -9.639 0.903 1.00 . A A . 15 THR C 1 1 3 1568 1 1 15 THR CA C 5.625 -9.000 1.075 1.00 . A A . 15 THR CA 1 1 3 1569 1 1 15 THR CB C 6.037 -8.944 2.557 1.00 . A A . 15 THR CB 1 1 3 1570 1 1 15 THR CG2 C 5.984 -10.327 3.213 1.00 . A A . 15 THR CG2 1 1 3 1571 1 1 15 THR H H 5.823 -6.881 1.113 1.00 . A A . 15 THR H 1 1 3 1572 1 1 15 THR HA H 6.353 -9.610 0.539 1.00 . A A . 15 THR HA 1 1 3 1573 1 1 15 THR HB H 5.366 -8.281 3.106 1.00 . A A . 15 THR HB 1 1 3 1574 1 1 15 THR HG1 H 7.370 -7.537 2.363 1.00 . A A . 15 THR HG1 1 1 3 1575 1 1 15 THR HG21 H 6.593 -11.033 2.648 1.00 . A A . 15 THR HG21 1 1 3 1576 1 1 15 THR HG22 H 6.369 -10.261 4.231 1.00 . A A . 15 THR HG22 1 1 3 1577 1 1 15 THR HG23 H 4.957 -10.689 3.257 1.00 . A A . 15 THR HG23 1 1 3 1578 1 1 15 THR N N 5.634 -7.659 0.496 1.00 . A A . 15 THR N 1 1 3 1579 1 1 15 THR O O 4.135 -10.764 0.421 1.00 . A A . 15 THR O 1 1 3 1580 1 1 15 THR OG1 O 7.355 -8.448 2.670 1.00 . A A . 15 THR OG1 1 1 3 1581 1 1 16 CYS C C 1.367 -9.592 -0.217 1.00 . A A . 16 CYS C 1 1 3 1582 1 1 16 CYS CA C 1.817 -9.368 1.232 1.00 . A A . 16 CYS CA 1 1 3 1583 1 1 16 CYS CB C 0.953 -8.354 1.987 1.00 . A A . 16 CYS CB 1 1 3 1584 1 1 16 CYS H H 3.366 -7.989 1.677 1.00 . A A . 16 CYS H 1 1 3 1585 1 1 16 CYS HA H 1.744 -10.323 1.756 1.00 . A A . 16 CYS HA 1 1 3 1586 1 1 16 CYS HB2 H 1.323 -8.319 3.012 1.00 . A A . 16 CYS HB2 1 1 3 1587 1 1 16 CYS HB3 H 1.088 -7.363 1.554 1.00 . A A . 16 CYS HB3 1 1 3 1588 1 1 16 CYS N N 3.196 -8.913 1.297 1.00 . A A . 16 CYS N 1 1 3 1589 1 1 16 CYS O O 0.667 -10.562 -0.502 1.00 . A A . 16 CYS O 1 1 3 1590 1 1 16 CYS SG S -0.820 -8.706 2.080 1.00 . A A . 16 CYS SG 1 1 3 1591 1 1 17 ARG C C 2.186 -10.114 -3.128 1.00 . A A . 17 ARG C 1 1 3 1592 1 1 17 ARG CA C 1.526 -8.852 -2.561 1.00 . A A . 17 ARG CA 1 1 3 1593 1 1 17 ARG CB C 1.990 -7.589 -3.301 1.00 . A A . 17 ARG CB 1 1 3 1594 1 1 17 ARG CD C 0.148 -5.962 -4.088 1.00 . A A . 17 ARG CD 1 1 3 1595 1 1 17 ARG CG C 1.113 -6.370 -2.963 1.00 . A A . 17 ARG CG 1 1 3 1596 1 1 17 ARG CZ C -1.516 -7.825 -4.160 1.00 . A A . 17 ARG CZ 1 1 3 1597 1 1 17 ARG H H 2.341 -7.924 -0.832 1.00 . A A . 17 ARG H 1 1 3 1598 1 1 17 ARG HA H 0.453 -8.966 -2.698 1.00 . A A . 17 ARG HA 1 1 3 1599 1 1 17 ARG HB2 H 3.017 -7.377 -3.006 1.00 . A A . 17 ARG HB2 1 1 3 1600 1 1 17 ARG HB3 H 1.988 -7.764 -4.378 1.00 . A A . 17 ARG HB3 1 1 3 1601 1 1 17 ARG HD2 H -0.592 -5.269 -3.691 1.00 . A A . 17 ARG HD2 1 1 3 1602 1 1 17 ARG HD3 H 0.715 -5.445 -4.862 1.00 . A A . 17 ARG HD3 1 1 3 1603 1 1 17 ARG HE H -0.249 -7.321 -5.661 1.00 . A A . 17 ARG HE 1 1 3 1604 1 1 17 ARG HG2 H 0.554 -6.552 -2.047 1.00 . A A . 17 ARG HG2 1 1 3 1605 1 1 17 ARG HG3 H 1.767 -5.516 -2.782 1.00 . A A . 17 ARG HG3 1 1 3 1606 1 1 17 ARG HH11 H -1.466 -6.866 -2.356 1.00 . A A . 17 ARG HH11 1 1 3 1607 1 1 17 ARG HH12 H -2.596 -8.195 -2.475 1.00 . A A . 17 ARG HH12 1 1 3 1608 1 1 17 ARG HH21 H -1.864 -8.962 -5.825 1.00 . A A . 17 ARG HH21 1 1 3 1609 1 1 17 ARG HH22 H -2.806 -9.378 -4.412 1.00 . A A . 17 ARG HH22 1 1 3 1610 1 1 17 ARG N N 1.790 -8.716 -1.135 1.00 . A A . 17 ARG N 1 1 3 1611 1 1 17 ARG NE N -0.539 -7.096 -4.720 1.00 . A A . 17 ARG NE 1 1 3 1612 1 1 17 ARG NH1 N -1.897 -7.600 -2.898 1.00 . A A . 17 ARG NH1 1 1 3 1613 1 1 17 ARG NH2 N -2.115 -8.793 -4.864 1.00 . A A . 17 ARG NH2 1 1 3 1614 1 1 17 ARG O O 1.548 -10.840 -3.888 1.00 . A A . 17 ARG O 1 1 3 1615 1 1 18 PHE C C 3.489 -12.840 -2.646 1.00 . A A . 18 PHE C 1 1 3 1616 1 1 18 PHE CA C 4.171 -11.576 -3.172 1.00 . A A . 18 PHE CA 1 1 3 1617 1 1 18 PHE CB C 5.629 -11.503 -2.698 1.00 . A A . 18 PHE CB 1 1 3 1618 1 1 18 PHE CD1 C 6.925 -13.107 -4.171 1.00 . A A . 18 PHE CD1 1 1 3 1619 1 1 18 PHE CD2 C 6.496 -13.731 -1.857 1.00 . A A . 18 PHE CD2 1 1 3 1620 1 1 18 PHE CE1 C 7.559 -14.345 -4.385 1.00 . A A . 18 PHE CE1 1 1 3 1621 1 1 18 PHE CE2 C 7.115 -14.973 -2.075 1.00 . A A . 18 PHE CE2 1 1 3 1622 1 1 18 PHE CG C 6.405 -12.791 -2.902 1.00 . A A . 18 PHE CG 1 1 3 1623 1 1 18 PHE CZ C 7.651 -15.279 -3.338 1.00 . A A . 18 PHE CZ 1 1 3 1624 1 1 18 PHE H H 3.914 -9.748 -2.119 1.00 . A A . 18 PHE H 1 1 3 1625 1 1 18 PHE HA H 4.176 -11.620 -4.263 1.00 . A A . 18 PHE HA 1 1 3 1626 1 1 18 PHE HB2 H 6.131 -10.696 -3.232 1.00 . A A . 18 PHE HB2 1 1 3 1627 1 1 18 PHE HB3 H 5.647 -11.256 -1.636 1.00 . A A . 18 PHE HB3 1 1 3 1628 1 1 18 PHE HD1 H 6.826 -12.410 -4.988 1.00 . A A . 18 PHE HD1 1 1 3 1629 1 1 18 PHE HD2 H 6.064 -13.515 -0.890 1.00 . A A . 18 PHE HD2 1 1 3 1630 1 1 18 PHE HE1 H 7.966 -14.582 -5.357 1.00 . A A . 18 PHE HE1 1 1 3 1631 1 1 18 PHE HE2 H 7.172 -15.697 -1.274 1.00 . A A . 18 PHE HE2 1 1 3 1632 1 1 18 PHE HZ H 8.123 -16.235 -3.508 1.00 . A A . 18 PHE HZ 1 1 3 1633 1 1 18 PHE N N 3.445 -10.383 -2.753 1.00 . A A . 18 PHE N 1 1 3 1634 1 1 18 PHE O O 3.270 -13.782 -3.407 1.00 . A A . 18 PHE O 1 1 3 1635 1 1 19 ALA C C 1.155 -14.263 -1.362 1.00 . A A . 19 ALA C 1 1 3 1636 1 1 19 ALA CA C 2.509 -13.989 -0.703 1.00 . A A . 19 ALA CA 1 1 3 1637 1 1 19 ALA CB C 2.351 -13.713 0.794 1.00 . A A . 19 ALA CB 1 1 3 1638 1 1 19 ALA H H 3.344 -12.038 -0.785 1.00 . A A . 19 ALA H 1 1 3 1639 1 1 19 ALA HA H 3.144 -14.869 -0.819 1.00 . A A . 19 ALA HA 1 1 3 1640 1 1 19 ALA HB1 H 3.325 -13.504 1.235 1.00 . A A . 19 ALA HB1 1 1 3 1641 1 1 19 ALA HB2 H 1.693 -12.859 0.954 1.00 . A A . 19 ALA HB2 1 1 3 1642 1 1 19 ALA HB3 H 1.922 -14.590 1.282 1.00 . A A . 19 ALA HB3 1 1 3 1643 1 1 19 ALA N N 3.164 -12.859 -1.346 1.00 . A A . 19 ALA N 1 1 3 1644 1 1 19 ALA O O 0.788 -15.420 -1.561 1.00 . A A . 19 ALA O 1 1 3 1645 1 1 20 GLY C C -1.995 -12.910 -1.669 1.00 . A A . 20 GLY C 1 1 3 1646 1 1 20 GLY CA C -0.773 -13.239 -2.519 1.00 . A A . 20 GLY CA 1 1 3 1647 1 1 20 GLY H H 0.804 -12.273 -1.502 1.00 . A A . 20 GLY H 1 1 3 1648 1 1 20 GLY HA2 H -0.693 -12.497 -3.314 1.00 . A A . 20 GLY HA2 1 1 3 1649 1 1 20 GLY HA3 H -0.902 -14.218 -2.983 1.00 . A A . 20 GLY HA3 1 1 3 1650 1 1 20 GLY N N 0.442 -13.190 -1.726 1.00 . A A . 20 GLY N 1 1 3 1651 1 1 20 GLY O O -2.915 -13.719 -1.571 1.00 . A A . 20 GLY O 1 1 3 1652 1 1 21 GLY C C -3.903 -10.206 -1.525 1.00 . A A . 21 GLY C 1 1 3 1653 1 1 21 GLY CA C -3.219 -11.121 -0.506 1.00 . A A . 21 GLY CA 1 1 3 1654 1 1 21 GLY H H -1.201 -11.112 -1.174 1.00 . A A . 21 GLY H 1 1 3 1655 1 1 21 GLY HA2 H -3.913 -11.897 -0.192 1.00 . A A . 21 GLY HA2 1 1 3 1656 1 1 21 GLY HA3 H -2.939 -10.537 0.369 1.00 . A A . 21 GLY HA3 1 1 3 1657 1 1 21 GLY N N -2.019 -11.701 -1.093 1.00 . A A . 21 GLY N 1 1 3 1658 1 1 21 GLY O O -3.385 -9.996 -2.621 1.00 . A A . 21 GLY O 1 1 3 1659 1 1 22 SER C C -4.986 -7.318 -1.891 1.00 . A A . 22 SER C 1 1 3 1660 1 1 22 SER CA C -5.733 -8.648 -1.994 1.00 . A A . 22 SER CA 1 1 3 1661 1 1 22 SER CB C -7.188 -8.492 -1.545 1.00 . A A . 22 SER CB 1 1 3 1662 1 1 22 SER H H -5.466 -9.850 -0.265 1.00 . A A . 22 SER H 1 1 3 1663 1 1 22 SER HA H -5.735 -8.996 -3.029 1.00 . A A . 22 SER HA 1 1 3 1664 1 1 22 SER HB2 H -7.230 -7.893 -0.637 1.00 . A A . 22 SER HB2 1 1 3 1665 1 1 22 SER HB3 H -7.755 -7.985 -2.325 1.00 . A A . 22 SER HB3 1 1 3 1666 1 1 22 SER HG H -8.670 -9.628 -0.989 1.00 . A A . 22 SER HG 1 1 3 1667 1 1 22 SER N N -5.056 -9.635 -1.163 1.00 . A A . 22 SER N 1 1 3 1668 1 1 22 SER O O -4.401 -7.030 -0.852 1.00 . A A . 22 SER O 1 1 3 1669 1 1 22 SER OG O -7.767 -9.756 -1.291 1.00 . A A . 22 SER OG 1 1 3 1670 1 1 23 ARG C C -4.771 -4.339 -1.811 1.00 . A A . 23 ARG C 1 1 3 1671 1 1 23 ARG CA C -4.339 -5.205 -2.995 1.00 . A A . 23 ARG CA 1 1 3 1672 1 1 23 ARG CB C -4.663 -4.508 -4.319 1.00 . A A . 23 ARG CB 1 1 3 1673 1 1 23 ARG CD C -4.327 -4.543 -6.819 1.00 . A A . 23 ARG CD 1 1 3 1674 1 1 23 ARG CG C -3.990 -5.230 -5.494 1.00 . A A . 23 ARG CG 1 1 3 1675 1 1 23 ARG CZ C -6.324 -5.628 -7.888 1.00 . A A . 23 ARG CZ 1 1 3 1676 1 1 23 ARG H H -5.475 -6.818 -3.791 1.00 . A A . 23 ARG H 1 1 3 1677 1 1 23 ARG HA H -3.256 -5.328 -2.938 1.00 . A A . 23 ARG HA 1 1 3 1678 1 1 23 ARG HB2 H -5.744 -4.480 -4.460 1.00 . A A . 23 ARG HB2 1 1 3 1679 1 1 23 ARG HB3 H -4.293 -3.483 -4.276 1.00 . A A . 23 ARG HB3 1 1 3 1680 1 1 23 ARG HD2 H -4.078 -3.486 -6.736 1.00 . A A . 23 ARG HD2 1 1 3 1681 1 1 23 ARG HD3 H -3.709 -4.966 -7.611 1.00 . A A . 23 ARG HD3 1 1 3 1682 1 1 23 ARG HE H -6.353 -3.941 -6.763 1.00 . A A . 23 ARG HE 1 1 3 1683 1 1 23 ARG HG2 H -2.909 -5.202 -5.354 1.00 . A A . 23 ARG HG2 1 1 3 1684 1 1 23 ARG HG3 H -4.312 -6.271 -5.541 1.00 . A A . 23 ARG HG3 1 1 3 1685 1 1 23 ARG HH11 H -4.606 -6.694 -8.193 1.00 . A A . 23 ARG HH11 1 1 3 1686 1 1 23 ARG HH12 H -6.032 -7.351 -8.954 1.00 . A A . 23 ARG HH12 1 1 3 1687 1 1 23 ARG HH21 H -8.195 -4.816 -7.772 1.00 . A A . 23 ARG HH21 1 1 3 1688 1 1 23 ARG HH22 H -8.080 -6.288 -8.703 1.00 . A A . 23 ARG HH22 1 1 3 1689 1 1 23 ARG N N -4.994 -6.512 -2.958 1.00 . A A . 23 ARG N 1 1 3 1690 1 1 23 ARG NE N -5.756 -4.662 -7.143 1.00 . A A . 23 ARG NE 1 1 3 1691 1 1 23 ARG NH1 N -5.596 -6.641 -8.383 1.00 . A A . 23 ARG NH1 1 1 3 1692 1 1 23 ARG NH2 N -7.638 -5.576 -8.138 1.00 . A A . 23 ARG NH2 1 1 3 1693 1 1 23 ARG O O -3.929 -3.860 -1.057 1.00 . A A . 23 ARG O 1 1 3 1694 1 1 24 GLU C C -6.372 -3.862 0.798 1.00 . A A . 24 GLU C 1 1 3 1695 1 1 24 GLU CA C -6.667 -3.322 -0.605 1.00 . A A . 24 GLU CA 1 1 3 1696 1 1 24 GLU CB C -8.173 -3.197 -0.852 1.00 . A A . 24 GLU CB 1 1 3 1697 1 1 24 GLU CD C -9.943 -2.261 -2.398 1.00 . A A . 24 GLU CD 1 1 3 1698 1 1 24 GLU CG C -8.449 -2.446 -2.162 1.00 . A A . 24 GLU CG 1 1 3 1699 1 1 24 GLU H H -6.711 -4.585 -2.309 1.00 . A A . 24 GLU H 1 1 3 1700 1 1 24 GLU HA H -6.235 -2.325 -0.673 1.00 . A A . 24 GLU HA 1 1 3 1701 1 1 24 GLU HB2 H -8.629 -4.188 -0.889 1.00 . A A . 24 GLU HB2 1 1 3 1702 1 1 24 GLU HB3 H -8.616 -2.642 -0.027 1.00 . A A . 24 GLU HB3 1 1 3 1703 1 1 24 GLU HE2 H -11.510 -1.303 -1.766 1.00 . A A . 24 GLU HE2 1 1 3 1704 1 1 24 GLU HG2 H -7.978 -1.463 -2.125 1.00 . A A . 24 GLU HG2 1 1 3 1705 1 1 24 GLU HG3 H -8.030 -2.998 -3.006 1.00 . A A . 24 GLU HG3 1 1 3 1706 1 1 24 GLU N N -6.083 -4.154 -1.647 1.00 . A A . 24 GLU N 1 1 3 1707 1 1 24 GLU O O -6.095 -3.085 1.707 1.00 . A A . 24 GLU O 1 1 3 1708 1 1 24 GLU OE1 O -10.494 -2.885 -3.300 1.00 . A A . 24 GLU OE1 1 1 3 1709 1 1 24 GLU OE2 O -10.575 -1.386 -1.563 1.00 . A A . 24 GLU OE2 1 1 3 1710 1 1 25 ARG C C -4.667 -5.646 2.635 1.00 . A A . 25 ARG C 1 1 3 1711 1 1 25 ARG CA C -6.133 -5.841 2.244 1.00 . A A . 25 ARG CA 1 1 3 1712 1 1 25 ARG CB C -6.496 -7.324 2.112 1.00 . A A . 25 ARG CB 1 1 3 1713 1 1 25 ARG CD C -6.858 -9.517 3.311 1.00 . A A . 25 ARG CD 1 1 3 1714 1 1 25 ARG CG C -6.491 -8.036 3.467 1.00 . A A . 25 ARG CG 1 1 3 1715 1 1 25 ARG CZ C -8.898 -10.885 2.883 1.00 . A A . 25 ARG CZ 1 1 3 1716 1 1 25 ARG H H -6.667 -5.777 0.197 1.00 . A A . 25 ARG H 1 1 3 1717 1 1 25 ARG HA H -6.764 -5.394 3.015 1.00 . A A . 25 ARG HA 1 1 3 1718 1 1 25 ARG HB2 H -7.492 -7.388 1.679 1.00 . A A . 25 ARG HB2 1 1 3 1719 1 1 25 ARG HB3 H -5.791 -7.816 1.440 1.00 . A A . 25 ARG HB3 1 1 3 1720 1 1 25 ARG HD2 H -6.206 -9.978 2.568 1.00 . A A . 25 ARG HD2 1 1 3 1721 1 1 25 ARG HD3 H -6.690 -9.994 4.274 1.00 . A A . 25 ARG HD3 1 1 3 1722 1 1 25 ARG HE H -8.787 -8.867 2.695 1.00 . A A . 25 ARG HE 1 1 3 1723 1 1 25 ARG HG2 H -5.493 -7.972 3.901 1.00 . A A . 25 ARG HG2 1 1 3 1724 1 1 25 ARG HG3 H -7.200 -7.556 4.142 1.00 . A A . 25 ARG HG3 1 1 3 1725 1 1 25 ARG HH11 H -7.270 -11.989 3.435 1.00 . A A . 25 ARG HH11 1 1 3 1726 1 1 25 ARG HH12 H -8.729 -12.906 3.163 1.00 . A A . 25 ARG HH12 1 1 3 1727 1 1 25 ARG HH21 H -10.699 -10.088 2.329 1.00 . A A . 25 ARG HH21 1 1 3 1728 1 1 25 ARG HH22 H -10.681 -11.822 2.527 1.00 . A A . 25 ARG HH22 1 1 3 1729 1 1 25 ARG N N -6.423 -5.186 0.977 1.00 . A A . 25 ARG N 1 1 3 1730 1 1 25 ARG NE N -8.264 -9.700 2.921 1.00 . A A . 25 ARG NE 1 1 3 1731 1 1 25 ARG NH1 N -8.248 -12.019 3.182 1.00 . A A . 25 ARG NH1 1 1 3 1732 1 1 25 ARG NH2 N -10.196 -10.936 2.549 1.00 . A A . 25 ARG NH2 1 1 3 1733 1 1 25 ARG O O -4.371 -5.276 3.769 1.00 . A A . 25 ARG O 1 1 3 1734 1 1 26 CYS C C -2.022 -4.179 2.134 1.00 . A A . 26 CYS C 1 1 3 1735 1 1 26 CYS CA C -2.323 -5.653 1.863 1.00 . A A . 26 CYS CA 1 1 3 1736 1 1 26 CYS CB C -1.561 -6.139 0.625 1.00 . A A . 26 CYS CB 1 1 3 1737 1 1 26 CYS H H -4.072 -6.202 0.787 1.00 . A A . 26 CYS H 1 1 3 1738 1 1 26 CYS HA H -1.983 -6.221 2.729 1.00 . A A . 26 CYS HA 1 1 3 1739 1 1 26 CYS HB2 H -1.967 -5.657 -0.264 1.00 . A A . 26 CYS HB2 1 1 3 1740 1 1 26 CYS HB3 H -0.522 -5.827 0.724 1.00 . A A . 26 CYS HB3 1 1 3 1741 1 1 26 CYS N N -3.751 -5.881 1.690 1.00 . A A . 26 CYS N 1 1 3 1742 1 1 26 CYS O O -1.164 -3.864 2.956 1.00 . A A . 26 CYS O 1 1 3 1743 1 1 26 CYS SG S -1.562 -7.931 0.349 1.00 . A A . 26 CYS SG 1 1 3 1744 1 1 27 ALA C C -2.967 -1.441 3.052 1.00 . A A . 27 ALA C 1 1 3 1745 1 1 27 ALA CA C -2.577 -1.843 1.630 1.00 . A A . 27 ALA CA 1 1 3 1746 1 1 27 ALA CB C -3.411 -1.116 0.583 1.00 . A A . 27 ALA CB 1 1 3 1747 1 1 27 ALA H H -3.410 -3.592 0.776 1.00 . A A . 27 ALA H 1 1 3 1748 1 1 27 ALA HA H -1.535 -1.575 1.458 1.00 . A A . 27 ALA HA 1 1 3 1749 1 1 27 ALA HB1 H -4.474 -1.296 0.733 1.00 . A A . 27 ALA HB1 1 1 3 1750 1 1 27 ALA HB2 H -3.219 -0.047 0.632 1.00 . A A . 27 ALA HB2 1 1 3 1751 1 1 27 ALA HB3 H -3.114 -1.482 -0.397 1.00 . A A . 27 ALA HB3 1 1 3 1752 1 1 27 ALA N N -2.728 -3.274 1.450 1.00 . A A . 27 ALA N 1 1 3 1753 1 1 27 ALA O O -2.215 -0.740 3.719 1.00 . A A . 27 ALA O 1 1 3 1754 1 1 28 LYS C C -3.545 -2.257 5.902 1.00 . A A . 28 LYS C 1 1 3 1755 1 1 28 LYS CA C -4.566 -1.720 4.897 1.00 . A A . 28 LYS CA 1 1 3 1756 1 1 28 LYS CB C -5.923 -2.398 5.087 1.00 . A A . 28 LYS CB 1 1 3 1757 1 1 28 LYS CD C -8.351 -2.325 4.428 1.00 . A A . 28 LYS CD 1 1 3 1758 1 1 28 LYS CE C -9.469 -1.479 3.807 1.00 . A A . 28 LYS CE 1 1 3 1759 1 1 28 LYS CG C -7.027 -1.556 4.443 1.00 . A A . 28 LYS CG 1 1 3 1760 1 1 28 LYS H H -4.685 -2.510 2.931 1.00 . A A . 28 LYS H 1 1 3 1761 1 1 28 LYS HA H -4.682 -0.649 5.073 1.00 . A A . 28 LYS HA 1 1 3 1762 1 1 28 LYS HB2 H -5.905 -3.392 4.640 1.00 . A A . 28 LYS HB2 1 1 3 1763 1 1 28 LYS HB3 H -6.116 -2.509 6.153 1.00 . A A . 28 LYS HB3 1 1 3 1764 1 1 28 LYS HD2 H -8.231 -3.251 3.863 1.00 . A A . 28 LYS HD2 1 1 3 1765 1 1 28 LYS HD3 H -8.620 -2.574 5.454 1.00 . A A . 28 LYS HD3 1 1 3 1766 1 1 28 LYS HE2 H -10.418 -2.004 3.926 1.00 . A A . 28 LYS HE2 1 1 3 1767 1 1 28 LYS HE3 H -9.532 -0.523 4.328 1.00 . A A . 28 LYS HE3 1 1 3 1768 1 1 28 LYS HG2 H -7.147 -0.632 5.012 1.00 . A A . 28 LYS HG2 1 1 3 1769 1 1 28 LYS HG3 H -6.737 -1.301 3.425 1.00 . A A . 28 LYS HG3 1 1 3 1770 1 1 28 LYS HZ1 H -9.221 -2.120 1.883 1.00 . A A . 28 LYS HZ1 1 1 3 1771 1 1 28 LYS HZ2 H -9.993 -0.669 1.998 1.00 . A A . 28 LYS HZ2 1 1 3 1772 1 1 28 LYS HZ3 H -8.366 -0.757 2.236 1.00 . A A . 28 LYS HZ3 1 1 3 1773 1 1 28 LYS N N -4.115 -1.927 3.530 1.00 . A A . 28 LYS N 1 1 3 1774 1 1 28 LYS NZ N -9.245 -1.236 2.371 1.00 . A A . 28 LYS NZ 1 1 3 1775 1 1 28 LYS O O -3.152 -1.531 6.814 1.00 . A A . 28 LYS O 1 1 3 1776 1 1 29 LEU C C -0.880 -3.303 6.719 1.00 . A A . 29 LEU C 1 1 3 1777 1 1 29 LEU CA C -2.132 -4.169 6.587 1.00 . A A . 29 LEU CA 1 1 3 1778 1 1 29 LEU CB C -1.759 -5.548 6.009 1.00 . A A . 29 LEU CB 1 1 3 1779 1 1 29 LEU CD1 C -1.179 -6.688 8.205 1.00 . A A . 29 LEU CD1 1 1 3 1780 1 1 29 LEU CD2 C -0.165 -7.505 6.060 1.00 . A A . 29 LEU CD2 1 1 3 1781 1 1 29 LEU CG C -0.666 -6.273 6.821 1.00 . A A . 29 LEU CG 1 1 3 1782 1 1 29 LEU H H -3.505 -4.050 4.962 1.00 . A A . 29 LEU H 1 1 3 1783 1 1 29 LEU HA H -2.579 -4.301 7.572 1.00 . A A . 29 LEU HA 1 1 3 1784 1 1 29 LEU HB2 H -2.650 -6.175 5.963 1.00 . A A . 29 LEU HB2 1 1 3 1785 1 1 29 LEU HB3 H -1.387 -5.413 4.995 1.00 . A A . 29 LEU HB3 1 1 3 1786 1 1 29 LEU HD11 H -2.106 -7.252 8.107 1.00 . A A . 29 LEU HD11 1 1 3 1787 1 1 29 LEU HD12 H -0.433 -7.310 8.703 1.00 . A A . 29 LEU HD12 1 1 3 1788 1 1 29 LEU HD13 H -1.354 -5.806 8.820 1.00 . A A . 29 LEU HD13 1 1 3 1789 1 1 29 LEU HD21 H 0.286 -7.194 5.117 1.00 . A A . 29 LEU HD21 1 1 3 1790 1 1 29 LEU HD22 H 0.594 -8.018 6.653 1.00 . A A . 29 LEU HD22 1 1 3 1791 1 1 29 LEU HD23 H -0.989 -8.191 5.861 1.00 . A A . 29 LEU HD23 1 1 3 1792 1 1 29 LEU HG H 0.201 -5.626 6.957 1.00 . A A . 29 LEU HG 1 1 3 1793 1 1 29 LEU N N -3.121 -3.517 5.731 1.00 . A A . 29 LEU N 1 1 3 1794 1 1 29 LEU O O -0.391 -3.071 7.822 1.00 . A A . 29 LEU O 1 1 3 1795 1 1 30 SER C C 0.805 -0.714 5.982 1.00 . A A . 30 SER C 1 1 3 1796 1 1 30 SER CA C 0.912 -2.155 5.489 1.00 . A A . 30 SER CA 1 1 3 1797 1 1 30 SER CB C 1.400 -2.190 4.042 1.00 . A A . 30 SER CB 1 1 3 1798 1 1 30 SER H H -0.857 -3.047 4.716 1.00 . A A . 30 SER H 1 1 3 1799 1 1 30 SER HA H 1.645 -2.676 6.105 1.00 . A A . 30 SER HA 1 1 3 1800 1 1 30 SER HB2 H 2.367 -1.700 3.994 1.00 . A A . 30 SER HB2 1 1 3 1801 1 1 30 SER HB3 H 1.502 -3.223 3.712 1.00 . A A . 30 SER HB3 1 1 3 1802 1 1 30 SER HG H -0.336 -1.997 3.185 1.00 . A A . 30 SER HG 1 1 3 1803 1 1 30 SER N N -0.357 -2.857 5.576 1.00 . A A . 30 SER N 1 1 3 1804 1 1 30 SER O O 1.769 -0.180 6.527 1.00 . A A . 30 SER O 1 1 3 1805 1 1 30 SER OG O 0.497 -1.516 3.191 1.00 . A A . 30 SER OG 1 1 3 1806 1 1 31 GLY C C -0.845 2.052 4.636 1.00 . A A . 31 GLY C 1 1 3 1807 1 1 31 GLY CA C -0.578 1.331 5.959 1.00 . A A . 31 GLY CA 1 1 3 1808 1 1 31 GLY H H -1.091 -0.599 5.285 1.00 . A A . 31 GLY H 1 1 3 1809 1 1 31 GLY HA2 H -1.447 1.450 6.607 1.00 . A A . 31 GLY HA2 1 1 3 1810 1 1 31 GLY HA3 H 0.278 1.805 6.439 1.00 . A A . 31 GLY HA3 1 1 3 1811 1 1 31 GLY N N -0.351 -0.086 5.748 1.00 . A A . 31 GLY N 1 1 3 1812 1 1 31 GLY O O -1.448 3.121 4.659 1.00 . A A . 31 GLY O 1 1 3 1813 1 1 32 CYS C C -1.905 2.372 1.713 1.00 . A A . 32 CYS C 1 1 3 1814 1 1 32 CYS CA C -0.463 2.136 2.189 1.00 . A A . 32 CYS CA 1 1 3 1815 1 1 32 CYS CB C 0.322 1.302 1.163 1.00 . A A . 32 CYS CB 1 1 3 1816 1 1 32 CYS H H 0.012 0.569 3.545 1.00 . A A . 32 CYS H 1 1 3 1817 1 1 32 CYS HA H 0.017 3.108 2.285 1.00 . A A . 32 CYS HA 1 1 3 1818 1 1 32 CYS HB2 H -0.238 0.387 0.970 1.00 . A A . 32 CYS HB2 1 1 3 1819 1 1 32 CYS HB3 H 0.382 1.852 0.225 1.00 . A A . 32 CYS HB3 1 1 3 1820 1 1 32 CYS N N -0.402 1.492 3.499 1.00 . A A . 32 CYS N 1 1 3 1821 1 1 32 CYS O O -2.847 1.793 2.251 1.00 . A A . 32 CYS O 1 1 3 1822 1 1 32 CYS SG S 2.000 0.796 1.647 1.00 . A A . 32 CYS SG 1 1 3 1823 1 1 33 LYS C C -3.361 2.990 -1.347 1.00 . A A . 33 LYS C 1 1 3 1824 1 1 33 LYS CA C -3.322 3.596 0.056 1.00 . A A . 33 LYS CA 1 1 3 1825 1 1 33 LYS CB C -3.454 5.122 -0.095 1.00 . A A . 33 LYS CB 1 1 3 1826 1 1 33 LYS CD C -4.171 5.879 2.292 1.00 . A A . 33 LYS CD 1 1 3 1827 1 1 33 LYS CE C -3.917 4.646 3.164 1.00 . A A . 33 LYS CE 1 1 3 1828 1 1 33 LYS CG C -3.167 5.992 1.135 1.00 . A A . 33 LYS CG 1 1 3 1829 1 1 33 LYS H H -1.235 3.668 0.319 1.00 . A A . 33 LYS H 1 1 3 1830 1 1 33 LYS HA H -4.169 3.215 0.626 1.00 . A A . 33 LYS HA 1 1 3 1831 1 1 33 LYS HB2 H -2.745 5.441 -0.861 1.00 . A A . 33 LYS HB2 1 1 3 1832 1 1 33 LYS HB3 H -4.457 5.349 -0.458 1.00 . A A . 33 LYS HB3 1 1 3 1833 1 1 33 LYS HD2 H -4.045 6.769 2.906 1.00 . A A . 33 LYS HD2 1 1 3 1834 1 1 33 LYS HD3 H -5.191 5.867 1.908 1.00 . A A . 33 LYS HD3 1 1 3 1835 1 1 33 LYS HE2 H -4.427 3.783 2.741 1.00 . A A . 33 LYS HE2 1 1 3 1836 1 1 33 LYS HE3 H -2.848 4.460 3.200 1.00 . A A . 33 LYS HE3 1 1 3 1837 1 1 33 LYS HG2 H -2.155 5.806 1.489 1.00 . A A . 33 LYS HG2 1 1 3 1838 1 1 33 LYS HG3 H -3.204 7.027 0.790 1.00 . A A . 33 LYS HG3 1 1 3 1839 1 1 33 LYS HZ1 H -5.355 5.081 4.561 1.00 . A A . 33 LYS HZ1 1 1 3 1840 1 1 33 LYS HZ2 H -4.254 3.956 5.051 1.00 . A A . 33 LYS HZ2 1 1 3 1841 1 1 33 LYS HZ3 H -3.826 5.544 5.000 1.00 . A A . 33 LYS HZ3 1 1 3 1842 1 1 33 LYS N N -2.063 3.243 0.706 1.00 . A A . 33 LYS N 1 1 3 1843 1 1 33 LYS NZ N -4.379 4.824 4.550 1.00 . A A . 33 LYS NZ 1 1 3 1844 1 1 33 LYS O O -2.319 2.862 -1.990 1.00 . A A . 33 LYS O 1 1 3 1845 1 1 34 ILE C C -5.969 3.141 -3.722 1.00 . A A . 34 ILE C 1 1 3 1846 1 1 34 ILE CA C -4.864 2.230 -3.179 1.00 . A A . 34 ILE CA 1 1 3 1847 1 1 34 ILE CB C -5.347 0.763 -3.155 1.00 . A A . 34 ILE CB 1 1 3 1848 1 1 34 ILE CD1 C -3.072 -0.453 -3.284 1.00 . A A . 34 ILE CD1 1 1 3 1849 1 1 34 ILE CG1 C -4.346 -0.183 -2.482 1.00 . A A . 34 ILE CG1 1 1 3 1850 1 1 34 ILE CG2 C -5.707 0.247 -4.556 1.00 . A A . 34 ILE CG2 1 1 3 1851 1 1 34 ILE H H -5.361 2.755 -1.201 1.00 . A A . 34 ILE H 1 1 3 1852 1 1 34 ILE HA H -3.975 2.310 -3.808 1.00 . A A . 34 ILE HA 1 1 3 1853 1 1 34 ILE HB H -6.253 0.713 -2.547 1.00 . A A . 34 ILE HB 1 1 3 1854 1 1 34 ILE HD11 H -2.580 0.482 -3.538 1.00 . A A . 34 ILE HD11 1 1 3 1855 1 1 34 ILE HD12 H -2.396 -1.048 -2.674 1.00 . A A . 34 ILE HD12 1 1 3 1856 1 1 34 ILE HD13 H -3.298 -1.009 -4.193 1.00 . A A . 34 ILE HD13 1 1 3 1857 1 1 34 ILE HG12 H -4.070 0.237 -1.520 1.00 . A A . 34 ILE HG12 1 1 3 1858 1 1 34 ILE HG13 H -4.844 -1.133 -2.296 1.00 . A A . 34 ILE HG13 1 1 3 1859 1 1 34 ILE HG21 H -4.871 0.390 -5.240 1.00 . A A . 34 ILE HG21 1 1 3 1860 1 1 34 ILE HG22 H -5.953 -0.815 -4.506 1.00 . A A . 34 ILE HG22 1 1 3 1861 1 1 34 ILE HG23 H -6.576 0.778 -4.945 1.00 . A A . 34 ILE HG23 1 1 3 1862 1 1 34 ILE N N -4.571 2.672 -1.822 1.00 . A A . 34 ILE N 1 1 3 1863 1 1 34 ILE O O -7.129 2.966 -3.348 1.00 . A A . 34 ILE O 1 1 3 1864 1 1 35 ILE C C -6.250 5.038 -6.788 1.00 . A A . 35 ILE C 1 1 3 1865 1 1 35 ILE CA C -6.625 4.900 -5.314 1.00 . A A . 35 ILE CA 1 1 3 1866 1 1 35 ILE CB C -6.861 6.276 -4.663 1.00 . A A . 35 ILE CB 1 1 3 1867 1 1 35 ILE CD1 C -5.869 8.521 -4.036 1.00 . A A . 35 ILE CD1 1 1 3 1868 1 1 35 ILE CG1 C -5.572 7.107 -4.546 1.00 . A A . 35 ILE CG1 1 1 3 1869 1 1 35 ILE CG2 C -7.564 6.129 -3.306 1.00 . A A . 35 ILE CG2 1 1 3 1870 1 1 35 ILE H H -4.661 4.223 -4.849 1.00 . A A . 35 ILE H 1 1 3 1871 1 1 35 ILE HA H -7.576 4.367 -5.303 1.00 . A A . 35 ILE HA 1 1 3 1872 1 1 35 ILE HB H -7.547 6.820 -5.313 1.00 . A A . 35 ILE HB 1 1 3 1873 1 1 35 ILE HD11 H -6.651 8.978 -4.643 1.00 . A A . 35 ILE HD11 1 1 3 1874 1 1 35 ILE HD12 H -6.180 8.494 -2.992 1.00 . A A . 35 ILE HD12 1 1 3 1875 1 1 35 ILE HD13 H -4.971 9.129 -4.108 1.00 . A A . 35 ILE HD13 1 1 3 1876 1 1 35 ILE HG12 H -4.865 6.623 -3.872 1.00 . A A . 35 ILE HG12 1 1 3 1877 1 1 35 ILE HG13 H -5.113 7.200 -5.530 1.00 . A A . 35 ILE HG13 1 1 3 1878 1 1 35 ILE HG21 H -6.879 5.727 -2.560 1.00 . A A . 35 ILE HG21 1 1 3 1879 1 1 35 ILE HG22 H -7.936 7.098 -2.969 1.00 . A A . 35 ILE HG22 1 1 3 1880 1 1 35 ILE HG23 H -8.423 5.464 -3.408 1.00 . A A . 35 ILE HG23 1 1 3 1881 1 1 35 ILE N N -5.633 4.099 -4.597 1.00 . A A . 35 ILE N 1 1 3 1882 1 1 35 ILE O O -5.071 5.044 -7.140 1.00 . A A . 35 ILE O 1 1 3 1883 1 1 36 SER C C -7.316 6.679 -9.566 1.00 . A A . 36 SER C 1 1 3 1884 1 1 36 SER CA C -7.163 5.229 -9.091 1.00 . A A . 36 SER CA 1 1 3 1885 1 1 36 SER CB C -8.238 4.322 -9.702 1.00 . A A . 36 SER CB 1 1 3 1886 1 1 36 SER H H -8.213 5.140 -7.267 1.00 . A A . 36 SER H 1 1 3 1887 1 1 36 SER HA H -6.189 4.865 -9.418 1.00 . A A . 36 SER HA 1 1 3 1888 1 1 36 SER HB2 H -8.183 4.345 -10.790 1.00 . A A . 36 SER HB2 1 1 3 1889 1 1 36 SER HB3 H -8.082 3.295 -9.368 1.00 . A A . 36 SER HB3 1 1 3 1890 1 1 36 SER HG H -9.675 5.631 -9.626 1.00 . A A . 36 SER HG 1 1 3 1891 1 1 36 SER N N -7.275 5.146 -7.642 1.00 . A A . 36 SER N 1 1 3 1892 1 1 36 SER O O -7.928 6.926 -10.603 1.00 . A A . 36 SER O 1 1 3 1893 1 1 36 SER OG O -9.521 4.746 -9.285 1.00 . A A . 36 SER OG 1 1 3 1894 1 1 37 ALA C C -5.634 9.473 -10.047 1.00 . A A . 37 ALA C 1 1 3 1895 1 1 37 ALA CA C -6.809 9.055 -9.153 1.00 . A A . 37 ALA CA 1 1 3 1896 1 1 37 ALA CB C -6.807 9.872 -7.856 1.00 . A A . 37 ALA CB 1 1 3 1897 1 1 37 ALA H H -6.271 7.374 -7.972 1.00 . A A . 37 ALA H 1 1 3 1898 1 1 37 ALA HA H -7.740 9.278 -9.676 1.00 . A A . 37 ALA HA 1 1 3 1899 1 1 37 ALA HB1 H -7.601 9.520 -7.197 1.00 . A A . 37 ALA HB1 1 1 3 1900 1 1 37 ALA HB2 H -5.848 9.767 -7.350 1.00 . A A . 37 ALA HB2 1 1 3 1901 1 1 37 ALA HB3 H -6.979 10.926 -8.081 1.00 . A A . 37 ALA HB3 1 1 3 1902 1 1 37 ALA N N -6.761 7.638 -8.814 1.00 . A A . 37 ALA N 1 1 3 1903 1 1 37 ALA O O -5.555 10.637 -10.433 1.00 . A A . 37 ALA O 1 1 3 1904 1 1 38 SER C C -2.630 9.870 -10.041 1.00 . A A . 38 SER C 1 1 3 1905 1 1 38 SER CA C -3.384 8.836 -10.894 1.00 . A A . 38 SER CA 1 1 3 1906 1 1 38 SER CB C -3.522 9.236 -12.368 1.00 . A A . 38 SER CB 1 1 3 1907 1 1 38 SER H H -4.858 7.600 -10.044 1.00 . A A . 38 SER H 1 1 3 1908 1 1 38 SER HA H -2.817 7.906 -10.859 1.00 . A A . 38 SER HA 1 1 3 1909 1 1 38 SER HB2 H -4.163 8.519 -12.884 1.00 . A A . 38 SER HB2 1 1 3 1910 1 1 38 SER HB3 H -3.973 10.224 -12.436 1.00 . A A . 38 SER HB3 1 1 3 1911 1 1 38 SER HG H -2.363 9.578 -13.894 1.00 . A A . 38 SER HG 1 1 3 1912 1 1 38 SER N N -4.699 8.550 -10.331 1.00 . A A . 38 SER N 1 1 3 1913 1 1 38 SER O O -1.780 10.608 -10.541 1.00 . A A . 38 SER O 1 1 3 1914 1 1 38 SER OG O -2.259 9.237 -13.003 1.00 . A A . 38 SER OG 1 1 3 1915 1 1 39 THR C C -2.619 10.269 -6.384 1.00 . A A . 39 THR C 1 1 3 1916 1 1 39 THR CA C -2.438 10.885 -7.774 1.00 . A A . 39 THR CA 1 1 3 1917 1 1 39 THR CB C -3.223 12.205 -7.921 1.00 . A A . 39 THR CB 1 1 3 1918 1 1 39 THR CG2 C -2.668 13.320 -7.030 1.00 . A A . 39 THR CG2 1 1 3 1919 1 1 39 THR H H -3.601 9.247 -8.375 1.00 . A A . 39 THR H 1 1 3 1920 1 1 39 THR HA H -1.377 11.064 -7.950 1.00 . A A . 39 THR HA 1 1 3 1921 1 1 39 THR HB H -4.269 12.033 -7.658 1.00 . A A . 39 THR HB 1 1 3 1922 1 1 39 THR HG1 H -2.339 12.445 -9.644 1.00 . A A . 39 THR HG1 1 1 3 1923 1 1 39 THR HG21 H -3.178 14.256 -7.262 1.00 . A A . 39 THR HG21 1 1 3 1924 1 1 39 THR HG22 H -2.841 13.093 -5.979 1.00 . A A . 39 THR HG22 1 1 3 1925 1 1 39 THR HG23 H -1.600 13.446 -7.208 1.00 . A A . 39 THR HG23 1 1 3 1926 1 1 39 THR N N -2.930 9.911 -8.737 1.00 . A A . 39 THR N 1 1 3 1927 1 1 39 THR O O -3.421 9.347 -6.229 1.00 . A A . 39 THR O 1 1 3 1928 1 1 39 THR OG1 O -3.190 12.666 -9.256 1.00 . A A . 39 THR OG1 1 1 3 1929 1 1 40 CYS C C -1.767 11.399 -3.016 1.00 . A A . 40 CYS C 1 1 3 1930 1 1 40 CYS CA C -1.907 10.249 -4.018 1.00 . A A . 40 CYS CA 1 1 3 1931 1 1 40 CYS CB C -0.773 9.245 -3.819 1.00 . A A . 40 CYS CB 1 1 3 1932 1 1 40 CYS H H -1.226 11.512 -5.568 1.00 . A A . 40 CYS H 1 1 3 1933 1 1 40 CYS HA H -2.855 9.743 -3.855 1.00 . A A . 40 CYS HA 1 1 3 1934 1 1 40 CYS HB2 H 0.164 9.691 -4.156 1.00 . A A . 40 CYS HB2 1 1 3 1935 1 1 40 CYS HB3 H -0.675 9.025 -2.756 1.00 . A A . 40 CYS HB3 1 1 3 1936 1 1 40 CYS N N -1.865 10.750 -5.386 1.00 . A A . 40 CYS N 1 1 3 1937 1 1 40 CYS O O -1.125 12.399 -3.330 1.00 . A A . 40 CYS O 1 1 3 1938 1 1 40 CYS SG S -1.017 7.669 -4.671 1.00 . A A . 40 CYS SG 1 1 3 1939 1 1 41 PRO C C -0.732 12.320 -0.259 1.00 . A A . 41 PRO C 1 1 3 1940 1 1 41 PRO CA C -2.188 12.225 -0.729 1.00 . A A . 41 PRO CA 1 1 3 1941 1 1 41 PRO CB C -3.121 11.756 0.393 1.00 . A A . 41 PRO CB 1 1 3 1942 1 1 41 PRO CD C -3.204 10.162 -1.396 1.00 . A A . 41 PRO CD 1 1 3 1943 1 1 41 PRO CG C -3.306 10.263 0.119 1.00 . A A . 41 PRO CG 1 1 3 1944 1 1 41 PRO HA H -2.520 13.205 -1.078 1.00 . A A . 41 PRO HA 1 1 3 1945 1 1 41 PRO HB2 H -2.713 11.940 1.388 1.00 . A A . 41 PRO HB2 1 1 3 1946 1 1 41 PRO HB3 H -4.085 12.255 0.288 1.00 . A A . 41 PRO HB3 1 1 3 1947 1 1 41 PRO HD2 H -2.807 9.183 -1.663 1.00 . A A . 41 PRO HD2 1 1 3 1948 1 1 41 PRO HD3 H -4.191 10.302 -1.835 1.00 . A A . 41 PRO HD3 1 1 3 1949 1 1 41 PRO HG2 H -2.476 9.704 0.543 1.00 . A A . 41 PRO HG2 1 1 3 1950 1 1 41 PRO HG3 H -4.253 9.880 0.503 1.00 . A A . 41 PRO HG3 1 1 3 1951 1 1 41 PRO N N -2.339 11.258 -1.806 1.00 . A A . 41 PRO N 1 1 3 1952 1 1 41 PRO O O -0.020 11.317 -0.198 1.00 . A A . 41 PRO O 1 1 3 1953 1 1 42 SER C C 1.570 13.090 1.645 1.00 . A A . 42 SER C 1 1 3 1954 1 1 42 SER CA C 1.055 13.901 0.453 1.00 . A A . 42 SER CA 1 1 3 1955 1 1 42 SER CB C 1.105 15.397 0.781 1.00 . A A . 42 SER CB 1 1 3 1956 1 1 42 SER H H -0.959 14.312 -0.001 1.00 . A A . 42 SER H 1 1 3 1957 1 1 42 SER HA H 1.707 13.716 -0.403 1.00 . A A . 42 SER HA 1 1 3 1958 1 1 42 SER HB2 H 0.494 15.601 1.663 1.00 . A A . 42 SER HB2 1 1 3 1959 1 1 42 SER HB3 H 2.135 15.693 0.985 1.00 . A A . 42 SER HB3 1 1 3 1960 1 1 42 SER HG H 0.684 17.083 -0.094 1.00 . A A . 42 SER HG 1 1 3 1961 1 1 42 SER N N -0.308 13.546 0.074 1.00 . A A . 42 SER N 1 1 3 1962 1 1 42 SER O O 2.762 12.801 1.724 1.00 . A A . 42 SER O 1 1 3 1963 1 1 42 SER OG O 0.607 16.150 -0.306 1.00 . A A . 42 SER OG 1 1 3 1964 1 1 43 ASP C C 1.547 10.551 3.436 1.00 . A A . 43 ASP C 1 1 3 1965 1 1 43 ASP CA C 0.952 11.929 3.753 1.00 . A A . 43 ASP CA 1 1 3 1966 1 1 43 ASP CB C -0.333 11.768 4.576 1.00 . A A . 43 ASP CB 1 1 3 1967 1 1 43 ASP CG C -0.907 13.113 5.010 1.00 . A A . 43 ASP CG 1 1 3 1968 1 1 43 ASP H H -0.293 13.011 2.428 1.00 . A A . 43 ASP H 1 1 3 1969 1 1 43 ASP HA H 1.678 12.473 4.358 1.00 . A A . 43 ASP HA 1 1 3 1970 1 1 43 ASP HB2 H -1.081 11.246 3.980 1.00 . A A . 43 ASP HB2 1 1 3 1971 1 1 43 ASP HB3 H -0.121 11.170 5.464 1.00 . A A . 43 ASP HB3 1 1 3 1972 1 1 43 ASP HD2 H -1.038 14.337 6.518 1.00 . A A . 43 ASP HD2 1 1 3 1973 1 1 43 ASP N N 0.665 12.718 2.559 1.00 . A A . 43 ASP N 1 1 3 1974 1 1 43 ASP O O 2.045 9.890 4.347 1.00 . A A . 43 ASP O 1 1 3 1975 1 1 43 ASP OD1 O -1.559 13.775 4.205 1.00 . A A . 43 ASP OD1 1 1 3 1976 1 1 43 ASP OD2 O -0.649 13.489 6.295 1.00 . A A . 43 ASP OD2 1 1 3 1977 1 1 44 TYR C C 3.119 9.163 0.635 1.00 . A A . 44 TYR C 1 1 3 1978 1 1 44 TYR CA C 2.061 8.857 1.701 1.00 . A A . 44 TYR CA 1 1 3 1979 1 1 44 TYR CB C 0.922 7.967 1.190 1.00 . A A . 44 TYR CB 1 1 3 1980 1 1 44 TYR CD1 C -1.031 8.562 2.700 1.00 . A A . 44 TYR CD1 1 1 3 1981 1 1 44 TYR CD2 C 0.096 6.438 3.018 1.00 . A A . 44 TYR CD2 1 1 3 1982 1 1 44 TYR CE1 C -1.843 8.304 3.816 1.00 . A A . 44 TYR CE1 1 1 3 1983 1 1 44 TYR CE2 C -0.663 6.211 4.178 1.00 . A A . 44 TYR CE2 1 1 3 1984 1 1 44 TYR CG C -0.074 7.620 2.282 1.00 . A A . 44 TYR CG 1 1 3 1985 1 1 44 TYR CZ C -1.663 7.121 4.554 1.00 . A A . 44 TYR CZ 1 1 3 1986 1 1 44 TYR H H 1.056 10.690 1.465 1.00 . A A . 44 TYR H 1 1 3 1987 1 1 44 TYR HA H 2.527 8.309 2.517 1.00 . A A . 44 TYR HA 1 1 3 1988 1 1 44 TYR HB2 H 0.401 8.455 0.367 1.00 . A A . 44 TYR HB2 1 1 3 1989 1 1 44 TYR HB3 H 1.357 7.046 0.807 1.00 . A A . 44 TYR HB3 1 1 3 1990 1 1 44 TYR HD1 H -1.113 9.511 2.195 1.00 . A A . 44 TYR HD1 1 1 3 1991 1 1 44 TYR HD2 H 0.819 5.711 2.696 1.00 . A A . 44 TYR HD2 1 1 3 1992 1 1 44 TYR HE1 H -2.594 9.021 4.109 1.00 . A A . 44 TYR HE1 1 1 3 1993 1 1 44 TYR HE2 H -0.457 5.345 4.787 1.00 . A A . 44 TYR HE2 1 1 3 1994 1 1 44 TYR HH H -3.018 7.596 5.874 1.00 . A A . 44 TYR HH 1 1 3 1995 1 1 44 TYR N N 1.503 10.116 2.168 1.00 . A A . 44 TYR N 1 1 3 1996 1 1 44 TYR O O 2.840 9.037 -0.556 1.00 . A A . 44 TYR O 1 1 3 1997 1 1 44 TYR OH O -2.468 6.851 5.622 1.00 . A A . 44 TYR OH 1 1 3 1998 1 1 45 PRO C C 6.087 9.000 -0.607 1.00 . A A . 45 PRO C 1 1 3 1999 1 1 45 PRO CA C 5.351 10.107 0.153 1.00 . A A . 45 PRO CA 1 1 3 2000 1 1 45 PRO CB C 6.322 10.880 1.050 1.00 . A A . 45 PRO CB 1 1 3 2001 1 1 45 PRO CD C 4.746 9.751 2.434 1.00 . A A . 45 PRO CD 1 1 3 2002 1 1 45 PRO CG C 6.221 10.148 2.386 1.00 . A A . 45 PRO CG 1 1 3 2003 1 1 45 PRO HA H 4.914 10.799 -0.570 1.00 . A A . 45 PRO HA 1 1 3 2004 1 1 45 PRO HB2 H 7.342 10.890 0.664 1.00 . A A . 45 PRO HB2 1 1 3 2005 1 1 45 PRO HB3 H 5.961 11.901 1.175 1.00 . A A . 45 PRO HB3 1 1 3 2006 1 1 45 PRO HD2 H 4.635 8.829 3.003 1.00 . A A . 45 PRO HD2 1 1 3 2007 1 1 45 PRO HD3 H 4.190 10.561 2.902 1.00 . A A . 45 PRO HD3 1 1 3 2008 1 1 45 PRO HG2 H 6.844 9.252 2.367 1.00 . A A . 45 PRO HG2 1 1 3 2009 1 1 45 PRO HG3 H 6.501 10.785 3.227 1.00 . A A . 45 PRO HG3 1 1 3 2010 1 1 45 PRO N N 4.322 9.600 1.050 1.00 . A A . 45 PRO N 1 1 3 2011 1 1 45 PRO O O 6.716 9.290 -1.622 1.00 . A A . 45 PRO O 1 1 3 2012 1 1 46 LYS C C 6.048 5.789 -1.580 1.00 . A A . 46 LYS C 1 1 3 2013 1 1 46 LYS CA C 6.853 6.661 -0.615 1.00 . A A . 46 LYS CA 1 1 3 2014 1 1 46 LYS CB C 7.342 5.846 0.593 1.00 . A A . 46 LYS CB 1 1 3 2015 1 1 46 LYS CD C 9.802 5.587 -0.143 1.00 . A A . 46 LYS CD 1 1 3 2016 1 1 46 LYS CE C 10.321 6.587 0.897 1.00 . A A . 46 LYS CE 1 1 3 2017 1 1 46 LYS CG C 8.492 4.891 0.252 1.00 . A A . 46 LYS CG 1 1 3 2018 1 1 46 LYS H H 5.478 7.551 0.697 1.00 . A A . 46 LYS H 1 1 3 2019 1 1 46 LYS HA H 7.712 7.070 -1.143 1.00 . A A . 46 LYS HA 1 1 3 2020 1 1 46 LYS HB2 H 7.654 6.520 1.391 1.00 . A A . 46 LYS HB2 1 1 3 2021 1 1 46 LYS HB3 H 6.508 5.255 0.974 1.00 . A A . 46 LYS HB3 1 1 3 2022 1 1 46 LYS HD2 H 10.556 4.815 -0.289 1.00 . A A . 46 LYS HD2 1 1 3 2023 1 1 46 LYS HD3 H 9.679 6.104 -1.097 1.00 . A A . 46 LYS HD3 1 1 3 2024 1 1 46 LYS HE2 H 11.305 6.932 0.582 1.00 . A A . 46 LYS HE2 1 1 3 2025 1 1 46 LYS HE3 H 9.662 7.454 0.941 1.00 . A A . 46 LYS HE3 1 1 3 2026 1 1 46 LYS HG2 H 8.673 4.246 1.113 1.00 . A A . 46 LYS HG2 1 1 3 2027 1 1 46 LYS HG3 H 8.192 4.255 -0.577 1.00 . A A . 46 LYS HG3 1 1 3 2028 1 1 46 LYS HZ1 H 11.013 5.157 2.211 1.00 . A A . 46 LYS HZ1 1 1 3 2029 1 1 46 LYS HZ2 H 10.832 6.654 2.878 1.00 . A A . 46 LYS HZ2 1 1 3 2030 1 1 46 LYS HZ3 H 9.508 5.730 2.559 1.00 . A A . 46 LYS HZ3 1 1 3 2031 1 1 46 LYS N N 6.036 7.753 -0.119 1.00 . A A . 46 LYS N 1 1 3 2032 1 1 46 LYS NZ N 10.430 5.984 2.238 1.00 . A A . 46 LYS NZ 1 1 3 2033 1 1 46 LYS O O 6.693 5.086 -2.385 1.00 . A A . 46 LYS O 1 1 3 2034 1 1 46 LYS OXT O 4.800 5.812 -1.510 1.00 . A A . 46 LYS OXT 1 1 4 2035 1 1 1 LYS C C -0.449 4.065 -6.817 1.00 . A A . 1 LYS C 1 1 4 2036 1 1 1 LYS CA C -1.002 5.137 -7.769 1.00 . A A . 1 LYS CA 1 1 4 2037 1 1 1 LYS CB C 0.139 6.006 -8.334 1.00 . A A . 1 LYS CB 1 1 4 2038 1 1 1 LYS CD C 2.118 7.503 -7.816 1.00 . A A . 1 LYS CD 1 1 4 2039 1 1 1 LYS CE C 2.884 8.283 -6.737 1.00 . A A . 1 LYS CE 1 1 4 2040 1 1 1 LYS CG C 0.882 6.797 -7.246 1.00 . A A . 1 LYS CG 1 1 4 2041 1 1 1 LYS H1 H -2.361 6.661 -7.841 1.00 . A A . 1 LYS H1 1 1 4 2042 1 1 1 LYS H2 H -2.839 5.415 -6.890 1.00 . A A . 1 LYS H2 1 1 4 2043 1 1 1 LYS H3 H -1.688 6.476 -6.355 1.00 . A A . 1 LYS H3 1 1 4 2044 1 1 1 LYS HA H -1.467 4.612 -8.603 1.00 . A A . 1 LYS HA 1 1 4 2045 1 1 1 LYS HB2 H 0.847 5.365 -8.860 1.00 . A A . 1 LYS HB2 1 1 4 2046 1 1 1 LYS HB3 H -0.265 6.716 -9.053 1.00 . A A . 1 LYS HB3 1 1 4 2047 1 1 1 LYS HD2 H 2.783 6.767 -8.270 1.00 . A A . 1 LYS HD2 1 1 4 2048 1 1 1 LYS HD3 H 1.795 8.203 -8.588 1.00 . A A . 1 LYS HD3 1 1 4 2049 1 1 1 LYS HE2 H 3.687 8.846 -7.216 1.00 . A A . 1 LYS HE2 1 1 4 2050 1 1 1 LYS HE3 H 2.214 8.992 -6.249 1.00 . A A . 1 LYS HE3 1 1 4 2051 1 1 1 LYS HG2 H 0.210 7.546 -6.832 1.00 . A A . 1 LYS HG2 1 1 4 2052 1 1 1 LYS HG3 H 1.200 6.122 -6.455 1.00 . A A . 1 LYS HG3 1 1 4 2053 1 1 1 LYS HZ1 H 2.779 6.859 -5.245 1.00 . A A . 1 LYS HZ1 1 1 4 2054 1 1 1 LYS HZ2 H 4.140 6.763 -6.157 1.00 . A A . 1 LYS HZ2 1 1 4 2055 1 1 1 LYS HZ3 H 3.979 7.942 -5.025 1.00 . A A . 1 LYS HZ3 1 1 4 2056 1 1 1 LYS N N -2.047 5.985 -7.163 1.00 . A A . 1 LYS N 1 1 4 2057 1 1 1 LYS NZ N 3.487 7.398 -5.722 1.00 . A A . 1 LYS NZ 1 1 4 2058 1 1 1 LYS O O 0.659 3.582 -7.043 1.00 . A A . 1 LYS O 1 1 4 2059 1 1 2 SER C C 0.237 3.997 -3.777 1.00 . A A . 2 SER C 1 1 4 2060 1 1 2 SER CA C -0.671 3.042 -4.555 1.00 . A A . 2 SER CA 1 1 4 2061 1 1 2 SER CB C 0.037 1.718 -4.880 1.00 . A A . 2 SER CB 1 1 4 2062 1 1 2 SER H H -2.111 4.113 -5.666 1.00 . A A . 2 SER H 1 1 4 2063 1 1 2 SER HA H -1.541 2.805 -3.943 1.00 . A A . 2 SER HA 1 1 4 2064 1 1 2 SER HB2 H -0.605 1.126 -5.526 1.00 . A A . 2 SER HB2 1 1 4 2065 1 1 2 SER HB3 H 0.993 1.890 -5.372 1.00 . A A . 2 SER HB3 1 1 4 2066 1 1 2 SER HG H 0.785 1.523 -3.086 1.00 . A A . 2 SER HG 1 1 4 2067 1 1 2 SER N N -1.182 3.727 -5.744 1.00 . A A . 2 SER N 1 1 4 2068 1 1 2 SER O O 1.124 4.615 -4.364 1.00 . A A . 2 SER O 1 1 4 2069 1 1 2 SER OG O 0.284 0.980 -3.701 1.00 . A A . 2 SER OG 1 1 4 2070 1 1 3 CYS C C 0.882 4.791 -0.282 1.00 . A A . 3 CYS C 1 1 4 2071 1 1 3 CYS CA C 0.524 5.263 -1.690 1.00 . A A . 3 CYS CA 1 1 4 2072 1 1 3 CYS CB C -0.527 6.380 -1.647 1.00 . A A . 3 CYS CB 1 1 4 2073 1 1 3 CYS H H -0.749 3.600 -2.051 1.00 . A A . 3 CYS H 1 1 4 2074 1 1 3 CYS HA H 1.425 5.664 -2.157 1.00 . A A . 3 CYS HA 1 1 4 2075 1 1 3 CYS HB2 H -1.396 6.033 -1.091 1.00 . A A . 3 CYS HB2 1 1 4 2076 1 1 3 CYS HB3 H -0.105 7.240 -1.133 1.00 . A A . 3 CYS HB3 1 1 4 2077 1 1 3 CYS N N -0.016 4.156 -2.473 1.00 . A A . 3 CYS N 1 1 4 2078 1 1 3 CYS O O -0.006 4.617 0.547 1.00 . A A . 3 CYS O 1 1 4 2079 1 1 3 CYS SG S -1.120 6.937 -3.262 1.00 . A A . 3 CYS SG 1 1 4 2080 1 1 4 CYS C C 3.387 5.274 2.024 1.00 . A A . 4 CYS C 1 1 4 2081 1 1 4 CYS CA C 2.695 4.134 1.273 1.00 . A A . 4 CYS CA 1 1 4 2082 1 1 4 CYS CB C 3.685 2.989 1.035 1.00 . A A . 4 CYS CB 1 1 4 2083 1 1 4 CYS H H 2.862 4.863 -0.706 1.00 . A A . 4 CYS H 1 1 4 2084 1 1 4 CYS HA H 1.873 3.758 1.877 1.00 . A A . 4 CYS HA 1 1 4 2085 1 1 4 CYS HB2 H 4.426 3.322 0.314 1.00 . A A . 4 CYS HB2 1 1 4 2086 1 1 4 CYS HB3 H 4.217 2.770 1.960 1.00 . A A . 4 CYS HB3 1 1 4 2087 1 1 4 CYS N N 2.176 4.606 -0.007 1.00 . A A . 4 CYS N 1 1 4 2088 1 1 4 CYS O O 3.870 6.222 1.401 1.00 . A A . 4 CYS O 1 1 4 2089 1 1 4 CYS SG S 2.963 1.428 0.472 1.00 . A A . 4 CYS SG 1 1 4 2090 1 1 5 PRO C C 5.596 6.129 4.130 1.00 . A A . 5 PRO C 1 1 4 2091 1 1 5 PRO CA C 4.069 6.211 4.192 1.00 . A A . 5 PRO CA 1 1 4 2092 1 1 5 PRO CB C 3.552 5.944 5.608 1.00 . A A . 5 PRO CB 1 1 4 2093 1 1 5 PRO CD C 2.851 4.154 4.199 1.00 . A A . 5 PRO CD 1 1 4 2094 1 1 5 PRO CG C 3.338 4.430 5.621 1.00 . A A . 5 PRO CG 1 1 4 2095 1 1 5 PRO HA H 3.749 7.205 3.886 1.00 . A A . 5 PRO HA 1 1 4 2096 1 1 5 PRO HB2 H 4.243 6.282 6.379 1.00 . A A . 5 PRO HB2 1 1 4 2097 1 1 5 PRO HB3 H 2.590 6.440 5.738 1.00 . A A . 5 PRO HB3 1 1 4 2098 1 1 5 PRO HD2 H 3.130 3.150 3.892 1.00 . A A . 5 PRO HD2 1 1 4 2099 1 1 5 PRO HD3 H 1.765 4.236 4.177 1.00 . A A . 5 PRO HD3 1 1 4 2100 1 1 5 PRO HG2 H 4.289 3.926 5.794 1.00 . A A . 5 PRO HG2 1 1 4 2101 1 1 5 PRO HG3 H 2.610 4.122 6.374 1.00 . A A . 5 PRO HG3 1 1 4 2102 1 1 5 PRO N N 3.451 5.191 3.363 1.00 . A A . 5 PRO N 1 1 4 2103 1 1 5 PRO O O 6.263 7.163 4.186 1.00 . A A . 5 PRO O 1 1 4 2104 1 1 6 ASN C C 7.961 3.408 3.353 1.00 . A A . 6 ASN C 1 1 4 2105 1 1 6 ASN CA C 7.577 4.652 4.150 1.00 . A A . 6 ASN CA 1 1 4 2106 1 1 6 ASN CB C 7.977 4.446 5.619 1.00 . A A . 6 ASN CB 1 1 4 2107 1 1 6 ASN CG C 7.656 5.649 6.502 1.00 . A A . 6 ASN CG 1 1 4 2108 1 1 6 ASN H H 5.547 4.106 3.931 1.00 . A A . 6 ASN H 1 1 4 2109 1 1 6 ASN HA H 8.134 5.495 3.745 1.00 . A A . 6 ASN HA 1 1 4 2110 1 1 6 ASN HB2 H 7.478 3.556 6.008 1.00 . A A . 6 ASN HB2 1 1 4 2111 1 1 6 ASN HB3 H 9.054 4.279 5.675 1.00 . A A . 6 ASN HB3 1 1 4 2112 1 1 6 ASN HD21 H 6.147 4.641 7.433 1.00 . A A . 6 ASN HD21 1 1 4 2113 1 1 6 ASN HD22 H 6.396 6.290 7.965 1.00 . A A . 6 ASN HD22 1 1 4 2114 1 1 6 ASN N N 6.148 4.910 4.043 1.00 . A A . 6 ASN N 1 1 4 2115 1 1 6 ASN ND2 N 6.653 5.512 7.374 1.00 . A A . 6 ASN ND2 1 1 4 2116 1 1 6 ASN O O 7.107 2.607 2.972 1.00 . A A . 6 ASN O 1 1 4 2117 1 1 6 ASN OD1 O 8.304 6.688 6.396 1.00 . A A . 6 ASN OD1 1 1 4 2118 1 1 7 THR C C 9.480 0.789 3.368 1.00 . A A . 7 THR C 1 1 4 2119 1 1 7 THR CA C 9.913 2.053 2.617 1.00 . A A . 7 THR CA 1 1 4 2120 1 1 7 THR CB C 11.437 2.234 2.686 1.00 . A A . 7 THR CB 1 1 4 2121 1 1 7 THR CG2 C 12.166 1.200 1.821 1.00 . A A . 7 THR CG2 1 1 4 2122 1 1 7 THR H H 9.893 3.987 3.444 1.00 . A A . 7 THR H 1 1 4 2123 1 1 7 THR HA H 9.618 1.969 1.570 1.00 . A A . 7 THR HA 1 1 4 2124 1 1 7 THR HB H 11.768 2.129 3.721 1.00 . A A . 7 THR HB 1 1 4 2125 1 1 7 THR HG1 H 12.740 3.624 2.294 1.00 . A A . 7 THR HG1 1 1 4 2126 1 1 7 THR HG21 H 13.242 1.365 1.886 1.00 . A A . 7 THR HG21 1 1 4 2127 1 1 7 THR HG22 H 11.946 0.191 2.168 1.00 . A A . 7 THR HG22 1 1 4 2128 1 1 7 THR HG23 H 11.855 1.299 0.780 1.00 . A A . 7 THR HG23 1 1 4 2129 1 1 7 THR N N 9.274 3.241 3.164 1.00 . A A . 7 THR N 1 1 4 2130 1 1 7 THR O O 9.286 -0.251 2.745 1.00 . A A . 7 THR O 1 1 4 2131 1 1 7 THR OG1 O 11.787 3.528 2.238 1.00 . A A . 7 THR OG1 1 1 4 2132 1 1 8 THR C C 7.407 -0.610 5.144 1.00 . A A . 8 THR C 1 1 4 2133 1 1 8 THR CA C 8.852 -0.252 5.507 1.00 . A A . 8 THR CA 1 1 4 2134 1 1 8 THR CB C 8.989 0.081 7.000 1.00 . A A . 8 THR CB 1 1 4 2135 1 1 8 THR CG2 C 8.786 -1.173 7.858 1.00 . A A . 8 THR CG2 1 1 4 2136 1 1 8 THR H H 9.526 1.733 5.171 1.00 . A A . 8 THR H 1 1 4 2137 1 1 8 THR HA H 9.495 -1.108 5.296 1.00 . A A . 8 THR HA 1 1 4 2138 1 1 8 THR HB H 8.253 0.835 7.278 1.00 . A A . 8 THR HB 1 1 4 2139 1 1 8 THR HG1 H 10.338 0.844 8.181 1.00 . A A . 8 THR HG1 1 1 4 2140 1 1 8 THR HG21 H 9.503 -1.944 7.569 1.00 . A A . 8 THR HG21 1 1 4 2141 1 1 8 THR HG22 H 8.932 -0.931 8.910 1.00 . A A . 8 THR HG22 1 1 4 2142 1 1 8 THR HG23 H 7.776 -1.564 7.729 1.00 . A A . 8 THR HG23 1 1 4 2143 1 1 8 THR N N 9.323 0.866 4.696 1.00 . A A . 8 THR N 1 1 4 2144 1 1 8 THR O O 7.057 -1.787 5.076 1.00 . A A . 8 THR O 1 1 4 2145 1 1 8 THR OG1 O 10.279 0.606 7.253 1.00 . A A . 8 THR OG1 1 1 4 2146 1 1 9 GLY C C 5.226 -0.514 3.062 1.00 . A A . 9 GLY C 1 1 4 2147 1 1 9 GLY CA C 5.216 0.211 4.404 1.00 . A A . 9 GLY CA 1 1 4 2148 1 1 9 GLY H H 6.925 1.350 4.918 1.00 . A A . 9 GLY H 1 1 4 2149 1 1 9 GLY HA2 H 4.649 -0.368 5.133 1.00 . A A . 9 GLY HA2 1 1 4 2150 1 1 9 GLY HA3 H 4.742 1.181 4.278 1.00 . A A . 9 GLY HA3 1 1 4 2151 1 1 9 GLY N N 6.573 0.405 4.885 1.00 . A A . 9 GLY N 1 1 4 2152 1 1 9 GLY O O 4.516 -1.504 2.893 1.00 . A A . 9 GLY O 1 1 4 2153 1 1 10 ARG C C 6.708 -2.146 1.030 1.00 . A A . 10 ARG C 1 1 4 2154 1 1 10 ARG CA C 6.262 -0.697 0.841 1.00 . A A . 10 ARG CA 1 1 4 2155 1 1 10 ARG CB C 7.268 0.075 -0.031 1.00 . A A . 10 ARG CB 1 1 4 2156 1 1 10 ARG CD C 5.735 1.004 -1.821 1.00 . A A . 10 ARG CD 1 1 4 2157 1 1 10 ARG CG C 6.667 1.343 -0.649 1.00 . A A . 10 ARG CG 1 1 4 2158 1 1 10 ARG CZ C 4.018 2.156 -3.204 1.00 . A A . 10 ARG CZ 1 1 4 2159 1 1 10 ARG H H 6.606 0.785 2.333 1.00 . A A . 10 ARG H 1 1 4 2160 1 1 10 ARG HA H 5.299 -0.732 0.342 1.00 . A A . 10 ARG HA 1 1 4 2161 1 1 10 ARG HB2 H 8.128 0.352 0.574 1.00 . A A . 10 ARG HB2 1 1 4 2162 1 1 10 ARG HB3 H 7.617 -0.568 -0.840 1.00 . A A . 10 ARG HB3 1 1 4 2163 1 1 10 ARG HD2 H 6.333 0.594 -2.637 1.00 . A A . 10 ARG HD2 1 1 4 2164 1 1 10 ARG HD3 H 5.002 0.260 -1.518 1.00 . A A . 10 ARG HD3 1 1 4 2165 1 1 10 ARG HE H 5.256 3.084 -1.899 1.00 . A A . 10 ARG HE 1 1 4 2166 1 1 10 ARG HG2 H 6.138 1.894 0.125 1.00 . A A . 10 ARG HG2 1 1 4 2167 1 1 10 ARG HG3 H 7.478 1.969 -1.024 1.00 . A A . 10 ARG HG3 1 1 4 2168 1 1 10 ARG HH11 H 4.034 0.130 -3.456 1.00 . A A . 10 ARG HH11 1 1 4 2169 1 1 10 ARG HH12 H 2.829 0.979 -4.386 1.00 . A A . 10 ARG HH12 1 1 4 2170 1 1 10 ARG HH21 H 3.734 4.167 -3.129 1.00 . A A . 10 ARG HH21 1 1 4 2171 1 1 10 ARG HH22 H 2.691 3.332 -4.251 1.00 . A A . 10 ARG HH22 1 1 4 2172 1 1 10 ARG N N 6.060 -0.041 2.126 1.00 . A A . 10 ARG N 1 1 4 2173 1 1 10 ARG NE N 5.012 2.186 -2.302 1.00 . A A . 10 ARG NE 1 1 4 2174 1 1 10 ARG NH1 N 3.595 0.997 -3.730 1.00 . A A . 10 ARG NH1 1 1 4 2175 1 1 10 ARG NH2 N 3.442 3.305 -3.575 1.00 . A A . 10 ARG NH2 1 1 4 2176 1 1 10 ARG O O 6.179 -3.024 0.364 1.00 . A A . 10 ARG O 1 1 4 2177 1 1 11 ASN C C 7.010 -4.680 2.625 1.00 . A A . 11 ASN C 1 1 4 2178 1 1 11 ASN CA C 8.151 -3.750 2.203 1.00 . A A . 11 ASN CA 1 1 4 2179 1 1 11 ASN CB C 9.271 -3.681 3.247 1.00 . A A . 11 ASN CB 1 1 4 2180 1 1 11 ASN CG C 9.684 -5.061 3.751 1.00 . A A . 11 ASN CG 1 1 4 2181 1 1 11 ASN H H 8.058 -1.641 2.454 1.00 . A A . 11 ASN H 1 1 4 2182 1 1 11 ASN HA H 8.579 -4.150 1.281 1.00 . A A . 11 ASN HA 1 1 4 2183 1 1 11 ASN HB2 H 10.141 -3.197 2.803 1.00 . A A . 11 ASN HB2 1 1 4 2184 1 1 11 ASN HB3 H 8.949 -3.082 4.096 1.00 . A A . 11 ASN HB3 1 1 4 2185 1 1 11 ASN HD21 H 8.688 -4.767 5.505 1.00 . A A . 11 ASN HD21 1 1 4 2186 1 1 11 ASN HD22 H 9.531 -6.292 5.360 1.00 . A A . 11 ASN HD22 1 1 4 2187 1 1 11 ASN N N 7.657 -2.407 1.931 1.00 . A A . 11 ASN N 1 1 4 2188 1 1 11 ASN ND2 N 9.262 -5.402 4.970 1.00 . A A . 11 ASN ND2 1 1 4 2189 1 1 11 ASN O O 6.834 -5.730 2.012 1.00 . A A . 11 ASN O 1 1 4 2190 1 1 11 ASN OD1 O 10.379 -5.797 3.057 1.00 . A A . 11 ASN OD1 1 1 4 2191 1 1 12 ILE C C 4.113 -5.362 2.998 1.00 . A A . 12 ILE C 1 1 4 2192 1 1 12 ILE CA C 5.119 -5.121 4.128 1.00 . A A . 12 ILE CA 1 1 4 2193 1 1 12 ILE CB C 4.461 -4.474 5.362 1.00 . A A . 12 ILE CB 1 1 4 2194 1 1 12 ILE CD1 C 5.008 -3.419 7.623 1.00 . A A . 12 ILE CD1 1 1 4 2195 1 1 12 ILE CG1 C 5.468 -4.385 6.526 1.00 . A A . 12 ILE CG1 1 1 4 2196 1 1 12 ILE CG2 C 3.234 -5.295 5.802 1.00 . A A . 12 ILE CG2 1 1 4 2197 1 1 12 ILE H H 6.383 -3.398 4.084 1.00 . A A . 12 ILE H 1 1 4 2198 1 1 12 ILE HA H 5.524 -6.088 4.431 1.00 . A A . 12 ILE HA 1 1 4 2199 1 1 12 ILE HB H 4.135 -3.468 5.097 1.00 . A A . 12 ILE HB 1 1 4 2200 1 1 12 ILE HD11 H 4.119 -3.794 8.126 1.00 . A A . 12 ILE HD11 1 1 4 2201 1 1 12 ILE HD12 H 5.803 -3.311 8.361 1.00 . A A . 12 ILE HD12 1 1 4 2202 1 1 12 ILE HD13 H 4.794 -2.440 7.190 1.00 . A A . 12 ILE HD13 1 1 4 2203 1 1 12 ILE HG12 H 5.624 -5.376 6.953 1.00 . A A . 12 ILE HG12 1 1 4 2204 1 1 12 ILE HG13 H 6.430 -4.024 6.170 1.00 . A A . 12 ILE HG13 1 1 4 2205 1 1 12 ILE HG21 H 3.529 -6.328 5.995 1.00 . A A . 12 ILE HG21 1 1 4 2206 1 1 12 ILE HG22 H 2.795 -4.882 6.707 1.00 . A A . 12 ILE HG22 1 1 4 2207 1 1 12 ILE HG23 H 2.465 -5.288 5.030 1.00 . A A . 12 ILE HG23 1 1 4 2208 1 1 12 ILE N N 6.224 -4.297 3.641 1.00 . A A . 12 ILE N 1 1 4 2209 1 1 12 ILE O O 3.716 -6.501 2.754 1.00 . A A . 12 ILE O 1 1 4 2210 1 1 13 TYR C C 3.244 -5.306 0.108 1.00 . A A . 13 TYR C 1 1 4 2211 1 1 13 TYR CA C 2.793 -4.314 1.186 1.00 . A A . 13 TYR CA 1 1 4 2212 1 1 13 TYR CB C 2.648 -2.891 0.633 1.00 . A A . 13 TYR CB 1 1 4 2213 1 1 13 TYR CD1 C 0.469 -3.116 -0.633 1.00 . A A . 13 TYR CD1 1 1 4 2214 1 1 13 TYR CD2 C 2.422 -2.278 -1.817 1.00 . A A . 13 TYR CD2 1 1 4 2215 1 1 13 TYR CE1 C -0.294 -2.998 -1.807 1.00 . A A . 13 TYR CE1 1 1 4 2216 1 1 13 TYR CE2 C 1.657 -2.148 -2.988 1.00 . A A . 13 TYR CE2 1 1 4 2217 1 1 13 TYR CG C 1.830 -2.769 -0.638 1.00 . A A . 13 TYR CG 1 1 4 2218 1 1 13 TYR CZ C 0.299 -2.518 -2.986 1.00 . A A . 13 TYR CZ 1 1 4 2219 1 1 13 TYR H H 4.100 -3.385 2.567 1.00 . A A . 13 TYR H 1 1 4 2220 1 1 13 TYR HA H 1.824 -4.639 1.569 1.00 . A A . 13 TYR HA 1 1 4 2221 1 1 13 TYR HB2 H 2.180 -2.268 1.395 1.00 . A A . 13 TYR HB2 1 1 4 2222 1 1 13 TYR HB3 H 3.641 -2.489 0.445 1.00 . A A . 13 TYR HB3 1 1 4 2223 1 1 13 TYR HD1 H 0.006 -3.471 0.274 1.00 . A A . 13 TYR HD1 1 1 4 2224 1 1 13 TYR HD2 H 3.466 -1.999 -1.829 1.00 . A A . 13 TYR HD2 1 1 4 2225 1 1 13 TYR HE1 H -1.337 -3.270 -1.799 1.00 . A A . 13 TYR HE1 1 1 4 2226 1 1 13 TYR HE2 H 2.115 -1.768 -3.889 1.00 . A A . 13 TYR HE2 1 1 4 2227 1 1 13 TYR HH H 0.044 -2.014 -4.851 1.00 . A A . 13 TYR HH 1 1 4 2228 1 1 13 TYR N N 3.722 -4.286 2.305 1.00 . A A . 13 TYR N 1 1 4 2229 1 1 13 TYR O O 2.469 -6.172 -0.286 1.00 . A A . 13 TYR O 1 1 4 2230 1 1 13 TYR OH O -0.443 -2.415 -4.127 1.00 . A A . 13 TYR OH 1 1 4 2231 1 1 14 ASN C C 5.157 -7.490 -0.951 1.00 . A A . 14 ASN C 1 1 4 2232 1 1 14 ASN CA C 5.075 -6.028 -1.393 1.00 . A A . 14 ASN CA 1 1 4 2233 1 1 14 ASN CB C 6.455 -5.499 -1.807 1.00 . A A . 14 ASN CB 1 1 4 2234 1 1 14 ASN CG C 6.354 -4.413 -2.879 1.00 . A A . 14 ASN CG 1 1 4 2235 1 1 14 ASN H H 5.079 -4.467 0.040 1.00 . A A . 14 ASN H 1 1 4 2236 1 1 14 ASN HA H 4.425 -5.989 -2.270 1.00 . A A . 14 ASN HA 1 1 4 2237 1 1 14 ASN HB2 H 7.011 -5.144 -0.939 1.00 . A A . 14 ASN HB2 1 1 4 2238 1 1 14 ASN HB3 H 7.028 -6.314 -2.249 1.00 . A A . 14 ASN HB3 1 1 4 2239 1 1 14 ASN HD21 H 6.204 -2.936 -1.487 1.00 . A A . 14 ASN HD21 1 1 4 2240 1 1 14 ASN HD22 H 6.183 -2.414 -3.160 1.00 . A A . 14 ASN HD22 1 1 4 2241 1 1 14 ASN N N 4.492 -5.184 -0.357 1.00 . A A . 14 ASN N 1 1 4 2242 1 1 14 ASN ND2 N 6.230 -3.149 -2.474 1.00 . A A . 14 ASN ND2 1 1 4 2243 1 1 14 ASN O O 4.850 -8.376 -1.743 1.00 . A A . 14 ASN O 1 1 4 2244 1 1 14 ASN OD1 O 6.393 -4.712 -4.069 1.00 . A A . 14 ASN OD1 1 1 4 2245 1 1 15 THR C C 4.251 -9.765 0.826 1.00 . A A . 15 THR C 1 1 4 2246 1 1 15 THR CA C 5.636 -9.113 0.825 1.00 . A A . 15 THR CA 1 1 4 2247 1 1 15 THR CB C 6.266 -9.102 2.226 1.00 . A A . 15 THR CB 1 1 4 2248 1 1 15 THR CG2 C 6.390 -10.519 2.798 1.00 . A A . 15 THR CG2 1 1 4 2249 1 1 15 THR H H 5.810 -6.990 0.916 1.00 . A A . 15 THR H 1 1 4 2250 1 1 15 THR HA H 6.283 -9.694 0.166 1.00 . A A . 15 THR HA 1 1 4 2251 1 1 15 THR HB H 5.657 -8.501 2.901 1.00 . A A . 15 THR HB 1 1 4 2252 1 1 15 THR HG1 H 8.091 -9.043 1.546 1.00 . A A . 15 THR HG1 1 1 4 2253 1 1 15 THR HG21 H 6.906 -10.480 3.758 1.00 . A A . 15 THR HG21 1 1 4 2254 1 1 15 THR HG22 H 5.403 -10.956 2.955 1.00 . A A . 15 THR HG22 1 1 4 2255 1 1 15 THR HG23 H 6.958 -11.151 2.115 1.00 . A A . 15 THR HG23 1 1 4 2256 1 1 15 THR N N 5.559 -7.753 0.299 1.00 . A A . 15 THR N 1 1 4 2257 1 1 15 THR O O 4.104 -10.903 0.386 1.00 . A A . 15 THR O 1 1 4 2258 1 1 15 THR OG1 O 7.557 -8.534 2.161 1.00 . A A . 15 THR OG1 1 1 4 2259 1 1 16 CYS C C 1.303 -9.748 -0.059 1.00 . A A . 16 CYS C 1 1 4 2260 1 1 16 CYS CA C 1.856 -9.500 1.349 1.00 . A A . 16 CYS CA 1 1 4 2261 1 1 16 CYS CB C 1.033 -8.476 2.133 1.00 . A A . 16 CYS CB 1 1 4 2262 1 1 16 CYS H H 3.431 -8.107 1.652 1.00 . A A . 16 CYS H 1 1 4 2263 1 1 16 CYS HA H 1.823 -10.444 1.895 1.00 . A A . 16 CYS HA 1 1 4 2264 1 1 16 CYS HB2 H 1.389 -8.485 3.164 1.00 . A A . 16 CYS HB2 1 1 4 2265 1 1 16 CYS HB3 H 1.213 -7.481 1.730 1.00 . A A . 16 CYS HB3 1 1 4 2266 1 1 16 CYS N N 3.236 -9.038 1.304 1.00 . A A . 16 CYS N 1 1 4 2267 1 1 16 CYS O O 0.676 -10.777 -0.306 1.00 . A A . 16 CYS O 1 1 4 2268 1 1 16 CYS SG S -0.756 -8.747 2.170 1.00 . A A . 16 CYS SG 1 1 4 2269 1 1 17 ARG C C 1.762 -10.198 -2.995 1.00 . A A . 17 ARG C 1 1 4 2270 1 1 17 ARG CA C 1.162 -8.931 -2.384 1.00 . A A . 17 ARG CA 1 1 4 2271 1 1 17 ARG CB C 1.638 -7.693 -3.155 1.00 . A A . 17 ARG CB 1 1 4 2272 1 1 17 ARG CD C -0.248 -6.171 -3.887 1.00 . A A . 17 ARG CD 1 1 4 2273 1 1 17 ARG CG C 0.825 -6.432 -2.827 1.00 . A A . 17 ARG CG 1 1 4 2274 1 1 17 ARG CZ C -1.702 -7.844 -5.079 1.00 . A A . 17 ARG CZ 1 1 4 2275 1 1 17 ARG H H 2.038 -7.974 -0.704 1.00 . A A . 17 ARG H 1 1 4 2276 1 1 17 ARG HA H 0.078 -9.006 -2.448 1.00 . A A . 17 ARG HA 1 1 4 2277 1 1 17 ARG HB2 H 2.681 -7.510 -2.904 1.00 . A A . 17 ARG HB2 1 1 4 2278 1 1 17 ARG HB3 H 1.587 -7.887 -4.227 1.00 . A A . 17 ARG HB3 1 1 4 2279 1 1 17 ARG HD2 H -0.769 -5.254 -3.622 1.00 . A A . 17 ARG HD2 1 1 4 2280 1 1 17 ARG HD3 H 0.262 -6.007 -4.835 1.00 . A A . 17 ARG HD3 1 1 4 2281 1 1 17 ARG HE H -1.533 -7.649 -3.073 1.00 . A A . 17 ARG HE 1 1 4 2282 1 1 17 ARG HG2 H 0.363 -6.511 -1.843 1.00 . A A . 17 ARG HG2 1 1 4 2283 1 1 17 ARG HG3 H 1.502 -5.577 -2.822 1.00 . A A . 17 ARG HG3 1 1 4 2284 1 1 17 ARG HH11 H -0.681 -6.665 -6.406 1.00 . A A . 17 ARG HH11 1 1 4 2285 1 1 17 ARG HH12 H -1.709 -7.875 -7.121 1.00 . A A . 17 ARG HH12 1 1 4 2286 1 1 17 ARG HH21 H -2.808 -9.221 -4.063 1.00 . A A . 17 ARG HH21 1 1 4 2287 1 1 17 ARG HH22 H -2.931 -9.314 -5.804 1.00 . A A . 17 ARG HH22 1 1 4 2288 1 1 17 ARG N N 1.542 -8.810 -0.983 1.00 . A A . 17 ARG N 1 1 4 2289 1 1 17 ARG NE N -1.222 -7.272 -3.960 1.00 . A A . 17 ARG NE 1 1 4 2290 1 1 17 ARG NH1 N -1.342 -7.417 -6.299 1.00 . A A . 17 ARG NH1 1 1 4 2291 1 1 17 ARG NH2 N -2.562 -8.865 -4.978 1.00 . A A . 17 ARG NH2 1 1 4 2292 1 1 17 ARG O O 1.057 -10.957 -3.656 1.00 . A A . 17 ARG O 1 1 4 2293 1 1 18 PHE C C 3.228 -12.874 -2.655 1.00 . A A . 18 PHE C 1 1 4 2294 1 1 18 PHE CA C 3.792 -11.580 -3.247 1.00 . A A . 18 PHE CA 1 1 4 2295 1 1 18 PHE CB C 5.281 -11.411 -2.932 1.00 . A A . 18 PHE CB 1 1 4 2296 1 1 18 PHE CD1 C 6.371 -12.858 -4.699 1.00 . A A . 18 PHE CD1 1 1 4 2297 1 1 18 PHE CD2 C 6.633 -13.476 -2.358 1.00 . A A . 18 PHE CD2 1 1 4 2298 1 1 18 PHE CE1 C 7.114 -13.989 -5.081 1.00 . A A . 18 PHE CE1 1 1 4 2299 1 1 18 PHE CE2 C 7.379 -14.604 -2.740 1.00 . A A . 18 PHE CE2 1 1 4 2300 1 1 18 PHE CG C 6.135 -12.596 -3.337 1.00 . A A . 18 PHE CG 1 1 4 2301 1 1 18 PHE CZ C 7.618 -14.861 -4.101 1.00 . A A . 18 PHE CZ 1 1 4 2302 1 1 18 PHE H H 3.573 -9.753 -2.196 1.00 . A A . 18 PHE H 1 1 4 2303 1 1 18 PHE HA H 3.678 -11.624 -4.332 1.00 . A A . 18 PHE HA 1 1 4 2304 1 1 18 PHE HB2 H 5.650 -10.529 -3.456 1.00 . A A . 18 PHE HB2 1 1 4 2305 1 1 18 PHE HB3 H 5.404 -11.235 -1.864 1.00 . A A . 18 PHE HB3 1 1 4 2306 1 1 18 PHE HD1 H 5.976 -12.197 -5.458 1.00 . A A . 18 PHE HD1 1 1 4 2307 1 1 18 PHE HD2 H 6.440 -13.294 -1.311 1.00 . A A . 18 PHE HD2 1 1 4 2308 1 1 18 PHE HE1 H 7.295 -14.188 -6.127 1.00 . A A . 18 PHE HE1 1 1 4 2309 1 1 18 PHE HE2 H 7.766 -15.275 -1.987 1.00 . A A . 18 PHE HE2 1 1 4 2310 1 1 18 PHE HZ H 8.187 -15.733 -4.394 1.00 . A A . 18 PHE HZ 1 1 4 2311 1 1 18 PHE N N 3.061 -10.420 -2.759 1.00 . A A . 18 PHE N 1 1 4 2312 1 1 18 PHE O O 3.065 -13.854 -3.380 1.00 . A A . 18 PHE O 1 1 4 2313 1 1 19 ALA C C 0.972 -14.381 -1.349 1.00 . A A . 19 ALA C 1 1 4 2314 1 1 19 ALA CA C 2.297 -14.009 -0.678 1.00 . A A . 19 ALA CA 1 1 4 2315 1 1 19 ALA CB C 2.097 -13.700 0.809 1.00 . A A . 19 ALA CB 1 1 4 2316 1 1 19 ALA H H 3.093 -12.041 -0.806 1.00 . A A . 19 ALA H 1 1 4 2317 1 1 19 ALA HA H 2.977 -14.858 -0.751 1.00 . A A . 19 ALA HA 1 1 4 2318 1 1 19 ALA HB1 H 3.049 -13.422 1.262 1.00 . A A . 19 ALA HB1 1 1 4 2319 1 1 19 ALA HB2 H 1.386 -12.886 0.940 1.00 . A A . 19 ALA HB2 1 1 4 2320 1 1 19 ALA HB3 H 1.711 -14.586 1.313 1.00 . A A . 19 ALA HB3 1 1 4 2321 1 1 19 ALA N N 2.917 -12.874 -1.351 1.00 . A A . 19 ALA N 1 1 4 2322 1 1 19 ALA O O 0.727 -15.559 -1.601 1.00 . A A . 19 ALA O 1 1 4 2323 1 1 20 GLY C C -2.246 -12.709 -1.944 1.00 . A A . 20 GLY C 1 1 4 2324 1 1 20 GLY CA C -1.066 -13.535 -2.459 1.00 . A A . 20 GLY CA 1 1 4 2325 1 1 20 GLY H H 0.421 -12.433 -1.417 1.00 . A A . 20 GLY H 1 1 4 2326 1 1 20 GLY HA2 H -0.845 -13.219 -3.479 1.00 . A A . 20 GLY HA2 1 1 4 2327 1 1 20 GLY HA3 H -1.377 -14.580 -2.485 1.00 . A A . 20 GLY HA3 1 1 4 2328 1 1 20 GLY N N 0.145 -13.375 -1.663 1.00 . A A . 20 GLY N 1 1 4 2329 1 1 20 GLY O O -3.360 -12.884 -2.437 1.00 . A A . 20 GLY O 1 1 4 2330 1 1 21 GLY C C -3.458 -9.879 -1.447 1.00 . A A . 21 GLY C 1 1 4 2331 1 1 21 GLY CA C -3.086 -10.969 -0.441 1.00 . A A . 21 GLY CA 1 1 4 2332 1 1 21 GLY H H -1.097 -11.678 -0.608 1.00 . A A . 21 GLY H 1 1 4 2333 1 1 21 GLY HA2 H -3.957 -11.583 -0.211 1.00 . A A . 21 GLY HA2 1 1 4 2334 1 1 21 GLY HA3 H -2.741 -10.509 0.483 1.00 . A A . 21 GLY HA3 1 1 4 2335 1 1 21 GLY N N -2.030 -11.813 -0.973 1.00 . A A . 21 GLY N 1 1 4 2336 1 1 21 GLY O O -2.605 -9.412 -2.201 1.00 . A A . 21 GLY O 1 1 4 2337 1 1 22 SER C C -4.585 -7.109 -2.125 1.00 . A A . 22 SER C 1 1 4 2338 1 1 22 SER CA C -5.250 -8.464 -2.377 1.00 . A A . 22 SER CA 1 1 4 2339 1 1 22 SER CB C -6.769 -8.352 -2.223 1.00 . A A . 22 SER CB 1 1 4 2340 1 1 22 SER H H -5.383 -9.889 -0.807 1.00 . A A . 22 SER H 1 1 4 2341 1 1 22 SER HA H -5.034 -8.780 -3.399 1.00 . A A . 22 SER HA 1 1 4 2342 1 1 22 SER HB2 H -7.015 -7.995 -1.223 1.00 . A A . 22 SER HB2 1 1 4 2343 1 1 22 SER HB3 H -7.156 -7.640 -2.953 1.00 . A A . 22 SER HB3 1 1 4 2344 1 1 22 SER HG H -7.067 -10.232 -1.795 1.00 . A A . 22 SER HG 1 1 4 2345 1 1 22 SER N N -4.734 -9.474 -1.460 1.00 . A A . 22 SER N 1 1 4 2346 1 1 22 SER O O -4.078 -6.861 -1.034 1.00 . A A . 22 SER O 1 1 4 2347 1 1 22 SER OG O -7.386 -9.602 -2.446 1.00 . A A . 22 SER OG 1 1 4 2348 1 1 23 ARG C C -4.538 -4.134 -1.849 1.00 . A A . 23 ARG C 1 1 4 2349 1 1 23 ARG CA C -4.000 -4.903 -3.055 1.00 . A A . 23 ARG CA 1 1 4 2350 1 1 23 ARG CB C -4.255 -4.117 -4.348 1.00 . A A . 23 ARG CB 1 1 4 2351 1 1 23 ARG CD C -3.801 -3.923 -6.826 1.00 . A A . 23 ARG CD 1 1 4 2352 1 1 23 ARG CG C -3.527 -4.728 -5.552 1.00 . A A . 23 ARG CG 1 1 4 2353 1 1 23 ARG CZ C -2.005 -2.186 -7.050 1.00 . A A . 23 ARG CZ 1 1 4 2354 1 1 23 ARG H H -5.055 -6.492 -3.998 1.00 . A A . 23 ARG H 1 1 4 2355 1 1 23 ARG HA H -2.926 -5.019 -2.922 1.00 . A A . 23 ARG HA 1 1 4 2356 1 1 23 ARG HB2 H -5.327 -4.082 -4.550 1.00 . A A . 23 ARG HB2 1 1 4 2357 1 1 23 ARG HB3 H -3.898 -3.098 -4.197 1.00 . A A . 23 ARG HB3 1 1 4 2358 1 1 23 ARG HD2 H -3.382 -4.447 -7.686 1.00 . A A . 23 ARG HD2 1 1 4 2359 1 1 23 ARG HD3 H -4.879 -3.855 -6.977 1.00 . A A . 23 ARG HD3 1 1 4 2360 1 1 23 ARG HE H -3.899 -1.847 -6.412 1.00 . A A . 23 ARG HE 1 1 4 2361 1 1 23 ARG HG2 H -2.454 -4.749 -5.359 1.00 . A A . 23 ARG HG2 1 1 4 2362 1 1 23 ARG HG3 H -3.879 -5.748 -5.710 1.00 . A A . 23 ARG HG3 1 1 4 2363 1 1 23 ARG HH11 H -1.365 -4.043 -7.611 1.00 . A A . 23 ARG HH11 1 1 4 2364 1 1 23 ARG HH12 H -0.171 -2.777 -7.740 1.00 . A A . 23 ARG HH12 1 1 4 2365 1 1 23 ARG HH21 H -2.314 -0.227 -6.568 1.00 . A A . 23 ARG HH21 1 1 4 2366 1 1 23 ARG HH22 H -0.714 -0.605 -7.158 1.00 . A A . 23 ARG HH22 1 1 4 2367 1 1 23 ARG N N -4.601 -6.230 -3.135 1.00 . A A . 23 ARG N 1 1 4 2368 1 1 23 ARG NE N -3.260 -2.558 -6.738 1.00 . A A . 23 ARG NE 1 1 4 2369 1 1 23 ARG NH1 N -1.106 -3.074 -7.495 1.00 . A A . 23 ARG NH1 1 1 4 2370 1 1 23 ARG NH2 N -1.647 -0.904 -6.913 1.00 . A A . 23 ARG NH2 1 1 4 2371 1 1 23 ARG O O -3.762 -3.676 -1.015 1.00 . A A . 23 ARG O 1 1 4 2372 1 1 24 GLU C C -6.168 -3.917 0.689 1.00 . A A . 24 GLU C 1 1 4 2373 1 1 24 GLU CA C -6.541 -3.320 -0.669 1.00 . A A . 24 GLU CA 1 1 4 2374 1 1 24 GLU CB C -8.057 -3.371 -0.889 1.00 . A A . 24 GLU CB 1 1 4 2375 1 1 24 GLU CD C -9.978 -2.597 -2.337 1.00 . A A . 24 GLU CD 1 1 4 2376 1 1 24 GLU CG C -8.464 -2.595 -2.149 1.00 . A A . 24 GLU CG 1 1 4 2377 1 1 24 GLU H H -6.436 -4.421 -2.482 1.00 . A A . 24 GLU H 1 1 4 2378 1 1 24 GLU HA H -6.226 -2.275 -0.673 1.00 . A A . 24 GLU HA 1 1 4 2379 1 1 24 GLU HB2 H -8.383 -4.409 -0.978 1.00 . A A . 24 GLU HB2 1 1 4 2380 1 1 24 GLU HB3 H -8.553 -2.921 -0.027 1.00 . A A . 24 GLU HB3 1 1 4 2381 1 1 24 GLU HE2 H -11.532 -1.439 -2.480 1.00 . A A . 24 GLU HE2 1 1 4 2382 1 1 24 GLU HG2 H -8.112 -1.565 -2.064 1.00 . A A . 24 GLU HG2 1 1 4 2383 1 1 24 GLU HG3 H -8.011 -3.045 -3.032 1.00 . A A . 24 GLU HG3 1 1 4 2384 1 1 24 GLU N N -5.865 -4.013 -1.756 1.00 . A A . 24 GLU N 1 1 4 2385 1 1 24 GLU O O -5.832 -3.177 1.608 1.00 . A A . 24 GLU O 1 1 4 2386 1 1 24 GLU OE1 O -10.567 -3.669 -2.457 1.00 . A A . 24 GLU OE1 1 1 4 2387 1 1 24 GLU OE2 O -10.582 -1.376 -2.362 1.00 . A A . 24 GLU OE2 1 1 4 2388 1 1 25 ARG C C -4.540 -5.701 2.547 1.00 . A A . 25 ARG C 1 1 4 2389 1 1 25 ARG CA C -5.964 -5.958 2.054 1.00 . A A . 25 ARG CA 1 1 4 2390 1 1 25 ARG CB C -6.224 -7.450 1.823 1.00 . A A . 25 ARG CB 1 1 4 2391 1 1 25 ARG CD C -6.723 -9.674 2.910 1.00 . A A . 25 ARG CD 1 1 4 2392 1 1 25 ARG CG C -6.282 -8.224 3.144 1.00 . A A . 25 ARG CG 1 1 4 2393 1 1 25 ARG CZ C -9.225 -9.599 3.047 1.00 . A A . 25 ARG CZ 1 1 4 2394 1 1 25 ARG H H -6.494 -5.800 0.012 1.00 . A A . 25 ARG H 1 1 4 2395 1 1 25 ARG HA H -6.669 -5.590 2.802 1.00 . A A . 25 ARG HA 1 1 4 2396 1 1 25 ARG HB2 H -7.180 -7.543 1.309 1.00 . A A . 25 ARG HB2 1 1 4 2397 1 1 25 ARG HB3 H -5.451 -7.877 1.183 1.00 . A A . 25 ARG HB3 1 1 4 2398 1 1 25 ARG HD2 H -6.031 -10.146 2.212 1.00 . A A . 25 ARG HD2 1 1 4 2399 1 1 25 ARG HD3 H -6.670 -10.218 3.852 1.00 . A A . 25 ARG HD3 1 1 4 2400 1 1 25 ARG HE H -8.147 -9.941 1.363 1.00 . A A . 25 ARG HE 1 1 4 2401 1 1 25 ARG HG2 H -5.293 -8.224 3.603 1.00 . A A . 25 ARG HG2 1 1 4 2402 1 1 25 ARG HG3 H -6.979 -7.734 3.823 1.00 . A A . 25 ARG HG3 1 1 4 2403 1 1 25 ARG HH11 H -8.324 -9.313 4.858 1.00 . A A . 25 ARG HH11 1 1 4 2404 1 1 25 ARG HH12 H -10.068 -9.251 4.879 1.00 . A A . 25 ARG HH12 1 1 4 2405 1 1 25 ARG HH21 H -10.429 -9.837 1.411 1.00 . A A . 25 ARG HH21 1 1 4 2406 1 1 25 ARG HH22 H -11.266 -9.546 2.915 1.00 . A A . 25 ARG HH22 1 1 4 2407 1 1 25 ARG N N -6.226 -5.247 0.812 1.00 . A A . 25 ARG N 1 1 4 2408 1 1 25 ARG NE N -8.083 -9.760 2.355 1.00 . A A . 25 ARG NE 1 1 4 2409 1 1 25 ARG NH1 N -9.205 -9.369 4.368 1.00 . A A . 25 ARG NH1 1 1 4 2410 1 1 25 ARG NH2 N -10.400 -9.667 2.407 1.00 . A A . 25 ARG NH2 1 1 4 2411 1 1 25 ARG O O -4.337 -5.317 3.696 1.00 . A A . 25 ARG O 1 1 4 2412 1 1 26 CYS C C -1.865 -4.220 2.255 1.00 . A A . 26 CYS C 1 1 4 2413 1 1 26 CYS CA C -2.152 -5.682 1.928 1.00 . A A . 26 CYS CA 1 1 4 2414 1 1 26 CYS CB C -1.333 -6.142 0.721 1.00 . A A . 26 CYS CB 1 1 4 2415 1 1 26 CYS H H -3.821 -6.223 0.734 1.00 . A A . 26 CYS H 1 1 4 2416 1 1 26 CYS HA H -1.867 -6.273 2.799 1.00 . A A . 26 CYS HA 1 1 4 2417 1 1 26 CYS HB2 H -1.685 -5.628 -0.174 1.00 . A A . 26 CYS HB2 1 1 4 2418 1 1 26 CYS HB3 H -0.291 -5.868 0.881 1.00 . A A . 26 CYS HB3 1 1 4 2419 1 1 26 CYS N N -3.563 -5.905 1.659 1.00 . A A . 26 CYS N 1 1 4 2420 1 1 26 CYS O O -1.055 -3.931 3.135 1.00 . A A . 26 CYS O 1 1 4 2421 1 1 26 CYS SG S -1.393 -7.924 0.416 1.00 . A A . 26 CYS SG 1 1 4 2422 1 1 27 ALA C C -2.890 -1.566 3.245 1.00 . A A . 27 ALA C 1 1 4 2423 1 1 27 ALA CA C -2.411 -1.877 1.827 1.00 . A A . 27 ALA CA 1 1 4 2424 1 1 27 ALA CB C -3.173 -1.089 0.766 1.00 . A A . 27 ALA CB 1 1 4 2425 1 1 27 ALA H H -3.173 -3.587 0.831 1.00 . A A . 27 ALA H 1 1 4 2426 1 1 27 ALA HA H -1.362 -1.601 1.740 1.00 . A A . 27 ALA HA 1 1 4 2427 1 1 27 ALA HB1 H -2.768 -1.347 -0.212 1.00 . A A . 27 ALA HB1 1 1 4 2428 1 1 27 ALA HB2 H -4.237 -1.323 0.794 1.00 . A A . 27 ALA HB2 1 1 4 2429 1 1 27 ALA HB3 H -3.040 -0.021 0.921 1.00 . A A . 27 ALA HB3 1 1 4 2430 1 1 27 ALA N N -2.530 -3.296 1.556 1.00 . A A . 27 ALA N 1 1 4 2431 1 1 27 ALA O O -2.200 -0.873 3.984 1.00 . A A . 27 ALA O 1 1 4 2432 1 1 28 LYS C C -3.608 -2.481 6.045 1.00 . A A . 28 LYS C 1 1 4 2433 1 1 28 LYS CA C -4.583 -1.948 4.989 1.00 . A A . 28 LYS CA 1 1 4 2434 1 1 28 LYS CB C -5.935 -2.669 5.075 1.00 . A A . 28 LYS CB 1 1 4 2435 1 1 28 LYS CD C -6.705 -1.591 7.246 1.00 . A A . 28 LYS CD 1 1 4 2436 1 1 28 LYS CE C -7.860 -0.843 7.918 1.00 . A A . 28 LYS CE 1 1 4 2437 1 1 28 LYS CG C -7.009 -1.822 5.761 1.00 . A A . 28 LYS CG 1 1 4 2438 1 1 28 LYS H H -4.568 -2.689 3.005 1.00 . A A . 28 LYS H 1 1 4 2439 1 1 28 LYS HA H -4.730 -0.878 5.146 1.00 . A A . 28 LYS HA 1 1 4 2440 1 1 28 LYS HB2 H -6.297 -2.879 4.072 1.00 . A A . 28 LYS HB2 1 1 4 2441 1 1 28 LYS HB3 H -5.826 -3.626 5.588 1.00 . A A . 28 LYS HB3 1 1 4 2442 1 1 28 LYS HD2 H -6.558 -2.555 7.736 1.00 . A A . 28 LYS HD2 1 1 4 2443 1 1 28 LYS HD3 H -5.797 -0.996 7.347 1.00 . A A . 28 LYS HD3 1 1 4 2444 1 1 28 LYS HE2 H -7.982 0.132 7.447 1.00 . A A . 28 LYS HE2 1 1 4 2445 1 1 28 LYS HE3 H -8.783 -1.413 7.798 1.00 . A A . 28 LYS HE3 1 1 4 2446 1 1 28 LYS HG2 H -7.101 -0.863 5.248 1.00 . A A . 28 LYS HG2 1 1 4 2447 1 1 28 LYS HG3 H -7.951 -2.358 5.660 1.00 . A A . 28 LYS HG3 1 1 4 2448 1 1 28 LYS HZ1 H -7.512 -1.549 9.809 1.00 . A A . 28 LYS HZ1 1 1 4 2449 1 1 28 LYS HZ2 H -6.756 -0.120 9.486 1.00 . A A . 28 LYS HZ2 1 1 4 2450 1 1 28 LYS HZ3 H -8.379 -0.149 9.771 1.00 . A A . 28 LYS HZ3 1 1 4 2451 1 1 28 LYS N N -4.039 -2.118 3.650 1.00 . A A . 28 LYS N 1 1 4 2452 1 1 28 LYS NZ N -7.606 -0.650 9.357 1.00 . A A . 28 LYS NZ 1 1 4 2453 1 1 28 LYS O O -3.321 -1.797 7.026 1.00 . A A . 28 LYS O 1 1 4 2454 1 1 29 LEU C C -0.903 -3.547 6.920 1.00 . A A . 29 LEU C 1 1 4 2455 1 1 29 LEU CA C -2.162 -4.392 6.697 1.00 . A A . 29 LEU CA 1 1 4 2456 1 1 29 LEU CB C -1.813 -5.744 6.055 1.00 . A A . 29 LEU CB 1 1 4 2457 1 1 29 LEU CD1 C -1.548 -7.147 8.156 1.00 . A A . 29 LEU CD1 1 1 4 2458 1 1 29 LEU CD2 C -0.431 -7.823 6.027 1.00 . A A . 29 LEU CD2 1 1 4 2459 1 1 29 LEU CG C -0.869 -6.630 6.884 1.00 . A A . 29 LEU CG 1 1 4 2460 1 1 29 LEU H H -3.410 -4.196 4.998 1.00 . A A . 29 LEU H 1 1 4 2461 1 1 29 LEU HA H -2.651 -4.563 7.656 1.00 . A A . 29 LEU HA 1 1 4 2462 1 1 29 LEU HB2 H -2.736 -6.292 5.862 1.00 . A A . 29 LEU HB2 1 1 4 2463 1 1 29 LEU HB3 H -1.331 -5.551 5.097 1.00 . A A . 29 LEU HB3 1 1 4 2464 1 1 29 LEU HD11 H -1.778 -6.322 8.829 1.00 . A A . 29 LEU HD11 1 1 4 2465 1 1 29 LEU HD12 H -2.468 -7.674 7.901 1.00 . A A . 29 LEU HD12 1 1 4 2466 1 1 29 LEU HD13 H -0.877 -7.836 8.672 1.00 . A A . 29 LEU HD13 1 1 4 2467 1 1 29 LEU HD21 H 0.129 -7.468 5.162 1.00 . A A . 29 LEU HD21 1 1 4 2468 1 1 29 LEU HD22 H 0.207 -8.486 6.612 1.00 . A A . 29 LEU HD22 1 1 4 2469 1 1 29 LEU HD23 H -1.305 -8.379 5.683 1.00 . A A . 29 LEU HD23 1 1 4 2470 1 1 29 LEU HG H 0.026 -6.074 7.158 1.00 . A A . 29 LEU HG 1 1 4 2471 1 1 29 LEU N N -3.107 -3.703 5.828 1.00 . A A . 29 LEU N 1 1 4 2472 1 1 29 LEU O O -0.448 -3.397 8.051 1.00 . A A . 29 LEU O 1 1 4 2473 1 1 30 SER C C 0.683 -0.838 6.426 1.00 . A A . 30 SER C 1 1 4 2474 1 1 30 SER CA C 0.892 -2.239 5.849 1.00 . A A . 30 SER CA 1 1 4 2475 1 1 30 SER CB C 1.464 -2.158 4.432 1.00 . A A . 30 SER CB 1 1 4 2476 1 1 30 SER H H -0.812 -3.142 4.941 1.00 . A A . 30 SER H 1 1 4 2477 1 1 30 SER HA H 1.622 -2.756 6.473 1.00 . A A . 30 SER HA 1 1 4 2478 1 1 30 SER HB2 H 2.361 -1.539 4.442 1.00 . A A . 30 SER HB2 1 1 4 2479 1 1 30 SER HB3 H 1.721 -3.156 4.080 1.00 . A A . 30 SER HB3 1 1 4 2480 1 1 30 SER HG H -0.202 -2.210 3.434 1.00 . A A . 30 SER HG 1 1 4 2481 1 1 30 SER N N -0.345 -3.009 5.830 1.00 . A A . 30 SER N 1 1 4 2482 1 1 30 SER O O 1.565 -0.315 7.106 1.00 . A A . 30 SER O 1 1 4 2483 1 1 30 SER OG O 0.525 -1.590 3.548 1.00 . A A . 30 SER OG 1 1 4 2484 1 1 31 GLY C C -0.921 2.000 5.137 1.00 . A A . 31 GLY C 1 1 4 2485 1 1 31 GLY CA C -0.786 1.159 6.411 1.00 . A A . 31 GLY CA 1 1 4 2486 1 1 31 GLY H H -1.127 -0.734 5.542 1.00 . A A . 31 GLY H 1 1 4 2487 1 1 31 GLY HA2 H -1.738 1.180 6.943 1.00 . A A . 31 GLY HA2 1 1 4 2488 1 1 31 GLY HA3 H -0.027 1.613 7.050 1.00 . A A . 31 GLY HA3 1 1 4 2489 1 1 31 GLY N N -0.465 -0.228 6.114 1.00 . A A . 31 GLY N 1 1 4 2490 1 1 31 GLY O O -1.372 3.142 5.221 1.00 . A A . 31 GLY O 1 1 4 2491 1 1 32 CYS C C -2.113 2.317 2.255 1.00 . A A . 32 CYS C 1 1 4 2492 1 1 32 CYS CA C -0.648 2.152 2.688 1.00 . A A . 32 CYS CA 1 1 4 2493 1 1 32 CYS CB C 0.131 1.381 1.613 1.00 . A A . 32 CYS CB 1 1 4 2494 1 1 32 CYS H H -0.250 0.491 3.948 1.00 . A A . 32 CYS H 1 1 4 2495 1 1 32 CYS HA H -0.189 3.135 2.804 1.00 . A A . 32 CYS HA 1 1 4 2496 1 1 32 CYS HB2 H -0.424 0.481 1.354 1.00 . A A . 32 CYS HB2 1 1 4 2497 1 1 32 CYS HB3 H 0.186 1.995 0.716 1.00 . A A . 32 CYS HB3 1 1 4 2498 1 1 32 CYS N N -0.554 1.455 3.967 1.00 . A A . 32 CYS N 1 1 4 2499 1 1 32 CYS O O -3.001 1.662 2.799 1.00 . A A . 32 CYS O 1 1 4 2500 1 1 32 CYS SG S 1.813 0.858 2.052 1.00 . A A . 32 CYS SG 1 1 4 2501 1 1 33 LYS C C -3.550 2.917 -0.849 1.00 . A A . 33 LYS C 1 1 4 2502 1 1 33 LYS CA C -3.637 3.397 0.602 1.00 . A A . 33 LYS CA 1 1 4 2503 1 1 33 LYS CB C -3.996 4.893 0.586 1.00 . A A . 33 LYS CB 1 1 4 2504 1 1 33 LYS CD C -4.845 5.406 2.982 1.00 . A A . 33 LYS CD 1 1 4 2505 1 1 33 LYS CE C -4.551 4.142 3.794 1.00 . A A . 33 LYS CE 1 1 4 2506 1 1 33 LYS CG C -3.800 5.675 1.891 1.00 . A A . 33 LYS CG 1 1 4 2507 1 1 33 LYS H H -1.573 3.694 0.879 1.00 . A A . 33 LYS H 1 1 4 2508 1 1 33 LYS HA H -4.428 2.840 1.104 1.00 . A A . 33 LYS HA 1 1 4 2509 1 1 33 LYS HB2 H -3.355 5.373 -0.152 1.00 . A A . 33 LYS HB2 1 1 4 2510 1 1 33 LYS HB3 H -5.026 5.007 0.246 1.00 . A A . 33 LYS HB3 1 1 4 2511 1 1 33 LYS HD2 H -4.823 6.256 3.664 1.00 . A A . 33 LYS HD2 1 1 4 2512 1 1 33 LYS HD3 H -5.839 5.347 2.539 1.00 . A A . 33 LYS HD3 1 1 4 2513 1 1 33 LYS HE2 H -4.883 3.269 3.237 1.00 . A A . 33 LYS HE2 1 1 4 2514 1 1 33 LYS HE3 H -3.482 4.073 3.988 1.00 . A A . 33 LYS HE3 1 1 4 2515 1 1 33 LYS HG2 H -2.792 5.524 2.276 1.00 . A A . 33 LYS HG2 1 1 4 2516 1 1 33 LYS HG3 H -3.894 6.731 1.627 1.00 . A A . 33 LYS HG3 1 1 4 2517 1 1 33 LYS HZ1 H -6.237 4.243 4.952 1.00 . A A . 33 LYS HZ1 1 1 4 2518 1 1 33 LYS HZ2 H -5.047 3.284 5.575 1.00 . A A . 33 LYS HZ2 1 1 4 2519 1 1 33 LYS HZ3 H -4.901 4.924 5.647 1.00 . A A . 33 LYS HZ3 1 1 4 2520 1 1 33 LYS N N -2.354 3.182 1.261 1.00 . A A . 33 LYS N 1 1 4 2521 1 1 33 LYS NZ N -5.241 4.151 5.093 1.00 . A A . 33 LYS NZ 1 1 4 2522 1 1 33 LYS O O -2.469 2.925 -1.440 1.00 . A A . 33 LYS O 1 1 4 2523 1 1 34 ILE C C -5.886 3.226 -3.420 1.00 . A A . 34 ILE C 1 1 4 2524 1 1 34 ILE CA C -4.870 2.243 -2.841 1.00 . A A . 34 ILE CA 1 1 4 2525 1 1 34 ILE CB C -5.349 0.789 -3.009 1.00 . A A . 34 ILE CB 1 1 4 2526 1 1 34 ILE CD1 C -3.009 -0.306 -3.108 1.00 . A A . 34 ILE CD1 1 1 4 2527 1 1 34 ILE CG1 C -4.362 -0.216 -2.395 1.00 . A A . 34 ILE CG1 1 1 4 2528 1 1 34 ILE CG2 C -5.628 0.443 -4.480 1.00 . A A . 34 ILE CG2 1 1 4 2529 1 1 34 ILE H H -5.534 2.520 -0.860 1.00 . A A . 34 ILE H 1 1 4 2530 1 1 34 ILE HA H -3.930 2.367 -3.379 1.00 . A A . 34 ILE HA 1 1 4 2531 1 1 34 ILE HB H -6.289 0.674 -2.464 1.00 . A A . 34 ILE HB 1 1 4 2532 1 1 34 ILE HD11 H -2.500 0.655 -3.094 1.00 . A A . 34 ILE HD11 1 1 4 2533 1 1 34 ILE HD12 H -2.385 -1.033 -2.589 1.00 . A A . 34 ILE HD12 1 1 4 2534 1 1 34 ILE HD13 H -3.137 -0.635 -4.138 1.00 . A A . 34 ILE HD13 1 1 4 2535 1 1 34 ILE HG12 H -4.196 0.055 -1.356 1.00 . A A . 34 ILE HG12 1 1 4 2536 1 1 34 ILE HG13 H -4.829 -1.198 -2.409 1.00 . A A . 34 ILE HG13 1 1 4 2537 1 1 34 ILE HG21 H -4.764 0.683 -5.100 1.00 . A A . 34 ILE HG21 1 1 4 2538 1 1 34 ILE HG22 H -5.854 -0.620 -4.570 1.00 . A A . 34 ILE HG22 1 1 4 2539 1 1 34 ILE HG23 H -6.487 1.006 -4.842 1.00 . A A . 34 ILE HG23 1 1 4 2540 1 1 34 ILE N N -4.701 2.552 -1.428 1.00 . A A . 34 ILE N 1 1 4 2541 1 1 34 ILE O O -7.057 3.185 -3.048 1.00 . A A . 34 ILE O 1 1 4 2542 1 1 35 ILE C C -5.814 4.798 -6.627 1.00 . A A . 35 ILE C 1 1 4 2543 1 1 35 ILE CA C -6.296 4.910 -5.181 1.00 . A A . 35 ILE CA 1 1 4 2544 1 1 35 ILE CB C -6.338 6.372 -4.694 1.00 . A A . 35 ILE CB 1 1 4 2545 1 1 35 ILE CD1 C -5.056 8.528 -4.292 1.00 . A A . 35 ILE CD1 1 1 4 2546 1 1 35 ILE CG1 C -4.974 7.083 -4.791 1.00 . A A . 35 ILE CG1 1 1 4 2547 1 1 35 ILE CG2 C -6.895 6.444 -3.266 1.00 . A A . 35 ILE CG2 1 1 4 2548 1 1 35 ILE H H -4.456 4.077 -4.581 1.00 . A A . 35 ILE H 1 1 4 2549 1 1 35 ILE HA H -7.312 4.515 -5.146 1.00 . A A . 35 ILE HA 1 1 4 2550 1 1 35 ILE HB H -7.037 6.902 -5.343 1.00 . A A . 35 ILE HB 1 1 4 2551 1 1 35 ILE HD11 H -5.163 8.549 -3.208 1.00 . A A . 35 ILE HD11 1 1 4 2552 1 1 35 ILE HD12 H -4.145 9.062 -4.555 1.00 . A A . 35 ILE HD12 1 1 4 2553 1 1 35 ILE HD13 H -5.904 9.033 -4.756 1.00 . A A . 35 ILE HD13 1 1 4 2554 1 1 35 ILE HG12 H -4.225 6.547 -4.208 1.00 . A A . 35 ILE HG12 1 1 4 2555 1 1 35 ILE HG13 H -4.655 7.113 -5.833 1.00 . A A . 35 ILE HG13 1 1 4 2556 1 1 35 ILE HG21 H -7.794 5.832 -3.186 1.00 . A A . 35 ILE HG21 1 1 4 2557 1 1 35 ILE HG22 H -6.152 6.089 -2.550 1.00 . A A . 35 ILE HG22 1 1 4 2558 1 1 35 ILE HG23 H -7.167 7.471 -3.020 1.00 . A A . 35 ILE HG23 1 1 4 2559 1 1 35 ILE N N -5.437 4.085 -4.344 1.00 . A A . 35 ILE N 1 1 4 2560 1 1 35 ILE O O -4.611 4.696 -6.873 1.00 . A A . 35 ILE O 1 1 4 2561 1 1 36 SER C C -6.499 6.047 -9.695 1.00 . A A . 36 SER C 1 1 4 2562 1 1 36 SER CA C -6.493 4.677 -9.005 1.00 . A A . 36 SER CA 1 1 4 2563 1 1 36 SER CB C -7.539 3.734 -9.615 1.00 . A A . 36 SER CB 1 1 4 2564 1 1 36 SER H H -7.725 4.883 -7.293 1.00 . A A . 36 SER H 1 1 4 2565 1 1 36 SER HA H -5.513 4.226 -9.165 1.00 . A A . 36 SER HA 1 1 4 2566 1 1 36 SER HB2 H -8.531 4.182 -9.539 1.00 . A A . 36 SER HB2 1 1 4 2567 1 1 36 SER HB3 H -7.309 3.554 -10.666 1.00 . A A . 36 SER HB3 1 1 4 2568 1 1 36 SER HG H -8.172 1.914 -9.337 1.00 . A A . 36 SER HG 1 1 4 2569 1 1 36 SER N N -6.758 4.809 -7.576 1.00 . A A . 36 SER N 1 1 4 2570 1 1 36 SER O O -6.836 6.143 -10.874 1.00 . A A . 36 SER O 1 1 4 2571 1 1 36 SER OG O -7.530 2.500 -8.927 1.00 . A A . 36 SER OG 1 1 4 2572 1 1 37 ALA C C -4.797 8.859 -10.141 1.00 . A A . 37 ALA C 1 1 4 2573 1 1 37 ALA CA C -6.116 8.479 -9.455 1.00 . A A . 37 ALA CA 1 1 4 2574 1 1 37 ALA CB C -6.397 9.412 -8.273 1.00 . A A . 37 ALA CB 1 1 4 2575 1 1 37 ALA H H -5.845 6.960 -8.006 1.00 . A A . 37 ALA H 1 1 4 2576 1 1 37 ALA HA H -6.922 8.611 -10.177 1.00 . A A . 37 ALA HA 1 1 4 2577 1 1 37 ALA HB1 H -5.582 9.353 -7.548 1.00 . A A . 37 ALA HB1 1 1 4 2578 1 1 37 ALA HB2 H -6.491 10.441 -8.623 1.00 . A A . 37 ALA HB2 1 1 4 2579 1 1 37 ALA HB3 H -7.329 9.122 -7.787 1.00 . A A . 37 ALA HB3 1 1 4 2580 1 1 37 ALA N N -6.118 7.104 -8.966 1.00 . A A . 37 ALA N 1 1 4 2581 1 1 37 ALA O O -4.655 9.996 -10.584 1.00 . A A . 37 ALA O 1 1 4 2582 1 1 38 SER C C -1.814 9.323 -9.832 1.00 . A A . 38 SER C 1 1 4 2583 1 1 38 SER CA C -2.460 8.186 -10.643 1.00 . A A . 38 SER CA 1 1 4 2584 1 1 38 SER CB C -2.434 8.424 -12.157 1.00 . A A . 38 SER CB 1 1 4 2585 1 1 38 SER H H -4.029 6.999 -9.892 1.00 . A A . 38 SER H 1 1 4 2586 1 1 38 SER HA H -1.900 7.272 -10.460 1.00 . A A . 38 SER HA 1 1 4 2587 1 1 38 SER HB2 H -3.022 7.653 -12.657 1.00 . A A . 38 SER HB2 1 1 4 2588 1 1 38 SER HB3 H -2.866 9.397 -12.382 1.00 . A A . 38 SER HB3 1 1 4 2589 1 1 38 SER HG H -1.110 8.583 -13.575 1.00 . A A . 38 SER HG 1 1 4 2590 1 1 38 SER N N -3.826 7.934 -10.201 1.00 . A A . 38 SER N 1 1 4 2591 1 1 38 SER O O -1.064 10.137 -10.367 1.00 . A A . 38 SER O 1 1 4 2592 1 1 38 SER OG O -1.110 8.353 -12.642 1.00 . A A . 38 SER OG 1 1 4 2593 1 1 39 THR C C -1.639 9.837 -6.201 1.00 . A A . 39 THR C 1 1 4 2594 1 1 39 THR CA C -1.714 10.436 -7.611 1.00 . A A . 39 THR CA 1 1 4 2595 1 1 39 THR CB C -2.721 11.603 -7.708 1.00 . A A . 39 THR CB 1 1 4 2596 1 1 39 THR CG2 C -2.331 12.842 -6.894 1.00 . A A . 39 THR CG2 1 1 4 2597 1 1 39 THR H H -2.774 8.700 -8.160 1.00 . A A . 39 THR H 1 1 4 2598 1 1 39 THR HA H -0.721 10.794 -7.889 1.00 . A A . 39 THR HA 1 1 4 2599 1 1 39 THR HB H -3.699 11.261 -7.368 1.00 . A A . 39 THR HB 1 1 4 2600 1 1 39 THR HG1 H -1.987 11.994 -9.470 1.00 . A A . 39 THR HG1 1 1 4 2601 1 1 39 THR HG21 H -3.002 13.665 -7.149 1.00 . A A . 39 THR HG21 1 1 4 2602 1 1 39 THR HG22 H -2.434 12.658 -5.826 1.00 . A A . 39 THR HG22 1 1 4 2603 1 1 39 THR HG23 H -1.308 13.140 -7.124 1.00 . A A . 39 THR HG23 1 1 4 2604 1 1 39 THR N N -2.129 9.382 -8.531 1.00 . A A . 39 THR N 1 1 4 2605 1 1 39 THR O O -2.084 8.708 -5.990 1.00 . A A . 39 THR O 1 1 4 2606 1 1 39 THR OG1 O -2.854 12.013 -9.054 1.00 . A A . 39 THR OG1 1 1 4 2607 1 1 40 CYS C C -1.290 11.559 -3.027 1.00 . A A . 40 CYS C 1 1 4 2608 1 1 40 CYS CA C -1.073 10.272 -3.825 1.00 . A A . 40 CYS CA 1 1 4 2609 1 1 40 CYS CB C 0.256 9.622 -3.424 1.00 . A A . 40 CYS CB 1 1 4 2610 1 1 40 CYS H H -0.699 11.491 -5.496 1.00 . A A . 40 CYS H 1 1 4 2611 1 1 40 CYS HA H -1.897 9.593 -3.620 1.00 . A A . 40 CYS HA 1 1 4 2612 1 1 40 CYS HB2 H 1.083 10.235 -3.783 1.00 . A A . 40 CYS HB2 1 1 4 2613 1 1 40 CYS HB3 H 0.310 9.593 -2.339 1.00 . A A . 40 CYS HB3 1 1 4 2614 1 1 40 CYS N N -1.068 10.584 -5.248 1.00 . A A . 40 CYS N 1 1 4 2615 1 1 40 CYS O O -0.871 12.625 -3.477 1.00 . A A . 40 CYS O 1 1 4 2616 1 1 40 CYS SG S 0.484 7.931 -4.022 1.00 . A A . 40 CYS SG 1 1 4 2617 1 1 41 PRO C C -0.849 13.027 -0.275 1.00 . A A . 41 PRO C 1 1 4 2618 1 1 41 PRO CA C -2.147 12.637 -0.989 1.00 . A A . 41 PRO CA 1 1 4 2619 1 1 41 PRO CB C -3.217 12.191 0.011 1.00 . A A . 41 PRO CB 1 1 4 2620 1 1 41 PRO CD C -2.499 10.288 -1.241 1.00 . A A . 41 PRO CD 1 1 4 2621 1 1 41 PRO CG C -2.914 10.702 0.170 1.00 . A A . 41 PRO CG 1 1 4 2622 1 1 41 PRO HA H -2.520 13.483 -1.568 1.00 . A A . 41 PRO HA 1 1 4 2623 1 1 41 PRO HB2 H -3.166 12.729 0.958 1.00 . A A . 41 PRO HB2 1 1 4 2624 1 1 41 PRO HB3 H -4.205 12.309 -0.436 1.00 . A A . 41 PRO HB3 1 1 4 2625 1 1 41 PRO HD2 H -1.787 9.464 -1.191 1.00 . A A . 41 PRO HD2 1 1 4 2626 1 1 41 PRO HD3 H -3.384 9.985 -1.801 1.00 . A A . 41 PRO HD3 1 1 4 2627 1 1 41 PRO HG2 H -2.066 10.589 0.844 1.00 . A A . 41 PRO HG2 1 1 4 2628 1 1 41 PRO HG3 H -3.773 10.137 0.535 1.00 . A A . 41 PRO HG3 1 1 4 2629 1 1 41 PRO N N -1.930 11.484 -1.847 1.00 . A A . 41 PRO N 1 1 4 2630 1 1 41 PRO O O 0.062 12.208 -0.136 1.00 . A A . 41 PRO O 1 1 4 2631 1 1 42 SER C C 0.307 14.260 2.374 1.00 . A A . 42 SER C 1 1 4 2632 1 1 42 SER CA C 0.335 14.826 0.948 1.00 . A A . 42 SER CA 1 1 4 2633 1 1 42 SER CB C 0.275 16.360 0.912 1.00 . A A . 42 SER CB 1 1 4 2634 1 1 42 SER H H -1.575 14.889 0.035 1.00 . A A . 42 SER H 1 1 4 2635 1 1 42 SER HA H 1.268 14.525 0.468 1.00 . A A . 42 SER HA 1 1 4 2636 1 1 42 SER HB2 H 0.232 16.693 -0.125 1.00 . A A . 42 SER HB2 1 1 4 2637 1 1 42 SER HB3 H -0.613 16.717 1.435 1.00 . A A . 42 SER HB3 1 1 4 2638 1 1 42 SER HG H 1.372 17.871 1.461 1.00 . A A . 42 SER HG 1 1 4 2639 1 1 42 SER N N -0.783 14.283 0.187 1.00 . A A . 42 SER N 1 1 4 2640 1 1 42 SER O O -0.034 14.959 3.328 1.00 . A A . 42 SER O 1 1 4 2641 1 1 42 SER OG O 1.430 16.913 1.506 1.00 . A A . 42 SER OG 1 1 4 2642 1 1 43 ASP C C 1.263 10.830 3.483 1.00 . A A . 43 ASP C 1 1 4 2643 1 1 43 ASP CA C 0.586 12.185 3.719 1.00 . A A . 43 ASP CA 1 1 4 2644 1 1 43 ASP CB C -0.872 11.985 4.158 1.00 . A A . 43 ASP CB 1 1 4 2645 1 1 43 ASP CG C -0.953 11.251 5.495 1.00 . A A . 43 ASP CG 1 1 4 2646 1 1 43 ASP H H 0.897 12.490 1.644 1.00 . A A . 43 ASP H 1 1 4 2647 1 1 43 ASP HA H 1.127 12.718 4.505 1.00 . A A . 43 ASP HA 1 1 4 2648 1 1 43 ASP HB2 H -1.375 12.947 4.268 1.00 . A A . 43 ASP HB2 1 1 4 2649 1 1 43 ASP HB3 H -1.402 11.408 3.398 1.00 . A A . 43 ASP HB3 1 1 4 2650 1 1 43 ASP HD2 H -0.604 12.942 6.404 1.00 . A A . 43 ASP HD2 1 1 4 2651 1 1 43 ASP N N 0.643 12.973 2.495 1.00 . A A . 43 ASP N 1 1 4 2652 1 1 43 ASP O O 2.012 10.359 4.336 1.00 . A A . 43 ASP O 1 1 4 2653 1 1 43 ASP OD1 O -1.155 10.042 5.508 1.00 . A A . 43 ASP OD1 1 1 4 2654 1 1 43 ASP OD2 O -0.786 12.023 6.607 1.00 . A A . 43 ASP OD2 1 1 4 2655 1 1 44 TYR C C 2.443 9.219 0.626 1.00 . A A . 44 TYR C 1 1 4 2656 1 1 44 TYR CA C 1.577 8.964 1.868 1.00 . A A . 44 TYR CA 1 1 4 2657 1 1 44 TYR CB C 0.442 7.984 1.559 1.00 . A A . 44 TYR CB 1 1 4 2658 1 1 44 TYR CD1 C 0.159 6.627 3.647 1.00 . A A . 44 TYR CD1 1 1 4 2659 1 1 44 TYR CD2 C -1.645 8.120 3.016 1.00 . A A . 44 TYR CD2 1 1 4 2660 1 1 44 TYR CE1 C -0.596 6.155 4.730 1.00 . A A . 44 TYR CE1 1 1 4 2661 1 1 44 TYR CE2 C -2.403 7.657 4.106 1.00 . A A . 44 TYR CE2 1 1 4 2662 1 1 44 TYR CG C -0.373 7.575 2.765 1.00 . A A . 44 TYR CG 1 1 4 2663 1 1 44 TYR CZ C -1.900 6.635 4.931 1.00 . A A . 44 TYR CZ 1 1 4 2664 1 1 44 TYR H H 0.358 10.676 1.677 1.00 . A A . 44 TYR H 1 1 4 2665 1 1 44 TYR HA H 2.184 8.509 2.648 1.00 . A A . 44 TYR HA 1 1 4 2666 1 1 44 TYR HB2 H -0.214 8.407 0.800 1.00 . A A . 44 TYR HB2 1 1 4 2667 1 1 44 TYR HB3 H 0.891 7.082 1.148 1.00 . A A . 44 TYR HB3 1 1 4 2668 1 1 44 TYR HD1 H 1.155 6.264 3.482 1.00 . A A . 44 TYR HD1 1 1 4 2669 1 1 44 TYR HD2 H -2.049 8.887 2.376 1.00 . A A . 44 TYR HD2 1 1 4 2670 1 1 44 TYR HE1 H -0.169 5.416 5.391 1.00 . A A . 44 TYR HE1 1 1 4 2671 1 1 44 TYR HE2 H -3.377 8.080 4.299 1.00 . A A . 44 TYR HE2 1 1 4 2672 1 1 44 TYR HH H -2.229 5.386 6.382 1.00 . A A . 44 TYR HH 1 1 4 2673 1 1 44 TYR N N 0.997 10.222 2.317 1.00 . A A . 44 TYR N 1 1 4 2674 1 1 44 TYR O O 1.993 8.966 -0.490 1.00 . A A . 44 TYR O 1 1 4 2675 1 1 44 TYR OH O -2.678 6.095 5.915 1.00 . A A . 44 TYR OH 1 1 4 2676 1 1 45 PRO C C 5.058 9.217 -1.245 1.00 . A A . 45 PRO C 1 1 4 2677 1 1 45 PRO CA C 4.465 10.276 -0.307 1.00 . A A . 45 PRO CA 1 1 4 2678 1 1 45 PRO CB C 5.560 11.113 0.360 1.00 . A A . 45 PRO CB 1 1 4 2679 1 1 45 PRO CD C 4.309 10.040 2.062 1.00 . A A . 45 PRO CD 1 1 4 2680 1 1 45 PRO CG C 5.740 10.423 1.708 1.00 . A A . 45 PRO CG 1 1 4 2681 1 1 45 PRO HA H 3.847 10.947 -0.907 1.00 . A A . 45 PRO HA 1 1 4 2682 1 1 45 PRO HB2 H 6.485 11.152 -0.218 1.00 . A A . 45 PRO HB2 1 1 4 2683 1 1 45 PRO HB3 H 5.188 12.124 0.533 1.00 . A A . 45 PRO HB3 1 1 4 2684 1 1 45 PRO HD2 H 4.311 9.190 2.742 1.00 . A A . 45 PRO HD2 1 1 4 2685 1 1 45 PRO HD3 H 3.825 10.901 2.519 1.00 . A A . 45 PRO HD3 1 1 4 2686 1 1 45 PRO HG2 H 6.319 9.512 1.577 1.00 . A A . 45 PRO HG2 1 1 4 2687 1 1 45 PRO HG3 H 6.200 11.068 2.456 1.00 . A A . 45 PRO HG3 1 1 4 2688 1 1 45 PRO N N 3.669 9.741 0.791 1.00 . A A . 45 PRO N 1 1 4 2689 1 1 45 PRO O O 5.341 9.553 -2.394 1.00 . A A . 45 PRO O 1 1 4 2690 1 1 46 LYS C C 4.706 6.037 -2.169 1.00 . A A . 46 LYS C 1 1 4 2691 1 1 46 LYS CA C 5.837 6.915 -1.629 1.00 . A A . 46 LYS CA 1 1 4 2692 1 1 46 LYS CB C 6.877 6.080 -0.856 1.00 . A A . 46 LYS CB 1 1 4 2693 1 1 46 LYS CD C 8.414 7.886 0.182 1.00 . A A . 46 LYS CD 1 1 4 2694 1 1 46 LYS CE C 8.200 7.394 1.619 1.00 . A A . 46 LYS CE 1 1 4 2695 1 1 46 LYS CG C 8.269 6.730 -0.813 1.00 . A A . 46 LYS CG 1 1 4 2696 1 1 46 LYS H H 4.946 7.708 0.133 1.00 . A A . 46 LYS H 1 1 4 2697 1 1 46 LYS HA H 6.363 7.348 -2.480 1.00 . A A . 46 LYS HA 1 1 4 2698 1 1 46 LYS HB2 H 6.518 5.823 0.140 1.00 . A A . 46 LYS HB2 1 1 4 2699 1 1 46 LYS HB3 H 7.023 5.142 -1.395 1.00 . A A . 46 LYS HB3 1 1 4 2700 1 1 46 LYS HD2 H 9.426 8.273 0.074 1.00 . A A . 46 LYS HD2 1 1 4 2701 1 1 46 LYS HD3 H 7.717 8.683 -0.070 1.00 . A A . 46 LYS HD3 1 1 4 2702 1 1 46 LYS HE2 H 7.143 7.178 1.767 1.00 . A A . 46 LYS HE2 1 1 4 2703 1 1 46 LYS HE3 H 8.776 6.481 1.769 1.00 . A A . 46 LYS HE3 1 1 4 2704 1 1 46 LYS HG2 H 8.993 5.960 -0.544 1.00 . A A . 46 LYS HG2 1 1 4 2705 1 1 46 LYS HG3 H 8.528 7.087 -1.811 1.00 . A A . 46 LYS HG3 1 1 4 2706 1 1 46 LYS HZ1 H 8.135 9.251 2.492 1.00 . A A . 46 LYS HZ1 1 1 4 2707 1 1 46 LYS HZ2 H 8.391 8.019 3.550 1.00 . A A . 46 LYS HZ2 1 1 4 2708 1 1 46 LYS HZ3 H 9.617 8.532 2.568 1.00 . A A . 46 LYS HZ3 1 1 4 2709 1 1 46 LYS N N 5.251 7.964 -0.796 1.00 . A A . 46 LYS N 1 1 4 2710 1 1 46 LYS NZ N 8.622 8.378 2.632 1.00 . A A . 46 LYS NZ 1 1 4 2711 1 1 46 LYS O O 4.093 6.442 -3.180 1.00 . A A . 46 LYS O 1 1 4 2712 1 1 46 LYS OXT O 4.474 4.959 -1.585 1.00 . A A . 46 LYS OXT 1 1 5 2713 1 1 1 LYS C C -0.099 4.825 -6.996 1.00 . A A . 1 LYS C 1 1 5 2714 1 1 1 LYS CA C -0.982 5.687 -7.912 1.00 . A A . 1 LYS CA 1 1 5 2715 1 1 1 LYS CB C -0.170 6.764 -8.652 1.00 . A A . 1 LYS CB 1 1 5 2716 1 1 1 LYS CD C 1.183 8.879 -8.537 1.00 . A A . 1 LYS CD 1 1 5 2717 1 1 1 LYS CE C 1.676 10.022 -7.644 1.00 . A A . 1 LYS CE 1 1 5 2718 1 1 1 LYS CG C 0.407 7.839 -7.721 1.00 . A A . 1 LYS CG 1 1 5 2719 1 1 1 LYS H1 H -2.636 6.888 -7.870 1.00 . A A . 1 LYS H1 1 1 5 2720 1 1 1 LYS H2 H -2.787 5.563 -6.923 1.00 . A A . 1 LYS H2 1 1 5 2721 1 1 1 LYS H3 H -1.850 6.833 -6.429 1.00 . A A . 1 LYS H3 1 1 5 2722 1 1 1 LYS HA H -1.386 5.015 -8.669 1.00 . A A . 1 LYS HA 1 1 5 2723 1 1 1 LYS HB2 H 0.645 6.291 -9.204 1.00 . A A . 1 LYS HB2 1 1 5 2724 1 1 1 LYS HB3 H -0.822 7.248 -9.376 1.00 . A A . 1 LYS HB3 1 1 5 2725 1 1 1 LYS HD2 H 2.038 8.396 -9.013 1.00 . A A . 1 LYS HD2 1 1 5 2726 1 1 1 LYS HD3 H 0.530 9.287 -9.310 1.00 . A A . 1 LYS HD3 1 1 5 2727 1 1 1 LYS HE2 H 0.825 10.486 -7.141 1.00 . A A . 1 LYS HE2 1 1 5 2728 1 1 1 LYS HE3 H 2.357 9.626 -6.890 1.00 . A A . 1 LYS HE3 1 1 5 2729 1 1 1 LYS HG2 H -0.406 8.343 -7.201 1.00 . A A . 1 LYS HG2 1 1 5 2730 1 1 1 LYS HG3 H 1.077 7.385 -6.989 1.00 . A A . 1 LYS HG3 1 1 5 2731 1 1 1 LYS HZ1 H 1.752 11.430 -9.129 1.00 . A A . 1 LYS HZ1 1 1 5 2732 1 1 1 LYS HZ2 H 2.686 11.794 -7.822 1.00 . A A . 1 LYS HZ2 1 1 5 2733 1 1 1 LYS HZ3 H 3.179 10.641 -8.889 1.00 . A A . 1 LYS HZ3 1 1 5 2734 1 1 1 LYS N N -2.146 6.286 -7.226 1.00 . A A . 1 LYS N 1 1 5 2735 1 1 1 LYS NZ N 2.376 11.051 -8.432 1.00 . A A . 1 LYS NZ 1 1 5 2736 1 1 1 LYS O O 1.076 4.630 -7.299 1.00 . A A . 1 LYS O 1 1 5 2737 1 1 2 SER C C 1.000 4.487 -4.071 1.00 . A A . 2 SER C 1 1 5 2738 1 1 2 SER CA C 0.012 3.587 -4.819 1.00 . A A . 2 SER CA 1 1 5 2739 1 1 2 SER CB C 0.644 2.262 -5.284 1.00 . A A . 2 SER CB 1 1 5 2740 1 1 2 SER H H -1.649 4.477 -5.752 1.00 . A A . 2 SER H 1 1 5 2741 1 1 2 SER HA H -0.784 3.309 -4.133 1.00 . A A . 2 SER HA 1 1 5 2742 1 1 2 SER HB2 H 0.750 1.609 -4.417 1.00 . A A . 2 SER HB2 1 1 5 2743 1 1 2 SER HB3 H -0.014 1.778 -6.004 1.00 . A A . 2 SER HB3 1 1 5 2744 1 1 2 SER HG H 1.899 3.103 -6.512 1.00 . A A . 2 SER HG 1 1 5 2745 1 1 2 SER N N -0.665 4.309 -5.896 1.00 . A A . 2 SER N 1 1 5 2746 1 1 2 SER O O 1.949 4.984 -4.676 1.00 . A A . 2 SER O 1 1 5 2747 1 1 2 SER OG O 1.934 2.413 -5.842 1.00 . A A . 2 SER OG 1 1 5 2748 1 1 3 CYS C C 1.736 4.919 -0.503 1.00 . A A . 3 CYS C 1 1 5 2749 1 1 3 CYS CA C 1.711 5.459 -1.928 1.00 . A A . 3 CYS CA 1 1 5 2750 1 1 3 CYS CB C 1.357 6.946 -1.923 1.00 . A A . 3 CYS CB 1 1 5 2751 1 1 3 CYS H H 0.010 4.228 -2.313 1.00 . A A . 3 CYS H 1 1 5 2752 1 1 3 CYS HA H 2.718 5.375 -2.332 1.00 . A A . 3 CYS HA 1 1 5 2753 1 1 3 CYS HB2 H 0.318 7.083 -1.619 1.00 . A A . 3 CYS HB2 1 1 5 2754 1 1 3 CYS HB3 H 1.995 7.419 -1.179 1.00 . A A . 3 CYS HB3 1 1 5 2755 1 1 3 CYS N N 0.795 4.685 -2.762 1.00 . A A . 3 CYS N 1 1 5 2756 1 1 3 CYS O O 0.686 4.682 0.087 1.00 . A A . 3 CYS O 1 1 5 2757 1 1 3 CYS SG S 1.671 7.820 -3.478 1.00 . A A . 3 CYS SG 1 1 5 2758 1 1 4 CYS C C 3.790 5.270 2.281 1.00 . A A . 4 CYS C 1 1 5 2759 1 1 4 CYS CA C 3.223 4.191 1.354 1.00 . A A . 4 CYS CA 1 1 5 2760 1 1 4 CYS CB C 4.219 3.041 1.189 1.00 . A A . 4 CYS CB 1 1 5 2761 1 1 4 CYS H H 3.753 5.000 -0.519 1.00 . A A . 4 CYS H 1 1 5 2762 1 1 4 CYS HA H 2.305 3.807 1.788 1.00 . A A . 4 CYS HA 1 1 5 2763 1 1 4 CYS HB2 H 5.049 3.391 0.575 1.00 . A A . 4 CYS HB2 1 1 5 2764 1 1 4 CYS HB3 H 4.633 2.755 2.155 1.00 . A A . 4 CYS HB3 1 1 5 2765 1 1 4 CYS N N 2.946 4.744 0.037 1.00 . A A . 4 CYS N 1 1 5 2766 1 1 4 CYS O O 4.327 6.271 1.803 1.00 . A A . 4 CYS O 1 1 5 2767 1 1 4 CYS SG S 3.533 1.544 0.436 1.00 . A A . 4 CYS SG 1 1 5 2768 1 1 5 PRO C C 5.791 6.017 4.501 1.00 . A A . 5 PRO C 1 1 5 2769 1 1 5 PRO CA C 4.262 5.995 4.586 1.00 . A A . 5 PRO CA 1 1 5 2770 1 1 5 PRO CB C 3.775 5.499 5.950 1.00 . A A . 5 PRO CB 1 1 5 2771 1 1 5 PRO CD C 3.006 3.983 4.283 1.00 . A A . 5 PRO CD 1 1 5 2772 1 1 5 PRO CG C 3.512 4.010 5.723 1.00 . A A . 5 PRO CG 1 1 5 2773 1 1 5 PRO HA H 3.880 7.004 4.430 1.00 . A A . 5 PRO HA 1 1 5 2774 1 1 5 PRO HB2 H 4.492 5.681 6.750 1.00 . A A . 5 PRO HB2 1 1 5 2775 1 1 5 PRO HB3 H 2.829 5.984 6.193 1.00 . A A . 5 PRO HB3 1 1 5 2776 1 1 5 PRO HD2 H 3.202 3.012 3.841 1.00 . A A . 5 PRO HD2 1 1 5 2777 1 1 5 PRO HD3 H 1.932 4.165 4.276 1.00 . A A . 5 PRO HD3 1 1 5 2778 1 1 5 PRO HG2 H 4.446 3.453 5.794 1.00 . A A . 5 PRO HG2 1 1 5 2779 1 1 5 PRO HG3 H 2.782 3.606 6.426 1.00 . A A . 5 PRO HG3 1 1 5 2780 1 1 5 PRO N N 3.691 5.079 3.609 1.00 . A A . 5 PRO N 1 1 5 2781 1 1 5 PRO O O 6.401 7.068 4.696 1.00 . A A . 5 PRO O 1 1 5 2782 1 1 6 ASN C C 8.240 3.365 3.593 1.00 . A A . 6 ASN C 1 1 5 2783 1 1 6 ASN CA C 7.851 4.671 4.289 1.00 . A A . 6 ASN CA 1 1 5 2784 1 1 6 ASN CB C 8.317 4.702 5.753 1.00 . A A . 6 ASN CB 1 1 5 2785 1 1 6 ASN CG C 7.537 3.714 6.616 1.00 . A A . 6 ASN CG 1 1 5 2786 1 1 6 ASN H H 5.852 4.040 4.036 1.00 . A A . 6 ASN H 1 1 5 2787 1 1 6 ASN HA H 8.348 5.486 3.767 1.00 . A A . 6 ASN HA 1 1 5 2788 1 1 6 ASN HB2 H 9.380 4.464 5.816 1.00 . A A . 6 ASN HB2 1 1 5 2789 1 1 6 ASN HB3 H 8.184 5.711 6.148 1.00 . A A . 6 ASN HB3 1 1 5 2790 1 1 6 ASN HD21 H 6.648 5.223 7.653 1.00 . A A . 6 ASN HD21 1 1 5 2791 1 1 6 ASN HD22 H 6.167 3.605 8.118 1.00 . A A . 6 ASN HD22 1 1 5 2792 1 1 6 ASN N N 6.408 4.861 4.230 1.00 . A A . 6 ASN N 1 1 5 2793 1 1 6 ASN ND2 N 6.723 4.222 7.542 1.00 . A A . 6 ASN ND2 1 1 5 2794 1 1 6 ASN O O 7.381 2.601 3.151 1.00 . A A . 6 ASN O 1 1 5 2795 1 1 6 ASN OD1 O 7.659 2.507 6.437 1.00 . A A . 6 ASN OD1 1 1 5 2796 1 1 7 THR C C 9.643 0.652 3.533 1.00 . A A . 7 THR C 1 1 5 2797 1 1 7 THR CA C 10.159 1.947 2.898 1.00 . A A . 7 THR CA 1 1 5 2798 1 1 7 THR CB C 11.687 2.052 3.022 1.00 . A A . 7 THR CB 1 1 5 2799 1 1 7 THR CG2 C 12.399 0.989 2.180 1.00 . A A . 7 THR CG2 1 1 5 2800 1 1 7 THR H H 10.192 3.819 3.859 1.00 . A A . 7 THR H 1 1 5 2801 1 1 7 THR HA H 9.898 1.947 1.838 1.00 . A A . 7 THR HA 1 1 5 2802 1 1 7 THR HB H 11.973 1.929 4.068 1.00 . A A . 7 THR HB 1 1 5 2803 1 1 7 THR HG1 H 13.052 3.416 2.764 1.00 . A A . 7 THR HG1 1 1 5 2804 1 1 7 THR HG21 H 13.479 1.116 2.270 1.00 . A A . 7 THR HG21 1 1 5 2805 1 1 7 THR HG22 H 12.137 -0.010 2.529 1.00 . A A . 7 THR HG22 1 1 5 2806 1 1 7 THR HG23 H 12.115 1.088 1.132 1.00 . A A . 7 THR HG23 1 1 5 2807 1 1 7 THR N N 9.553 3.122 3.506 1.00 . A A . 7 THR N 1 1 5 2808 1 1 7 THR O O 9.404 -0.323 2.825 1.00 . A A . 7 THR O 1 1 5 2809 1 1 7 THR OG1 O 12.109 3.334 2.599 1.00 . A A . 7 THR OG1 1 1 5 2810 1 1 8 THR C C 7.499 -0.806 5.144 1.00 . A A . 8 THR C 1 1 5 2811 1 1 8 THR CA C 8.946 -0.528 5.567 1.00 . A A . 8 THR CA 1 1 5 2812 1 1 8 THR CB C 9.080 -0.349 7.086 1.00 . A A . 8 THR CB 1 1 5 2813 1 1 8 THR CG2 C 8.932 -1.698 7.799 1.00 . A A . 8 THR CG2 1 1 5 2814 1 1 8 THR H H 9.666 1.465 5.404 1.00 . A A . 8 THR H 1 1 5 2815 1 1 8 THR HA H 9.564 -1.381 5.284 1.00 . A A . 8 THR HA 1 1 5 2816 1 1 8 THR HB H 8.312 0.330 7.454 1.00 . A A . 8 THR HB 1 1 5 2817 1 1 8 THR HG1 H 10.402 0.328 8.344 1.00 . A A . 8 THR HG1 1 1 5 2818 1 1 8 THR HG21 H 9.681 -2.399 7.431 1.00 . A A . 8 THR HG21 1 1 5 2819 1 1 8 THR HG22 H 9.070 -1.564 8.872 1.00 . A A . 8 THR HG22 1 1 5 2820 1 1 8 THR HG23 H 7.939 -2.108 7.620 1.00 . A A . 8 THR HG23 1 1 5 2821 1 1 8 THR N N 9.466 0.636 4.861 1.00 . A A . 8 THR N 1 1 5 2822 1 1 8 THR O O 7.110 -1.962 5.011 1.00 . A A . 8 THR O 1 1 5 2823 1 1 8 THR OG1 O 10.349 0.194 7.394 1.00 . A A . 8 THR OG1 1 1 5 2824 1 1 9 GLY C C 5.441 -0.604 2.968 1.00 . A A . 9 GLY C 1 1 5 2825 1 1 9 GLY CA C 5.393 0.147 4.298 1.00 . A A . 9 GLY CA 1 1 5 2826 1 1 9 GLY H H 7.090 1.179 5.043 1.00 . A A . 9 GLY H 1 1 5 2827 1 1 9 GLY HA2 H 4.727 -0.370 4.988 1.00 . A A . 9 GLY HA2 1 1 5 2828 1 1 9 GLY HA3 H 5.006 1.148 4.119 1.00 . A A . 9 GLY HA3 1 1 5 2829 1 1 9 GLY N N 6.717 0.251 4.889 1.00 . A A . 9 GLY N 1 1 5 2830 1 1 9 GLY O O 4.707 -1.573 2.790 1.00 . A A . 9 GLY O 1 1 5 2831 1 1 10 ARG C C 6.913 -2.318 0.981 1.00 . A A . 10 ARG C 1 1 5 2832 1 1 10 ARG CA C 6.511 -0.859 0.772 1.00 . A A . 10 ARG CA 1 1 5 2833 1 1 10 ARG CB C 7.549 -0.138 -0.104 1.00 . A A . 10 ARG CB 1 1 5 2834 1 1 10 ARG CD C 6.056 0.932 -1.871 1.00 . A A . 10 ARG CD 1 1 5 2835 1 1 10 ARG CG C 7.021 1.172 -0.699 1.00 . A A . 10 ARG CG 1 1 5 2836 1 1 10 ARG CZ C 4.573 2.332 -3.323 1.00 . A A . 10 ARG CZ 1 1 5 2837 1 1 10 ARG H H 6.896 0.627 2.259 1.00 . A A . 10 ARG H 1 1 5 2838 1 1 10 ARG HA H 5.555 -0.870 0.253 1.00 . A A . 10 ARG HA 1 1 5 2839 1 1 10 ARG HB2 H 8.435 0.078 0.491 1.00 . A A . 10 ARG HB2 1 1 5 2840 1 1 10 ARG HB3 H 7.847 -0.791 -0.927 1.00 . A A . 10 ARG HB3 1 1 5 2841 1 1 10 ARG HD2 H 6.604 0.463 -2.690 1.00 . A A . 10 ARG HD2 1 1 5 2842 1 1 10 ARG HD3 H 5.247 0.268 -1.573 1.00 . A A . 10 ARG HD3 1 1 5 2843 1 1 10 ARG HE H 5.768 3.044 -1.860 1.00 . A A . 10 ARG HE 1 1 5 2844 1 1 10 ARG HG2 H 6.539 1.748 0.088 1.00 . A A . 10 ARG HG2 1 1 5 2845 1 1 10 ARG HG3 H 7.870 1.747 -1.073 1.00 . A A . 10 ARG HG3 1 1 5 2846 1 1 10 ARG HH11 H 4.382 0.338 -3.732 1.00 . A A . 10 ARG HH11 1 1 5 2847 1 1 10 ARG HH12 H 3.394 1.405 -4.709 1.00 . A A . 10 ARG HH12 1 1 5 2848 1 1 10 ARG HH21 H 4.526 4.354 -3.139 1.00 . A A . 10 ARG HH21 1 1 5 2849 1 1 10 ARG HH22 H 3.466 3.710 -4.376 1.00 . A A . 10 ARG HH22 1 1 5 2850 1 1 10 ARG N N 6.319 -0.176 2.048 1.00 . A A . 10 ARG N 1 1 5 2851 1 1 10 ARG NE N 5.476 2.198 -2.337 1.00 . A A . 10 ARG NE 1 1 5 2852 1 1 10 ARG NH1 N 4.077 1.271 -3.974 1.00 . A A . 10 ARG NH1 1 1 5 2853 1 1 10 ARG NH2 N 4.163 3.559 -3.657 1.00 . A A . 10 ARG NH2 1 1 5 2854 1 1 10 ARG O O 6.363 -3.193 0.321 1.00 . A A . 10 ARG O 1 1 5 2855 1 1 11 ASN C C 7.116 -4.824 2.618 1.00 . A A . 11 ASN C 1 1 5 2856 1 1 11 ASN CA C 8.294 -3.941 2.194 1.00 . A A . 11 ASN CA 1 1 5 2857 1 1 11 ASN CB C 9.396 -3.898 3.258 1.00 . A A . 11 ASN CB 1 1 5 2858 1 1 11 ASN CG C 9.811 -5.294 3.708 1.00 . A A . 11 ASN CG 1 1 5 2859 1 1 11 ASN H H 8.276 -1.821 2.399 1.00 . A A . 11 ASN H 1 1 5 2860 1 1 11 ASN HA H 8.721 -4.369 1.284 1.00 . A A . 11 ASN HA 1 1 5 2861 1 1 11 ASN HB2 H 10.269 -3.390 2.848 1.00 . A A . 11 ASN HB2 1 1 5 2862 1 1 11 ASN HB3 H 9.049 -3.335 4.122 1.00 . A A . 11 ASN HB3 1 1 5 2863 1 1 11 ASN HD21 H 8.683 -5.139 5.400 1.00 . A A . 11 ASN HD21 1 1 5 2864 1 1 11 ASN HD22 H 9.583 -6.630 5.220 1.00 . A A . 11 ASN HD22 1 1 5 2865 1 1 11 ASN N N 7.851 -2.587 1.892 1.00 . A A . 11 ASN N 1 1 5 2866 1 1 11 ASN ND2 N 9.313 -5.725 4.869 1.00 . A A . 11 ASN ND2 1 1 5 2867 1 1 11 ASN O O 6.919 -5.887 2.036 1.00 . A A . 11 ASN O 1 1 5 2868 1 1 11 ASN OD1 O 10.577 -5.968 3.025 1.00 . A A . 11 ASN OD1 1 1 5 2869 1 1 12 ILE C C 4.165 -5.358 2.963 1.00 . A A . 12 ILE C 1 1 5 2870 1 1 12 ILE CA C 5.170 -5.133 4.097 1.00 . A A . 12 ILE CA 1 1 5 2871 1 1 12 ILE CB C 4.533 -4.405 5.298 1.00 . A A . 12 ILE CB 1 1 5 2872 1 1 12 ILE CD1 C 5.150 -3.352 7.544 1.00 . A A . 12 ILE CD1 1 1 5 2873 1 1 12 ILE CG1 C 5.512 -4.403 6.488 1.00 . A A . 12 ILE CG1 1 1 5 2874 1 1 12 ILE CG2 C 3.222 -5.096 5.710 1.00 . A A . 12 ILE CG2 1 1 5 2875 1 1 12 ILE H H 6.508 -3.481 4.023 1.00 . A A . 12 ILE H 1 1 5 2876 1 1 12 ILE HA H 5.516 -6.109 4.440 1.00 . A A . 12 ILE HA 1 1 5 2877 1 1 12 ILE HB H 4.314 -3.376 5.009 1.00 . A A . 12 ILE HB 1 1 5 2878 1 1 12 ILE HD11 H 4.185 -3.567 8.001 1.00 . A A . 12 ILE HD11 1 1 5 2879 1 1 12 ILE HD12 H 5.911 -3.357 8.325 1.00 . A A . 12 ILE HD12 1 1 5 2880 1 1 12 ILE HD13 H 5.122 -2.361 7.087 1.00 . A A . 12 ILE HD13 1 1 5 2881 1 1 12 ILE HG12 H 5.525 -5.391 6.948 1.00 . A A . 12 ILE HG12 1 1 5 2882 1 1 12 ILE HG13 H 6.522 -4.182 6.150 1.00 . A A . 12 ILE HG13 1 1 5 2883 1 1 12 ILE HG21 H 3.401 -6.159 5.879 1.00 . A A . 12 ILE HG21 1 1 5 2884 1 1 12 ILE HG22 H 2.826 -4.661 6.625 1.00 . A A . 12 ILE HG22 1 1 5 2885 1 1 12 ILE HG23 H 2.466 -4.984 4.935 1.00 . A A . 12 ILE HG23 1 1 5 2886 1 1 12 ILE N N 6.323 -4.384 3.603 1.00 . A A . 12 ILE N 1 1 5 2887 1 1 12 ILE O O 3.671 -6.472 2.791 1.00 . A A . 12 ILE O 1 1 5 2888 1 1 13 TYR C C 3.376 -5.434 0.070 1.00 . A A . 13 TYR C 1 1 5 2889 1 1 13 TYR CA C 2.958 -4.350 1.066 1.00 . A A . 13 TYR CA 1 1 5 2890 1 1 13 TYR CB C 2.882 -2.971 0.400 1.00 . A A . 13 TYR CB 1 1 5 2891 1 1 13 TYR CD1 C 0.523 -2.615 -0.411 1.00 . A A . 13 TYR CD1 1 1 5 2892 1 1 13 TYR CD2 C 2.225 -3.229 -2.038 1.00 . A A . 13 TYR CD2 1 1 5 2893 1 1 13 TYR CE1 C -0.458 -2.678 -1.412 1.00 . A A . 13 TYR CE1 1 1 5 2894 1 1 13 TYR CE2 C 1.241 -3.298 -3.039 1.00 . A A . 13 TYR CE2 1 1 5 2895 1 1 13 TYR CG C 1.863 -2.901 -0.718 1.00 . A A . 13 TYR CG 1 1 5 2896 1 1 13 TYR CZ C -0.104 -3.047 -2.720 1.00 . A A . 13 TYR CZ 1 1 5 2897 1 1 13 TYR H H 4.322 -3.418 2.392 1.00 . A A . 13 TYR H 1 1 5 2898 1 1 13 TYR HA H 1.968 -4.598 1.453 1.00 . A A . 13 TYR HA 1 1 5 2899 1 1 13 TYR HB2 H 2.615 -2.232 1.156 1.00 . A A . 13 TYR HB2 1 1 5 2900 1 1 13 TYR HB3 H 3.858 -2.697 0.003 1.00 . A A . 13 TYR HB3 1 1 5 2901 1 1 13 TYR HD1 H 0.245 -2.363 0.601 1.00 . A A . 13 TYR HD1 1 1 5 2902 1 1 13 TYR HD2 H 3.253 -3.454 -2.281 1.00 . A A . 13 TYR HD2 1 1 5 2903 1 1 13 TYR HE1 H -1.482 -2.449 -1.169 1.00 . A A . 13 TYR HE1 1 1 5 2904 1 1 13 TYR HE2 H 1.519 -3.570 -4.048 1.00 . A A . 13 TYR HE2 1 1 5 2905 1 1 13 TYR HH H -1.949 -3.028 -3.315 1.00 . A A . 13 TYR HH 1 1 5 2906 1 1 13 TYR N N 3.877 -4.304 2.192 1.00 . A A . 13 TYR N 1 1 5 2907 1 1 13 TYR O O 2.587 -6.321 -0.242 1.00 . A A . 13 TYR O 1 1 5 2908 1 1 13 TYR OH O -1.070 -3.167 -3.677 1.00 . A A . 13 TYR OH 1 1 5 2909 1 1 14 ASN C C 5.126 -7.736 -0.788 1.00 . A A . 14 ASN C 1 1 5 2910 1 1 14 ASN CA C 5.182 -6.320 -1.356 1.00 . A A . 14 ASN CA 1 1 5 2911 1 1 14 ASN CB C 6.619 -5.921 -1.720 1.00 . A A . 14 ASN CB 1 1 5 2912 1 1 14 ASN CG C 6.650 -4.873 -2.830 1.00 . A A . 14 ASN CG 1 1 5 2913 1 1 14 ASN H H 5.221 -4.618 -0.091 1.00 . A A . 14 ASN H 1 1 5 2914 1 1 14 ASN HA H 4.579 -6.313 -2.267 1.00 . A A . 14 ASN HA 1 1 5 2915 1 1 14 ASN HB2 H 7.151 -5.561 -0.838 1.00 . A A . 14 ASN HB2 1 1 5 2916 1 1 14 ASN HB3 H 7.148 -6.797 -2.090 1.00 . A A . 14 ASN HB3 1 1 5 2917 1 1 14 ASN HD21 H 6.163 -3.373 -1.540 1.00 . A A . 14 ASN HD21 1 1 5 2918 1 1 14 ASN HD22 H 6.398 -2.901 -3.213 1.00 . A A . 14 ASN HD22 1 1 5 2919 1 1 14 ASN N N 4.620 -5.363 -0.414 1.00 . A A . 14 ASN N 1 1 5 2920 1 1 14 ASN ND2 N 6.372 -3.612 -2.499 1.00 . A A . 14 ASN ND2 1 1 5 2921 1 1 14 ASN O O 4.651 -8.639 -1.469 1.00 . A A . 14 ASN O 1 1 5 2922 1 1 14 ASN OD1 O 6.922 -5.200 -3.982 1.00 . A A . 14 ASN OD1 1 1 5 2923 1 1 15 THR C C 4.102 -9.809 1.088 1.00 . A A . 15 THR C 1 1 5 2924 1 1 15 THR CA C 5.526 -9.244 1.103 1.00 . A A . 15 THR CA 1 1 5 2925 1 1 15 THR CB C 6.102 -9.151 2.524 1.00 . A A . 15 THR CB 1 1 5 2926 1 1 15 THR CG2 C 6.132 -10.518 3.214 1.00 . A A . 15 THR CG2 1 1 5 2927 1 1 15 THR H H 5.939 -7.159 0.989 1.00 . A A . 15 THR H 1 1 5 2928 1 1 15 THR HA H 6.162 -9.920 0.531 1.00 . A A . 15 THR HA 1 1 5 2929 1 1 15 THR HB H 5.503 -8.462 3.121 1.00 . A A . 15 THR HB 1 1 5 2930 1 1 15 THR HG1 H 7.747 -8.509 3.344 1.00 . A A . 15 THR HG1 1 1 5 2931 1 1 15 THR HG21 H 6.688 -11.229 2.602 1.00 . A A . 15 THR HG21 1 1 5 2932 1 1 15 THR HG22 H 6.621 -10.427 4.185 1.00 . A A . 15 THR HG22 1 1 5 2933 1 1 15 THR HG23 H 5.120 -10.890 3.369 1.00 . A A . 15 THR HG23 1 1 5 2934 1 1 15 THR N N 5.571 -7.938 0.457 1.00 . A A . 15 THR N 1 1 5 2935 1 1 15 THR O O 3.914 -10.995 0.823 1.00 . A A . 15 THR O 1 1 5 2936 1 1 15 THR OG1 O 7.425 -8.663 2.453 1.00 . A A . 15 THR OG1 1 1 5 2937 1 1 16 CYS C C 1.242 -9.681 -0.155 1.00 . A A . 16 CYS C 1 1 5 2938 1 1 16 CYS CA C 1.693 -9.328 1.270 1.00 . A A . 16 CYS CA 1 1 5 2939 1 1 16 CYS CB C 0.858 -8.215 1.908 1.00 . A A . 16 CYS CB 1 1 5 2940 1 1 16 CYS H H 3.321 -7.994 1.547 1.00 . A A . 16 CYS H 1 1 5 2941 1 1 16 CYS HA H 1.558 -10.216 1.887 1.00 . A A . 16 CYS HA 1 1 5 2942 1 1 16 CYS HB2 H 1.184 -8.125 2.942 1.00 . A A . 16 CYS HB2 1 1 5 2943 1 1 16 CYS HB3 H 1.058 -7.267 1.418 1.00 . A A . 16 CYS HB3 1 1 5 2944 1 1 16 CYS N N 3.099 -8.958 1.328 1.00 . A A . 16 CYS N 1 1 5 2945 1 1 16 CYS O O 0.434 -10.595 -0.324 1.00 . A A . 16 CYS O 1 1 5 2946 1 1 16 CYS SG S -0.933 -8.466 1.908 1.00 . A A . 16 CYS SG 1 1 5 2947 1 1 17 ARG C C 2.060 -10.799 -2.831 1.00 . A A . 17 ARG C 1 1 5 2948 1 1 17 ARG CA C 1.531 -9.386 -2.571 1.00 . A A . 17 ARG CA 1 1 5 2949 1 1 17 ARG CB C 2.147 -8.392 -3.571 1.00 . A A . 17 ARG CB 1 1 5 2950 1 1 17 ARG CD C 0.111 -6.827 -3.438 1.00 . A A . 17 ARG CD 1 1 5 2951 1 1 17 ARG CG C 1.637 -6.949 -3.476 1.00 . A A . 17 ARG CG 1 1 5 2952 1 1 17 ARG CZ C -1.557 -8.328 -4.573 1.00 . A A . 17 ARG CZ 1 1 5 2953 1 1 17 ARG H H 2.398 -8.228 -0.997 1.00 . A A . 17 ARG H 1 1 5 2954 1 1 17 ARG HA H 0.456 -9.417 -2.735 1.00 . A A . 17 ARG HA 1 1 5 2955 1 1 17 ARG HB2 H 3.230 -8.378 -3.463 1.00 . A A . 17 ARG HB2 1 1 5 2956 1 1 17 ARG HB3 H 1.934 -8.758 -4.574 1.00 . A A . 17 ARG HB3 1 1 5 2957 1 1 17 ARG HD2 H -0.237 -7.225 -2.488 1.00 . A A . 17 ARG HD2 1 1 5 2958 1 1 17 ARG HD3 H -0.151 -5.771 -3.464 1.00 . A A . 17 ARG HD3 1 1 5 2959 1 1 17 ARG HE H -0.135 -7.226 -5.500 1.00 . A A . 17 ARG HE 1 1 5 2960 1 1 17 ARG HG2 H 2.042 -6.479 -2.586 1.00 . A A . 17 ARG HG2 1 1 5 2961 1 1 17 ARG HG3 H 2.016 -6.398 -4.337 1.00 . A A . 17 ARG HG3 1 1 5 2962 1 1 17 ARG HH11 H -1.754 -8.398 -2.534 1.00 . A A . 17 ARG HH11 1 1 5 2963 1 1 17 ARG HH12 H -2.854 -9.407 -3.428 1.00 . A A . 17 ARG HH12 1 1 5 2964 1 1 17 ARG HH21 H -1.671 -8.491 -6.606 1.00 . A A . 17 ARG HH21 1 1 5 2965 1 1 17 ARG HH22 H -2.828 -9.446 -5.717 1.00 . A A . 17 ARG HH22 1 1 5 2966 1 1 17 ARG N N 1.765 -8.996 -1.183 1.00 . A A . 17 ARG N 1 1 5 2967 1 1 17 ARG NE N -0.520 -7.472 -4.600 1.00 . A A . 17 ARG NE 1 1 5 2968 1 1 17 ARG NH1 N -2.105 -8.729 -3.420 1.00 . A A . 17 ARG NH1 1 1 5 2969 1 1 17 ARG NH2 N -2.060 -8.791 -5.724 1.00 . A A . 17 ARG NH2 1 1 5 2970 1 1 17 ARG O O 1.325 -11.636 -3.351 1.00 . A A . 17 ARG O 1 1 5 2971 1 1 18 PHE C C 3.155 -13.448 -1.810 1.00 . A A . 18 PHE C 1 1 5 2972 1 1 18 PHE CA C 3.935 -12.385 -2.591 1.00 . A A . 18 PHE CA 1 1 5 2973 1 1 18 PHE CB C 5.405 -12.345 -2.149 1.00 . A A . 18 PHE CB 1 1 5 2974 1 1 18 PHE CD1 C 6.937 -12.865 -4.100 1.00 . A A . 18 PHE CD1 1 1 5 2975 1 1 18 PHE CD2 C 6.752 -10.557 -3.356 1.00 . A A . 18 PHE CD2 1 1 5 2976 1 1 18 PHE CE1 C 7.863 -12.475 -5.082 1.00 . A A . 18 PHE CE1 1 1 5 2977 1 1 18 PHE CE2 C 7.660 -10.162 -4.354 1.00 . A A . 18 PHE CE2 1 1 5 2978 1 1 18 PHE CG C 6.376 -11.907 -3.232 1.00 . A A . 18 PHE CG 1 1 5 2979 1 1 18 PHE CZ C 8.223 -11.122 -5.213 1.00 . A A . 18 PHE CZ 1 1 5 2980 1 1 18 PHE H H 3.866 -10.327 -2.035 1.00 . A A . 18 PHE H 1 1 5 2981 1 1 18 PHE HA H 3.905 -12.673 -3.643 1.00 . A A . 18 PHE HA 1 1 5 2982 1 1 18 PHE HB2 H 5.512 -11.705 -1.274 1.00 . A A . 18 PHE HB2 1 1 5 2983 1 1 18 PHE HB3 H 5.698 -13.352 -1.846 1.00 . A A . 18 PHE HB3 1 1 5 2984 1 1 18 PHE HD1 H 6.663 -13.907 -4.010 1.00 . A A . 18 PHE HD1 1 1 5 2985 1 1 18 PHE HD2 H 6.362 -9.817 -2.682 1.00 . A A . 18 PHE HD2 1 1 5 2986 1 1 18 PHE HE1 H 8.303 -13.215 -5.735 1.00 . A A . 18 PHE HE1 1 1 5 2987 1 1 18 PHE HE2 H 7.934 -9.121 -4.453 1.00 . A A . 18 PHE HE2 1 1 5 2988 1 1 18 PHE HZ H 8.935 -10.821 -5.967 1.00 . A A . 18 PHE HZ 1 1 5 2989 1 1 18 PHE N N 3.320 -11.066 -2.459 1.00 . A A . 18 PHE N 1 1 5 2990 1 1 18 PHE O O 2.991 -14.563 -2.301 1.00 . A A . 18 PHE O 1 1 5 2991 1 1 19 ALA C C 0.562 -14.372 -0.486 1.00 . A A . 19 ALA C 1 1 5 2992 1 1 19 ALA CA C 1.873 -14.014 0.216 1.00 . A A . 19 ALA CA 1 1 5 2993 1 1 19 ALA CB C 1.613 -13.380 1.584 1.00 . A A . 19 ALA CB 1 1 5 2994 1 1 19 ALA H H 2.839 -12.180 -0.252 1.00 . A A . 19 ALA H 1 1 5 2995 1 1 19 ALA HA H 2.445 -14.929 0.377 1.00 . A A . 19 ALA HA 1 1 5 2996 1 1 19 ALA HB1 H 2.561 -13.133 2.064 1.00 . A A . 19 ALA HB1 1 1 5 2997 1 1 19 ALA HB2 H 1.019 -12.475 1.473 1.00 . A A . 19 ALA HB2 1 1 5 2998 1 1 19 ALA HB3 H 1.070 -14.084 2.214 1.00 . A A . 19 ALA HB3 1 1 5 2999 1 1 19 ALA N N 2.670 -13.112 -0.606 1.00 . A A . 19 ALA N 1 1 5 3000 1 1 19 ALA O O 0.158 -15.534 -0.477 1.00 . A A . 19 ALA O 1 1 5 3001 1 1 20 GLY C C -2.516 -13.020 -1.295 1.00 . A A . 20 GLY C 1 1 5 3002 1 1 20 GLY CA C -1.250 -13.557 -1.954 1.00 . A A . 20 GLY CA 1 1 5 3003 1 1 20 GLY H H 0.306 -12.443 -1.053 1.00 . A A . 20 GLY H 1 1 5 3004 1 1 20 GLY HA2 H -1.090 -13.005 -2.879 1.00 . A A . 20 GLY HA2 1 1 5 3005 1 1 20 GLY HA3 H -1.392 -14.607 -2.210 1.00 . A A . 20 GLY HA3 1 1 5 3006 1 1 20 GLY N N -0.082 -13.376 -1.108 1.00 . A A . 20 GLY N 1 1 5 3007 1 1 20 GLY O O -3.540 -13.700 -1.290 1.00 . A A . 20 GLY O 1 1 5 3008 1 1 21 GLY C C -4.300 -10.400 -1.635 1.00 . A A . 21 GLY C 1 1 5 3009 1 1 21 GLY CA C -3.656 -11.039 -0.400 1.00 . A A . 21 GLY CA 1 1 5 3010 1 1 21 GLY H H -1.577 -11.291 -0.788 1.00 . A A . 21 GLY H 1 1 5 3011 1 1 21 GLY HA2 H -4.370 -11.696 0.095 1.00 . A A . 21 GLY HA2 1 1 5 3012 1 1 21 GLY HA3 H -3.362 -10.255 0.297 1.00 . A A . 21 GLY HA3 1 1 5 3013 1 1 21 GLY N N -2.463 -11.780 -0.789 1.00 . A A . 21 GLY N 1 1 5 3014 1 1 21 GLY O O -3.974 -10.765 -2.765 1.00 . A A . 21 GLY O 1 1 5 3015 1 1 22 SER C C -4.742 -7.187 -2.308 1.00 . A A . 22 SER C 1 1 5 3016 1 1 22 SER CA C -5.565 -8.461 -2.466 1.00 . A A . 22 SER CA 1 1 5 3017 1 1 22 SER CB C -7.057 -8.139 -2.366 1.00 . A A . 22 SER CB 1 1 5 3018 1 1 22 SER H H -5.427 -9.162 -0.482 1.00 . A A . 22 SER H 1 1 5 3019 1 1 22 SER HA H -5.382 -8.880 -3.457 1.00 . A A . 22 SER HA 1 1 5 3020 1 1 22 SER HB2 H -7.330 -7.453 -3.166 1.00 . A A . 22 SER HB2 1 1 5 3021 1 1 22 SER HB3 H -7.629 -9.056 -2.487 1.00 . A A . 22 SER HB3 1 1 5 3022 1 1 22 SER HG H -8.316 -7.410 -1.080 1.00 . A A . 22 SER HG 1 1 5 3023 1 1 22 SER N N -5.169 -9.403 -1.427 1.00 . A A . 22 SER N 1 1 5 3024 1 1 22 SER O O -4.226 -6.916 -1.224 1.00 . A A . 22 SER O 1 1 5 3025 1 1 22 SER OG O -7.366 -7.540 -1.125 1.00 . A A . 22 SER OG 1 1 5 3026 1 1 23 ARG C C -4.528 -4.225 -2.216 1.00 . A A . 23 ARG C 1 1 5 3027 1 1 23 ARG CA C -3.965 -5.104 -3.334 1.00 . A A . 23 ARG CA 1 1 5 3028 1 1 23 ARG CB C -4.085 -4.387 -4.683 1.00 . A A . 23 ARG CB 1 1 5 3029 1 1 23 ARG CD C -2.909 -4.176 -6.910 1.00 . A A . 23 ARG CD 1 1 5 3030 1 1 23 ARG CG C -3.292 -5.121 -5.771 1.00 . A A . 23 ARG CG 1 1 5 3031 1 1 23 ARG CZ C -1.287 -2.308 -7.253 1.00 . A A . 23 ARG CZ 1 1 5 3032 1 1 23 ARG H H -5.077 -6.681 -4.244 1.00 . A A . 23 ARG H 1 1 5 3033 1 1 23 ARG HA H -2.909 -5.276 -3.122 1.00 . A A . 23 ARG HA 1 1 5 3034 1 1 23 ARG HB2 H -5.131 -4.308 -4.981 1.00 . A A . 23 ARG HB2 1 1 5 3035 1 1 23 ARG HB3 H -3.695 -3.379 -4.557 1.00 . A A . 23 ARG HB3 1 1 5 3036 1 1 23 ARG HD2 H -2.538 -4.779 -7.739 1.00 . A A . 23 ARG HD2 1 1 5 3037 1 1 23 ARG HD3 H -3.792 -3.623 -7.240 1.00 . A A . 23 ARG HD3 1 1 5 3038 1 1 23 ARG HE H -1.520 -3.350 -5.531 1.00 . A A . 23 ARG HE 1 1 5 3039 1 1 23 ARG HG2 H -2.374 -5.534 -5.353 1.00 . A A . 23 ARG HG2 1 1 5 3040 1 1 23 ARG HG3 H -3.896 -5.938 -6.164 1.00 . A A . 23 ARG HG3 1 1 5 3041 1 1 23 ARG HH11 H -2.473 -2.646 -8.881 1.00 . A A . 23 ARG HH11 1 1 5 3042 1 1 23 ARG HH12 H -1.281 -1.387 -9.082 1.00 . A A . 23 ARG HH12 1 1 5 3043 1 1 23 ARG HH21 H 0.038 -1.734 -5.813 1.00 . A A . 23 ARG HH21 1 1 5 3044 1 1 23 ARG HH22 H 0.165 -0.869 -7.326 1.00 . A A . 23 ARG HH22 1 1 5 3045 1 1 23 ARG N N -4.638 -6.395 -3.380 1.00 . A A . 23 ARG N 1 1 5 3046 1 1 23 ARG NE N -1.853 -3.250 -6.482 1.00 . A A . 23 ARG NE 1 1 5 3047 1 1 23 ARG NH1 N -1.712 -2.097 -8.507 1.00 . A A . 23 ARG NH1 1 1 5 3048 1 1 23 ARG NH2 N -0.282 -1.573 -6.758 1.00 . A A . 23 ARG NH2 1 1 5 3049 1 1 23 ARG O O -3.763 -3.618 -1.473 1.00 . A A . 23 ARG O 1 1 5 3050 1 1 24 GLU C C -6.205 -3.852 0.320 1.00 . A A . 24 GLU C 1 1 5 3051 1 1 24 GLU CA C -6.546 -3.373 -1.094 1.00 . A A . 24 GLU CA 1 1 5 3052 1 1 24 GLU CB C -8.059 -3.411 -1.337 1.00 . A A . 24 GLU CB 1 1 5 3053 1 1 24 GLU CD C -9.939 -2.727 -2.878 1.00 . A A . 24 GLU CD 1 1 5 3054 1 1 24 GLU CG C -8.428 -2.744 -2.669 1.00 . A A . 24 GLU CG 1 1 5 3055 1 1 24 GLU H H -6.419 -4.713 -2.740 1.00 . A A . 24 GLU H 1 1 5 3056 1 1 24 GLU HA H -6.210 -2.339 -1.192 1.00 . A A . 24 GLU HA 1 1 5 3057 1 1 24 GLU HB2 H -8.409 -4.445 -1.339 1.00 . A A . 24 GLU HB2 1 1 5 3058 1 1 24 GLU HB3 H -8.555 -2.876 -0.527 1.00 . A A . 24 GLU HB3 1 1 5 3059 1 1 24 GLU HE2 H -11.587 -1.914 -2.246 1.00 . A A . 24 GLU HE2 1 1 5 3060 1 1 24 GLU HG2 H -8.064 -1.716 -2.675 1.00 . A A . 24 GLU HG2 1 1 5 3061 1 1 24 GLU HG3 H -7.964 -3.284 -3.494 1.00 . A A . 24 GLU HG3 1 1 5 3062 1 1 24 GLU N N -5.859 -4.173 -2.098 1.00 . A A . 24 GLU N 1 1 5 3063 1 1 24 GLU O O -5.802 -3.046 1.155 1.00 . A A . 24 GLU O 1 1 5 3064 1 1 24 GLU OE1 O -10.438 -3.449 -3.738 1.00 . A A . 24 GLU OE1 1 1 5 3065 1 1 24 GLU OE2 O -10.644 -1.888 -2.067 1.00 . A A . 24 GLU OE2 1 1 5 3066 1 1 25 ARG C C -4.631 -5.466 2.313 1.00 . A A . 25 ARG C 1 1 5 3067 1 1 25 ARG CA C -6.078 -5.727 1.904 1.00 . A A . 25 ARG CA 1 1 5 3068 1 1 25 ARG CB C -6.382 -7.226 1.866 1.00 . A A . 25 ARG CB 1 1 5 3069 1 1 25 ARG CD C -6.877 -9.265 3.281 1.00 . A A . 25 ARG CD 1 1 5 3070 1 1 25 ARG CG C -6.271 -7.857 3.259 1.00 . A A . 25 ARG CG 1 1 5 3071 1 1 25 ARG CZ C -9.165 -10.276 3.263 1.00 . A A . 25 ARG CZ 1 1 5 3072 1 1 25 ARG H H -6.681 -5.787 -0.126 1.00 . A A . 25 ARG H 1 1 5 3073 1 1 25 ARG HA H -6.736 -5.252 2.635 1.00 . A A . 25 ARG HA 1 1 5 3074 1 1 25 ARG HB2 H -7.393 -7.347 1.491 1.00 . A A . 25 ARG HB2 1 1 5 3075 1 1 25 ARG HB3 H -5.694 -7.729 1.184 1.00 . A A . 25 ARG HB3 1 1 5 3076 1 1 25 ARG HD2 H -6.433 -9.867 2.486 1.00 . A A . 25 ARG HD2 1 1 5 3077 1 1 25 ARG HD3 H -6.634 -9.712 4.243 1.00 . A A . 25 ARG HD3 1 1 5 3078 1 1 25 ARG HE H -8.745 -8.318 2.943 1.00 . A A . 25 ARG HE 1 1 5 3079 1 1 25 ARG HG2 H -5.219 -7.920 3.538 1.00 . A A . 25 ARG HG2 1 1 5 3080 1 1 25 ARG HG3 H -6.791 -7.237 3.991 1.00 . A A . 25 ARG HG3 1 1 5 3081 1 1 25 ARG HH11 H -7.685 -11.649 3.577 1.00 . A A . 25 ARG HH11 1 1 5 3082 1 1 25 ARG HH12 H -9.307 -12.288 3.607 1.00 . A A . 25 ARG HH12 1 1 5 3083 1 1 25 ARG HH21 H -10.862 -9.172 2.982 1.00 . A A . 25 ARG HH21 1 1 5 3084 1 1 25 ARG HH22 H -11.121 -10.875 3.262 1.00 . A A . 25 ARG HH22 1 1 5 3085 1 1 25 ARG N N -6.362 -5.154 0.595 1.00 . A A . 25 ARG N 1 1 5 3086 1 1 25 ARG NE N -8.340 -9.224 3.129 1.00 . A A . 25 ARG NE 1 1 5 3087 1 1 25 ARG NH1 N -8.680 -11.503 3.502 1.00 . A A . 25 ARG NH1 1 1 5 3088 1 1 25 ARG NH2 N -10.489 -10.094 3.158 1.00 . A A . 25 ARG NH2 1 1 5 3089 1 1 25 ARG O O -4.371 -5.065 3.444 1.00 . A A . 25 ARG O 1 1 5 3090 1 1 26 CYS C C -2.045 -3.907 1.865 1.00 . A A . 26 CYS C 1 1 5 3091 1 1 26 CYS CA C -2.288 -5.391 1.580 1.00 . A A . 26 CYS CA 1 1 5 3092 1 1 26 CYS CB C -1.479 -5.883 0.377 1.00 . A A . 26 CYS CB 1 1 5 3093 1 1 26 CYS H H -3.997 -6.031 0.479 1.00 . A A . 26 CYS H 1 1 5 3094 1 1 26 CYS HA H -1.957 -5.940 2.460 1.00 . A A . 26 CYS HA 1 1 5 3095 1 1 26 CYS HB2 H -1.841 -5.396 -0.528 1.00 . A A . 26 CYS HB2 1 1 5 3096 1 1 26 CYS HB3 H -0.441 -5.589 0.523 1.00 . A A . 26 CYS HB3 1 1 5 3097 1 1 26 CYS N N -3.700 -5.676 1.378 1.00 . A A . 26 CYS N 1 1 5 3098 1 1 26 CYS O O -1.211 -3.586 2.709 1.00 . A A . 26 CYS O 1 1 5 3099 1 1 26 CYS SG S -1.519 -7.682 0.120 1.00 . A A . 26 CYS SG 1 1 5 3100 1 1 27 ALA C C -3.047 -1.282 2.916 1.00 . A A . 27 ALA C 1 1 5 3101 1 1 27 ALA CA C -2.711 -1.572 1.453 1.00 . A A . 27 ALA CA 1 1 5 3102 1 1 27 ALA CB C -3.646 -0.813 0.503 1.00 . A A . 27 ALA CB 1 1 5 3103 1 1 27 ALA H H -3.432 -3.330 0.494 1.00 . A A . 27 ALA H 1 1 5 3104 1 1 27 ALA HA H -1.693 -1.233 1.262 1.00 . A A . 27 ALA HA 1 1 5 3105 1 1 27 ALA HB1 H -3.581 -1.237 -0.493 1.00 . A A . 27 ALA HB1 1 1 5 3106 1 1 27 ALA HB2 H -4.680 -0.862 0.839 1.00 . A A . 27 ALA HB2 1 1 5 3107 1 1 27 ALA HB3 H -3.353 0.233 0.454 1.00 . A A . 27 ALA HB3 1 1 5 3108 1 1 27 ALA N N -2.778 -3.006 1.196 1.00 . A A . 27 ALA N 1 1 5 3109 1 1 27 ALA O O -2.248 -0.673 3.620 1.00 . A A . 27 ALA O 1 1 5 3110 1 1 28 LYS C C -3.587 -2.159 5.731 1.00 . A A . 28 LYS C 1 1 5 3111 1 1 28 LYS CA C -4.639 -1.608 4.762 1.00 . A A . 28 LYS CA 1 1 5 3112 1 1 28 LYS CB C -5.985 -2.314 4.972 1.00 . A A . 28 LYS CB 1 1 5 3113 1 1 28 LYS CD C -7.367 -1.060 3.228 1.00 . A A . 28 LYS CD 1 1 5 3114 1 1 28 LYS CE C -8.650 -0.258 2.989 1.00 . A A . 28 LYS CE 1 1 5 3115 1 1 28 LYS CG C -7.190 -1.398 4.712 1.00 . A A . 28 LYS CG 1 1 5 3116 1 1 28 LYS H H -4.816 -2.263 2.746 1.00 . A A . 28 LYS H 1 1 5 3117 1 1 28 LYS HA H -4.758 -0.545 4.978 1.00 . A A . 28 LYS HA 1 1 5 3118 1 1 28 LYS HB2 H -6.052 -3.205 4.347 1.00 . A A . 28 LYS HB2 1 1 5 3119 1 1 28 LYS HB3 H -6.035 -2.641 6.010 1.00 . A A . 28 LYS HB3 1 1 5 3120 1 1 28 LYS HD2 H -6.514 -0.481 2.872 1.00 . A A . 28 LYS HD2 1 1 5 3121 1 1 28 LYS HD3 H -7.437 -1.995 2.675 1.00 . A A . 28 LYS HD3 1 1 5 3122 1 1 28 LYS HE2 H -9.500 -0.795 3.413 1.00 . A A . 28 LYS HE2 1 1 5 3123 1 1 28 LYS HE3 H -8.569 0.715 3.473 1.00 . A A . 28 LYS HE3 1 1 5 3124 1 1 28 LYS HG2 H -8.084 -1.918 5.060 1.00 . A A . 28 LYS HG2 1 1 5 3125 1 1 28 LYS HG3 H -7.081 -0.479 5.289 1.00 . A A . 28 LYS HG3 1 1 5 3126 1 1 28 LYS HZ1 H -8.973 -0.963 1.092 1.00 . A A . 28 LYS HZ1 1 1 5 3127 1 1 28 LYS HZ2 H -9.758 0.449 1.417 1.00 . A A . 28 LYS HZ2 1 1 5 3128 1 1 28 LYS HZ3 H -8.134 0.455 1.136 1.00 . A A . 28 LYS HZ3 1 1 5 3129 1 1 28 LYS N N -4.210 -1.756 3.379 1.00 . A A . 28 LYS N 1 1 5 3130 1 1 28 LYS NZ N -8.896 -0.064 1.548 1.00 . A A . 28 LYS NZ 1 1 5 3131 1 1 28 LYS O O -3.161 -1.448 6.640 1.00 . A A . 28 LYS O 1 1 5 3132 1 1 29 LEU C C -0.922 -3.344 6.525 1.00 . A A . 29 LEU C 1 1 5 3133 1 1 29 LEU CA C -2.225 -4.132 6.372 1.00 . A A . 29 LEU CA 1 1 5 3134 1 1 29 LEU CB C -1.960 -5.511 5.751 1.00 . A A . 29 LEU CB 1 1 5 3135 1 1 29 LEU CD1 C -1.400 -6.738 7.912 1.00 . A A . 29 LEU CD1 1 1 5 3136 1 1 29 LEU CD2 C -0.662 -7.642 5.696 1.00 . A A . 29 LEU CD2 1 1 5 3137 1 1 29 LEU CG C -0.926 -6.367 6.503 1.00 . A A . 29 LEU CG 1 1 5 3138 1 1 29 LEU H H -3.584 -3.931 4.758 1.00 . A A . 29 LEU H 1 1 5 3139 1 1 29 LEU HA H -2.679 -4.263 7.354 1.00 . A A . 29 LEU HA 1 1 5 3140 1 1 29 LEU HB2 H -2.901 -6.060 5.695 1.00 . A A . 29 LEU HB2 1 1 5 3141 1 1 29 LEU HB3 H -1.594 -5.360 4.736 1.00 . A A . 29 LEU HB3 1 1 5 3142 1 1 29 LEU HD11 H -1.503 -5.844 8.524 1.00 . A A . 29 LEU HD11 1 1 5 3143 1 1 29 LEU HD12 H -2.358 -7.256 7.861 1.00 . A A . 29 LEU HD12 1 1 5 3144 1 1 29 LEU HD13 H -0.666 -7.392 8.383 1.00 . A A . 29 LEU HD13 1 1 5 3145 1 1 29 LEU HD21 H -1.594 -8.183 5.529 1.00 . A A . 29 LEU HD21 1 1 5 3146 1 1 29 LEU HD22 H -0.227 -7.374 4.734 1.00 . A A . 29 LEU HD22 1 1 5 3147 1 1 29 LEU HD23 H 0.037 -8.287 6.229 1.00 . A A . 29 LEU HD23 1 1 5 3148 1 1 29 LEU HG H 0.021 -5.830 6.582 1.00 . A A . 29 LEU HG 1 1 5 3149 1 1 29 LEU N N -3.183 -3.420 5.534 1.00 . A A . 29 LEU N 1 1 5 3150 1 1 29 LEU O O -0.409 -3.201 7.634 1.00 . A A . 29 LEU O 1 1 5 3151 1 1 30 SER C C 0.750 -0.723 5.933 1.00 . A A . 30 SER C 1 1 5 3152 1 1 30 SER CA C 0.878 -2.133 5.360 1.00 . A A . 30 SER CA 1 1 5 3153 1 1 30 SER CB C 1.382 -2.080 3.916 1.00 . A A . 30 SER CB 1 1 5 3154 1 1 30 SER H H -0.901 -2.970 4.539 1.00 . A A . 30 SER H 1 1 5 3155 1 1 30 SER HA H 1.616 -2.676 5.951 1.00 . A A . 30 SER HA 1 1 5 3156 1 1 30 SER HB2 H 2.345 -1.570 3.893 1.00 . A A . 30 SER HB2 1 1 5 3157 1 1 30 SER HB3 H 1.505 -3.092 3.529 1.00 . A A . 30 SER HB3 1 1 5 3158 1 1 30 SER HG H -0.360 -1.867 3.074 1.00 . A A . 30 SER HG 1 1 5 3159 1 1 30 SER N N -0.388 -2.850 5.404 1.00 . A A . 30 SER N 1 1 5 3160 1 1 30 SER O O 1.703 -0.208 6.516 1.00 . A A . 30 SER O 1 1 5 3161 1 1 30 SER OG O 0.469 -1.379 3.101 1.00 . A A . 30 SER OG 1 1 5 3162 1 1 31 GLY C C -0.630 2.154 4.734 1.00 . A A . 31 GLY C 1 1 5 3163 1 1 31 GLY CA C -0.654 1.310 6.009 1.00 . A A . 31 GLY CA 1 1 5 3164 1 1 31 GLY H H -1.134 -0.582 5.209 1.00 . A A . 31 GLY H 1 1 5 3165 1 1 31 GLY HA2 H -1.642 1.395 6.464 1.00 . A A . 31 GLY HA2 1 1 5 3166 1 1 31 GLY HA3 H 0.081 1.702 6.714 1.00 . A A . 31 GLY HA3 1 1 5 3167 1 1 31 GLY N N -0.411 -0.093 5.722 1.00 . A A . 31 GLY N 1 1 5 3168 1 1 31 GLY O O -0.969 3.334 4.791 1.00 . A A . 31 GLY O 1 1 5 3169 1 1 32 CYS C C -1.640 2.507 1.795 1.00 . A A . 32 CYS C 1 1 5 3170 1 1 32 CYS CA C -0.219 2.273 2.310 1.00 . A A . 32 CYS CA 1 1 5 3171 1 1 32 CYS CB C 0.590 1.474 1.277 1.00 . A A . 32 CYS CB 1 1 5 3172 1 1 32 CYS H H -0.015 0.585 3.577 1.00 . A A . 32 CYS H 1 1 5 3173 1 1 32 CYS HA H 0.259 3.240 2.465 1.00 . A A . 32 CYS HA 1 1 5 3174 1 1 32 CYS HB2 H 0.007 0.607 0.969 1.00 . A A . 32 CYS HB2 1 1 5 3175 1 1 32 CYS HB3 H 0.733 2.090 0.392 1.00 . A A . 32 CYS HB3 1 1 5 3176 1 1 32 CYS N N -0.246 1.571 3.586 1.00 . A A . 32 CYS N 1 1 5 3177 1 1 32 CYS O O -2.575 1.821 2.204 1.00 . A A . 32 CYS O 1 1 5 3178 1 1 32 CYS SG S 2.210 0.867 1.825 1.00 . A A . 32 CYS SG 1 1 5 3179 1 1 33 LYS C C -2.856 3.161 -1.270 1.00 . A A . 33 LYS C 1 1 5 3180 1 1 33 LYS CA C -3.018 3.722 0.139 1.00 . A A . 33 LYS CA 1 1 5 3181 1 1 33 LYS CB C -3.290 5.228 0.035 1.00 . A A . 33 LYS CB 1 1 5 3182 1 1 33 LYS CD C -4.387 5.635 2.353 1.00 . A A . 33 LYS CD 1 1 5 3183 1 1 33 LYS CE C -4.013 4.481 3.294 1.00 . A A . 33 LYS CE 1 1 5 3184 1 1 33 LYS CG C -3.272 5.993 1.360 1.00 . A A . 33 LYS CG 1 1 5 3185 1 1 33 LYS H H -0.981 4.008 0.613 1.00 . A A . 33 LYS H 1 1 5 3186 1 1 33 LYS HA H -3.870 3.248 0.626 1.00 . A A . 33 LYS HA 1 1 5 3187 1 1 33 LYS HB2 H -2.520 5.673 -0.598 1.00 . A A . 33 LYS HB2 1 1 5 3188 1 1 33 LYS HB3 H -4.254 5.381 -0.452 1.00 . A A . 33 LYS HB3 1 1 5 3189 1 1 33 LYS HD2 H -4.567 6.523 2.960 1.00 . A A . 33 LYS HD2 1 1 5 3190 1 1 33 LYS HD3 H -5.308 5.402 1.817 1.00 . A A . 33 LYS HD3 1 1 5 3191 1 1 33 LYS HE2 H -4.337 3.538 2.859 1.00 . A A . 33 LYS HE2 1 1 5 3192 1 1 33 LYS HE3 H -2.937 4.456 3.449 1.00 . A A . 33 LYS HE3 1 1 5 3193 1 1 33 LYS HG2 H -2.294 5.882 1.826 1.00 . A A . 33 LYS HG2 1 1 5 3194 1 1 33 LYS HG3 H -3.400 7.045 1.102 1.00 . A A . 33 LYS HG3 1 1 5 3195 1 1 33 LYS HZ1 H -5.643 4.700 4.521 1.00 . A A . 33 LYS HZ1 1 1 5 3196 1 1 33 LYS HZ2 H -4.413 3.823 5.186 1.00 . A A . 33 LYS HZ2 1 1 5 3197 1 1 33 LYS HZ3 H -4.278 5.459 5.069 1.00 . A A . 33 LYS HZ3 1 1 5 3198 1 1 33 LYS N N -1.791 3.470 0.881 1.00 . A A . 33 LYS N 1 1 5 3199 1 1 33 LYS NZ N -4.640 4.628 4.619 1.00 . A A . 33 LYS NZ 1 1 5 3200 1 1 33 LYS O O -1.826 3.387 -1.906 1.00 . A A . 33 LYS O 1 1 5 3201 1 1 34 ILE C C -5.317 2.803 -3.659 1.00 . A A . 34 ILE C 1 1 5 3202 1 1 34 ILE CA C -4.058 2.100 -3.157 1.00 . A A . 34 ILE CA 1 1 5 3203 1 1 34 ILE CB C -4.169 0.571 -3.275 1.00 . A A . 34 ILE CB 1 1 5 3204 1 1 34 ILE CD1 C -1.753 -0.010 -3.945 1.00 . A A . 34 ILE CD1 1 1 5 3205 1 1 34 ILE CG1 C -2.850 -0.117 -2.884 1.00 . A A . 34 ILE CG1 1 1 5 3206 1 1 34 ILE CG2 C -4.616 0.131 -4.677 1.00 . A A . 34 ILE CG2 1 1 5 3207 1 1 34 ILE H H -4.667 2.262 -1.151 1.00 . A A . 34 ILE H 1 1 5 3208 1 1 34 ILE HA H -3.215 2.448 -3.754 1.00 . A A . 34 ILE HA 1 1 5 3209 1 1 34 ILE HB H -4.930 0.229 -2.570 1.00 . A A . 34 ILE HB 1 1 5 3210 1 1 34 ILE HD11 H -1.591 1.029 -4.215 1.00 . A A . 34 ILE HD11 1 1 5 3211 1 1 34 ILE HD12 H -0.825 -0.418 -3.548 1.00 . A A . 34 ILE HD12 1 1 5 3212 1 1 34 ILE HD13 H -2.035 -0.576 -4.832 1.00 . A A . 34 ILE HD13 1 1 5 3213 1 1 34 ILE HG12 H -2.472 0.303 -1.953 1.00 . A A . 34 ILE HG12 1 1 5 3214 1 1 34 ILE HG13 H -3.064 -1.171 -2.720 1.00 . A A . 34 ILE HG13 1 1 5 3215 1 1 34 ILE HG21 H -3.995 0.601 -5.442 1.00 . A A . 34 ILE HG21 1 1 5 3216 1 1 34 ILE HG22 H -4.539 -0.953 -4.766 1.00 . A A . 34 ILE HG22 1 1 5 3217 1 1 34 ILE HG23 H -5.655 0.410 -4.852 1.00 . A A . 34 ILE HG23 1 1 5 3218 1 1 34 ILE N N -3.891 2.472 -1.762 1.00 . A A . 34 ILE N 1 1 5 3219 1 1 34 ILE O O -6.424 2.443 -3.259 1.00 . A A . 34 ILE O 1 1 5 3220 1 1 35 ILE C C -5.808 4.633 -6.704 1.00 . A A . 35 ILE C 1 1 5 3221 1 1 35 ILE CA C -6.211 4.483 -5.237 1.00 . A A . 35 ILE CA 1 1 5 3222 1 1 35 ILE CB C -6.550 5.834 -4.575 1.00 . A A . 35 ILE CB 1 1 5 3223 1 1 35 ILE CD1 C -5.747 8.181 -3.997 1.00 . A A . 35 ILE CD1 1 1 5 3224 1 1 35 ILE CG1 C -5.369 6.823 -4.593 1.00 . A A . 35 ILE CG1 1 1 5 3225 1 1 35 ILE CG2 C -7.055 5.607 -3.143 1.00 . A A . 35 ILE CG2 1 1 5 3226 1 1 35 ILE H H -4.198 4.049 -4.800 1.00 . A A . 35 ILE H 1 1 5 3227 1 1 35 ILE HA H -7.106 3.860 -5.212 1.00 . A A . 35 ILE HA 1 1 5 3228 1 1 35 ILE HB H -7.368 6.276 -5.147 1.00 . A A . 35 ILE HB 1 1 5 3229 1 1 35 ILE HD11 H -6.643 8.566 -4.486 1.00 . A A . 35 ILE HD11 1 1 5 3230 1 1 35 ILE HD12 H -5.923 8.094 -2.926 1.00 . A A . 35 ILE HD12 1 1 5 3231 1 1 35 ILE HD13 H -4.933 8.886 -4.153 1.00 . A A . 35 ILE HD13 1 1 5 3232 1 1 35 ILE HG12 H -4.524 6.415 -4.038 1.00 . A A . 35 ILE HG12 1 1 5 3233 1 1 35 ILE HG13 H -5.058 6.999 -5.622 1.00 . A A . 35 ILE HG13 1 1 5 3234 1 1 35 ILE HG21 H -6.229 5.328 -2.488 1.00 . A A . 35 ILE HG21 1 1 5 3235 1 1 35 ILE HG22 H -7.522 6.514 -2.758 1.00 . A A . 35 ILE HG22 1 1 5 3236 1 1 35 ILE HG23 H -7.804 4.816 -3.133 1.00 . A A . 35 ILE HG23 1 1 5 3237 1 1 35 ILE N N -5.137 3.800 -4.532 1.00 . A A . 35 ILE N 1 1 5 3238 1 1 35 ILE O O -4.631 4.836 -7.007 1.00 . A A . 35 ILE O 1 1 5 3239 1 1 36 SER C C -6.875 6.004 -9.576 1.00 . A A . 36 SER C 1 1 5 3240 1 1 36 SER CA C -6.591 4.591 -9.053 1.00 . A A . 36 SER CA 1 1 5 3241 1 1 36 SER CB C -7.490 3.550 -9.731 1.00 . A A . 36 SER CB 1 1 5 3242 1 1 36 SER H H -7.727 4.337 -7.282 1.00 . A A . 36 SER H 1 1 5 3243 1 1 36 SER HA H -5.558 4.343 -9.299 1.00 . A A . 36 SER HA 1 1 5 3244 1 1 36 SER HB2 H -8.538 3.807 -9.575 1.00 . A A . 36 SER HB2 1 1 5 3245 1 1 36 SER HB3 H -7.289 3.526 -10.803 1.00 . A A . 36 SER HB3 1 1 5 3246 1 1 36 SER HG H -6.330 2.033 -9.356 1.00 . A A . 36 SER HG 1 1 5 3247 1 1 36 SER N N -6.789 4.519 -7.609 1.00 . A A . 36 SER N 1 1 5 3248 1 1 36 SER O O -7.337 6.163 -10.704 1.00 . A A . 36 SER O 1 1 5 3249 1 1 36 SER OG O -7.246 2.267 -9.193 1.00 . A A . 36 SER OG 1 1 5 3250 1 1 37 ALA C C -5.581 9.044 -9.821 1.00 . A A . 37 ALA C 1 1 5 3251 1 1 37 ALA CA C -6.798 8.431 -9.116 1.00 . A A . 37 ALA CA 1 1 5 3252 1 1 37 ALA CB C -7.124 9.202 -7.831 1.00 . A A . 37 ALA CB 1 1 5 3253 1 1 37 ALA H H -6.192 6.838 -7.857 1.00 . A A . 37 ALA H 1 1 5 3254 1 1 37 ALA HA H -7.660 8.519 -9.779 1.00 . A A . 37 ALA HA 1 1 5 3255 1 1 37 ALA HB1 H -7.991 8.756 -7.342 1.00 . A A . 37 ALA HB1 1 1 5 3256 1 1 37 ALA HB2 H -6.272 9.165 -7.150 1.00 . A A . 37 ALA HB2 1 1 5 3257 1 1 37 ALA HB3 H -7.351 10.242 -8.066 1.00 . A A . 37 ALA HB3 1 1 5 3258 1 1 37 ALA N N -6.582 7.031 -8.768 1.00 . A A . 37 ALA N 1 1 5 3259 1 1 37 ALA O O -5.542 10.257 -10.015 1.00 . A A . 37 ALA O 1 1 5 3260 1 1 38 SER C C -2.634 9.715 -9.736 1.00 . A A . 38 SER C 1 1 5 3261 1 1 38 SER CA C -3.272 8.666 -10.664 1.00 . A A . 38 SER CA 1 1 5 3262 1 1 38 SER CB C -3.418 9.150 -12.112 1.00 . A A . 38 SER CB 1 1 5 3263 1 1 38 SER H H -4.690 7.235 -10.044 1.00 . A A . 38 SER H 1 1 5 3264 1 1 38 SER HA H -2.623 7.792 -10.682 1.00 . A A . 38 SER HA 1 1 5 3265 1 1 38 SER HB2 H -3.913 8.380 -12.705 1.00 . A A . 38 SER HB2 1 1 5 3266 1 1 38 SER HB3 H -4.021 10.057 -12.136 1.00 . A A . 38 SER HB3 1 1 5 3267 1 1 38 SER HG H -1.712 10.072 -12.147 1.00 . A A . 38 SER HG 1 1 5 3268 1 1 38 SER N N -4.571 8.227 -10.166 1.00 . A A . 38 SER N 1 1 5 3269 1 1 38 SER O O -1.886 10.579 -10.190 1.00 . A A . 38 SER O 1 1 5 3270 1 1 38 SER OG O -2.153 9.408 -12.684 1.00 . A A . 38 SER OG 1 1 5 3271 1 1 39 THR C C -2.555 9.979 -6.076 1.00 . A A . 39 THR C 1 1 5 3272 1 1 39 THR CA C -2.669 10.668 -7.439 1.00 . A A . 39 THR CA 1 1 5 3273 1 1 39 THR CB C -3.799 11.722 -7.454 1.00 . A A . 39 THR CB 1 1 5 3274 1 1 39 THR CG2 C -3.576 12.879 -6.474 1.00 . A A . 39 THR CG2 1 1 5 3275 1 1 39 THR H H -3.554 8.894 -8.128 1.00 . A A . 39 THR H 1 1 5 3276 1 1 39 THR HA H -1.719 11.152 -7.671 1.00 . A A . 39 THR HA 1 1 5 3277 1 1 39 THR HB H -4.744 11.237 -7.203 1.00 . A A . 39 THR HB 1 1 5 3278 1 1 39 THR HG1 H -4.316 11.625 -9.330 1.00 . A A . 39 THR HG1 1 1 5 3279 1 1 39 THR HG21 H -4.304 13.667 -6.677 1.00 . A A . 39 THR HG21 1 1 5 3280 1 1 39 THR HG22 H -3.723 12.551 -5.446 1.00 . A A . 39 THR HG22 1 1 5 3281 1 1 39 THR HG23 H -2.572 13.288 -6.596 1.00 . A A . 39 THR HG23 1 1 5 3282 1 1 39 THR N N -2.958 9.648 -8.437 1.00 . A A . 39 THR N 1 1 5 3283 1 1 39 THR O O -2.965 8.827 -5.926 1.00 . A A . 39 THR O 1 1 5 3284 1 1 39 THR OG1 O -3.927 12.282 -8.744 1.00 . A A . 39 THR OG1 1 1 5 3285 1 1 40 CYS C C -2.178 11.594 -2.862 1.00 . A A . 40 CYS C 1 1 5 3286 1 1 40 CYS CA C -1.970 10.320 -3.686 1.00 . A A . 40 CYS CA 1 1 5 3287 1 1 40 CYS CB C -0.613 9.711 -3.337 1.00 . A A . 40 CYS CB 1 1 5 3288 1 1 40 CYS H H -1.653 11.619 -5.302 1.00 . A A . 40 CYS H 1 1 5 3289 1 1 40 CYS HA H -2.758 9.597 -3.484 1.00 . A A . 40 CYS HA 1 1 5 3290 1 1 40 CYS HB2 H 0.166 10.443 -3.553 1.00 . A A . 40 CYS HB2 1 1 5 3291 1 1 40 CYS HB3 H -0.592 9.505 -2.267 1.00 . A A . 40 CYS HB3 1 1 5 3292 1 1 40 CYS N N -1.991 10.690 -5.094 1.00 . A A . 40 CYS N 1 1 5 3293 1 1 40 CYS O O -1.751 12.664 -3.301 1.00 . A A . 40 CYS O 1 1 5 3294 1 1 40 CYS SG S -0.189 8.181 -4.201 1.00 . A A . 40 CYS SG 1 1 5 3295 1 1 41 PRO C C -1.594 12.965 -0.123 1.00 . A A . 41 PRO C 1 1 5 3296 1 1 41 PRO CA C -2.941 12.657 -0.787 1.00 . A A . 41 PRO CA 1 1 5 3297 1 1 41 PRO CB C -3.995 12.238 0.236 1.00 . A A . 41 PRO CB 1 1 5 3298 1 1 41 PRO CD C -3.392 10.326 -1.077 1.00 . A A . 41 PRO CD 1 1 5 3299 1 1 41 PRO CG C -3.776 10.730 0.348 1.00 . A A . 41 PRO CG 1 1 5 3300 1 1 41 PRO HA H -3.293 13.533 -1.335 1.00 . A A . 41 PRO HA 1 1 5 3301 1 1 41 PRO HB2 H -3.887 12.748 1.195 1.00 . A A . 41 PRO HB2 1 1 5 3302 1 1 41 PRO HB3 H -4.988 12.426 -0.175 1.00 . A A . 41 PRO HB3 1 1 5 3303 1 1 41 PRO HD2 H -2.692 9.490 -1.049 1.00 . A A . 41 PRO HD2 1 1 5 3304 1 1 41 PRO HD3 H -4.288 10.048 -1.632 1.00 . A A . 41 PRO HD3 1 1 5 3305 1 1 41 PRO HG2 H -2.939 10.540 1.021 1.00 . A A . 41 PRO HG2 1 1 5 3306 1 1 41 PRO HG3 H -4.666 10.209 0.701 1.00 . A A . 41 PRO HG3 1 1 5 3307 1 1 41 PRO N N -2.804 11.515 -1.676 1.00 . A A . 41 PRO N 1 1 5 3308 1 1 41 PRO O O -0.728 12.092 -0.030 1.00 . A A . 41 PRO O 1 1 5 3309 1 1 42 SER C C -0.144 14.135 2.425 1.00 . A A . 42 SER C 1 1 5 3310 1 1 42 SER CA C -0.207 14.680 0.992 1.00 . A A . 42 SER CA 1 1 5 3311 1 1 42 SER CB C -0.144 16.212 0.932 1.00 . A A . 42 SER CB 1 1 5 3312 1 1 42 SER H H -2.176 14.876 0.227 1.00 . A A . 42 SER H 1 1 5 3313 1 1 42 SER HA H 0.657 14.303 0.441 1.00 . A A . 42 SER HA 1 1 5 3314 1 1 42 SER HB2 H -0.270 16.537 -0.101 1.00 . A A . 42 SER HB2 1 1 5 3315 1 1 42 SER HB3 H -0.939 16.647 1.539 1.00 . A A . 42 SER HB3 1 1 5 3316 1 1 42 SER HG H 1.139 17.621 1.327 1.00 . A A . 42 SER HG 1 1 5 3317 1 1 42 SER N N -1.419 14.215 0.328 1.00 . A A . 42 SER N 1 1 5 3318 1 1 42 SER O O -0.331 14.871 3.392 1.00 . A A . 42 SER O 1 1 5 3319 1 1 42 SER OG O 1.113 16.664 1.389 1.00 . A A . 42 SER OG 1 1 5 3320 1 1 43 ASP C C 1.178 10.920 3.634 1.00 . A A . 43 ASP C 1 1 5 3321 1 1 43 ASP CA C 0.184 12.075 3.784 1.00 . A A . 43 ASP CA 1 1 5 3322 1 1 43 ASP CB C -1.204 11.536 4.163 1.00 . A A . 43 ASP CB 1 1 5 3323 1 1 43 ASP CG C -2.170 12.656 4.535 1.00 . A A . 43 ASP CG 1 1 5 3324 1 1 43 ASP H H 0.210 12.312 1.674 1.00 . A A . 43 ASP H 1 1 5 3325 1 1 43 ASP HA H 0.542 12.724 4.584 1.00 . A A . 43 ASP HA 1 1 5 3326 1 1 43 ASP HB2 H -1.615 10.970 3.328 1.00 . A A . 43 ASP HB2 1 1 5 3327 1 1 43 ASP HB3 H -1.108 10.867 5.019 1.00 . A A . 43 ASP HB3 1 1 5 3328 1 1 43 ASP HD2 H -2.576 13.962 5.918 1.00 . A A . 43 ASP HD2 1 1 5 3329 1 1 43 ASP N N 0.109 12.828 2.538 1.00 . A A . 43 ASP N 1 1 5 3330 1 1 43 ASP O O 1.922 10.632 4.569 1.00 . A A . 43 ASP O 1 1 5 3331 1 1 43 ASP OD1 O -3.061 12.971 3.748 1.00 . A A . 43 ASP OD1 1 1 5 3332 1 1 43 ASP OD2 O -1.967 13.240 5.750 1.00 . A A . 43 ASP OD2 1 1 5 3333 1 1 44 TYR C C 3.003 9.497 1.058 1.00 . A A . 44 TYR C 1 1 5 3334 1 1 44 TYR CA C 2.014 9.106 2.162 1.00 . A A . 44 TYR CA 1 1 5 3335 1 1 44 TYR CB C 1.107 7.945 1.738 1.00 . A A . 44 TYR CB 1 1 5 3336 1 1 44 TYR CD1 C 0.492 6.755 3.880 1.00 . A A . 44 TYR CD1 1 1 5 3337 1 1 44 TYR CD2 C -1.188 8.135 2.800 1.00 . A A . 44 TYR CD2 1 1 5 3338 1 1 44 TYR CE1 C -0.422 6.421 4.892 1.00 . A A . 44 TYR CE1 1 1 5 3339 1 1 44 TYR CE2 C -2.099 7.822 3.825 1.00 . A A . 44 TYR CE2 1 1 5 3340 1 1 44 TYR CG C 0.099 7.567 2.805 1.00 . A A . 44 TYR CG 1 1 5 3341 1 1 44 TYR CZ C -1.731 6.932 4.849 1.00 . A A . 44 TYR CZ 1 1 5 3342 1 1 44 TYR H H 0.529 10.544 1.749 1.00 . A A . 44 TYR H 1 1 5 3343 1 1 44 TYR HA H 2.539 8.770 3.054 1.00 . A A . 44 TYR HA 1 1 5 3344 1 1 44 TYR HB2 H 0.578 8.201 0.820 1.00 . A A . 44 TYR HB2 1 1 5 3345 1 1 44 TYR HB3 H 1.730 7.077 1.525 1.00 . A A . 44 TYR HB3 1 1 5 3346 1 1 44 TYR HD1 H 1.504 6.403 3.937 1.00 . A A . 44 TYR HD1 1 1 5 3347 1 1 44 TYR HD2 H -1.485 8.801 2.004 1.00 . A A . 44 TYR HD2 1 1 5 3348 1 1 44 TYR HE1 H -0.109 5.768 5.695 1.00 . A A . 44 TYR HE1 1 1 5 3349 1 1 44 TYR HE2 H -3.089 8.251 3.806 1.00 . A A . 44 TYR HE2 1 1 5 3350 1 1 44 TYR HH H -2.264 6.015 6.486 1.00 . A A . 44 TYR HH 1 1 5 3351 1 1 44 TYR N N 1.177 10.259 2.469 1.00 . A A . 44 TYR N 1 1 5 3352 1 1 44 TYR O O 2.593 9.623 -0.094 1.00 . A A . 44 TYR O 1 1 5 3353 1 1 44 TYR OH O -2.646 6.558 5.792 1.00 . A A . 44 TYR OH 1 1 5 3354 1 1 45 PRO C C 5.874 9.246 -0.480 1.00 . A A . 45 PRO C 1 1 5 3355 1 1 45 PRO CA C 5.250 10.295 0.449 1.00 . A A . 45 PRO CA 1 1 5 3356 1 1 45 PRO CB C 6.314 10.959 1.325 1.00 . A A . 45 PRO CB 1 1 5 3357 1 1 45 PRO CD C 4.853 9.691 2.725 1.00 . A A . 45 PRO CD 1 1 5 3358 1 1 45 PRO CG C 6.322 10.087 2.577 1.00 . A A . 45 PRO CG 1 1 5 3359 1 1 45 PRO HA H 4.781 11.065 -0.167 1.00 . A A . 45 PRO HA 1 1 5 3360 1 1 45 PRO HB2 H 7.293 11.005 0.844 1.00 . A A . 45 PRO HB2 1 1 5 3361 1 1 45 PRO HB3 H 5.983 11.963 1.594 1.00 . A A . 45 PRO HB3 1 1 5 3362 1 1 45 PRO HD2 H 4.790 8.693 3.152 1.00 . A A . 45 PRO HD2 1 1 5 3363 1 1 45 PRO HD3 H 4.346 10.414 3.363 1.00 . A A . 45 PRO HD3 1 1 5 3364 1 1 45 PRO HG2 H 6.924 9.198 2.396 1.00 . A A . 45 PRO HG2 1 1 5 3365 1 1 45 PRO HG3 H 6.696 10.618 3.452 1.00 . A A . 45 PRO HG3 1 1 5 3366 1 1 45 PRO N N 4.285 9.738 1.385 1.00 . A A . 45 PRO N 1 1 5 3367 1 1 45 PRO O O 6.422 9.632 -1.510 1.00 . A A . 45 PRO O 1 1 5 3368 1 1 46 LYS C C 5.500 6.160 -1.762 1.00 . A A . 46 LYS C 1 1 5 3369 1 1 46 LYS CA C 6.511 6.902 -0.884 1.00 . A A . 46 LYS CA 1 1 5 3370 1 1 46 LYS CB C 7.261 5.943 0.062 1.00 . A A . 46 LYS CB 1 1 5 3371 1 1 46 LYS CD C 9.084 7.729 0.564 1.00 . A A . 46 LYS CD 1 1 5 3372 1 1 46 LYS CE C 10.093 7.213 -0.465 1.00 . A A . 46 LYS CE 1 1 5 3373 1 1 46 LYS CG C 8.167 6.621 1.098 1.00 . A A . 46 LYS CG 1 1 5 3374 1 1 46 LYS H H 5.341 7.672 0.712 1.00 . A A . 46 LYS H 1 1 5 3375 1 1 46 LYS HA H 7.257 7.340 -1.545 1.00 . A A . 46 LYS HA 1 1 5 3376 1 1 46 LYS HB2 H 6.545 5.342 0.621 1.00 . A A . 46 LYS HB2 1 1 5 3377 1 1 46 LYS HB3 H 7.867 5.266 -0.544 1.00 . A A . 46 LYS HB3 1 1 5 3378 1 1 46 LYS HD2 H 8.493 8.533 0.129 1.00 . A A . 46 LYS HD2 1 1 5 3379 1 1 46 LYS HD3 H 9.632 8.139 1.413 1.00 . A A . 46 LYS HD3 1 1 5 3380 1 1 46 LYS HE2 H 10.700 6.428 -0.011 1.00 . A A . 46 LYS HE2 1 1 5 3381 1 1 46 LYS HE3 H 9.572 6.801 -1.328 1.00 . A A . 46 LYS HE3 1 1 5 3382 1 1 46 LYS HG2 H 7.532 7.042 1.879 1.00 . A A . 46 LYS HG2 1 1 5 3383 1 1 46 LYS HG3 H 8.788 5.848 1.551 1.00 . A A . 46 LYS HG3 1 1 5 3384 1 1 46 LYS HZ1 H 11.472 8.693 -0.139 1.00 . A A . 46 LYS HZ1 1 1 5 3385 1 1 46 LYS HZ2 H 11.646 7.930 -1.590 1.00 . A A . 46 LYS HZ2 1 1 5 3386 1 1 46 LYS HZ3 H 10.427 9.017 -1.372 1.00 . A A . 46 LYS HZ3 1 1 5 3387 1 1 46 LYS N N 5.832 7.950 -0.127 1.00 . A A . 46 LYS N 1 1 5 3388 1 1 46 LYS NZ N 10.978 8.297 -0.927 1.00 . A A . 46 LYS NZ 1 1 5 3389 1 1 46 LYS O O 4.919 6.819 -2.651 1.00 . A A . 46 LYS O 1 1 5 3390 1 1 46 LYS OXT O 5.318 4.943 -1.548 1.00 . A A . 46 LYS OXT 1 1 6 3391 1 1 1 LYS C C -1.361 3.740 -6.595 1.00 . A A . 1 LYS C 1 1 6 3392 1 1 1 LYS CA C -1.498 4.042 -8.088 1.00 . A A . 1 LYS CA 1 1 6 3393 1 1 1 LYS CB C -1.207 5.520 -8.396 1.00 . A A . 1 LYS CB 1 1 6 3394 1 1 1 LYS CD C 0.604 7.290 -8.680 1.00 . A A . 1 LYS CD 1 1 6 3395 1 1 1 LYS CE C 0.122 8.357 -7.692 1.00 . A A . 1 LYS CE 1 1 6 3396 1 1 1 LYS CG C 0.278 5.865 -8.207 1.00 . A A . 1 LYS CG 1 1 6 3397 1 1 1 LYS H1 H -2.901 3.822 -9.569 1.00 . A A . 1 LYS H1 1 1 6 3398 1 1 1 LYS H2 H -2.991 2.677 -8.382 1.00 . A A . 1 LYS H2 1 1 6 3399 1 1 1 LYS H3 H -3.527 4.207 -8.089 1.00 . A A . 1 LYS H3 1 1 6 3400 1 1 1 LYS HA H -0.784 3.433 -8.644 1.00 . A A . 1 LYS HA 1 1 6 3401 1 1 1 LYS HB2 H -1.470 5.709 -9.439 1.00 . A A . 1 LYS HB2 1 1 6 3402 1 1 1 LYS HB3 H -1.828 6.152 -7.760 1.00 . A A . 1 LYS HB3 1 1 6 3403 1 1 1 LYS HD2 H 1.687 7.379 -8.775 1.00 . A A . 1 LYS HD2 1 1 6 3404 1 1 1 LYS HD3 H 0.158 7.459 -9.662 1.00 . A A . 1 LYS HD3 1 1 6 3405 1 1 1 LYS HE2 H -0.956 8.281 -7.548 1.00 . A A . 1 LYS HE2 1 1 6 3406 1 1 1 LYS HE3 H 0.619 8.201 -6.736 1.00 . A A . 1 LYS HE3 1 1 6 3407 1 1 1 LYS HG2 H 0.567 5.751 -7.161 1.00 . A A . 1 LYS HG2 1 1 6 3408 1 1 1 LYS HG3 H 0.872 5.172 -8.804 1.00 . A A . 1 LYS HG3 1 1 6 3409 1 1 1 LYS HZ1 H 1.440 9.802 -8.309 1.00 . A A . 1 LYS HZ1 1 1 6 3410 1 1 1 LYS HZ2 H -0.046 9.912 -9.024 1.00 . A A . 1 LYS HZ2 1 1 6 3411 1 1 1 LYS HZ3 H 0.154 10.388 -7.464 1.00 . A A . 1 LYS HZ3 1 1 6 3412 1 1 1 LYS N N -2.832 3.657 -8.575 1.00 . A A . 1 LYS N 1 1 6 3413 1 1 1 LYS NZ N 0.444 9.716 -8.160 1.00 . A A . 1 LYS NZ 1 1 6 3414 1 1 1 LYS O O -2.238 4.105 -5.813 1.00 . A A . 1 LYS O 1 1 6 3415 1 1 2 SER C C 0.910 3.722 -4.203 1.00 . A A . 2 SER C 1 1 6 3416 1 1 2 SER CA C 0.028 2.659 -4.856 1.00 . A A . 2 SER CA 1 1 6 3417 1 1 2 SER CB C 0.719 1.290 -4.874 1.00 . A A . 2 SER CB 1 1 6 3418 1 1 2 SER H H 0.409 2.815 -6.927 1.00 . A A . 2 SER H 1 1 6 3419 1 1 2 SER HA H -0.902 2.560 -4.298 1.00 . A A . 2 SER HA 1 1 6 3420 1 1 2 SER HB2 H 0.072 0.573 -5.379 1.00 . A A . 2 SER HB2 1 1 6 3421 1 1 2 SER HB3 H 1.658 1.360 -5.421 1.00 . A A . 2 SER HB3 1 1 6 3422 1 1 2 SER HG H 1.542 1.437 -3.107 1.00 . A A . 2 SER HG 1 1 6 3423 1 1 2 SER N N -0.272 3.057 -6.223 1.00 . A A . 2 SER N 1 1 6 3424 1 1 2 SER O O 1.851 4.207 -4.830 1.00 . A A . 2 SER O 1 1 6 3425 1 1 2 SER OG O 0.964 0.821 -3.564 1.00 . A A . 2 SER OG 1 1 6 3426 1 1 3 CYS C C 1.350 4.799 -0.763 1.00 . A A . 3 CYS C 1 1 6 3427 1 1 3 CYS CA C 1.203 5.192 -2.230 1.00 . A A . 3 CYS CA 1 1 6 3428 1 1 3 CYS CB C 0.312 6.428 -2.390 1.00 . A A . 3 CYS CB 1 1 6 3429 1 1 3 CYS H H -0.193 3.625 -2.512 1.00 . A A . 3 CYS H 1 1 6 3430 1 1 3 CYS HA H 2.190 5.426 -2.633 1.00 . A A . 3 CYS HA 1 1 6 3431 1 1 3 CYS HB2 H -0.714 6.163 -2.129 1.00 . A A . 3 CYS HB2 1 1 6 3432 1 1 3 CYS HB3 H 0.647 7.208 -1.709 1.00 . A A . 3 CYS HB3 1 1 6 3433 1 1 3 CYS N N 0.592 4.084 -2.956 1.00 . A A . 3 CYS N 1 1 6 3434 1 1 3 CYS O O 0.346 4.551 -0.100 1.00 . A A . 3 CYS O 1 1 6 3435 1 1 3 CYS SG S 0.329 7.120 -4.063 1.00 . A A . 3 CYS SG 1 1 6 3436 1 1 4 CYS C C 3.540 5.302 1.945 1.00 . A A . 4 CYS C 1 1 6 3437 1 1 4 CYS CA C 2.933 4.210 1.057 1.00 . A A . 4 CYS CA 1 1 6 3438 1 1 4 CYS CB C 3.930 3.059 0.888 1.00 . A A . 4 CYS CB 1 1 6 3439 1 1 4 CYS H H 3.365 5.033 -0.844 1.00 . A A . 4 CYS H 1 1 6 3440 1 1 4 CYS HA H 2.036 3.830 1.539 1.00 . A A . 4 CYS HA 1 1 6 3441 1 1 4 CYS HB2 H 4.731 3.391 0.229 1.00 . A A . 4 CYS HB2 1 1 6 3442 1 1 4 CYS HB3 H 4.384 2.821 1.850 1.00 . A A . 4 CYS HB3 1 1 6 3443 1 1 4 CYS N N 2.591 4.724 -0.265 1.00 . A A . 4 CYS N 1 1 6 3444 1 1 4 CYS O O 4.098 6.271 1.432 1.00 . A A . 4 CYS O 1 1 6 3445 1 1 4 CYS SG S 3.237 1.514 0.241 1.00 . A A . 4 CYS SG 1 1 6 3446 1 1 5 PRO C C 5.572 6.059 4.162 1.00 . A A . 5 PRO C 1 1 6 3447 1 1 5 PRO CA C 4.046 6.085 4.228 1.00 . A A . 5 PRO CA 1 1 6 3448 1 1 5 PRO CB C 3.531 5.662 5.609 1.00 . A A . 5 PRO CB 1 1 6 3449 1 1 5 PRO CD C 2.738 4.097 3.986 1.00 . A A . 5 PRO CD 1 1 6 3450 1 1 5 PRO CG C 3.198 4.180 5.440 1.00 . A A . 5 PRO CG 1 1 6 3451 1 1 5 PRO HA H 3.716 7.104 4.031 1.00 . A A . 5 PRO HA 1 1 6 3452 1 1 5 PRO HB2 H 4.257 5.837 6.403 1.00 . A A . 5 PRO HB2 1 1 6 3453 1 1 5 PRO HB3 H 2.613 6.203 5.838 1.00 . A A . 5 PRO HB3 1 1 6 3454 1 1 5 PRO HD2 H 2.939 3.105 3.593 1.00 . A A . 5 PRO HD2 1 1 6 3455 1 1 5 PRO HD3 H 1.669 4.295 3.933 1.00 . A A . 5 PRO HD3 1 1 6 3456 1 1 5 PRO HG2 H 4.101 3.584 5.572 1.00 . A A . 5 PRO HG2 1 1 6 3457 1 1 5 PRO HG3 H 2.426 3.849 6.135 1.00 . A A . 5 PRO HG3 1 1 6 3458 1 1 5 PRO N N 3.454 5.152 3.280 1.00 . A A . 5 PRO N 1 1 6 3459 1 1 5 PRO O O 6.206 7.106 4.279 1.00 . A A . 5 PRO O 1 1 6 3460 1 1 6 ASN C C 8.008 3.333 3.489 1.00 . A A . 6 ASN C 1 1 6 3461 1 1 6 ASN CA C 7.597 4.670 4.111 1.00 . A A . 6 ASN CA 1 1 6 3462 1 1 6 ASN CB C 8.021 4.772 5.586 1.00 . A A . 6 ASN CB 1 1 6 3463 1 1 6 ASN CG C 7.229 3.815 6.472 1.00 . A A . 6 ASN CG 1 1 6 3464 1 1 6 ASN H H 5.592 4.047 3.854 1.00 . A A . 6 ASN H 1 1 6 3465 1 1 6 ASN HA H 8.108 5.464 3.568 1.00 . A A . 6 ASN HA 1 1 6 3466 1 1 6 ASN HB2 H 9.083 4.544 5.684 1.00 . A A . 6 ASN HB2 1 1 6 3467 1 1 6 ASN HB3 H 7.873 5.795 5.933 1.00 . A A . 6 ASN HB3 1 1 6 3468 1 1 6 ASN HD21 H 6.273 5.352 7.404 1.00 . A A . 6 ASN HD21 1 1 6 3469 1 1 6 ASN HD22 H 5.803 3.748 7.921 1.00 . A A . 6 ASN HD22 1 1 6 3470 1 1 6 ASN N N 6.161 4.868 4.000 1.00 . A A . 6 ASN N 1 1 6 3471 1 1 6 ASN ND2 N 6.369 4.349 7.340 1.00 . A A . 6 ASN ND2 1 1 6 3472 1 1 6 ASN O O 7.166 2.542 3.064 1.00 . A A . 6 ASN O 1 1 6 3473 1 1 6 ASN OD1 O 7.388 2.604 6.364 1.00 . A A . 6 ASN OD1 1 1 6 3474 1 1 7 THR C C 9.517 0.630 3.614 1.00 . A A . 7 THR C 1 1 6 3475 1 1 7 THR CA C 9.951 1.909 2.885 1.00 . A A . 7 THR CA 1 1 6 3476 1 1 7 THR CB C 11.477 2.094 2.911 1.00 . A A . 7 THR CB 1 1 6 3477 1 1 7 THR CG2 C 12.204 1.002 2.119 1.00 . A A . 7 THR CG2 1 1 6 3478 1 1 7 THR H H 9.950 3.812 3.786 1.00 . A A . 7 THR H 1 1 6 3479 1 1 7 THR HA H 9.641 1.835 1.842 1.00 . A A . 7 THR HA 1 1 6 3480 1 1 7 THR HB H 11.826 2.076 3.945 1.00 . A A . 7 THR HB 1 1 6 3481 1 1 7 THR HG1 H 12.746 3.496 2.447 1.00 . A A . 7 THR HG1 1 1 6 3482 1 1 7 THR HG21 H 11.830 0.972 1.095 1.00 . A A . 7 THR HG21 1 1 6 3483 1 1 7 THR HG22 H 13.272 1.216 2.100 1.00 . A A . 7 THR HG22 1 1 6 3484 1 1 7 THR HG23 H 12.053 0.029 2.586 1.00 . A A . 7 THR HG23 1 1 6 3485 1 1 7 THR N N 9.324 3.097 3.447 1.00 . A A . 7 THR N 1 1 6 3486 1 1 7 THR O O 9.414 -0.422 2.987 1.00 . A A . 7 THR O 1 1 6 3487 1 1 7 THR OG1 O 11.801 3.353 2.351 1.00 . A A . 7 THR OG1 1 1 6 3488 1 1 8 THR C C 7.293 -0.750 5.238 1.00 . A A . 8 THR C 1 1 6 3489 1 1 8 THR CA C 8.729 -0.439 5.672 1.00 . A A . 8 THR CA 1 1 6 3490 1 1 8 THR CB C 8.845 -0.213 7.189 1.00 . A A . 8 THR CB 1 1 6 3491 1 1 8 THR CG2 C 8.549 -1.505 7.958 1.00 . A A . 8 THR CG2 1 1 6 3492 1 1 8 THR H H 9.305 1.594 5.399 1.00 . A A . 8 THR H 1 1 6 3493 1 1 8 THR HA H 9.360 -1.297 5.434 1.00 . A A . 8 THR HA 1 1 6 3494 1 1 8 THR HB H 8.139 0.550 7.514 1.00 . A A . 8 THR HB 1 1 6 3495 1 1 8 THR HG1 H 10.320 1.058 7.103 1.00 . A A . 8 THR HG1 1 1 6 3496 1 1 8 THR HG21 H 9.215 -2.303 7.623 1.00 . A A . 8 THR HG21 1 1 6 3497 1 1 8 THR HG22 H 8.708 -1.338 9.024 1.00 . A A . 8 THR HG22 1 1 6 3498 1 1 8 THR HG23 H 7.516 -1.811 7.802 1.00 . A A . 8 THR HG23 1 1 6 3499 1 1 8 THR N N 9.242 0.705 4.924 1.00 . A A . 8 THR N 1 1 6 3500 1 1 8 THR O O 6.928 -1.915 5.113 1.00 . A A . 8 THR O 1 1 6 3501 1 1 8 THR OG1 O 10.155 0.207 7.514 1.00 . A A . 8 THR OG1 1 1 6 3502 1 1 9 GLY C C 5.235 -0.602 3.053 1.00 . A A . 9 GLY C 1 1 6 3503 1 1 9 GLY CA C 5.162 0.136 4.388 1.00 . A A . 9 GLY CA 1 1 6 3504 1 1 9 GLY H H 6.839 1.223 5.101 1.00 . A A . 9 GLY H 1 1 6 3505 1 1 9 GLY HA2 H 4.525 -0.412 5.083 1.00 . A A . 9 GLY HA2 1 1 6 3506 1 1 9 GLY HA3 H 4.734 1.123 4.222 1.00 . A A . 9 GLY HA3 1 1 6 3507 1 1 9 GLY N N 6.488 0.284 4.966 1.00 . A A . 9 GLY N 1 1 6 3508 1 1 9 GLY O O 4.519 -1.582 2.852 1.00 . A A . 9 GLY O 1 1 6 3509 1 1 10 ARG C C 6.776 -2.299 1.134 1.00 . A A . 10 ARG C 1 1 6 3510 1 1 10 ARG CA C 6.396 -0.838 0.898 1.00 . A A . 10 ARG CA 1 1 6 3511 1 1 10 ARG CB C 7.504 -0.124 0.109 1.00 . A A . 10 ARG CB 1 1 6 3512 1 1 10 ARG CD C 6.198 1.039 -1.717 1.00 . A A . 10 ARG CD 1 1 6 3513 1 1 10 ARG CG C 7.059 1.224 -0.463 1.00 . A A . 10 ARG CG 1 1 6 3514 1 1 10 ARG CZ C 4.741 2.501 -3.120 1.00 . A A . 10 ARG CZ 1 1 6 3515 1 1 10 ARG H H 6.675 0.663 2.387 1.00 . A A . 10 ARG H 1 1 6 3516 1 1 10 ARG HA H 5.478 -0.836 0.312 1.00 . A A . 10 ARG HA 1 1 6 3517 1 1 10 ARG HB2 H 8.358 0.038 0.762 1.00 . A A . 10 ARG HB2 1 1 6 3518 1 1 10 ARG HB3 H 7.829 -0.761 -0.715 1.00 . A A . 10 ARG HB3 1 1 6 3519 1 1 10 ARG HD2 H 6.801 0.578 -2.501 1.00 . A A . 10 ARG HD2 1 1 6 3520 1 1 10 ARG HD3 H 5.354 0.386 -1.498 1.00 . A A . 10 ARG HD3 1 1 6 3521 1 1 10 ARG HE H 6.119 3.162 -1.797 1.00 . A A . 10 ARG HE 1 1 6 3522 1 1 10 ARG HG2 H 6.514 1.784 0.296 1.00 . A A . 10 ARG HG2 1 1 6 3523 1 1 10 ARG HG3 H 7.947 1.795 -0.739 1.00 . A A . 10 ARG HG3 1 1 6 3524 1 1 10 ARG HH11 H 4.514 0.513 -3.532 1.00 . A A . 10 ARG HH11 1 1 6 3525 1 1 10 ARG HH12 H 3.509 1.587 -4.470 1.00 . A A . 10 ARG HH12 1 1 6 3526 1 1 10 ARG HH21 H 4.692 4.526 -2.895 1.00 . A A . 10 ARG HH21 1 1 6 3527 1 1 10 ARG HH22 H 3.610 3.896 -4.115 1.00 . A A . 10 ARG HH22 1 1 6 3528 1 1 10 ARG N N 6.128 -0.156 2.159 1.00 . A A . 10 ARG N 1 1 6 3529 1 1 10 ARG NE N 5.695 2.331 -2.192 1.00 . A A . 10 ARG NE 1 1 6 3530 1 1 10 ARG NH1 N 4.204 1.448 -3.754 1.00 . A A . 10 ARG NH1 1 1 6 3531 1 1 10 ARG NH2 N 4.323 3.737 -3.416 1.00 . A A . 10 ARG NH2 1 1 6 3532 1 1 10 ARG O O 6.242 -3.175 0.462 1.00 . A A . 10 ARG O 1 1 6 3533 1 1 11 ASN C C 6.917 -4.799 2.796 1.00 . A A . 11 ASN C 1 1 6 3534 1 1 11 ASN CA C 8.109 -3.923 2.399 1.00 . A A . 11 ASN CA 1 1 6 3535 1 1 11 ASN CB C 9.191 -3.886 3.484 1.00 . A A . 11 ASN CB 1 1 6 3536 1 1 11 ASN CG C 9.517 -5.274 4.024 1.00 . A A . 11 ASN CG 1 1 6 3537 1 1 11 ASN H H 8.092 -1.801 2.596 1.00 . A A . 11 ASN H 1 1 6 3538 1 1 11 ASN HA H 8.553 -4.358 1.501 1.00 . A A . 11 ASN HA 1 1 6 3539 1 1 11 ASN HB2 H 10.099 -3.450 3.067 1.00 . A A . 11 ASN HB2 1 1 6 3540 1 1 11 ASN HB3 H 8.866 -3.261 4.311 1.00 . A A . 11 ASN HB3 1 1 6 3541 1 1 11 ASN HD21 H 8.353 -4.959 5.667 1.00 . A A . 11 ASN HD21 1 1 6 3542 1 1 11 ASN HD22 H 9.163 -6.510 5.597 1.00 . A A . 11 ASN HD22 1 1 6 3543 1 1 11 ASN N N 7.681 -2.568 2.080 1.00 . A A . 11 ASN N 1 1 6 3544 1 1 11 ASN ND2 N 8.963 -5.608 5.192 1.00 . A A . 11 ASN ND2 1 1 6 3545 1 1 11 ASN O O 6.730 -5.858 2.205 1.00 . A A . 11 ASN O 1 1 6 3546 1 1 11 ASN OD1 O 10.262 -6.029 3.404 1.00 . A A . 11 ASN OD1 1 1 6 3547 1 1 12 ILE C C 3.993 -5.393 3.078 1.00 . A A . 12 ILE C 1 1 6 3548 1 1 12 ILE CA C 4.951 -5.124 4.242 1.00 . A A . 12 ILE CA 1 1 6 3549 1 1 12 ILE CB C 4.258 -4.386 5.406 1.00 . A A . 12 ILE CB 1 1 6 3550 1 1 12 ILE CD1 C 4.749 -3.271 7.654 1.00 . A A . 12 ILE CD1 1 1 6 3551 1 1 12 ILE CG1 C 5.204 -4.305 6.620 1.00 . A A . 12 ILE CG1 1 1 6 3552 1 1 12 ILE CG2 C 2.963 -5.115 5.810 1.00 . A A . 12 ILE CG2 1 1 6 3553 1 1 12 ILE H H 6.281 -3.460 4.191 1.00 . A A . 12 ILE H 1 1 6 3554 1 1 12 ILE HA H 5.306 -6.084 4.617 1.00 . A A . 12 ILE HA 1 1 6 3555 1 1 12 ILE HB H 4.010 -3.375 5.082 1.00 . A A . 12 ILE HB 1 1 6 3556 1 1 12 ILE HD11 H 4.650 -2.292 7.184 1.00 . A A . 12 ILE HD11 1 1 6 3557 1 1 12 ILE HD12 H 3.797 -3.555 8.101 1.00 . A A . 12 ILE HD12 1 1 6 3558 1 1 12 ILE HD13 H 5.495 -3.208 8.446 1.00 . A A . 12 ILE HD13 1 1 6 3559 1 1 12 ILE HG12 H 5.278 -5.284 7.092 1.00 . A A . 12 ILE HG12 1 1 6 3560 1 1 12 ILE HG13 H 6.204 -4.017 6.303 1.00 . A A . 12 ILE HG13 1 1 6 3561 1 1 12 ILE HG21 H 2.246 -5.125 4.990 1.00 . A A . 12 ILE HG21 1 1 6 3562 1 1 12 ILE HG22 H 3.188 -6.144 6.094 1.00 . A A . 12 ILE HG22 1 1 6 3563 1 1 12 ILE HG23 H 2.486 -4.615 6.651 1.00 . A A . 12 ILE HG23 1 1 6 3564 1 1 12 ILE N N 6.104 -4.363 3.769 1.00 . A A . 12 ILE N 1 1 6 3565 1 1 12 ILE O O 3.571 -6.532 2.879 1.00 . A A . 12 ILE O 1 1 6 3566 1 1 13 TYR C C 3.282 -5.482 0.160 1.00 . A A . 13 TYR C 1 1 6 3567 1 1 13 TYR CA C 2.795 -4.419 1.149 1.00 . A A . 13 TYR CA 1 1 6 3568 1 1 13 TYR CB C 2.710 -3.033 0.495 1.00 . A A . 13 TYR CB 1 1 6 3569 1 1 13 TYR CD1 C 0.573 -3.313 -0.829 1.00 . A A . 13 TYR CD1 1 1 6 3570 1 1 13 TYR CD2 C 2.594 -2.646 -2.011 1.00 . A A . 13 TYR CD2 1 1 6 3571 1 1 13 TYR CE1 C -0.141 -3.293 -2.038 1.00 . A A . 13 TYR CE1 1 1 6 3572 1 1 13 TYR CE2 C 1.879 -2.622 -3.220 1.00 . A A . 13 TYR CE2 1 1 6 3573 1 1 13 TYR CG C 1.943 -2.995 -0.812 1.00 . A A . 13 TYR CG 1 1 6 3574 1 1 13 TYR CZ C 0.512 -2.950 -3.236 1.00 . A A . 13 TYR CZ 1 1 6 3575 1 1 13 TYR H H 4.062 -3.442 2.536 1.00 . A A . 13 TYR H 1 1 6 3576 1 1 13 TYR HA H 1.803 -4.703 1.500 1.00 . A A . 13 TYR HA 1 1 6 3577 1 1 13 TYR HB2 H 2.230 -2.347 1.192 1.00 . A A . 13 TYR HB2 1 1 6 3578 1 1 13 TYR HB3 H 3.719 -2.667 0.316 1.00 . A A . 13 TYR HB3 1 1 6 3579 1 1 13 TYR HD1 H 0.072 -3.572 0.089 1.00 . A A . 13 TYR HD1 1 1 6 3580 1 1 13 TYR HD2 H 3.644 -2.392 -2.008 1.00 . A A . 13 TYR HD2 1 1 6 3581 1 1 13 TYR HE1 H -1.192 -3.536 -2.045 1.00 . A A . 13 TYR HE1 1 1 6 3582 1 1 13 TYR HE2 H 2.385 -2.350 -4.135 1.00 . A A . 13 TYR HE2 1 1 6 3583 1 1 13 TYR HH H 0.352 -2.687 -5.165 1.00 . A A . 13 TYR HH 1 1 6 3584 1 1 13 TYR N N 3.670 -4.346 2.309 1.00 . A A . 13 TYR N 1 1 6 3585 1 1 13 TYR O O 2.529 -6.389 -0.184 1.00 . A A . 13 TYR O 1 1 6 3586 1 1 13 TYR OH O -0.185 -2.940 -4.409 1.00 . A A . 13 TYR OH 1 1 6 3587 1 1 14 ASN C C 5.185 -7.726 -0.710 1.00 . A A . 14 ASN C 1 1 6 3588 1 1 14 ASN CA C 5.152 -6.288 -1.237 1.00 . A A . 14 ASN CA 1 1 6 3589 1 1 14 ASN CB C 6.560 -5.806 -1.613 1.00 . A A . 14 ASN CB 1 1 6 3590 1 1 14 ASN CG C 6.523 -4.762 -2.728 1.00 . A A . 14 ASN CG 1 1 6 3591 1 1 14 ASN H H 5.101 -4.602 0.052 1.00 . A A . 14 ASN H 1 1 6 3592 1 1 14 ASN HA H 4.545 -6.291 -2.144 1.00 . A A . 14 ASN HA 1 1 6 3593 1 1 14 ASN HB2 H 7.082 -5.421 -0.737 1.00 . A A . 14 ASN HB2 1 1 6 3594 1 1 14 ASN HB3 H 7.133 -6.649 -1.991 1.00 . A A . 14 ASN HB3 1 1 6 3595 1 1 14 ASN HD21 H 6.243 -3.238 -1.407 1.00 . A A . 14 ASN HD21 1 1 6 3596 1 1 14 ASN HD22 H 6.333 -2.779 -3.097 1.00 . A A . 14 ASN HD22 1 1 6 3597 1 1 14 ASN N N 4.538 -5.371 -0.284 1.00 . A A . 14 ASN N 1 1 6 3598 1 1 14 ASN ND2 N 6.346 -3.488 -2.381 1.00 . A A . 14 ASN ND2 1 1 6 3599 1 1 14 ASN O O 4.891 -8.652 -1.463 1.00 . A A . 14 ASN O 1 1 6 3600 1 1 14 ASN OD1 O 6.656 -5.103 -3.900 1.00 . A A . 14 ASN OD1 1 1 6 3601 1 1 15 THR C C 4.203 -9.901 1.171 1.00 . A A . 15 THR C 1 1 6 3602 1 1 15 THR CA C 5.591 -9.254 1.171 1.00 . A A . 15 THR CA 1 1 6 3603 1 1 15 THR CB C 6.179 -9.163 2.588 1.00 . A A . 15 THR CB 1 1 6 3604 1 1 15 THR CG2 C 6.263 -10.537 3.261 1.00 . A A . 15 THR CG2 1 1 6 3605 1 1 15 THR H H 5.773 -7.132 1.146 1.00 . A A . 15 THR H 1 1 6 3606 1 1 15 THR HA H 6.255 -9.875 0.568 1.00 . A A . 15 THR HA 1 1 6 3607 1 1 15 THR HB H 5.560 -8.508 3.204 1.00 . A A . 15 THR HB 1 1 6 3608 1 1 15 THR HG1 H 8.021 -9.169 1.955 1.00 . A A . 15 THR HG1 1 1 6 3609 1 1 15 THR HG21 H 6.782 -10.442 4.215 1.00 . A A . 15 THR HG21 1 1 6 3610 1 1 15 THR HG22 H 5.264 -10.931 3.449 1.00 . A A . 15 THR HG22 1 1 6 3611 1 1 15 THR HG23 H 6.811 -11.233 2.626 1.00 . A A . 15 THR HG23 1 1 6 3612 1 1 15 THR N N 5.537 -7.927 0.565 1.00 . A A . 15 THR N 1 1 6 3613 1 1 15 THR O O 4.063 -11.068 0.814 1.00 . A A . 15 THR O 1 1 6 3614 1 1 15 THR OG1 O 7.481 -8.617 2.524 1.00 . A A . 15 THR OG1 1 1 6 3615 1 1 16 CYS C C 1.294 -9.924 0.179 1.00 . A A . 16 CYS C 1 1 6 3616 1 1 16 CYS CA C 1.797 -9.595 1.590 1.00 . A A . 16 CYS CA 1 1 6 3617 1 1 16 CYS CB C 0.951 -8.530 2.293 1.00 . A A . 16 CYS CB 1 1 6 3618 1 1 16 CYS H H 3.362 -8.183 1.843 1.00 . A A . 16 CYS H 1 1 6 3619 1 1 16 CYS HA H 1.746 -10.507 2.186 1.00 . A A . 16 CYS HA 1 1 6 3620 1 1 16 CYS HB2 H 1.269 -8.491 3.334 1.00 . A A . 16 CYS HB2 1 1 6 3621 1 1 16 CYS HB3 H 1.155 -7.556 1.851 1.00 . A A . 16 CYS HB3 1 1 6 3622 1 1 16 CYS N N 3.178 -9.137 1.561 1.00 . A A . 16 CYS N 1 1 6 3623 1 1 16 CYS O O 0.668 -10.962 -0.024 1.00 . A A . 16 CYS O 1 1 6 3624 1 1 16 CYS SG S -0.841 -8.786 2.275 1.00 . A A . 16 CYS SG 1 1 6 3625 1 1 17 ARG C C 1.894 -10.576 -2.701 1.00 . A A . 17 ARG C 1 1 6 3626 1 1 17 ARG CA C 1.258 -9.277 -2.200 1.00 . A A . 17 ARG CA 1 1 6 3627 1 1 17 ARG CB C 1.737 -8.085 -3.040 1.00 . A A . 17 ARG CB 1 1 6 3628 1 1 17 ARG CD C -0.163 -6.625 -3.877 1.00 . A A . 17 ARG CD 1 1 6 3629 1 1 17 ARG CG C 0.911 -6.811 -2.802 1.00 . A A . 17 ARG CG 1 1 6 3630 1 1 17 ARG CZ C -1.423 -8.513 -4.975 1.00 . A A . 17 ARG CZ 1 1 6 3631 1 1 17 ARG H H 2.077 -8.206 -0.557 1.00 . A A . 17 ARG H 1 1 6 3632 1 1 17 ARG HA H 0.177 -9.378 -2.293 1.00 . A A . 17 ARG HA 1 1 6 3633 1 1 17 ARG HB2 H 2.774 -7.879 -2.783 1.00 . A A . 17 ARG HB2 1 1 6 3634 1 1 17 ARG HB3 H 1.704 -8.344 -4.098 1.00 . A A . 17 ARG HB3 1 1 6 3635 1 1 17 ARG HD2 H -0.719 -5.718 -3.648 1.00 . A A . 17 ARG HD2 1 1 6 3636 1 1 17 ARG HD3 H 0.339 -6.475 -4.832 1.00 . A A . 17 ARG HD3 1 1 6 3637 1 1 17 ARG HE H -1.492 -8.030 -3.014 1.00 . A A . 17 ARG HE 1 1 6 3638 1 1 17 ARG HG2 H 0.449 -6.828 -1.816 1.00 . A A . 17 ARG HG2 1 1 6 3639 1 1 17 ARG HG3 H 1.581 -5.951 -2.852 1.00 . A A . 17 ARG HG3 1 1 6 3640 1 1 17 ARG HH11 H -0.338 -7.459 -6.358 1.00 . A A . 17 ARG HH11 1 1 6 3641 1 1 17 ARG HH12 H -1.185 -8.848 -6.977 1.00 . A A . 17 ARG HH12 1 1 6 3642 1 1 17 ARG HH21 H -2.575 -9.791 -3.884 1.00 . A A . 17 ARG HH21 1 1 6 3643 1 1 17 ARG HH22 H -2.489 -10.151 -5.592 1.00 . A A . 17 ARG HH22 1 1 6 3644 1 1 17 ARG N N 1.581 -9.054 -0.796 1.00 . A A . 17 ARG N 1 1 6 3645 1 1 17 ARG NE N -1.099 -7.760 -3.907 1.00 . A A . 17 ARG NE 1 1 6 3646 1 1 17 ARG NH1 N -0.950 -8.245 -6.201 1.00 . A A . 17 ARG NH1 1 1 6 3647 1 1 17 ARG NH2 N -2.237 -9.562 -4.810 1.00 . A A . 17 ARG NH2 1 1 6 3648 1 1 17 ARG O O 1.223 -11.374 -3.353 1.00 . A A . 17 ARG O 1 1 6 3649 1 1 18 PHE C C 3.288 -13.235 -2.137 1.00 . A A . 18 PHE C 1 1 6 3650 1 1 18 PHE CA C 3.923 -11.984 -2.750 1.00 . A A . 18 PHE CA 1 1 6 3651 1 1 18 PHE CB C 5.389 -11.834 -2.323 1.00 . A A . 18 PHE CB 1 1 6 3652 1 1 18 PHE CD1 C 6.697 -13.389 -3.834 1.00 . A A . 18 PHE CD1 1 1 6 3653 1 1 18 PHE CD2 C 6.483 -13.958 -1.476 1.00 . A A . 18 PHE CD2 1 1 6 3654 1 1 18 PHE CE1 C 7.436 -14.565 -4.050 1.00 . A A . 18 PHE CE1 1 1 6 3655 1 1 18 PHE CE2 C 7.224 -15.132 -1.692 1.00 . A A . 18 PHE CE2 1 1 6 3656 1 1 18 PHE CG C 6.227 -13.078 -2.545 1.00 . A A . 18 PHE CG 1 1 6 3657 1 1 18 PHE CZ C 7.703 -15.435 -2.979 1.00 . A A . 18 PHE CZ 1 1 6 3658 1 1 18 PHE H H 3.663 -10.086 -1.839 1.00 . A A . 18 PHE H 1 1 6 3659 1 1 18 PHE HA H 3.897 -12.086 -3.836 1.00 . A A . 18 PHE HA 1 1 6 3660 1 1 18 PHE HB2 H 5.831 -11.010 -2.886 1.00 . A A . 18 PHE HB2 1 1 6 3661 1 1 18 PHE HB3 H 5.432 -11.570 -1.268 1.00 . A A . 18 PHE HB3 1 1 6 3662 1 1 18 PHE HD1 H 6.486 -12.728 -4.662 1.00 . A A . 18 PHE HD1 1 1 6 3663 1 1 18 PHE HD2 H 6.104 -13.741 -0.487 1.00 . A A . 18 PHE HD2 1 1 6 3664 1 1 18 PHE HE1 H 7.799 -14.801 -5.040 1.00 . A A . 18 PHE HE1 1 1 6 3665 1 1 18 PHE HE2 H 7.424 -15.804 -0.869 1.00 . A A . 18 PHE HE2 1 1 6 3666 1 1 18 PHE HZ H 8.273 -16.338 -3.145 1.00 . A A . 18 PHE HZ 1 1 6 3667 1 1 18 PHE N N 3.178 -10.787 -2.384 1.00 . A A . 18 PHE N 1 1 6 3668 1 1 18 PHE O O 3.114 -14.235 -2.831 1.00 . A A . 18 PHE O 1 1 6 3669 1 1 19 ALA C C 0.933 -14.613 -0.841 1.00 . A A . 19 ALA C 1 1 6 3670 1 1 19 ALA CA C 2.254 -14.261 -0.150 1.00 . A A . 19 ALA CA 1 1 6 3671 1 1 19 ALA CB C 2.030 -13.882 1.316 1.00 . A A . 19 ALA CB 1 1 6 3672 1 1 19 ALA H H 3.117 -12.325 -0.329 1.00 . A A . 19 ALA H 1 1 6 3673 1 1 19 ALA HA H 2.902 -15.140 -0.172 1.00 . A A . 19 ALA HA 1 1 6 3674 1 1 19 ALA HB1 H 2.987 -13.663 1.791 1.00 . A A . 19 ALA HB1 1 1 6 3675 1 1 19 ALA HB2 H 1.386 -13.007 1.392 1.00 . A A . 19 ALA HB2 1 1 6 3676 1 1 19 ALA HB3 H 1.559 -14.715 1.839 1.00 . A A . 19 ALA HB3 1 1 6 3677 1 1 19 ALA N N 2.934 -13.176 -0.846 1.00 . A A . 19 ALA N 1 1 6 3678 1 1 19 ALA O O 0.610 -15.791 -0.981 1.00 . A A . 19 ALA O 1 1 6 3679 1 1 20 GLY C C -2.216 -13.067 -1.494 1.00 . A A . 20 GLY C 1 1 6 3680 1 1 20 GLY CA C -0.993 -13.729 -2.123 1.00 . A A . 20 GLY CA 1 1 6 3681 1 1 20 GLY H H 0.525 -12.649 -1.115 1.00 . A A . 20 GLY H 1 1 6 3682 1 1 20 GLY HA2 H -0.798 -13.245 -3.080 1.00 . A A . 20 GLY HA2 1 1 6 3683 1 1 20 GLY HA3 H -1.218 -14.778 -2.316 1.00 . A A . 20 GLY HA3 1 1 6 3684 1 1 20 GLY N N 0.195 -13.589 -1.291 1.00 . A A . 20 GLY N 1 1 6 3685 1 1 20 GLY O O -3.337 -13.515 -1.724 1.00 . A A . 20 GLY O 1 1 6 3686 1 1 21 GLY C C -3.529 -10.147 -1.199 1.00 . A A . 21 GLY C 1 1 6 3687 1 1 21 GLY CA C -3.091 -11.191 -0.176 1.00 . A A . 21 GLY CA 1 1 6 3688 1 1 21 GLY H H -1.069 -11.666 -0.565 1.00 . A A . 21 GLY H 1 1 6 3689 1 1 21 GLY HA2 H -3.931 -11.833 0.083 1.00 . A A . 21 GLY HA2 1 1 6 3690 1 1 21 GLY HA3 H -2.745 -10.694 0.730 1.00 . A A . 21 GLY HA3 1 1 6 3691 1 1 21 GLY N N -2.012 -11.993 -0.723 1.00 . A A . 21 GLY N 1 1 6 3692 1 1 21 GLY O O -2.719 -9.691 -2.008 1.00 . A A . 21 GLY O 1 1 6 3693 1 1 22 SER C C -4.689 -7.456 -1.996 1.00 . A A . 22 SER C 1 1 6 3694 1 1 22 SER CA C -5.385 -8.812 -2.110 1.00 . A A . 22 SER CA 1 1 6 3695 1 1 22 SER CB C -6.887 -8.673 -1.845 1.00 . A A . 22 SER CB 1 1 6 3696 1 1 22 SER H H -5.441 -10.184 -0.499 1.00 . A A . 22 SER H 1 1 6 3697 1 1 22 SER HA H -5.249 -9.206 -3.118 1.00 . A A . 22 SER HA 1 1 6 3698 1 1 22 SER HB2 H -7.044 -8.149 -0.905 1.00 . A A . 22 SER HB2 1 1 6 3699 1 1 22 SER HB3 H -7.347 -8.099 -2.649 1.00 . A A . 22 SER HB3 1 1 6 3700 1 1 22 SER HG H -8.439 -9.839 -1.677 1.00 . A A . 22 SER HG 1 1 6 3701 1 1 22 SER N N -4.812 -9.768 -1.170 1.00 . A A . 22 SER N 1 1 6 3702 1 1 22 SER O O -4.188 -7.107 -0.931 1.00 . A A . 22 SER O 1 1 6 3703 1 1 22 SER OG O -7.489 -9.949 -1.773 1.00 . A A . 22 SER OG 1 1 6 3704 1 1 23 ARG C C -4.465 -4.475 -2.059 1.00 . A A . 23 ARG C 1 1 6 3705 1 1 23 ARG CA C -3.993 -5.405 -3.175 1.00 . A A . 23 ARG CA 1 1 6 3706 1 1 23 ARG CB C -4.251 -4.768 -4.543 1.00 . A A . 23 ARG CB 1 1 6 3707 1 1 23 ARG CD C -3.877 -4.909 -7.023 1.00 . A A . 23 ARG CD 1 1 6 3708 1 1 23 ARG CG C -3.545 -5.538 -5.668 1.00 . A A . 23 ARG CG 1 1 6 3709 1 1 23 ARG CZ C -5.877 -6.136 -7.898 1.00 . A A . 23 ARG CZ 1 1 6 3710 1 1 23 ARG H H -5.115 -7.041 -3.932 1.00 . A A . 23 ARG H 1 1 6 3711 1 1 23 ARG HA H -2.922 -5.558 -3.059 1.00 . A A . 23 ARG HA 1 1 6 3712 1 1 23 ARG HB2 H -5.325 -4.737 -4.726 1.00 . A A . 23 ARG HB2 1 1 6 3713 1 1 23 ARG HB3 H -3.871 -3.746 -4.531 1.00 . A A . 23 ARG HB3 1 1 6 3714 1 1 23 ARG HD2 H -3.635 -3.847 -6.982 1.00 . A A . 23 ARG HD2 1 1 6 3715 1 1 23 ARG HD3 H -3.259 -5.361 -7.799 1.00 . A A . 23 ARG HD3 1 1 6 3716 1 1 23 ARG HE H -5.890 -4.264 -7.111 1.00 . A A . 23 ARG HE 1 1 6 3717 1 1 23 ARG HG2 H -2.468 -5.484 -5.510 1.00 . A A . 23 ARG HG2 1 1 6 3718 1 1 23 ARG HG3 H -3.850 -6.584 -5.669 1.00 . A A . 23 ARG HG3 1 1 6 3719 1 1 23 ARG HH11 H -4.159 -7.235 -8.002 1.00 . A A . 23 ARG HH11 1 1 6 3720 1 1 23 ARG HH12 H -5.587 -8.034 -8.606 1.00 . A A . 23 ARG HH12 1 1 6 3721 1 1 23 ARG HH21 H -7.750 -5.316 -7.941 1.00 . A A . 23 ARG HH21 1 1 6 3722 1 1 23 ARG HH22 H -7.632 -6.942 -8.565 1.00 . A A . 23 ARG HH22 1 1 6 3723 1 1 23 ARG N N -4.661 -6.698 -3.098 1.00 . A A . 23 ARG N 1 1 6 3724 1 1 23 ARG NE N -5.303 -5.050 -7.351 1.00 . A A . 23 ARG NE 1 1 6 3725 1 1 23 ARG NH1 N -5.150 -7.224 -8.189 1.00 . A A . 23 ARG NH1 1 1 6 3726 1 1 23 ARG NH2 N -7.192 -6.133 -8.151 1.00 . A A . 23 ARG NH2 1 1 6 3727 1 1 23 ARG O O -3.656 -3.978 -1.278 1.00 . A A . 23 ARG O 1 1 6 3728 1 1 24 GLU C C -6.063 -3.908 0.435 1.00 . A A . 24 GLU C 1 1 6 3729 1 1 24 GLU CA C -6.420 -3.433 -0.973 1.00 . A A . 24 GLU CA 1 1 6 3730 1 1 24 GLU CB C -7.939 -3.440 -1.179 1.00 . A A . 24 GLU CB 1 1 6 3731 1 1 24 GLU CD C -9.842 -2.764 -2.699 1.00 . A A . 24 GLU CD 1 1 6 3732 1 1 24 GLU CG C -8.328 -2.782 -2.510 1.00 . A A . 24 GLU CG 1 1 6 3733 1 1 24 GLU H H -6.379 -4.723 -2.656 1.00 . A A . 24 GLU H 1 1 6 3734 1 1 24 GLU HA H -6.055 -2.411 -1.089 1.00 . A A . 24 GLU HA 1 1 6 3735 1 1 24 GLU HB2 H -8.311 -4.466 -1.160 1.00 . A A . 24 GLU HB2 1 1 6 3736 1 1 24 GLU HB3 H -8.402 -2.887 -0.360 1.00 . A A . 24 GLU HB3 1 1 6 3737 1 1 24 GLU HE2 H -9.972 -1.455 -1.259 1.00 . A A . 24 GLU HE2 1 1 6 3738 1 1 24 GLU HG2 H -7.962 -1.756 -2.531 1.00 . A A . 24 GLU HG2 1 1 6 3739 1 1 24 GLU HG3 H -7.880 -3.328 -3.339 1.00 . A A . 24 GLU HG3 1 1 6 3740 1 1 24 GLU N N -5.783 -4.268 -1.981 1.00 . A A . 24 GLU N 1 1 6 3741 1 1 24 GLU O O -5.693 -3.096 1.276 1.00 . A A . 24 GLU O 1 1 6 3742 1 1 24 GLU OE1 O -10.349 -3.471 -3.565 1.00 . A A . 24 GLU OE1 1 1 6 3743 1 1 24 GLU OE2 O -10.538 -1.937 -1.866 1.00 . A A . 24 GLU OE2 1 1 6 3744 1 1 25 ARG C C -4.515 -5.583 2.480 1.00 . A A . 25 ARG C 1 1 6 3745 1 1 25 ARG CA C -5.950 -5.808 2.001 1.00 . A A . 25 ARG CA 1 1 6 3746 1 1 25 ARG CB C -6.299 -7.299 1.935 1.00 . A A . 25 ARG CB 1 1 6 3747 1 1 25 ARG CD C -7.240 -9.211 3.282 1.00 . A A . 25 ARG CD 1 1 6 3748 1 1 25 ARG CG C -6.452 -7.899 3.335 1.00 . A A . 25 ARG CG 1 1 6 3749 1 1 25 ARG CZ C -7.059 -11.399 2.094 1.00 . A A . 25 ARG CZ 1 1 6 3750 1 1 25 ARG H H -6.473 -5.836 -0.048 1.00 . A A . 25 ARG H 1 1 6 3751 1 1 25 ARG HA H -6.632 -5.319 2.698 1.00 . A A . 25 ARG HA 1 1 6 3752 1 1 25 ARG HB2 H -7.246 -7.393 1.408 1.00 . A A . 25 ARG HB2 1 1 6 3753 1 1 25 ARG HB3 H -5.540 -7.847 1.375 1.00 . A A . 25 ARG HB3 1 1 6 3754 1 1 25 ARG HD2 H -7.432 -9.536 4.304 1.00 . A A . 25 ARG HD2 1 1 6 3755 1 1 25 ARG HD3 H -8.196 -9.015 2.794 1.00 . A A . 25 ARG HD3 1 1 6 3756 1 1 25 ARG HE H -5.506 -10.155 2.503 1.00 . A A . 25 ARG HE 1 1 6 3757 1 1 25 ARG HG2 H -5.471 -8.059 3.786 1.00 . A A . 25 ARG HG2 1 1 6 3758 1 1 25 ARG HG3 H -7.014 -7.207 3.962 1.00 . A A . 25 ARG HG3 1 1 6 3759 1 1 25 ARG HH11 H -8.982 -10.914 2.586 1.00 . A A . 25 ARG HH11 1 1 6 3760 1 1 25 ARG HH12 H -8.789 -12.450 1.784 1.00 . A A . 25 ARG HH12 1 1 6 3761 1 1 25 ARG HH21 H -5.275 -12.222 1.539 1.00 . A A . 25 ARG HH21 1 1 6 3762 1 1 25 ARG HH22 H -6.680 -13.182 1.164 1.00 . A A . 25 ARG HH22 1 1 6 3763 1 1 25 ARG N N -6.174 -5.218 0.690 1.00 . A A . 25 ARG N 1 1 6 3764 1 1 25 ARG NE N -6.506 -10.274 2.580 1.00 . A A . 25 ARG NE 1 1 6 3765 1 1 25 ARG NH1 N -8.383 -11.602 2.156 1.00 . A A . 25 ARG NH1 1 1 6 3766 1 1 25 ARG NH2 N -6.277 -12.338 1.543 1.00 . A A . 25 ARG NH2 1 1 6 3767 1 1 25 ARG O O -4.300 -5.125 3.601 1.00 . A A . 25 ARG O 1 1 6 3768 1 1 26 CYS C C -1.811 -4.211 2.113 1.00 . A A . 26 CYS C 1 1 6 3769 1 1 26 CYS CA C -2.126 -5.687 1.882 1.00 . A A . 26 CYS CA 1 1 6 3770 1 1 26 CYS CB C -1.304 -6.230 0.710 1.00 . A A . 26 CYS CB 1 1 6 3771 1 1 26 CYS H H -3.806 -6.268 0.717 1.00 . A A . 26 CYS H 1 1 6 3772 1 1 26 CYS HA H -1.858 -6.227 2.790 1.00 . A A . 26 CYS HA 1 1 6 3773 1 1 26 CYS HB2 H -1.621 -5.742 -0.211 1.00 . A A . 26 CYS HB2 1 1 6 3774 1 1 26 CYS HB3 H -0.259 -5.979 0.881 1.00 . A A . 26 CYS HB3 1 1 6 3775 1 1 26 CYS N N -3.542 -5.892 1.618 1.00 . A A . 26 CYS N 1 1 6 3776 1 1 26 CYS O O -1.033 -3.875 3.005 1.00 . A A . 26 CYS O 1 1 6 3777 1 1 26 CYS SG S -1.407 -8.020 0.473 1.00 . A A . 26 CYS SG 1 1 6 3778 1 1 27 ALA C C -2.754 -1.437 2.823 1.00 . A A . 27 ALA C 1 1 6 3779 1 1 27 ALA CA C -2.250 -1.897 1.455 1.00 . A A . 27 ALA CA 1 1 6 3780 1 1 27 ALA CB C -2.958 -1.192 0.304 1.00 . A A . 27 ALA CB 1 1 6 3781 1 1 27 ALA H H -3.043 -3.661 0.588 1.00 . A A . 27 ALA H 1 1 6 3782 1 1 27 ALA HA H -1.188 -1.664 1.371 1.00 . A A . 27 ALA HA 1 1 6 3783 1 1 27 ALA HB1 H -4.034 -1.346 0.361 1.00 . A A . 27 ALA HB1 1 1 6 3784 1 1 27 ALA HB2 H -2.743 -0.127 0.329 1.00 . A A . 27 ALA HB2 1 1 6 3785 1 1 27 ALA HB3 H -2.582 -1.600 -0.633 1.00 . A A . 27 ALA HB3 1 1 6 3786 1 1 27 ALA N N -2.418 -3.330 1.313 1.00 . A A . 27 ALA N 1 1 6 3787 1 1 27 ALA O O -2.065 -0.693 3.510 1.00 . A A . 27 ALA O 1 1 6 3788 1 1 28 LYS C C -3.550 -2.096 5.673 1.00 . A A . 28 LYS C 1 1 6 3789 1 1 28 LYS CA C -4.494 -1.633 4.558 1.00 . A A . 28 LYS CA 1 1 6 3790 1 1 28 LYS CB C -5.864 -2.318 4.666 1.00 . A A . 28 LYS CB 1 1 6 3791 1 1 28 LYS CD C -6.737 -1.119 6.748 1.00 . A A . 28 LYS CD 1 1 6 3792 1 1 28 LYS CE C -7.874 -0.228 7.263 1.00 . A A . 28 LYS CE 1 1 6 3793 1 1 28 LYS CG C -6.945 -1.411 5.258 1.00 . A A . 28 LYS CG 1 1 6 3794 1 1 28 LYS H H -4.460 -2.521 2.635 1.00 . A A . 28 LYS H 1 1 6 3795 1 1 28 LYS HA H -4.624 -0.551 4.628 1.00 . A A . 28 LYS HA 1 1 6 3796 1 1 28 LYS HB2 H -6.206 -2.584 3.670 1.00 . A A . 28 LYS HB2 1 1 6 3797 1 1 28 LYS HB3 H -5.788 -3.241 5.242 1.00 . A A . 28 LYS HB3 1 1 6 3798 1 1 28 LYS HD2 H -6.725 -2.061 7.302 1.00 . A A . 28 LYS HD2 1 1 6 3799 1 1 28 LYS HD3 H -5.788 -0.606 6.898 1.00 . A A . 28 LYS HD3 1 1 6 3800 1 1 28 LYS HE2 H -7.835 0.734 6.750 1.00 . A A . 28 LYS HE2 1 1 6 3801 1 1 28 LYS HE3 H -8.834 -0.702 7.050 1.00 . A A . 28 LYS HE3 1 1 6 3802 1 1 28 LYS HG2 H -6.978 -0.475 4.699 1.00 . A A . 28 LYS HG2 1 1 6 3803 1 1 28 LYS HG3 H -7.896 -1.923 5.123 1.00 . A A . 28 LYS HG3 1 1 6 3804 1 1 28 LYS HZ1 H -6.888 0.434 8.933 1.00 . A A . 28 LYS HZ1 1 1 6 3805 1 1 28 LYS HZ2 H -8.525 0.611 9.009 1.00 . A A . 28 LYS HZ2 1 1 6 3806 1 1 28 LYS HZ3 H -7.849 -0.879 9.204 1.00 . A A . 28 LYS HZ3 1 1 6 3807 1 1 28 LYS N N -3.927 -1.917 3.247 1.00 . A A . 28 LYS N 1 1 6 3808 1 1 28 LYS NZ N -7.774 0.002 8.714 1.00 . A A . 28 LYS NZ 1 1 6 3809 1 1 28 LYS O O -3.252 -1.327 6.586 1.00 . A A . 28 LYS O 1 1 6 3810 1 1 29 LEU C C -0.911 -3.148 6.736 1.00 . A A . 29 LEU C 1 1 6 3811 1 1 29 LEU CA C -2.185 -3.975 6.550 1.00 . A A . 29 LEU CA 1 1 6 3812 1 1 29 LEU CB C -1.851 -5.398 6.067 1.00 . A A . 29 LEU CB 1 1 6 3813 1 1 29 LEU CD1 C -1.702 -6.527 8.341 1.00 . A A . 29 LEU CD1 1 1 6 3814 1 1 29 LEU CD2 C -0.575 -7.526 6.342 1.00 . A A . 29 LEU CD2 1 1 6 3815 1 1 29 LEU CG C -0.971 -6.215 7.029 1.00 . A A . 29 LEU CG 1 1 6 3816 1 1 29 LEU H H -3.387 -3.913 4.803 1.00 . A A . 29 LEU H 1 1 6 3817 1 1 29 LEU HA H -2.713 -4.035 7.502 1.00 . A A . 29 LEU HA 1 1 6 3818 1 1 29 LEU HB2 H -2.782 -5.940 5.895 1.00 . A A . 29 LEU HB2 1 1 6 3819 1 1 29 LEU HB3 H -1.326 -5.320 5.116 1.00 . A A . 29 LEU HB3 1 1 6 3820 1 1 29 LEU HD11 H -2.661 -7.000 8.132 1.00 . A A . 29 LEU HD11 1 1 6 3821 1 1 29 LEU HD12 H -1.096 -7.204 8.945 1.00 . A A . 29 LEU HD12 1 1 6 3822 1 1 29 LEU HD13 H -1.865 -5.613 8.911 1.00 . A A . 29 LEU HD13 1 1 6 3823 1 1 29 LEU HD21 H 0.006 -7.310 5.444 1.00 . A A . 29 LEU HD21 1 1 6 3824 1 1 29 LEU HD22 H 0.035 -8.130 7.015 1.00 . A A . 29 LEU HD22 1 1 6 3825 1 1 29 LEU HD23 H -1.467 -8.089 6.066 1.00 . A A . 29 LEU HD23 1 1 6 3826 1 1 29 LEU HG H -0.055 -5.668 7.256 1.00 . A A . 29 LEU HG 1 1 6 3827 1 1 29 LEU N N -3.084 -3.349 5.585 1.00 . A A . 29 LEU N 1 1 6 3828 1 1 29 LEU O O -0.467 -2.936 7.863 1.00 . A A . 29 LEU O 1 1 6 3829 1 1 30 SER C C 0.671 -0.458 6.035 1.00 . A A . 30 SER C 1 1 6 3830 1 1 30 SER CA C 0.901 -1.910 5.608 1.00 . A A . 30 SER CA 1 1 6 3831 1 1 30 SER CB C 1.519 -1.964 4.211 1.00 . A A . 30 SER CB 1 1 6 3832 1 1 30 SER H H -0.785 -2.882 4.736 1.00 . A A . 30 SER H 1 1 6 3833 1 1 30 SER HA H 1.614 -2.357 6.301 1.00 . A A . 30 SER HA 1 1 6 3834 1 1 30 SER HB2 H 2.405 -1.333 4.196 1.00 . A A . 30 SER HB2 1 1 6 3835 1 1 30 SER HB3 H 1.798 -2.987 3.968 1.00 . A A . 30 SER HB3 1 1 6 3836 1 1 30 SER HG H -0.105 -2.144 3.156 1.00 . A A . 30 SER HG 1 1 6 3837 1 1 30 SER N N -0.332 -2.688 5.621 1.00 . A A . 30 SER N 1 1 6 3838 1 1 30 SER O O 1.554 0.157 6.631 1.00 . A A . 30 SER O 1 1 6 3839 1 1 30 SER OG O 0.609 -1.503 3.238 1.00 . A A . 30 SER OG 1 1 6 3840 1 1 31 GLY C C -0.714 2.297 4.590 1.00 . A A . 31 GLY C 1 1 6 3841 1 1 31 GLY CA C -0.860 1.485 5.882 1.00 . A A . 31 GLY CA 1 1 6 3842 1 1 31 GLY H H -1.158 -0.482 5.181 1.00 . A A . 31 GLY H 1 1 6 3843 1 1 31 GLY HA2 H -1.906 1.524 6.191 1.00 . A A . 31 GLY HA2 1 1 6 3844 1 1 31 GLY HA3 H -0.257 1.945 6.666 1.00 . A A . 31 GLY HA3 1 1 6 3845 1 1 31 GLY N N -0.500 0.090 5.695 1.00 . A A . 31 GLY N 1 1 6 3846 1 1 31 GLY O O -0.795 3.523 4.640 1.00 . A A . 31 GLY O 1 1 6 3847 1 1 32 CYS C C -1.933 2.402 1.595 1.00 . A A . 32 CYS C 1 1 6 3848 1 1 32 CYS CA C -0.504 2.248 2.127 1.00 . A A . 32 CYS CA 1 1 6 3849 1 1 32 CYS CB C 0.321 1.393 1.155 1.00 . A A . 32 CYS CB 1 1 6 3850 1 1 32 CYS H H -0.511 0.615 3.463 1.00 . A A . 32 CYS H 1 1 6 3851 1 1 32 CYS HA H -0.043 3.232 2.208 1.00 . A A . 32 CYS HA 1 1 6 3852 1 1 32 CYS HB2 H -0.231 0.478 0.944 1.00 . A A . 32 CYS HB2 1 1 6 3853 1 1 32 CYS HB3 H 0.425 1.930 0.215 1.00 . A A . 32 CYS HB3 1 1 6 3854 1 1 32 CYS N N -0.528 1.627 3.442 1.00 . A A . 32 CYS N 1 1 6 3855 1 1 32 CYS O O -2.844 1.706 2.039 1.00 . A A . 32 CYS O 1 1 6 3856 1 1 32 CYS SG S 1.973 0.894 1.715 1.00 . A A . 32 CYS SG 1 1 6 3857 1 1 33 LYS C C -3.200 3.162 -1.534 1.00 . A A . 33 LYS C 1 1 6 3858 1 1 33 LYS CA C -3.370 3.555 -0.066 1.00 . A A . 33 LYS CA 1 1 6 3859 1 1 33 LYS CB C -3.766 5.038 0.020 1.00 . A A . 33 LYS CB 1 1 6 3860 1 1 33 LYS CD C -4.703 4.934 2.413 1.00 . A A . 33 LYS CD 1 1 6 3861 1 1 33 LYS CE C -3.966 4.185 3.536 1.00 . A A . 33 LYS CE 1 1 6 3862 1 1 33 LYS CG C -3.746 5.634 1.433 1.00 . A A . 33 LYS CG 1 1 6 3863 1 1 33 LYS H H -1.327 3.870 0.351 1.00 . A A . 33 LYS H 1 1 6 3864 1 1 33 LYS HA H -4.168 2.952 0.369 1.00 . A A . 33 LYS HA 1 1 6 3865 1 1 33 LYS HB2 H -3.073 5.622 -0.589 1.00 . A A . 33 LYS HB2 1 1 6 3866 1 1 33 LYS HB3 H -4.766 5.158 -0.400 1.00 . A A . 33 LYS HB3 1 1 6 3867 1 1 33 LYS HD2 H -5.365 5.684 2.847 1.00 . A A . 33 LYS HD2 1 1 6 3868 1 1 33 LYS HD3 H -5.332 4.229 1.869 1.00 . A A . 33 LYS HD3 1 1 6 3869 1 1 33 LYS HE2 H -4.344 3.165 3.587 1.00 . A A . 33 LYS HE2 1 1 6 3870 1 1 33 LYS HE3 H -2.899 4.140 3.341 1.00 . A A . 33 LYS HE3 1 1 6 3871 1 1 33 LYS HG2 H -2.721 5.629 1.800 1.00 . A A . 33 LYS HG2 1 1 6 3872 1 1 33 LYS HG3 H -4.055 6.676 1.344 1.00 . A A . 33 LYS HG3 1 1 6 3873 1 1 33 LYS HZ1 H -5.133 4.870 5.077 1.00 . A A . 33 LYS HZ1 1 1 6 3874 1 1 33 LYS HZ2 H -3.673 4.273 5.555 1.00 . A A . 33 LYS HZ2 1 1 6 3875 1 1 33 LYS HZ3 H -3.757 5.753 4.847 1.00 . A A . 33 LYS HZ3 1 1 6 3876 1 1 33 LYS N N -2.121 3.319 0.641 1.00 . A A . 33 LYS N 1 1 6 3877 1 1 33 LYS NZ N -4.150 4.820 4.852 1.00 . A A . 33 LYS NZ 1 1 6 3878 1 1 33 LYS O O -2.198 3.518 -2.154 1.00 . A A . 33 LYS O 1 1 6 3879 1 1 34 ILE C C -5.486 3.002 -4.024 1.00 . A A . 34 ILE C 1 1 6 3880 1 1 34 ILE CA C -4.327 2.155 -3.502 1.00 . A A . 34 ILE CA 1 1 6 3881 1 1 34 ILE CB C -4.621 0.657 -3.710 1.00 . A A . 34 ILE CB 1 1 6 3882 1 1 34 ILE CD1 C -2.190 -0.075 -3.244 1.00 . A A . 34 ILE CD1 1 1 6 3883 1 1 34 ILE CG1 C -3.675 -0.261 -2.924 1.00 . A A . 34 ILE CG1 1 1 6 3884 1 1 34 ILE CG2 C -4.615 0.307 -5.205 1.00 . A A . 34 ILE CG2 1 1 6 3885 1 1 34 ILE H H -4.964 2.168 -1.496 1.00 . A A . 34 ILE H 1 1 6 3886 1 1 34 ILE HA H -3.412 2.413 -4.037 1.00 . A A . 34 ILE HA 1 1 6 3887 1 1 34 ILE HB H -5.622 0.443 -3.330 1.00 . A A . 34 ILE HB 1 1 6 3888 1 1 34 ILE HD11 H -1.869 0.927 -2.968 1.00 . A A . 34 ILE HD11 1 1 6 3889 1 1 34 ILE HD12 H -1.604 -0.790 -2.669 1.00 . A A . 34 ILE HD12 1 1 6 3890 1 1 34 ILE HD13 H -2.003 -0.245 -4.303 1.00 . A A . 34 ILE HD13 1 1 6 3891 1 1 34 ILE HG12 H -3.832 -0.077 -1.864 1.00 . A A . 34 ILE HG12 1 1 6 3892 1 1 34 ILE HG13 H -3.951 -1.295 -3.121 1.00 . A A . 34 ILE HG13 1 1 6 3893 1 1 34 ILE HG21 H -3.666 0.588 -5.663 1.00 . A A . 34 ILE HG21 1 1 6 3894 1 1 34 ILE HG22 H -4.771 -0.766 -5.333 1.00 . A A . 34 ILE HG22 1 1 6 3895 1 1 34 ILE HG23 H -5.421 0.835 -5.714 1.00 . A A . 34 ILE HG23 1 1 6 3896 1 1 34 ILE N N -4.196 2.456 -2.083 1.00 . A A . 34 ILE N 1 1 6 3897 1 1 34 ILE O O -6.627 2.778 -3.621 1.00 . A A . 34 ILE O 1 1 6 3898 1 1 35 ILE C C -5.904 5.127 -6.933 1.00 . A A . 35 ILE C 1 1 6 3899 1 1 35 ILE CA C -6.220 4.856 -5.463 1.00 . A A . 35 ILE CA 1 1 6 3900 1 1 35 ILE CB C -6.367 6.150 -4.638 1.00 . A A . 35 ILE CB 1 1 6 3901 1 1 35 ILE CD1 C -5.164 8.114 -3.564 1.00 . A A . 35 ILE CD1 1 1 6 3902 1 1 35 ILE CG1 C -5.025 6.873 -4.446 1.00 . A A . 35 ILE CG1 1 1 6 3903 1 1 35 ILE CG2 C -7.015 5.859 -3.276 1.00 . A A . 35 ILE CG2 1 1 6 3904 1 1 35 ILE H H -4.248 4.115 -5.196 1.00 . A A . 35 ILE H 1 1 6 3905 1 1 35 ILE HA H -7.180 4.339 -5.444 1.00 . A A . 35 ILE HA 1 1 6 3906 1 1 35 ILE HB H -7.045 6.809 -5.185 1.00 . A A . 35 ILE HB 1 1 6 3907 1 1 35 ILE HD11 H -5.919 8.786 -3.975 1.00 . A A . 35 ILE HD11 1 1 6 3908 1 1 35 ILE HD12 H -5.419 7.844 -2.540 1.00 . A A . 35 ILE HD12 1 1 6 3909 1 1 35 ILE HD13 H -4.205 8.616 -3.535 1.00 . A A . 35 ILE HD13 1 1 6 3910 1 1 35 ILE HG12 H -4.297 6.210 -3.980 1.00 . A A . 35 ILE HG12 1 1 6 3911 1 1 35 ILE HG13 H -4.640 7.186 -5.417 1.00 . A A . 35 ILE HG13 1 1 6 3912 1 1 35 ILE HG21 H -6.302 5.363 -2.616 1.00 . A A . 35 ILE HG21 1 1 6 3913 1 1 35 ILE HG22 H -7.342 6.789 -2.808 1.00 . A A . 35 ILE HG22 1 1 6 3914 1 1 35 ILE HG23 H -7.895 5.231 -3.404 1.00 . A A . 35 ILE HG23 1 1 6 3915 1 1 35 ILE N N -5.205 3.974 -4.898 1.00 . A A . 35 ILE N 1 1 6 3916 1 1 35 ILE O O -4.756 5.374 -7.296 1.00 . A A . 35 ILE O 1 1 6 3917 1 1 36 SER C C -6.895 6.522 -9.781 1.00 . A A . 36 SER C 1 1 6 3918 1 1 36 SER CA C -6.816 5.089 -9.233 1.00 . A A . 36 SER CA 1 1 6 3919 1 1 36 SER CB C -7.896 4.183 -9.840 1.00 . A A . 36 SER CB 1 1 6 3920 1 1 36 SER H H -7.854 4.871 -7.395 1.00 . A A . 36 SER H 1 1 6 3921 1 1 36 SER HA H -5.843 4.680 -9.512 1.00 . A A . 36 SER HA 1 1 6 3922 1 1 36 SER HB2 H -7.928 3.236 -9.296 1.00 . A A . 36 SER HB2 1 1 6 3923 1 1 36 SER HB3 H -8.871 4.665 -9.763 1.00 . A A . 36 SER HB3 1 1 6 3924 1 1 36 SER HG H -6.784 3.423 -11.247 1.00 . A A . 36 SER HG 1 1 6 3925 1 1 36 SER N N -6.936 5.041 -7.780 1.00 . A A . 36 SER N 1 1 6 3926 1 1 36 SER O O -6.959 6.714 -10.993 1.00 . A A . 36 SER O 1 1 6 3927 1 1 36 SER OG O -7.619 3.895 -11.195 1.00 . A A . 36 SER OG 1 1 6 3928 1 1 37 ALA C C -5.510 9.400 -9.858 1.00 . A A . 37 ALA C 1 1 6 3929 1 1 37 ALA CA C -6.859 8.941 -9.286 1.00 . A A . 37 ALA CA 1 1 6 3930 1 1 37 ALA CB C -7.231 9.775 -8.056 1.00 . A A . 37 ALA CB 1 1 6 3931 1 1 37 ALA H H -6.771 7.325 -7.919 1.00 . A A . 37 ALA H 1 1 6 3932 1 1 37 ALA HA H -7.628 9.101 -10.043 1.00 . A A . 37 ALA HA 1 1 6 3933 1 1 37 ALA HB1 H -8.197 9.449 -7.669 1.00 . A A . 37 ALA HB1 1 1 6 3934 1 1 37 ALA HB2 H -6.474 9.651 -7.281 1.00 . A A . 37 ALA HB2 1 1 6 3935 1 1 37 ALA HB3 H -7.297 10.831 -8.325 1.00 . A A . 37 ALA HB3 1 1 6 3936 1 1 37 ALA N N -6.852 7.534 -8.902 1.00 . A A . 37 ALA N 1 1 6 3937 1 1 37 ALA O O -5.381 10.557 -10.256 1.00 . A A . 37 ALA O 1 1 6 3938 1 1 38 SER C C -2.573 10.015 -9.431 1.00 . A A . 38 SER C 1 1 6 3939 1 1 38 SER CA C -3.116 8.811 -10.216 1.00 . A A . 38 SER CA 1 1 6 3940 1 1 38 SER CB C -2.992 8.956 -11.739 1.00 . A A . 38 SER CB 1 1 6 3941 1 1 38 SER H H -4.676 7.581 -9.532 1.00 . A A . 38 SER H 1 1 6 3942 1 1 38 SER HA H -2.522 7.946 -9.921 1.00 . A A . 38 SER HA 1 1 6 3943 1 1 38 SER HB2 H -3.399 8.068 -12.224 1.00 . A A . 38 SER HB2 1 1 6 3944 1 1 38 SER HB3 H -3.552 9.827 -12.075 1.00 . A A . 38 SER HB3 1 1 6 3945 1 1 38 SER HG H -1.295 9.889 -11.710 1.00 . A A . 38 SER HG 1 1 6 3946 1 1 38 SER N N -4.497 8.516 -9.858 1.00 . A A . 38 SER N 1 1 6 3947 1 1 38 SER O O -1.698 10.736 -9.909 1.00 . A A . 38 SER O 1 1 6 3948 1 1 38 SER OG O -1.637 9.086 -12.113 1.00 . A A . 38 SER OG 1 1 6 3949 1 1 39 THR C C -2.944 10.797 -5.899 1.00 . A A . 39 THR C 1 1 6 3950 1 1 39 THR CA C -2.813 11.329 -7.326 1.00 . A A . 39 THR CA 1 1 6 3951 1 1 39 THR CB C -3.836 12.447 -7.591 1.00 . A A . 39 THR CB 1 1 6 3952 1 1 39 THR CG2 C -3.514 13.707 -6.782 1.00 . A A . 39 THR CG2 1 1 6 3953 1 1 39 THR H H -3.764 9.542 -7.865 1.00 . A A . 39 THR H 1 1 6 3954 1 1 39 THR HA H -1.802 11.702 -7.496 1.00 . A A . 39 THR HA 1 1 6 3955 1 1 39 THR HB H -4.830 12.096 -7.310 1.00 . A A . 39 THR HB 1 1 6 3956 1 1 39 THR HG1 H -4.283 12.068 -9.450 1.00 . A A . 39 THR HG1 1 1 6 3957 1 1 39 THR HG21 H -4.211 14.499 -7.056 1.00 . A A . 39 THR HG21 1 1 6 3958 1 1 39 THR HG22 H -3.615 13.509 -5.715 1.00 . A A . 39 THR HG22 1 1 6 3959 1 1 39 THR HG23 H -2.499 14.039 -6.996 1.00 . A A . 39 THR HG23 1 1 6 3960 1 1 39 THR N N -3.086 10.206 -8.210 1.00 . A A . 39 THR N 1 1 6 3961 1 1 39 THR O O -3.778 9.927 -5.664 1.00 . A A . 39 THR O 1 1 6 3962 1 1 39 THR OG1 O -3.867 12.786 -8.963 1.00 . A A . 39 THR OG1 1 1 6 3963 1 1 40 CYS C C -1.848 12.059 -2.661 1.00 . A A . 40 CYS C 1 1 6 3964 1 1 40 CYS CA C -2.098 10.855 -3.574 1.00 . A A . 40 CYS CA 1 1 6 3965 1 1 40 CYS CB C -1.015 9.783 -3.393 1.00 . A A . 40 CYS CB 1 1 6 3966 1 1 40 CYS H H -1.484 12.038 -5.212 1.00 . A A . 40 CYS H 1 1 6 3967 1 1 40 CYS HA H -3.066 10.432 -3.324 1.00 . A A . 40 CYS HA 1 1 6 3968 1 1 40 CYS HB2 H -0.072 10.163 -3.789 1.00 . A A . 40 CYS HB2 1 1 6 3969 1 1 40 CYS HB3 H -0.880 9.589 -2.329 1.00 . A A . 40 CYS HB3 1 1 6 3970 1 1 40 CYS N N -2.121 11.294 -4.965 1.00 . A A . 40 CYS N 1 1 6 3971 1 1 40 CYS O O -1.128 12.974 -3.058 1.00 . A A . 40 CYS O 1 1 6 3972 1 1 40 CYS SG S -1.389 8.203 -4.198 1.00 . A A . 40 CYS SG 1 1 6 3973 1 1 41 PRO C C -0.963 13.266 0.141 1.00 . A A . 41 PRO C 1 1 6 3974 1 1 41 PRO CA C -2.334 13.215 -0.538 1.00 . A A . 41 PRO CA 1 1 6 3975 1 1 41 PRO CB C -3.449 13.000 0.487 1.00 . A A . 41 PRO CB 1 1 6 3976 1 1 41 PRO CD C -3.321 11.065 -0.896 1.00 . A A . 41 PRO CD 1 1 6 3977 1 1 41 PRO CG C -3.553 11.477 0.559 1.00 . A A . 41 PRO CG 1 1 6 3978 1 1 41 PRO HA H -2.506 14.153 -1.071 1.00 . A A . 41 PRO HA 1 1 6 3979 1 1 41 PRO HB2 H -3.235 13.450 1.458 1.00 . A A . 41 PRO HB2 1 1 6 3980 1 1 41 PRO HB3 H -4.382 13.403 0.091 1.00 . A A . 41 PRO HB3 1 1 6 3981 1 1 41 PRO HD2 H -2.891 10.063 -0.944 1.00 . A A . 41 PRO HD2 1 1 6 3982 1 1 41 PRO HD3 H -4.276 11.080 -1.425 1.00 . A A . 41 PRO HD3 1 1 6 3983 1 1 41 PRO HG2 H -2.748 11.086 1.183 1.00 . A A . 41 PRO HG2 1 1 6 3984 1 1 41 PRO HG3 H -4.521 11.146 0.937 1.00 . A A . 41 PRO HG3 1 1 6 3985 1 1 41 PRO N N -2.441 12.085 -1.452 1.00 . A A . 41 PRO N 1 1 6 3986 1 1 41 PRO O O -0.188 12.311 0.077 1.00 . A A . 41 PRO O 1 1 6 3987 1 1 42 SER C C 0.536 13.875 2.883 1.00 . A A . 42 SER C 1 1 6 3988 1 1 42 SER CA C 0.531 14.655 1.562 1.00 . A A . 42 SER CA 1 1 6 3989 1 1 42 SER CB C 0.662 16.165 1.791 1.00 . A A . 42 SER CB 1 1 6 3990 1 1 42 SER H H -1.371 15.138 0.784 1.00 . A A . 42 SER H 1 1 6 3991 1 1 42 SER HA H 1.390 14.332 0.972 1.00 . A A . 42 SER HA 1 1 6 3992 1 1 42 SER HB2 H -0.203 16.531 2.347 1.00 . A A . 42 SER HB2 1 1 6 3993 1 1 42 SER HB3 H 1.568 16.374 2.362 1.00 . A A . 42 SER HB3 1 1 6 3994 1 1 42 SER HG H 0.816 17.779 0.712 1.00 . A A . 42 SER HG 1 1 6 3995 1 1 42 SER N N -0.688 14.396 0.807 1.00 . A A . 42 SER N 1 1 6 3996 1 1 42 SER O O 0.527 14.459 3.965 1.00 . A A . 42 SER O 1 1 6 3997 1 1 42 SER OG O 0.733 16.836 0.549 1.00 . A A . 42 SER OG 1 1 6 3998 1 1 43 ASP C C 1.439 10.382 3.466 1.00 . A A . 43 ASP C 1 1 6 3999 1 1 43 ASP CA C 0.574 11.580 3.861 1.00 . A A . 43 ASP CA 1 1 6 4000 1 1 43 ASP CB C -0.849 11.104 4.184 1.00 . A A . 43 ASP CB 1 1 6 4001 1 1 43 ASP CG C -1.678 12.175 4.884 1.00 . A A . 43 ASP CG 1 1 6 4002 1 1 43 ASP H H 0.540 12.178 1.830 1.00 . A A . 43 ASP H 1 1 6 4003 1 1 43 ASP HA H 1.008 12.029 4.756 1.00 . A A . 43 ASP HA 1 1 6 4004 1 1 43 ASP HB2 H -1.357 10.795 3.270 1.00 . A A . 43 ASP HB2 1 1 6 4005 1 1 43 ASP HB3 H -0.785 10.243 4.850 1.00 . A A . 43 ASP HB3 1 1 6 4006 1 1 43 ASP HD2 H -2.836 13.701 4.571 1.00 . A A . 43 ASP HD2 1 1 6 4007 1 1 43 ASP N N 0.552 12.545 2.769 1.00 . A A . 43 ASP N 1 1 6 4008 1 1 43 ASP O O 2.146 9.837 4.313 1.00 . A A . 43 ASP O 1 1 6 4009 1 1 43 ASP OD1 O -1.725 12.193 6.112 1.00 . A A . 43 ASP OD1 1 1 6 4010 1 1 43 ASP OD2 O -2.338 13.048 4.074 1.00 . A A . 43 ASP OD2 1 1 6 4011 1 1 44 TYR C C 2.876 9.072 0.471 1.00 . A A . 44 TYR C 1 1 6 4012 1 1 44 TYR CA C 1.996 8.756 1.687 1.00 . A A . 44 TYR CA 1 1 6 4013 1 1 44 TYR CB C 0.885 7.751 1.355 1.00 . A A . 44 TYR CB 1 1 6 4014 1 1 44 TYR CD1 C 0.401 6.937 3.694 1.00 . A A . 44 TYR CD1 1 1 6 4015 1 1 44 TYR CD2 C -1.400 7.969 2.435 1.00 . A A . 44 TYR CD2 1 1 6 4016 1 1 44 TYR CE1 C -0.442 6.798 4.807 1.00 . A A . 44 TYR CE1 1 1 6 4017 1 1 44 TYR CE2 C -2.250 7.824 3.545 1.00 . A A . 44 TYR CE2 1 1 6 4018 1 1 44 TYR CG C -0.076 7.501 2.500 1.00 . A A . 44 TYR CG 1 1 6 4019 1 1 44 TYR CZ C -1.774 7.232 4.727 1.00 . A A . 44 TYR CZ 1 1 6 4020 1 1 44 TYR H H 0.754 10.451 1.553 1.00 . A A . 44 TYR H 1 1 6 4021 1 1 44 TYR HA H 2.627 8.304 2.448 1.00 . A A . 44 TYR HA 1 1 6 4022 1 1 44 TYR HB2 H 0.319 8.108 0.494 1.00 . A A . 44 TYR HB2 1 1 6 4023 1 1 44 TYR HB3 H 1.348 6.806 1.087 1.00 . A A . 44 TYR HB3 1 1 6 4024 1 1 44 TYR HD1 H 1.429 6.640 3.769 1.00 . A A . 44 TYR HD1 1 1 6 4025 1 1 44 TYR HD2 H -1.768 8.446 1.538 1.00 . A A . 44 TYR HD2 1 1 6 4026 1 1 44 TYR HE1 H -0.055 6.356 5.714 1.00 . A A . 44 TYR HE1 1 1 6 4027 1 1 44 TYR HE2 H -3.270 8.172 3.485 1.00 . A A . 44 TYR HE2 1 1 6 4028 1 1 44 TYR HH H -2.160 6.782 6.588 1.00 . A A . 44 TYR HH 1 1 6 4029 1 1 44 TYR N N 1.365 9.964 2.193 1.00 . A A . 44 TYR N 1 1 6 4030 1 1 44 TYR O O 2.514 8.728 -0.652 1.00 . A A . 44 TYR O 1 1 6 4031 1 1 44 TYR OH O -2.613 7.070 5.791 1.00 . A A . 44 TYR OH 1 1 6 4032 1 1 45 PRO C C 5.781 9.040 -0.975 1.00 . A A . 45 PRO C 1 1 6 4033 1 1 45 PRO CA C 4.895 10.166 -0.422 1.00 . A A . 45 PRO CA 1 1 6 4034 1 1 45 PRO CB C 5.757 11.273 0.189 1.00 . A A . 45 PRO CB 1 1 6 4035 1 1 45 PRO CD C 4.561 10.193 1.942 1.00 . A A . 45 PRO CD 1 1 6 4036 1 1 45 PRO CG C 5.932 10.794 1.629 1.00 . A A . 45 PRO CG 1 1 6 4037 1 1 45 PRO HA H 4.305 10.586 -1.239 1.00 . A A . 45 PRO HA 1 1 6 4038 1 1 45 PRO HB2 H 6.710 11.409 -0.324 1.00 . A A . 45 PRO HB2 1 1 6 4039 1 1 45 PRO HB3 H 5.197 12.210 0.188 1.00 . A A . 45 PRO HB3 1 1 6 4040 1 1 45 PRO HD2 H 4.663 9.384 2.667 1.00 . A A . 45 PRO HD2 1 1 6 4041 1 1 45 PRO HD3 H 3.921 10.982 2.338 1.00 . A A . 45 PRO HD3 1 1 6 4042 1 1 45 PRO HG2 H 6.695 10.014 1.664 1.00 . A A . 45 PRO HG2 1 1 6 4043 1 1 45 PRO HG3 H 6.195 11.607 2.306 1.00 . A A . 45 PRO HG3 1 1 6 4044 1 1 45 PRO N N 4.033 9.729 0.667 1.00 . A A . 45 PRO N 1 1 6 4045 1 1 45 PRO O O 6.414 9.241 -2.010 1.00 . A A . 45 PRO O 1 1 6 4046 1 1 46 LYS C C 6.163 5.691 -1.371 1.00 . A A . 46 LYS C 1 1 6 4047 1 1 46 LYS CA C 6.817 6.834 -0.590 1.00 . A A . 46 LYS CA 1 1 6 4048 1 1 46 LYS CB C 7.433 6.339 0.732 1.00 . A A . 46 LYS CB 1 1 6 4049 1 1 46 LYS CD C 9.867 6.627 0.037 1.00 . A A . 46 LYS CD 1 1 6 4050 1 1 46 LYS CE C 10.251 6.334 -1.418 1.00 . A A . 46 LYS CE 1 1 6 4051 1 1 46 LYS CG C 8.802 5.660 0.572 1.00 . A A . 46 LYS CG 1 1 6 4052 1 1 46 LYS H H 5.286 7.746 0.526 1.00 . A A . 46 LYS H 1 1 6 4053 1 1 46 LYS HA H 7.607 7.257 -1.205 1.00 . A A . 46 LYS HA 1 1 6 4054 1 1 46 LYS HB2 H 7.561 7.188 1.407 1.00 . A A . 46 LYS HB2 1 1 6 4055 1 1 46 LYS HB3 H 6.743 5.638 1.203 1.00 . A A . 46 LYS HB3 1 1 6 4056 1 1 46 LYS HD2 H 9.505 7.654 0.112 1.00 . A A . 46 LYS HD2 1 1 6 4057 1 1 46 LYS HD3 H 10.760 6.553 0.658 1.00 . A A . 46 LYS HD3 1 1 6 4058 1 1 46 LYS HE2 H 9.363 6.225 -2.040 1.00 . A A . 46 LYS HE2 1 1 6 4059 1 1 46 LYS HE3 H 10.827 7.180 -1.793 1.00 . A A . 46 LYS HE3 1 1 6 4060 1 1 46 LYS HG2 H 9.127 5.332 1.557 1.00 . A A . 46 LYS HG2 1 1 6 4061 1 1 46 LYS HG3 H 8.716 4.774 -0.057 1.00 . A A . 46 LYS HG3 1 1 6 4062 1 1 46 LYS HZ1 H 10.531 4.317 -1.198 1.00 . A A . 46 LYS HZ1 1 1 6 4063 1 1 46 LYS HZ2 H 11.305 4.958 -2.504 1.00 . A A . 46 LYS HZ2 1 1 6 4064 1 1 46 LYS HZ3 H 11.906 5.204 -0.990 1.00 . A A . 46 LYS HZ3 1 1 6 4065 1 1 46 LYS N N 5.861 7.888 -0.291 1.00 . A A . 46 LYS N 1 1 6 4066 1 1 46 LYS NZ N 11.062 5.108 -1.536 1.00 . A A . 46 LYS NZ 1 1 6 4067 1 1 46 LYS O O 6.921 4.807 -1.822 1.00 . A A . 46 LYS O 1 1 6 4068 1 1 46 LYS OXT O 4.920 5.700 -1.516 1.00 . A A . 46 LYS OXT 1 1 7 4069 1 1 1 LYS C C -1.510 3.483 -6.671 1.00 . A A . 1 LYS C 1 1 7 4070 1 1 1 LYS CA C -1.467 3.811 -8.165 1.00 . A A . 1 LYS CA 1 1 7 4071 1 1 1 LYS CB C -0.634 5.075 -8.438 1.00 . A A . 1 LYS CB 1 1 7 4072 1 1 1 LYS CD C -0.514 7.625 -8.287 1.00 . A A . 1 LYS CD 1 1 7 4073 1 1 1 LYS CE C 0.682 8.106 -7.450 1.00 . A A . 1 LYS CE 1 1 7 4074 1 1 1 LYS CG C -1.207 6.345 -7.787 1.00 . A A . 1 LYS CG 1 1 7 4075 1 1 1 LYS H1 H -2.760 4.194 -9.714 1.00 . A A . 1 LYS H1 1 1 7 4076 1 1 1 LYS H2 H -3.265 2.994 -8.700 1.00 . A A . 1 LYS H2 1 1 7 4077 1 1 1 LYS H3 H -3.362 4.559 -8.215 1.00 . A A . 1 LYS H3 1 1 7 4078 1 1 1 LYS HA H -0.969 2.984 -8.676 1.00 . A A . 1 LYS HA 1 1 7 4079 1 1 1 LYS HB2 H 0.379 4.907 -8.076 1.00 . A A . 1 LYS HB2 1 1 7 4080 1 1 1 LYS HB3 H -0.591 5.217 -9.519 1.00 . A A . 1 LYS HB3 1 1 7 4081 1 1 1 LYS HD2 H -0.211 7.505 -9.328 1.00 . A A . 1 LYS HD2 1 1 7 4082 1 1 1 LYS HD3 H -1.249 8.428 -8.248 1.00 . A A . 1 LYS HD3 1 1 7 4083 1 1 1 LYS HE2 H 1.129 8.962 -7.955 1.00 . A A . 1 LYS HE2 1 1 7 4084 1 1 1 LYS HE3 H 0.329 8.439 -6.477 1.00 . A A . 1 LYS HE3 1 1 7 4085 1 1 1 LYS HG2 H -2.254 6.419 -8.072 1.00 . A A . 1 LYS HG2 1 1 7 4086 1 1 1 LYS HG3 H -1.159 6.287 -6.700 1.00 . A A . 1 LYS HG3 1 1 7 4087 1 1 1 LYS HZ1 H 2.043 6.749 -8.161 1.00 . A A . 1 LYS HZ1 1 1 7 4088 1 1 1 LYS HZ2 H 2.503 7.482 -6.762 1.00 . A A . 1 LYS HZ2 1 1 7 4089 1 1 1 LYS HZ3 H 1.355 6.306 -6.726 1.00 . A A . 1 LYS HZ3 1 1 7 4090 1 1 1 LYS N N -2.816 3.896 -8.750 1.00 . A A . 1 LYS N 1 1 7 4091 1 1 1 LYS NZ N 1.724 7.079 -7.263 1.00 . A A . 1 LYS NZ 1 1 7 4092 1 1 1 LYS O O -2.481 3.808 -5.988 1.00 . A A . 1 LYS O 1 1 7 4093 1 1 2 SER C C 0.636 3.689 -4.174 1.00 . A A . 2 SER C 1 1 7 4094 1 1 2 SER CA C -0.216 2.569 -4.772 1.00 . A A . 2 SER CA 1 1 7 4095 1 1 2 SER CB C 0.466 1.205 -4.621 1.00 . A A . 2 SER CB 1 1 7 4096 1 1 2 SER H H 0.316 2.645 -6.820 1.00 . A A . 2 SER H 1 1 7 4097 1 1 2 SER HA H -1.176 2.525 -4.260 1.00 . A A . 2 SER HA 1 1 7 4098 1 1 2 SER HB2 H -0.166 0.431 -5.058 1.00 . A A . 2 SER HB2 1 1 7 4099 1 1 2 SER HB3 H 1.421 1.214 -5.142 1.00 . A A . 2 SER HB3 1 1 7 4100 1 1 2 SER HG H 1.030 0.015 -3.182 1.00 . A A . 2 SER HG 1 1 7 4101 1 1 2 SER N N -0.438 2.851 -6.183 1.00 . A A . 2 SER N 1 1 7 4102 1 1 2 SER O O 1.495 4.240 -4.866 1.00 . A A . 2 SER O 1 1 7 4103 1 1 2 SER OG O 0.683 0.908 -3.257 1.00 . A A . 2 SER OG 1 1 7 4104 1 1 3 CYS C C 1.196 4.719 -0.717 1.00 . A A . 3 CYS C 1 1 7 4105 1 1 3 CYS CA C 1.048 5.112 -2.186 1.00 . A A . 3 CYS CA 1 1 7 4106 1 1 3 CYS CB C 0.208 6.385 -2.331 1.00 . A A . 3 CYS CB 1 1 7 4107 1 1 3 CYS H H -0.342 3.522 -2.410 1.00 . A A . 3 CYS H 1 1 7 4108 1 1 3 CYS HA H 2.039 5.303 -2.602 1.00 . A A . 3 CYS HA 1 1 7 4109 1 1 3 CYS HB2 H -0.817 6.173 -2.021 1.00 . A A . 3 CYS HB2 1 1 7 4110 1 1 3 CYS HB3 H 0.613 7.159 -1.679 1.00 . A A . 3 CYS HB3 1 1 7 4111 1 1 3 CYS N N 0.388 4.025 -2.902 1.00 . A A . 3 CYS N 1 1 7 4112 1 1 3 CYS O O 0.196 4.618 -0.012 1.00 . A A . 3 CYS O 1 1 7 4113 1 1 3 CYS SG S 0.179 7.053 -4.011 1.00 . A A . 3 CYS SG 1 1 7 4114 1 1 4 CYS C C 3.400 5.118 1.914 1.00 . A A . 4 CYS C 1 1 7 4115 1 1 4 CYS CA C 2.768 4.009 1.069 1.00 . A A . 4 CYS CA 1 1 7 4116 1 1 4 CYS CB C 3.729 2.820 0.938 1.00 . A A . 4 CYS CB 1 1 7 4117 1 1 4 CYS H H 3.218 4.678 -0.882 1.00 . A A . 4 CYS H 1 1 7 4118 1 1 4 CYS HA H 1.862 3.672 1.564 1.00 . A A . 4 CYS HA 1 1 7 4119 1 1 4 CYS HB2 H 4.571 3.113 0.319 1.00 . A A . 4 CYS HB2 1 1 7 4120 1 1 4 CYS HB3 H 4.138 2.556 1.911 1.00 . A A . 4 CYS HB3 1 1 7 4121 1 1 4 CYS N N 2.436 4.495 -0.265 1.00 . A A . 4 CYS N 1 1 7 4122 1 1 4 CYS O O 3.924 6.090 1.368 1.00 . A A . 4 CYS O 1 1 7 4123 1 1 4 CYS SG S 3.004 1.315 0.246 1.00 . A A . 4 CYS SG 1 1 7 4124 1 1 5 PRO C C 5.520 5.964 3.981 1.00 . A A . 5 PRO C 1 1 7 4125 1 1 5 PRO CA C 4.000 5.924 4.162 1.00 . A A . 5 PRO CA 1 1 7 4126 1 1 5 PRO CB C 3.591 5.481 5.571 1.00 . A A . 5 PRO CB 1 1 7 4127 1 1 5 PRO CD C 2.681 3.942 4.006 1.00 . A A . 5 PRO CD 1 1 7 4128 1 1 5 PRO CG C 3.276 3.995 5.411 1.00 . A A . 5 PRO CG 1 1 7 4129 1 1 5 PRO HA H 3.606 6.926 3.997 1.00 . A A . 5 PRO HA 1 1 7 4130 1 1 5 PRO HB2 H 4.362 5.669 6.317 1.00 . A A . 5 PRO HB2 1 1 7 4131 1 1 5 PRO HB3 H 2.675 5.998 5.859 1.00 . A A . 5 PRO HB3 1 1 7 4132 1 1 5 PRO HD2 H 2.787 2.944 3.592 1.00 . A A . 5 PRO HD2 1 1 7 4133 1 1 5 PRO HD3 H 1.620 4.187 4.059 1.00 . A A . 5 PRO HD3 1 1 7 4134 1 1 5 PRO HG2 H 4.202 3.418 5.444 1.00 . A A . 5 PRO HG2 1 1 7 4135 1 1 5 PRO HG3 H 2.579 3.633 6.168 1.00 . A A . 5 PRO HG3 1 1 7 4136 1 1 5 PRO N N 3.372 4.980 3.251 1.00 . A A . 5 PRO N 1 1 7 4137 1 1 5 PRO O O 6.111 7.038 4.070 1.00 . A A . 5 PRO O 1 1 7 4138 1 1 6 ASN C C 8.047 3.340 3.149 1.00 . A A . 6 ASN C 1 1 7 4139 1 1 6 ASN CA C 7.611 4.695 3.717 1.00 . A A . 6 ASN CA 1 1 7 4140 1 1 6 ASN CB C 8.177 4.927 5.130 1.00 . A A . 6 ASN CB 1 1 7 4141 1 1 6 ASN CG C 7.556 3.973 6.147 1.00 . A A . 6 ASN CG 1 1 7 4142 1 1 6 ASN H H 5.622 3.956 3.650 1.00 . A A . 6 ASN H 1 1 7 4143 1 1 6 ASN HA H 8.014 5.465 3.058 1.00 . A A . 6 ASN HA 1 1 7 4144 1 1 6 ASN HB2 H 9.258 4.790 5.137 1.00 . A A . 6 ASN HB2 1 1 7 4145 1 1 6 ASN HB3 H 7.986 5.956 5.436 1.00 . A A . 6 ASN HB3 1 1 7 4146 1 1 6 ASN HD21 H 6.533 5.488 7.038 1.00 . A A . 6 ASN HD21 1 1 7 4147 1 1 6 ASN HD22 H 6.270 3.898 7.724 1.00 . A A . 6 ASN HD22 1 1 7 4148 1 1 6 ASN N N 6.158 4.808 3.749 1.00 . A A . 6 ASN N 1 1 7 4149 1 1 6 ASN ND2 N 6.722 4.496 7.046 1.00 . A A . 6 ASN ND2 1 1 7 4150 1 1 6 ASN O O 7.218 2.520 2.754 1.00 . A A . 6 ASN O 1 1 7 4151 1 1 6 ASN OD1 O 7.819 2.775 6.111 1.00 . A A . 6 ASN OD1 1 1 7 4152 1 1 7 THR C C 9.554 0.667 3.393 1.00 . A A . 7 THR C 1 1 7 4153 1 1 7 THR CA C 10.031 1.917 2.644 1.00 . A A . 7 THR CA 1 1 7 4154 1 1 7 THR CB C 11.554 2.091 2.772 1.00 . A A . 7 THR CB 1 1 7 4155 1 1 7 THR CG2 C 12.326 0.914 2.163 1.00 . A A . 7 THR CG2 1 1 7 4156 1 1 7 THR H H 9.970 3.862 3.455 1.00 . A A . 7 THR H 1 1 7 4157 1 1 7 THR HA H 9.793 1.802 1.585 1.00 . A A . 7 THR HA 1 1 7 4158 1 1 7 THR HB H 11.824 2.174 3.826 1.00 . A A . 7 THR HB 1 1 7 4159 1 1 7 THR HG1 H 11.654 4.033 2.609 1.00 . A A . 7 THR HG1 1 1 7 4160 1 1 7 THR HG21 H 12.051 0.789 1.116 1.00 . A A . 7 THR HG21 1 1 7 4161 1 1 7 THR HG22 H 13.396 1.111 2.227 1.00 . A A . 7 THR HG22 1 1 7 4162 1 1 7 THR HG23 H 12.113 -0.007 2.705 1.00 . A A . 7 THR HG23 1 1 7 4163 1 1 7 THR N N 9.369 3.124 3.121 1.00 . A A . 7 THR N 1 1 7 4164 1 1 7 THR O O 9.429 -0.393 2.784 1.00 . A A . 7 THR O 1 1 7 4165 1 1 7 THR OG1 O 11.960 3.273 2.109 1.00 . A A . 7 THR OG1 1 1 7 4166 1 1 8 THR C C 7.351 -0.662 5.111 1.00 . A A . 8 THR C 1 1 7 4167 1 1 8 THR CA C 8.801 -0.351 5.491 1.00 . A A . 8 THR CA 1 1 7 4168 1 1 8 THR CB C 8.958 -0.089 6.998 1.00 . A A . 8 THR CB 1 1 7 4169 1 1 8 THR CG2 C 8.751 -1.379 7.801 1.00 . A A . 8 THR CG2 1 1 7 4170 1 1 8 THR H H 9.341 1.680 5.148 1.00 . A A . 8 THR H 1 1 7 4171 1 1 8 THR HA H 9.425 -1.212 5.253 1.00 . A A . 8 THR HA 1 1 7 4172 1 1 8 THR HB H 8.226 0.643 7.333 1.00 . A A . 8 THR HB 1 1 7 4173 1 1 8 THR HG1 H 10.370 1.242 6.823 1.00 . A A . 8 THR HG1 1 1 7 4174 1 1 8 THR HG21 H 9.480 -2.131 7.495 1.00 . A A . 8 THR HG21 1 1 7 4175 1 1 8 THR HG22 H 8.881 -1.172 8.863 1.00 . A A . 8 THR HG22 1 1 7 4176 1 1 8 THR HG23 H 7.746 -1.769 7.641 1.00 . A A . 8 THR HG23 1 1 7 4177 1 1 8 THR N N 9.287 0.774 4.700 1.00 . A A . 8 THR N 1 1 7 4178 1 1 8 THR O O 6.981 -1.828 4.999 1.00 . A A . 8 THR O 1 1 7 4179 1 1 8 THR OG1 O 10.255 0.401 7.272 1.00 . A A . 8 THR OG1 1 1 7 4180 1 1 9 GLY C C 5.226 -0.560 3.020 1.00 . A A . 9 GLY C 1 1 7 4181 1 1 9 GLY CA C 5.199 0.229 4.329 1.00 . A A . 9 GLY CA 1 1 7 4182 1 1 9 GLY H H 6.899 1.315 5.000 1.00 . A A . 9 GLY H 1 1 7 4183 1 1 9 GLY HA2 H 4.568 -0.282 5.057 1.00 . A A . 9 GLY HA2 1 1 7 4184 1 1 9 GLY HA3 H 4.785 1.215 4.136 1.00 . A A . 9 GLY HA3 1 1 7 4185 1 1 9 GLY N N 6.540 0.376 4.872 1.00 . A A . 9 GLY N 1 1 7 4186 1 1 9 GLY O O 4.491 -1.534 2.873 1.00 . A A . 9 GLY O 1 1 7 4187 1 1 10 ARG C C 6.738 -2.342 1.142 1.00 . A A . 10 ARG C 1 1 7 4188 1 1 10 ARG CA C 6.333 -0.897 0.853 1.00 . A A . 10 ARG CA 1 1 7 4189 1 1 10 ARG CB C 7.388 -0.203 -0.024 1.00 . A A . 10 ARG CB 1 1 7 4190 1 1 10 ARG CD C 5.938 0.803 -1.858 1.00 . A A . 10 ARG CD 1 1 7 4191 1 1 10 ARG CG C 6.870 1.086 -0.673 1.00 . A A . 10 ARG CG 1 1 7 4192 1 1 10 ARG CZ C 4.441 2.118 -3.360 1.00 . A A . 10 ARG CZ 1 1 7 4193 1 1 10 ARG H H 6.670 0.659 2.272 1.00 . A A . 10 ARG H 1 1 7 4194 1 1 10 ARG HA H 5.391 -0.936 0.312 1.00 . A A . 10 ARG HA 1 1 7 4195 1 1 10 ARG HB2 H 8.256 0.039 0.586 1.00 . A A . 10 ARG HB2 1 1 7 4196 1 1 10 ARG HB3 H 7.708 -0.882 -0.815 1.00 . A A . 10 ARG HB3 1 1 7 4197 1 1 10 ARG HD2 H 6.522 0.362 -2.667 1.00 . A A . 10 ARG HD2 1 1 7 4198 1 1 10 ARG HD3 H 5.153 0.104 -1.573 1.00 . A A . 10 ARG HD3 1 1 7 4199 1 1 10 ARG HE H 5.484 2.888 -1.811 1.00 . A A . 10 ARG HE 1 1 7 4200 1 1 10 ARG HG2 H 6.363 1.688 0.079 1.00 . A A . 10 ARG HG2 1 1 7 4201 1 1 10 ARG HG3 H 7.725 1.649 -1.048 1.00 . A A . 10 ARG HG3 1 1 7 4202 1 1 10 ARG HH11 H 4.506 0.133 -3.832 1.00 . A A . 10 ARG HH11 1 1 7 4203 1 1 10 ARG HH12 H 3.496 1.112 -4.866 1.00 . A A . 10 ARG HH12 1 1 7 4204 1 1 10 ARG HH21 H 4.170 4.118 -3.122 1.00 . A A . 10 ARG HH21 1 1 7 4205 1 1 10 ARG HH22 H 3.233 3.408 -4.417 1.00 . A A . 10 ARG HH22 1 1 7 4206 1 1 10 ARG N N 6.105 -0.161 2.090 1.00 . A A . 10 ARG N 1 1 7 4207 1 1 10 ARG NE N 5.300 2.036 -2.330 1.00 . A A . 10 ARG NE 1 1 7 4208 1 1 10 ARG NH1 N 4.115 1.032 -4.074 1.00 . A A . 10 ARG NH1 1 1 7 4209 1 1 10 ARG NH2 N 3.909 3.306 -3.672 1.00 . A A . 10 ARG NH2 1 1 7 4210 1 1 10 ARG O O 6.174 -3.249 0.543 1.00 . A A . 10 ARG O 1 1 7 4211 1 1 11 ASN C C 6.978 -4.811 2.823 1.00 . A A . 11 ASN C 1 1 7 4212 1 1 11 ASN CA C 8.145 -3.917 2.391 1.00 . A A . 11 ASN CA 1 1 7 4213 1 1 11 ASN CB C 9.239 -3.845 3.465 1.00 . A A . 11 ASN CB 1 1 7 4214 1 1 11 ASN CG C 9.658 -5.226 3.958 1.00 . A A . 11 ASN CG 1 1 7 4215 1 1 11 ASN H H 8.122 -1.789 2.522 1.00 . A A . 11 ASN H 1 1 7 4216 1 1 11 ASN HA H 8.585 -4.362 1.495 1.00 . A A . 11 ASN HA 1 1 7 4217 1 1 11 ASN HB2 H 10.114 -3.342 3.053 1.00 . A A . 11 ASN HB2 1 1 7 4218 1 1 11 ASN HB3 H 8.886 -3.269 4.316 1.00 . A A . 11 ASN HB3 1 1 7 4219 1 1 11 ASN HD21 H 8.433 -5.072 5.581 1.00 . A A . 11 ASN HD21 1 1 7 4220 1 1 11 ASN HD22 H 9.368 -6.545 5.475 1.00 . A A . 11 ASN HD22 1 1 7 4221 1 1 11 ASN N N 7.689 -2.574 2.052 1.00 . A A . 11 ASN N 1 1 7 4222 1 1 11 ASN ND2 N 9.104 -5.649 5.096 1.00 . A A . 11 ASN ND2 1 1 7 4223 1 1 11 ASN O O 6.836 -5.914 2.299 1.00 . A A . 11 ASN O 1 1 7 4224 1 1 11 ASN OD1 O 10.476 -5.894 3.331 1.00 . A A . 11 ASN OD1 1 1 7 4225 1 1 12 ILE C C 4.011 -5.382 3.103 1.00 . A A . 12 ILE C 1 1 7 4226 1 1 12 ILE CA C 4.989 -5.100 4.248 1.00 . A A . 12 ILE CA 1 1 7 4227 1 1 12 ILE CB C 4.318 -4.346 5.414 1.00 . A A . 12 ILE CB 1 1 7 4228 1 1 12 ILE CD1 C 4.869 -3.145 7.602 1.00 . A A . 12 ILE CD1 1 1 7 4229 1 1 12 ILE CG1 C 5.291 -4.228 6.604 1.00 . A A . 12 ILE CG1 1 1 7 4230 1 1 12 ILE CG2 C 3.041 -5.079 5.864 1.00 . A A . 12 ILE CG2 1 1 7 4231 1 1 12 ILE H H 6.278 -3.411 4.124 1.00 . A A . 12 ILE H 1 1 7 4232 1 1 12 ILE HA H 5.348 -6.057 4.628 1.00 . A A . 12 ILE HA 1 1 7 4233 1 1 12 ILE HB H 4.057 -3.343 5.074 1.00 . A A . 12 ILE HB 1 1 7 4234 1 1 12 ILE HD11 H 3.921 -3.393 8.077 1.00 . A A . 12 ILE HD11 1 1 7 4235 1 1 12 ILE HD12 H 5.631 -3.059 8.376 1.00 . A A . 12 ILE HD12 1 1 7 4236 1 1 12 ILE HD13 H 4.778 -2.184 7.094 1.00 . A A . 12 ILE HD13 1 1 7 4237 1 1 12 ILE HG12 H 5.358 -5.188 7.114 1.00 . A A . 12 ILE HG12 1 1 7 4238 1 1 12 ILE HG13 H 6.288 -3.967 6.257 1.00 . A A . 12 ILE HG13 1 1 7 4239 1 1 12 ILE HG21 H 3.282 -6.108 6.129 1.00 . A A . 12 ILE HG21 1 1 7 4240 1 1 12 ILE HG22 H 2.601 -4.587 6.729 1.00 . A A . 12 ILE HG22 1 1 7 4241 1 1 12 ILE HG23 H 2.294 -5.085 5.072 1.00 . A A . 12 ILE HG23 1 1 7 4242 1 1 12 ILE N N 6.134 -4.340 3.751 1.00 . A A . 12 ILE N 1 1 7 4243 1 1 12 ILE O O 3.580 -6.521 2.927 1.00 . A A . 12 ILE O 1 1 7 4244 1 1 13 TYR C C 3.226 -5.484 0.186 1.00 . A A . 13 TYR C 1 1 7 4245 1 1 13 TYR CA C 2.766 -4.425 1.192 1.00 . A A . 13 TYR CA 1 1 7 4246 1 1 13 TYR CB C 2.662 -3.039 0.544 1.00 . A A . 13 TYR CB 1 1 7 4247 1 1 13 TYR CD1 C 0.544 -3.347 -0.802 1.00 . A A . 13 TYR CD1 1 1 7 4248 1 1 13 TYR CD2 C 2.567 -2.658 -1.966 1.00 . A A . 13 TYR CD2 1 1 7 4249 1 1 13 TYR CE1 C -0.152 -3.361 -2.021 1.00 . A A . 13 TYR CE1 1 1 7 4250 1 1 13 TYR CE2 C 1.869 -2.666 -3.185 1.00 . A A . 13 TYR CE2 1 1 7 4251 1 1 13 TYR CG C 1.905 -3.003 -0.770 1.00 . A A . 13 TYR CG 1 1 7 4252 1 1 13 TYR CZ C 0.508 -3.026 -3.214 1.00 . A A . 13 TYR CZ 1 1 7 4253 1 1 13 TYR H H 4.082 -3.441 2.528 1.00 . A A . 13 TYR H 1 1 7 4254 1 1 13 TYR HA H 1.783 -4.713 1.567 1.00 . A A . 13 TYR HA 1 1 7 4255 1 1 13 TYR HB2 H 2.169 -2.365 1.245 1.00 . A A . 13 TYR HB2 1 1 7 4256 1 1 13 TYR HB3 H 3.668 -2.656 0.376 1.00 . A A . 13 TYR HB3 1 1 7 4257 1 1 13 TYR HD1 H 0.037 -3.609 0.113 1.00 . A A . 13 TYR HD1 1 1 7 4258 1 1 13 TYR HD2 H 3.611 -2.389 -1.953 1.00 . A A . 13 TYR HD2 1 1 7 4259 1 1 13 TYR HE1 H -1.198 -3.629 -2.040 1.00 . A A . 13 TYR HE1 1 1 7 4260 1 1 13 TYR HE2 H 2.382 -2.401 -4.097 1.00 . A A . 13 TYR HE2 1 1 7 4261 1 1 13 TYR HH H 0.372 -2.833 -5.158 1.00 . A A . 13 TYR HH 1 1 7 4262 1 1 13 TYR N N 3.675 -4.345 2.326 1.00 . A A . 13 TYR N 1 1 7 4263 1 1 13 TYR O O 2.455 -6.373 -0.172 1.00 . A A . 13 TYR O 1 1 7 4264 1 1 13 TYR OH O -0.171 -3.052 -4.398 1.00 . A A . 13 TYR OH 1 1 7 4265 1 1 14 ASN C C 5.133 -7.719 -0.673 1.00 . A A . 14 ASN C 1 1 7 4266 1 1 14 ASN CA C 5.083 -6.294 -1.224 1.00 . A A . 14 ASN CA 1 1 7 4267 1 1 14 ASN CB C 6.482 -5.801 -1.619 1.00 . A A . 14 ASN CB 1 1 7 4268 1 1 14 ASN CG C 6.422 -4.720 -2.697 1.00 . A A . 14 ASN CG 1 1 7 4269 1 1 14 ASN H H 5.055 -4.642 0.101 1.00 . A A . 14 ASN H 1 1 7 4270 1 1 14 ASN HA H 4.464 -6.308 -2.122 1.00 . A A . 14 ASN HA 1 1 7 4271 1 1 14 ASN HB2 H 7.024 -5.443 -0.742 1.00 . A A . 14 ASN HB2 1 1 7 4272 1 1 14 ASN HB3 H 7.046 -6.633 -2.035 1.00 . A A . 14 ASN HB3 1 1 7 4273 1 1 14 ASN HD21 H 6.195 -3.247 -1.314 1.00 . A A . 14 ASN HD21 1 1 7 4274 1 1 14 ASN HD22 H 6.246 -2.721 -2.986 1.00 . A A . 14 ASN HD22 1 1 7 4275 1 1 14 ASN N N 4.480 -5.386 -0.262 1.00 . A A . 14 ASN N 1 1 7 4276 1 1 14 ASN ND2 N 6.269 -3.458 -2.298 1.00 . A A . 14 ASN ND2 1 1 7 4277 1 1 14 ASN O O 4.745 -8.650 -1.372 1.00 . A A . 14 ASN O 1 1 7 4278 1 1 14 ASN OD1 O 6.517 -5.021 -3.884 1.00 . A A . 14 ASN OD1 1 1 7 4279 1 1 15 THR C C 4.291 -9.877 1.221 1.00 . A A . 15 THR C 1 1 7 4280 1 1 15 THR CA C 5.668 -9.208 1.207 1.00 . A A . 15 THR CA 1 1 7 4281 1 1 15 THR CB C 6.265 -9.081 2.618 1.00 . A A . 15 THR CB 1 1 7 4282 1 1 15 THR CG2 C 6.311 -10.426 3.350 1.00 . A A . 15 THR CG2 1 1 7 4283 1 1 15 THR H H 5.867 -7.089 1.116 1.00 . A A . 15 THR H 1 1 7 4284 1 1 15 THR HA H 6.337 -9.831 0.612 1.00 . A A . 15 THR HA 1 1 7 4285 1 1 15 THR HB H 5.671 -8.383 3.210 1.00 . A A . 15 THR HB 1 1 7 4286 1 1 15 THR HG1 H 7.552 -7.692 2.167 1.00 . A A . 15 THR HG1 1 1 7 4287 1 1 15 THR HG21 H 6.869 -11.153 2.759 1.00 . A A . 15 THR HG21 1 1 7 4288 1 1 15 THR HG22 H 6.803 -10.299 4.313 1.00 . A A . 15 THR HG22 1 1 7 4289 1 1 15 THR HG23 H 5.304 -10.803 3.526 1.00 . A A . 15 THR HG23 1 1 7 4290 1 1 15 THR N N 5.589 -7.896 0.574 1.00 . A A . 15 THR N 1 1 7 4291 1 1 15 THR O O 4.168 -11.040 0.844 1.00 . A A . 15 THR O 1 1 7 4292 1 1 15 THR OG1 O 7.584 -8.586 2.521 1.00 . A A . 15 THR OG1 1 1 7 4293 1 1 16 CYS C C 1.373 -9.956 0.261 1.00 . A A . 16 CYS C 1 1 7 4294 1 1 16 CYS CA C 1.883 -9.604 1.663 1.00 . A A . 16 CYS CA 1 1 7 4295 1 1 16 CYS CB C 1.023 -8.542 2.353 1.00 . A A . 16 CYS CB 1 1 7 4296 1 1 16 CYS H H 3.433 -8.177 1.917 1.00 . A A . 16 CYS H 1 1 7 4297 1 1 16 CYS HA H 1.848 -10.509 2.271 1.00 . A A . 16 CYS HA 1 1 7 4298 1 1 16 CYS HB2 H 1.343 -8.482 3.393 1.00 . A A . 16 CYS HB2 1 1 7 4299 1 1 16 CYS HB3 H 1.209 -7.572 1.893 1.00 . A A . 16 CYS HB3 1 1 7 4300 1 1 16 CYS N N 3.259 -9.132 1.630 1.00 . A A . 16 CYS N 1 1 7 4301 1 1 16 CYS O O 0.710 -10.977 0.086 1.00 . A A . 16 CYS O 1 1 7 4302 1 1 16 CYS SG S -0.765 -8.820 2.341 1.00 . A A . 16 CYS SG 1 1 7 4303 1 1 17 ARG C C 1.941 -10.680 -2.629 1.00 . A A . 17 ARG C 1 1 7 4304 1 1 17 ARG CA C 1.323 -9.372 -2.127 1.00 . A A . 17 ARG CA 1 1 7 4305 1 1 17 ARG CB C 1.744 -8.183 -3.004 1.00 . A A . 17 ARG CB 1 1 7 4306 1 1 17 ARG CD C -0.231 -6.888 -3.920 1.00 . A A . 17 ARG CD 1 1 7 4307 1 1 17 ARG CG C 0.833 -6.960 -2.819 1.00 . A A . 17 ARG CG 1 1 7 4308 1 1 17 ARG CZ C -1.697 -8.665 -4.921 1.00 . A A . 17 ARG CZ 1 1 7 4309 1 1 17 ARG H H 2.211 -8.284 -0.529 1.00 . A A . 17 ARG H 1 1 7 4310 1 1 17 ARG HA H 0.242 -9.486 -2.180 1.00 . A A . 17 ARG HA 1 1 7 4311 1 1 17 ARG HB2 H 2.763 -7.902 -2.752 1.00 . A A . 17 ARG HB2 1 1 7 4312 1 1 17 ARG HB3 H 1.735 -8.483 -4.052 1.00 . A A . 17 ARG HB3 1 1 7 4313 1 1 17 ARG HD2 H -0.794 -5.966 -3.791 1.00 . A A . 17 ARG HD2 1 1 7 4314 1 1 17 ARG HD3 H 0.288 -6.838 -4.878 1.00 . A A . 17 ARG HD3 1 1 7 4315 1 1 17 ARG HE H -1.361 -8.404 -2.946 1.00 . A A . 17 ARG HE 1 1 7 4316 1 1 17 ARG HG2 H 0.358 -6.973 -1.838 1.00 . A A . 17 ARG HG2 1 1 7 4317 1 1 17 ARG HG3 H 1.443 -6.059 -2.890 1.00 . A A . 17 ARG HG3 1 1 7 4318 1 1 17 ARG HH11 H -0.997 -7.366 -6.339 1.00 . A A . 17 ARG HH11 1 1 7 4319 1 1 17 ARG HH12 H -1.945 -8.695 -6.952 1.00 . A A . 17 ARG HH12 1 1 7 4320 1 1 17 ARG HH21 H -2.529 -10.137 -3.784 1.00 . A A . 17 ARG HH21 1 1 7 4321 1 1 17 ARG HH22 H -2.822 -10.278 -5.501 1.00 . A A . 17 ARG HH22 1 1 7 4322 1 1 17 ARG N N 1.685 -9.123 -0.738 1.00 . A A . 17 ARG N 1 1 7 4323 1 1 17 ARG NE N -1.153 -8.034 -3.866 1.00 . A A . 17 ARG NE 1 1 7 4324 1 1 17 ARG NH1 N -1.534 -8.204 -6.171 1.00 . A A . 17 ARG NH1 1 1 7 4325 1 1 17 ARG NH2 N -2.419 -9.776 -4.724 1.00 . A A . 17 ARG NH2 1 1 7 4326 1 1 17 ARG O O 1.240 -11.483 -3.242 1.00 . A A . 17 ARG O 1 1 7 4327 1 1 18 PHE C C 3.304 -13.337 -1.957 1.00 . A A . 18 PHE C 1 1 7 4328 1 1 18 PHE CA C 3.915 -12.147 -2.697 1.00 . A A . 18 PHE CA 1 1 7 4329 1 1 18 PHE CB C 5.423 -12.042 -2.419 1.00 . A A . 18 PHE CB 1 1 7 4330 1 1 18 PHE CD1 C 6.421 -12.171 -4.738 1.00 . A A . 18 PHE CD1 1 1 7 4331 1 1 18 PHE CD2 C 6.838 -10.173 -3.413 1.00 . A A . 18 PHE CD2 1 1 7 4332 1 1 18 PHE CE1 C 7.182 -11.632 -5.791 1.00 . A A . 18 PHE CE1 1 1 7 4333 1 1 18 PHE CE2 C 7.587 -9.628 -4.472 1.00 . A A . 18 PHE CE2 1 1 7 4334 1 1 18 PHE CG C 6.228 -11.434 -3.554 1.00 . A A . 18 PHE CG 1 1 7 4335 1 1 18 PHE CZ C 7.764 -10.361 -5.658 1.00 . A A . 18 PHE CZ 1 1 7 4336 1 1 18 PHE H H 3.749 -10.210 -1.830 1.00 . A A . 18 PHE H 1 1 7 4337 1 1 18 PHE HA H 3.775 -12.328 -3.765 1.00 . A A . 18 PHE HA 1 1 7 4338 1 1 18 PHE HB2 H 5.590 -11.489 -1.494 1.00 . A A . 18 PHE HB2 1 1 7 4339 1 1 18 PHE HB3 H 5.815 -13.049 -2.269 1.00 . A A . 18 PHE HB3 1 1 7 4340 1 1 18 PHE HD1 H 5.991 -13.157 -4.842 1.00 . A A . 18 PHE HD1 1 1 7 4341 1 1 18 PHE HD2 H 6.757 -9.624 -2.489 1.00 . A A . 18 PHE HD2 1 1 7 4342 1 1 18 PHE HE1 H 7.325 -12.200 -6.700 1.00 . A A . 18 PHE HE1 1 1 7 4343 1 1 18 PHE HE2 H 8.037 -8.652 -4.367 1.00 . A A . 18 PHE HE2 1 1 7 4344 1 1 18 PHE HZ H 8.357 -9.951 -6.464 1.00 . A A . 18 PHE HZ 1 1 7 4345 1 1 18 PHE N N 3.232 -10.907 -2.351 1.00 . A A . 18 PHE N 1 1 7 4346 1 1 18 PHE O O 3.128 -14.397 -2.556 1.00 . A A . 18 PHE O 1 1 7 4347 1 1 19 ALA C C 1.024 -14.654 -0.507 1.00 . A A . 19 ALA C 1 1 7 4348 1 1 19 ALA CA C 2.341 -14.206 0.132 1.00 . A A . 19 ALA CA 1 1 7 4349 1 1 19 ALA CB C 2.134 -13.716 1.569 1.00 . A A . 19 ALA CB 1 1 7 4350 1 1 19 ALA H H 3.147 -12.274 -0.228 1.00 . A A . 19 ALA H 1 1 7 4351 1 1 19 ALA HA H 3.017 -15.062 0.173 1.00 . A A . 19 ALA HA 1 1 7 4352 1 1 19 ALA HB1 H 3.085 -13.394 1.992 1.00 . A A . 19 ALA HB1 1 1 7 4353 1 1 19 ALA HB2 H 1.432 -12.886 1.594 1.00 . A A . 19 ALA HB2 1 1 7 4354 1 1 19 ALA HB3 H 1.736 -14.530 2.177 1.00 . A A . 19 ALA HB3 1 1 7 4355 1 1 19 ALA N N 2.975 -13.168 -0.668 1.00 . A A . 19 ALA N 1 1 7 4356 1 1 19 ALA O O 0.774 -15.853 -0.610 1.00 . A A . 19 ALA O 1 1 7 4357 1 1 20 GLY C C -2.067 -12.902 -1.598 1.00 . A A . 20 GLY C 1 1 7 4358 1 1 20 GLY CA C -0.991 -13.979 -1.743 1.00 . A A . 20 GLY CA 1 1 7 4359 1 1 20 GLY H H 0.473 -12.727 -0.841 1.00 . A A . 20 GLY H 1 1 7 4360 1 1 20 GLY HA2 H -0.713 -14.065 -2.794 1.00 . A A . 20 GLY HA2 1 1 7 4361 1 1 20 GLY HA3 H -1.432 -14.923 -1.421 1.00 . A A . 20 GLY HA3 1 1 7 4362 1 1 20 GLY N N 0.208 -13.696 -0.968 1.00 . A A . 20 GLY N 1 1 7 4363 1 1 20 GLY O O -2.914 -12.774 -2.480 1.00 . A A . 20 GLY O 1 1 7 4364 1 1 21 GLY C C -3.412 -10.191 -1.183 1.00 . A A . 21 GLY C 1 1 7 4365 1 1 21 GLY CA C -3.145 -11.255 -0.117 1.00 . A A . 21 GLY CA 1 1 7 4366 1 1 21 GLY H H -1.309 -12.277 0.179 1.00 . A A . 21 GLY H 1 1 7 4367 1 1 21 GLY HA2 H -4.046 -11.850 0.040 1.00 . A A . 21 GLY HA2 1 1 7 4368 1 1 21 GLY HA3 H -2.891 -10.764 0.823 1.00 . A A . 21 GLY HA3 1 1 7 4369 1 1 21 GLY N N -2.063 -12.159 -0.483 1.00 . A A . 21 GLY N 1 1 7 4370 1 1 21 GLY O O -2.499 -9.768 -1.893 1.00 . A A . 21 GLY O 1 1 7 4371 1 1 22 SER C C -4.499 -7.436 -2.092 1.00 . A A . 22 SER C 1 1 7 4372 1 1 22 SER CA C -5.143 -8.809 -2.290 1.00 . A A . 22 SER CA 1 1 7 4373 1 1 22 SER CB C -6.667 -8.700 -2.209 1.00 . A A . 22 SER CB 1 1 7 4374 1 1 22 SER H H -5.381 -10.178 -0.699 1.00 . A A . 22 SER H 1 1 7 4375 1 1 22 SER HA H -4.880 -9.182 -3.281 1.00 . A A . 22 SER HA 1 1 7 4376 1 1 22 SER HB2 H -6.953 -8.179 -1.295 1.00 . A A . 22 SER HB2 1 1 7 4377 1 1 22 SER HB3 H -7.045 -8.140 -3.065 1.00 . A A . 22 SER HB3 1 1 7 4378 1 1 22 SER HG H -6.971 -10.458 -2.989 1.00 . A A . 22 SER HG 1 1 7 4379 1 1 22 SER N N -4.678 -9.769 -1.297 1.00 . A A . 22 SER N 1 1 7 4380 1 1 22 SER O O -4.017 -7.124 -1.006 1.00 . A A . 22 SER O 1 1 7 4381 1 1 22 SER OG O -7.250 -9.987 -2.200 1.00 . A A . 22 SER OG 1 1 7 4382 1 1 23 ARG C C -4.432 -4.437 -2.001 1.00 . A A . 23 ARG C 1 1 7 4383 1 1 23 ARG CA C -3.902 -5.290 -3.150 1.00 . A A . 23 ARG CA 1 1 7 4384 1 1 23 ARG CB C -4.156 -4.596 -4.494 1.00 . A A . 23 ARG CB 1 1 7 4385 1 1 23 ARG CD C -3.768 -4.670 -6.989 1.00 . A A . 23 ARG CD 1 1 7 4386 1 1 23 ARG CG C -3.436 -5.313 -5.643 1.00 . A A . 23 ARG CG 1 1 7 4387 1 1 23 ARG CZ C -5.751 -4.407 -8.473 1.00 . A A . 23 ARG CZ 1 1 7 4388 1 1 23 ARG H H -4.933 -6.936 -4.007 1.00 . A A . 23 ARG H 1 1 7 4389 1 1 23 ARG HA H -2.829 -5.405 -3.011 1.00 . A A . 23 ARG HA 1 1 7 4390 1 1 23 ARG HB2 H -5.228 -4.560 -4.688 1.00 . A A . 23 ARG HB2 1 1 7 4391 1 1 23 ARG HB3 H -3.780 -3.573 -4.431 1.00 . A A . 23 ARG HB3 1 1 7 4392 1 1 23 ARG HD2 H -3.571 -3.599 -6.926 1.00 . A A . 23 ARG HD2 1 1 7 4393 1 1 23 ARG HD3 H -3.119 -5.108 -7.750 1.00 . A A . 23 ARG HD3 1 1 7 4394 1 1 23 ARG HE H -5.715 -5.489 -6.754 1.00 . A A . 23 ARG HE 1 1 7 4395 1 1 23 ARG HG2 H -2.361 -5.236 -5.484 1.00 . A A . 23 ARG HG2 1 1 7 4396 1 1 23 ARG HG3 H -3.714 -6.367 -5.675 1.00 . A A . 23 ARG HG3 1 1 7 4397 1 1 23 ARG HH11 H -4.103 -3.383 -9.113 1.00 . A A . 23 ARG HH11 1 1 7 4398 1 1 23 ARG HH12 H -5.508 -3.242 -10.138 1.00 . A A . 23 ARG HH12 1 1 7 4399 1 1 23 ARG HH21 H -7.549 -5.308 -8.119 1.00 . A A . 23 ARG HH21 1 1 7 4400 1 1 23 ARG HH22 H -7.472 -4.342 -9.570 1.00 . A A . 23 ARG HH22 1 1 7 4401 1 1 23 ARG N N -4.508 -6.616 -3.149 1.00 . A A . 23 ARG N 1 1 7 4402 1 1 23 ARG NE N -5.167 -4.905 -7.370 1.00 . A A . 23 ARG NE 1 1 7 4403 1 1 23 ARG NH1 N -5.065 -3.614 -9.310 1.00 . A A . 23 ARG NH1 1 1 7 4404 1 1 23 ARG NH2 N -7.028 -4.708 -8.740 1.00 . A A . 23 ARG NH2 1 1 7 4405 1 1 23 ARG O O -3.650 -3.963 -1.184 1.00 . A A . 23 ARG O 1 1 7 4406 1 1 24 GLU C C -6.091 -3.973 0.476 1.00 . A A . 24 GLU C 1 1 7 4407 1 1 24 GLU CA C -6.407 -3.440 -0.926 1.00 . A A . 24 GLU CA 1 1 7 4408 1 1 24 GLU CB C -7.917 -3.415 -1.209 1.00 . A A . 24 GLU CB 1 1 7 4409 1 1 24 GLU CD C -8.536 -2.073 0.874 1.00 . A A . 24 GLU CD 1 1 7 4410 1 1 24 GLU CG C -8.607 -2.167 -0.649 1.00 . A A . 24 GLU CG 1 1 7 4411 1 1 24 GLU H H -6.341 -4.664 -2.650 1.00 . A A . 24 GLU H 1 1 7 4412 1 1 24 GLU HA H -6.022 -2.424 -1.014 1.00 . A A . 24 GLU HA 1 1 7 4413 1 1 24 GLU HB2 H -8.070 -3.396 -2.289 1.00 . A A . 24 GLU HB2 1 1 7 4414 1 1 24 GLU HB3 H -8.393 -4.315 -0.817 1.00 . A A . 24 GLU HB3 1 1 7 4415 1 1 24 GLU HE2 H -7.744 -1.069 2.334 1.00 . A A . 24 GLU HE2 1 1 7 4416 1 1 24 GLU HG2 H -8.158 -1.279 -1.094 1.00 . A A . 24 GLU HG2 1 1 7 4417 1 1 24 GLU HG3 H -9.652 -2.206 -0.951 1.00 . A A . 24 GLU HG3 1 1 7 4418 1 1 24 GLU N N -5.755 -4.250 -1.941 1.00 . A A . 24 GLU N 1 1 7 4419 1 1 24 GLU O O -5.748 -3.200 1.364 1.00 . A A . 24 GLU O 1 1 7 4420 1 1 24 GLU OE1 O -9.126 -2.907 1.558 1.00 . A A . 24 GLU OE1 1 1 7 4421 1 1 24 GLU OE2 O -7.793 -1.047 1.377 1.00 . A A . 24 GLU OE2 1 1 7 4422 1 1 25 ARG C C -4.547 -5.689 2.447 1.00 . A A . 25 ARG C 1 1 7 4423 1 1 25 ARG CA C -5.966 -5.963 1.940 1.00 . A A . 25 ARG CA 1 1 7 4424 1 1 25 ARG CB C -6.231 -7.465 1.747 1.00 . A A . 25 ARG CB 1 1 7 4425 1 1 25 ARG CD C -5.388 -8.417 3.994 1.00 . A A . 25 ARG CD 1 1 7 4426 1 1 25 ARG CG C -6.564 -8.241 3.027 1.00 . A A . 25 ARG CG 1 1 7 4427 1 1 25 ARG CZ C -4.923 -9.824 6.011 1.00 . A A . 25 ARG CZ 1 1 7 4428 1 1 25 ARG H H -6.465 -5.861 -0.123 1.00 . A A . 25 ARG H 1 1 7 4429 1 1 25 ARG HA H -6.685 -5.566 2.658 1.00 . A A . 25 ARG HA 1 1 7 4430 1 1 25 ARG HB2 H -7.106 -7.562 1.106 1.00 . A A . 25 ARG HB2 1 1 7 4431 1 1 25 ARG HB3 H -5.394 -7.942 1.236 1.00 . A A . 25 ARG HB3 1 1 7 4432 1 1 25 ARG HD2 H -4.510 -8.752 3.442 1.00 . A A . 25 ARG HD2 1 1 7 4433 1 1 25 ARG HD3 H -5.173 -7.469 4.485 1.00 . A A . 25 ARG HD3 1 1 7 4434 1 1 25 ARG HE H -6.655 -9.810 4.955 1.00 . A A . 25 ARG HE 1 1 7 4435 1 1 25 ARG HG2 H -7.394 -7.756 3.543 1.00 . A A . 25 ARG HG2 1 1 7 4436 1 1 25 ARG HG3 H -6.892 -9.234 2.715 1.00 . A A . 25 ARG HG3 1 1 7 4437 1 1 25 ARG HH11 H -3.346 -8.638 5.491 1.00 . A A . 25 ARG HH11 1 1 7 4438 1 1 25 ARG HH12 H -3.082 -9.653 6.887 1.00 . A A . 25 ARG HH12 1 1 7 4439 1 1 25 ARG HH21 H -6.305 -11.112 6.789 1.00 . A A . 25 ARG HH21 1 1 7 4440 1 1 25 ARG HH22 H -4.780 -11.064 7.635 1.00 . A A . 25 ARG HH22 1 1 7 4441 1 1 25 ARG N N -6.194 -5.292 0.665 1.00 . A A . 25 ARG N 1 1 7 4442 1 1 25 ARG NE N -5.729 -9.411 5.018 1.00 . A A . 25 ARG NE 1 1 7 4443 1 1 25 ARG NH1 N -3.683 -9.333 6.141 1.00 . A A . 25 ARG NH1 1 1 7 4444 1 1 25 ARG NH2 N -5.369 -10.741 6.881 1.00 . A A . 25 ARG NH2 1 1 7 4445 1 1 25 ARG O O -4.362 -5.213 3.565 1.00 . A A . 25 ARG O 1 1 7 4446 1 1 26 CYS C C -1.855 -4.272 2.151 1.00 . A A . 26 CYS C 1 1 7 4447 1 1 26 CYS CA C -2.143 -5.750 1.908 1.00 . A A . 26 CYS CA 1 1 7 4448 1 1 26 CYS CB C -1.289 -6.279 0.754 1.00 . A A . 26 CYS CB 1 1 7 4449 1 1 26 CYS H H -3.779 -6.355 0.699 1.00 . A A . 26 CYS H 1 1 7 4450 1 1 26 CYS HA H -1.889 -6.290 2.820 1.00 . A A . 26 CYS HA 1 1 7 4451 1 1 26 CYS HB2 H -1.605 -5.807 -0.177 1.00 . A A . 26 CYS HB2 1 1 7 4452 1 1 26 CYS HB3 H -0.252 -6.002 0.935 1.00 . A A . 26 CYS HB3 1 1 7 4453 1 1 26 CYS N N -3.548 -5.977 1.608 1.00 . A A . 26 CYS N 1 1 7 4454 1 1 26 CYS O O -1.102 -3.932 3.061 1.00 . A A . 26 CYS O 1 1 7 4455 1 1 26 CYS SG S -1.345 -8.075 0.535 1.00 . A A . 26 CYS SG 1 1 7 4456 1 1 27 ALA C C -2.849 -1.526 2.868 1.00 . A A . 27 ALA C 1 1 7 4457 1 1 27 ALA CA C -2.337 -1.955 1.495 1.00 . A A . 27 ALA CA 1 1 7 4458 1 1 27 ALA CB C -3.085 -1.251 0.366 1.00 . A A . 27 ALA CB 1 1 7 4459 1 1 27 ALA H H -3.074 -3.737 0.617 1.00 . A A . 27 ALA H 1 1 7 4460 1 1 27 ALA HA H -1.284 -1.689 1.409 1.00 . A A . 27 ALA HA 1 1 7 4461 1 1 27 ALA HB1 H -4.150 -1.470 0.413 1.00 . A A . 27 ALA HB1 1 1 7 4462 1 1 27 ALA HB2 H -2.943 -0.174 0.439 1.00 . A A . 27 ALA HB2 1 1 7 4463 1 1 27 ALA HB3 H -2.687 -1.592 -0.588 1.00 . A A . 27 ALA HB3 1 1 7 4464 1 1 27 ALA N N -2.459 -3.394 1.344 1.00 . A A . 27 ALA N 1 1 7 4465 1 1 27 ALA O O -2.212 -0.718 3.531 1.00 . A A . 27 ALA O 1 1 7 4466 1 1 28 LYS C C -3.520 -2.284 5.724 1.00 . A A . 28 LYS C 1 1 7 4467 1 1 28 LYS CA C -4.519 -1.854 4.643 1.00 . A A . 28 LYS CA 1 1 7 4468 1 1 28 LYS CB C -5.848 -2.609 4.767 1.00 . A A . 28 LYS CB 1 1 7 4469 1 1 28 LYS CD C -6.533 -1.746 7.053 1.00 . A A . 28 LYS CD 1 1 7 4470 1 1 28 LYS CE C -7.690 -1.162 7.867 1.00 . A A . 28 LYS CE 1 1 7 4471 1 1 28 LYS CG C -6.904 -1.851 5.571 1.00 . A A . 28 LYS CG 1 1 7 4472 1 1 28 LYS H H -4.469 -2.751 2.733 1.00 . A A . 28 LYS H 1 1 7 4473 1 1 28 LYS HA H -4.706 -0.782 4.726 1.00 . A A . 28 LYS HA 1 1 7 4474 1 1 28 LYS HB2 H -6.261 -2.751 3.771 1.00 . A A . 28 LYS HB2 1 1 7 4475 1 1 28 LYS HB3 H -5.688 -3.596 5.202 1.00 . A A . 28 LYS HB3 1 1 7 4476 1 1 28 LYS HD2 H -6.288 -2.738 7.431 1.00 . A A . 28 LYS HD2 1 1 7 4477 1 1 28 LYS HD3 H -5.667 -1.094 7.166 1.00 . A A . 28 LYS HD3 1 1 7 4478 1 1 28 LYS HE2 H -7.915 -0.157 7.508 1.00 . A A . 28 LYS HE2 1 1 7 4479 1 1 28 LYS HE3 H -8.575 -1.787 7.743 1.00 . A A . 28 LYS HE3 1 1 7 4480 1 1 28 LYS HG2 H -7.047 -0.855 5.148 1.00 . A A . 28 LYS HG2 1 1 7 4481 1 1 28 LYS HG3 H -7.835 -2.407 5.465 1.00 . A A . 28 LYS HG3 1 1 7 4482 1 1 28 LYS HZ1 H -6.528 -0.530 9.432 1.00 . A A . 28 LYS HZ1 1 1 7 4483 1 1 28 LYS HZ2 H -8.126 -0.689 9.812 1.00 . A A . 28 LYS HZ2 1 1 7 4484 1 1 28 LYS HZ3 H -7.181 -2.028 9.649 1.00 . A A . 28 LYS HZ3 1 1 7 4485 1 1 28 LYS N N -3.969 -2.098 3.320 1.00 . A A . 28 LYS N 1 1 7 4486 1 1 28 LYS NZ N -7.355 -1.096 9.300 1.00 . A A . 28 LYS NZ 1 1 7 4487 1 1 28 LYS O O -3.213 -1.502 6.621 1.00 . A A . 28 LYS O 1 1 7 4488 1 1 29 LEU C C -0.863 -3.227 6.785 1.00 . A A . 29 LEU C 1 1 7 4489 1 1 29 LEU CA C -2.086 -4.122 6.576 1.00 . A A . 29 LEU CA 1 1 7 4490 1 1 29 LEU CB C -1.662 -5.511 6.063 1.00 . A A . 29 LEU CB 1 1 7 4491 1 1 29 LEU CD1 C -1.579 -6.736 8.288 1.00 . A A . 29 LEU CD1 1 1 7 4492 1 1 29 LEU CD2 C -0.256 -7.570 6.346 1.00 . A A . 29 LEU CD2 1 1 7 4493 1 1 29 LEU CG C -0.788 -6.313 7.045 1.00 . A A . 29 LEU CG 1 1 7 4494 1 1 29 LEU H H -3.326 -4.099 4.850 1.00 . A A . 29 LEU H 1 1 7 4495 1 1 29 LEU HA H -2.612 -4.232 7.525 1.00 . A A . 29 LEU HA 1 1 7 4496 1 1 29 LEU HB2 H -2.552 -6.095 5.827 1.00 . A A . 29 LEU HB2 1 1 7 4497 1 1 29 LEU HB3 H -1.090 -5.377 5.145 1.00 . A A . 29 LEU HB3 1 1 7 4498 1 1 29 LEU HD11 H -2.482 -7.270 7.991 1.00 . A A . 29 LEU HD11 1 1 7 4499 1 1 29 LEU HD12 H -0.967 -7.395 8.906 1.00 . A A . 29 LEU HD12 1 1 7 4500 1 1 29 LEU HD13 H -1.855 -5.867 8.882 1.00 . A A . 29 LEU HD13 1 1 7 4501 1 1 29 LEU HD21 H 0.335 -7.289 5.475 1.00 . A A . 29 LEU HD21 1 1 7 4502 1 1 29 LEU HD22 H 0.376 -8.136 7.030 1.00 . A A . 29 LEU HD22 1 1 7 4503 1 1 29 LEU HD23 H -1.087 -8.199 6.027 1.00 . A A . 29 LEU HD23 1 1 7 4504 1 1 29 LEU HG H 0.072 -5.719 7.356 1.00 . A A . 29 LEU HG 1 1 7 4505 1 1 29 LEU N N -3.021 -3.524 5.626 1.00 . A A . 29 LEU N 1 1 7 4506 1 1 29 LEU O O -0.444 -2.999 7.918 1.00 . A A . 29 LEU O 1 1 7 4507 1 1 30 SER C C 0.583 -0.454 6.090 1.00 . A A . 30 SER C 1 1 7 4508 1 1 30 SER CA C 0.895 -1.894 5.675 1.00 . A A . 30 SER CA 1 1 7 4509 1 1 30 SER CB C 1.517 -1.929 4.278 1.00 . A A . 30 SER CB 1 1 7 4510 1 1 30 SER H H -0.746 -2.928 4.794 1.00 . A A . 30 SER H 1 1 7 4511 1 1 30 SER HA H 1.627 -2.302 6.375 1.00 . A A . 30 SER HA 1 1 7 4512 1 1 30 SER HB2 H 2.328 -1.204 4.230 1.00 . A A . 30 SER HB2 1 1 7 4513 1 1 30 SER HB3 H 1.911 -2.924 4.074 1.00 . A A . 30 SER HB3 1 1 7 4514 1 1 30 SER HG H -0.038 -2.372 3.197 1.00 . A A . 30 SER HG 1 1 7 4515 1 1 30 SER N N -0.299 -2.731 5.681 1.00 . A A . 30 SER N 1 1 7 4516 1 1 30 SER O O 1.402 0.194 6.739 1.00 . A A . 30 SER O 1 1 7 4517 1 1 30 SER OG O 0.554 -1.621 3.296 1.00 . A A . 30 SER OG 1 1 7 4518 1 1 31 GLY C C -0.874 2.247 4.595 1.00 . A A . 31 GLY C 1 1 7 4519 1 1 31 GLY CA C -1.039 1.414 5.869 1.00 . A A . 31 GLY CA 1 1 7 4520 1 1 31 GLY H H -1.192 -0.559 5.139 1.00 . A A . 31 GLY H 1 1 7 4521 1 1 31 GLY HA2 H -2.101 1.382 6.114 1.00 . A A . 31 GLY HA2 1 1 7 4522 1 1 31 GLY HA3 H -0.509 1.891 6.694 1.00 . A A . 31 GLY HA3 1 1 7 4523 1 1 31 GLY N N -0.589 0.044 5.682 1.00 . A A . 31 GLY N 1 1 7 4524 1 1 31 GLY O O -0.904 3.473 4.668 1.00 . A A . 31 GLY O 1 1 7 4525 1 1 32 CYS C C -2.133 2.446 1.613 1.00 . A A . 32 CYS C 1 1 7 4526 1 1 32 CYS CA C -0.706 2.238 2.126 1.00 . A A . 32 CYS CA 1 1 7 4527 1 1 32 CYS CB C 0.071 1.364 1.132 1.00 . A A . 32 CYS CB 1 1 7 4528 1 1 32 CYS H H -0.755 0.584 3.439 1.00 . A A . 32 CYS H 1 1 7 4529 1 1 32 CYS HA H -0.212 3.205 2.217 1.00 . A A . 32 CYS HA 1 1 7 4530 1 1 32 CYS HB2 H -0.533 0.488 0.900 1.00 . A A . 32 CYS HB2 1 1 7 4531 1 1 32 CYS HB3 H 0.208 1.920 0.204 1.00 . A A . 32 CYS HB3 1 1 7 4532 1 1 32 CYS N N -0.731 1.596 3.432 1.00 . A A . 32 CYS N 1 1 7 4533 1 1 32 CYS O O -3.065 1.793 2.080 1.00 . A A . 32 CYS O 1 1 7 4534 1 1 32 CYS SG S 1.683 0.744 1.684 1.00 . A A . 32 CYS SG 1 1 7 4535 1 1 33 LYS C C -3.369 2.940 -1.508 1.00 . A A . 33 LYS C 1 1 7 4536 1 1 33 LYS CA C -3.523 3.556 -0.117 1.00 . A A . 33 LYS CA 1 1 7 4537 1 1 33 LYS CB C -3.805 5.056 -0.286 1.00 . A A . 33 LYS CB 1 1 7 4538 1 1 33 LYS CD C -4.719 5.705 2.054 1.00 . A A . 33 LYS CD 1 1 7 4539 1 1 33 LYS CE C -4.378 4.554 3.008 1.00 . A A . 33 LYS CE 1 1 7 4540 1 1 33 LYS CG C -3.659 5.927 0.966 1.00 . A A . 33 LYS CG 1 1 7 4541 1 1 33 LYS H H -1.477 3.841 0.305 1.00 . A A . 33 LYS H 1 1 7 4542 1 1 33 LYS HA H -4.367 3.089 0.390 1.00 . A A . 33 LYS HA 1 1 7 4543 1 1 33 LYS HB2 H -3.102 5.451 -1.022 1.00 . A A . 33 LYS HB2 1 1 7 4544 1 1 33 LYS HB3 H -4.811 5.180 -0.689 1.00 . A A . 33 LYS HB3 1 1 7 4545 1 1 33 LYS HD2 H -4.770 6.623 2.639 1.00 . A A . 33 LYS HD2 1 1 7 4546 1 1 33 LYS HD3 H -5.698 5.544 1.599 1.00 . A A . 33 LYS HD3 1 1 7 4547 1 1 33 LYS HE2 H -4.737 3.616 2.589 1.00 . A A . 33 LYS HE2 1 1 7 4548 1 1 33 LYS HE3 H -3.298 4.501 3.158 1.00 . A A . 33 LYS HE3 1 1 7 4549 1 1 33 LYS HG2 H -2.656 5.824 1.378 1.00 . A A . 33 LYS HG2 1 1 7 4550 1 1 33 LYS HG3 H -3.769 6.959 0.627 1.00 . A A . 33 LYS HG3 1 1 7 4551 1 1 33 LYS HZ1 H -4.647 5.596 4.744 1.00 . A A . 33 LYS HZ1 1 1 7 4552 1 1 33 LYS HZ2 H -6.001 4.792 4.236 1.00 . A A . 33 LYS HZ2 1 1 7 4553 1 1 33 LYS HZ3 H -4.751 3.963 4.926 1.00 . A A . 33 LYS HZ3 1 1 7 4554 1 1 33 LYS N N -2.291 3.341 0.631 1.00 . A A . 33 LYS N 1 1 7 4555 1 1 33 LYS NZ N -4.997 4.741 4.330 1.00 . A A . 33 LYS NZ 1 1 7 4556 1 1 33 LYS O O -2.265 2.921 -2.052 1.00 . A A . 33 LYS O 1 1 7 4557 1 1 34 ILE C C -5.706 2.951 -4.091 1.00 . A A . 34 ILE C 1 1 7 4558 1 1 34 ILE CA C -4.616 2.074 -3.476 1.00 . A A . 34 ILE CA 1 1 7 4559 1 1 34 ILE CB C -4.996 0.581 -3.550 1.00 . A A . 34 ILE CB 1 1 7 4560 1 1 34 ILE CD1 C -2.675 -0.534 -3.578 1.00 . A A . 34 ILE CD1 1 1 7 4561 1 1 34 ILE CG1 C -3.990 -0.325 -2.823 1.00 . A A . 34 ILE CG1 1 1 7 4562 1 1 34 ILE CG2 C -5.175 0.129 -5.007 1.00 . A A . 34 ILE CG2 1 1 7 4563 1 1 34 ILE H H -5.338 2.491 -1.542 1.00 . A A . 34 ILE H 1 1 7 4564 1 1 34 ILE HA H -3.682 2.234 -4.018 1.00 . A A . 34 ILE HA 1 1 7 4565 1 1 34 ILE HB H -5.952 0.446 -3.040 1.00 . A A . 34 ILE HB 1 1 7 4566 1 1 34 ILE HD11 H -2.845 -1.110 -4.489 1.00 . A A . 34 ILE HD11 1 1 7 4567 1 1 34 ILE HD12 H -2.235 0.427 -3.828 1.00 . A A . 34 ILE HD12 1 1 7 4568 1 1 34 ILE HD13 H -1.981 -1.086 -2.945 1.00 . A A . 34 ILE HD13 1 1 7 4569 1 1 34 ILE HG12 H -3.765 0.093 -1.845 1.00 . A A . 34 ILE HG12 1 1 7 4570 1 1 34 ILE HG13 H -4.459 -1.293 -2.666 1.00 . A A . 34 ILE HG13 1 1 7 4571 1 1 34 ILE HG21 H -4.302 0.404 -5.600 1.00 . A A . 34 ILE HG21 1 1 7 4572 1 1 34 ILE HG22 H -5.310 -0.952 -5.043 1.00 . A A . 34 ILE HG22 1 1 7 4573 1 1 34 ILE HG23 H -6.057 0.600 -5.442 1.00 . A A . 34 ILE HG23 1 1 7 4574 1 1 34 ILE N N -4.489 2.490 -2.086 1.00 . A A . 34 ILE N 1 1 7 4575 1 1 34 ILE O O -6.887 2.706 -3.853 1.00 . A A . 34 ILE O 1 1 7 4576 1 1 35 ILE C C -5.761 5.202 -6.920 1.00 . A A . 35 ILE C 1 1 7 4577 1 1 35 ILE CA C -6.247 4.897 -5.504 1.00 . A A . 35 ILE CA 1 1 7 4578 1 1 35 ILE CB C -6.449 6.178 -4.672 1.00 . A A . 35 ILE CB 1 1 7 4579 1 1 35 ILE CD1 C -5.344 8.186 -3.568 1.00 . A A . 35 ILE CD1 1 1 7 4580 1 1 35 ILE CG1 C -5.142 6.961 -4.462 1.00 . A A . 35 ILE CG1 1 1 7 4581 1 1 35 ILE CG2 C -7.097 5.843 -3.321 1.00 . A A . 35 ILE CG2 1 1 7 4582 1 1 35 ILE H H -4.330 4.126 -5.026 1.00 . A A . 35 ILE H 1 1 7 4583 1 1 35 ILE HA H -7.218 4.410 -5.599 1.00 . A A . 35 ILE HA 1 1 7 4584 1 1 35 ILE HB H -7.145 6.813 -5.222 1.00 . A A . 35 ILE HB 1 1 7 4585 1 1 35 ILE HD11 H -6.137 8.815 -3.975 1.00 . A A . 35 ILE HD11 1 1 7 4586 1 1 35 ILE HD12 H -5.586 7.889 -2.548 1.00 . A A . 35 ILE HD12 1 1 7 4587 1 1 35 ILE HD13 H -4.418 8.748 -3.542 1.00 . A A . 35 ILE HD13 1 1 7 4588 1 1 35 ILE HG12 H -4.383 6.323 -4.006 1.00 . A A . 35 ILE HG12 1 1 7 4589 1 1 35 ILE HG13 H -4.769 7.316 -5.422 1.00 . A A . 35 ILE HG13 1 1 7 4590 1 1 35 ILE HG21 H -7.943 5.175 -3.470 1.00 . A A . 35 ILE HG21 1 1 7 4591 1 1 35 ILE HG22 H -6.368 5.369 -2.663 1.00 . A A . 35 ILE HG22 1 1 7 4592 1 1 35 ILE HG23 H -7.468 6.750 -2.845 1.00 . A A . 35 ILE HG23 1 1 7 4593 1 1 35 ILE N N -5.317 3.980 -4.856 1.00 . A A . 35 ILE N 1 1 7 4594 1 1 35 ILE O O -4.581 5.477 -7.129 1.00 . A A . 35 ILE O 1 1 7 4595 1 1 36 SER C C -6.753 6.773 -9.739 1.00 . A A . 36 SER C 1 1 7 4596 1 1 36 SER CA C -6.377 5.350 -9.308 1.00 . A A . 36 SER CA 1 1 7 4597 1 1 36 SER CB C -7.095 4.273 -10.134 1.00 . A A . 36 SER CB 1 1 7 4598 1 1 36 SER H H -7.635 4.954 -7.640 1.00 . A A . 36 SER H 1 1 7 4599 1 1 36 SER HA H -5.309 5.228 -9.486 1.00 . A A . 36 SER HA 1 1 7 4600 1 1 36 SER HB2 H -6.846 3.287 -9.741 1.00 . A A . 36 SER HB2 1 1 7 4601 1 1 36 SER HB3 H -8.176 4.415 -10.080 1.00 . A A . 36 SER HB3 1 1 7 4602 1 1 36 SER HG H -6.912 5.189 -11.836 1.00 . A A . 36 SER HG 1 1 7 4603 1 1 36 SER N N -6.676 5.144 -7.894 1.00 . A A . 36 SER N 1 1 7 4604 1 1 36 SER O O -7.220 6.980 -10.859 1.00 . A A . 36 SER O 1 1 7 4605 1 1 36 SER OG O -6.681 4.325 -11.483 1.00 . A A . 36 SER OG 1 1 7 4606 1 1 37 ALA C C -5.532 9.813 -9.833 1.00 . A A . 37 ALA C 1 1 7 4607 1 1 37 ALA CA C -6.739 9.168 -9.141 1.00 . A A . 37 ALA CA 1 1 7 4608 1 1 37 ALA CB C -7.046 9.887 -7.823 1.00 . A A . 37 ALA CB 1 1 7 4609 1 1 37 ALA H H -6.135 7.516 -7.956 1.00 . A A . 37 ALA H 1 1 7 4610 1 1 37 ALA HA H -7.610 9.281 -9.788 1.00 . A A . 37 ALA HA 1 1 7 4611 1 1 37 ALA HB1 H -6.180 9.834 -7.163 1.00 . A A . 37 ALA HB1 1 1 7 4612 1 1 37 ALA HB2 H -7.285 10.933 -8.018 1.00 . A A . 37 ALA HB2 1 1 7 4613 1 1 37 ALA HB3 H -7.898 9.415 -7.334 1.00 . A A . 37 ALA HB3 1 1 7 4614 1 1 37 ALA N N -6.518 7.755 -8.860 1.00 . A A . 37 ALA N 1 1 7 4615 1 1 37 ALA O O -5.576 11.005 -10.128 1.00 . A A . 37 ALA O 1 1 7 4616 1 1 38 SER C C -2.598 10.650 -9.601 1.00 . A A . 38 SER C 1 1 7 4617 1 1 38 SER CA C -3.155 9.548 -10.521 1.00 . A A . 38 SER CA 1 1 7 4618 1 1 38 SER CB C -3.272 9.981 -11.988 1.00 . A A . 38 SER CB 1 1 7 4619 1 1 38 SER H H -4.487 8.074 -9.820 1.00 . A A . 38 SER H 1 1 7 4620 1 1 38 SER HA H -2.459 8.712 -10.486 1.00 . A A . 38 SER HA 1 1 7 4621 1 1 38 SER HB2 H -3.694 9.167 -12.576 1.00 . A A . 38 SER HB2 1 1 7 4622 1 1 38 SER HB3 H -3.926 10.847 -12.065 1.00 . A A . 38 SER HB3 1 1 7 4623 1 1 38 SER HG H -1.613 10.985 -11.974 1.00 . A A . 38 SER HG 1 1 7 4624 1 1 38 SER N N -4.445 9.053 -10.050 1.00 . A A . 38 SER N 1 1 7 4625 1 1 38 SER O O -1.808 11.485 -10.040 1.00 . A A . 38 SER O 1 1 7 4626 1 1 38 SER OG O -2.003 10.297 -12.522 1.00 . A A . 38 SER OG 1 1 7 4627 1 1 39 THR C C -2.829 10.927 -5.949 1.00 . A A . 39 THR C 1 1 7 4628 1 1 39 THR CA C -2.680 11.619 -7.303 1.00 . A A . 39 THR CA 1 1 7 4629 1 1 39 THR CB C -3.644 12.815 -7.417 1.00 . A A . 39 THR CB 1 1 7 4630 1 1 39 THR CG2 C -3.392 13.879 -6.343 1.00 . A A . 39 THR CG2 1 1 7 4631 1 1 39 THR H H -3.630 9.897 -8.028 1.00 . A A . 39 THR H 1 1 7 4632 1 1 39 THR HA H -1.650 11.960 -7.434 1.00 . A A . 39 THR HA 1 1 7 4633 1 1 39 THR HB H -4.667 12.454 -7.314 1.00 . A A . 39 THR HB 1 1 7 4634 1 1 39 THR HG1 H -4.181 14.112 -8.765 1.00 . A A . 39 THR HG1 1 1 7 4635 1 1 39 THR HG21 H -4.036 14.739 -6.528 1.00 . A A . 39 THR HG21 1 1 7 4636 1 1 39 THR HG22 H -3.621 13.488 -5.352 1.00 . A A . 39 THR HG22 1 1 7 4637 1 1 39 THR HG23 H -2.351 14.202 -6.377 1.00 . A A . 39 THR HG23 1 1 7 4638 1 1 39 THR N N -3.004 10.632 -8.324 1.00 . A A . 39 THR N 1 1 7 4639 1 1 39 THR O O -3.675 10.045 -5.807 1.00 . A A . 39 THR O 1 1 7 4640 1 1 39 THR OG1 O -3.516 13.426 -8.685 1.00 . A A . 39 THR OG1 1 1 7 4641 1 1 40 CYS C C -1.878 12.051 -2.644 1.00 . A A . 40 CYS C 1 1 7 4642 1 1 40 CYS CA C -2.101 10.865 -3.584 1.00 . A A . 40 CYS CA 1 1 7 4643 1 1 40 CYS CB C -1.070 9.754 -3.349 1.00 . A A . 40 CYS CB 1 1 7 4644 1 1 40 CYS H H -1.348 12.062 -5.151 1.00 . A A . 40 CYS H 1 1 7 4645 1 1 40 CYS HA H -3.099 10.468 -3.409 1.00 . A A . 40 CYS HA 1 1 7 4646 1 1 40 CYS HB2 H -0.104 10.076 -3.740 1.00 . A A . 40 CYS HB2 1 1 7 4647 1 1 40 CYS HB3 H -0.961 9.587 -2.277 1.00 . A A . 40 CYS HB3 1 1 7 4648 1 1 40 CYS N N -2.017 11.329 -4.963 1.00 . A A . 40 CYS N 1 1 7 4649 1 1 40 CYS O O -1.126 12.961 -2.992 1.00 . A A . 40 CYS O 1 1 7 4650 1 1 40 CYS SG S -1.519 8.171 -4.106 1.00 . A A . 40 CYS SG 1 1 7 4651 1 1 41 PRO C C -1.073 13.225 0.154 1.00 . A A . 41 PRO C 1 1 7 4652 1 1 41 PRO CA C -2.443 13.180 -0.529 1.00 . A A . 41 PRO CA 1 1 7 4653 1 1 41 PRO CB C -3.574 12.943 0.476 1.00 . A A . 41 PRO CB 1 1 7 4654 1 1 41 PRO CD C -3.434 11.045 -0.963 1.00 . A A . 41 PRO CD 1 1 7 4655 1 1 41 PRO CG C -3.702 11.421 0.494 1.00 . A A . 41 PRO CG 1 1 7 4656 1 1 41 PRO HA H -2.615 14.125 -1.048 1.00 . A A . 41 PRO HA 1 1 7 4657 1 1 41 PRO HB2 H -3.363 13.356 1.464 1.00 . A A . 41 PRO HB2 1 1 7 4658 1 1 41 PRO HB3 H -4.496 13.374 0.084 1.00 . A A . 41 PRO HB3 1 1 7 4659 1 1 41 PRO HD2 H -3.010 10.042 -1.023 1.00 . A A . 41 PRO HD2 1 1 7 4660 1 1 41 PRO HD3 H -4.372 11.081 -1.521 1.00 . A A . 41 PRO HD3 1 1 7 4661 1 1 41 PRO HG2 H -2.924 11.002 1.134 1.00 . A A . 41 PRO HG2 1 1 7 4662 1 1 41 PRO HG3 H -4.685 11.093 0.834 1.00 . A A . 41 PRO HG3 1 1 7 4663 1 1 41 PRO N N -2.528 12.070 -1.467 1.00 . A A . 41 PRO N 1 1 7 4664 1 1 41 PRO O O -0.323 12.248 0.119 1.00 . A A . 41 PRO O 1 1 7 4665 1 1 42 SER C C 0.592 13.926 2.784 1.00 . A A . 42 SER C 1 1 7 4666 1 1 42 SER CA C 0.512 14.649 1.435 1.00 . A A . 42 SER CA 1 1 7 4667 1 1 42 SER CB C 0.688 16.165 1.582 1.00 . A A . 42 SER CB 1 1 7 4668 1 1 42 SER H H -1.425 15.129 0.740 1.00 . A A . 42 SER H 1 1 7 4669 1 1 42 SER HA H 1.326 14.283 0.805 1.00 . A A . 42 SER HA 1 1 7 4670 1 1 42 SER HB2 H -0.084 16.572 2.237 1.00 . A A . 42 SER HB2 1 1 7 4671 1 1 42 SER HB3 H 1.669 16.381 2.008 1.00 . A A . 42 SER HB3 1 1 7 4672 1 1 42 SER HG H 1.225 16.378 -0.275 1.00 . A A . 42 SER HG 1 1 7 4673 1 1 42 SER N N -0.753 14.376 0.763 1.00 . A A . 42 SER N 1 1 7 4674 1 1 42 SER O O 0.621 14.550 3.842 1.00 . A A . 42 SER O 1 1 7 4675 1 1 42 SER OG O 0.587 16.782 0.317 1.00 . A A . 42 SER OG 1 1 7 4676 1 1 43 ASP C C 1.473 10.438 3.481 1.00 . A A . 43 ASP C 1 1 7 4677 1 1 43 ASP CA C 0.635 11.667 3.842 1.00 . A A . 43 ASP CA 1 1 7 4678 1 1 43 ASP CB C -0.799 11.242 4.188 1.00 . A A . 43 ASP CB 1 1 7 4679 1 1 43 ASP CG C -1.607 12.377 4.811 1.00 . A A . 43 ASP CG 1 1 7 4680 1 1 43 ASP H H 0.579 12.195 1.793 1.00 . A A . 43 ASP H 1 1 7 4681 1 1 43 ASP HA H 1.085 12.143 4.715 1.00 . A A . 43 ASP HA 1 1 7 4682 1 1 43 ASP HB2 H -1.307 10.890 3.291 1.00 . A A . 43 ASP HB2 1 1 7 4683 1 1 43 ASP HB3 H -0.761 10.418 4.904 1.00 . A A . 43 ASP HB3 1 1 7 4684 1 1 43 ASP HD2 H -2.746 13.893 4.388 1.00 . A A . 43 ASP HD2 1 1 7 4685 1 1 43 ASP N N 0.621 12.593 2.718 1.00 . A A . 43 ASP N 1 1 7 4686 1 1 43 ASP O O 2.169 9.901 4.340 1.00 . A A . 43 ASP O 1 1 7 4687 1 1 43 ASP OD1 O -1.633 12.498 6.034 1.00 . A A . 43 ASP OD1 1 1 7 4688 1 1 43 ASP OD2 O -2.271 13.190 3.940 1.00 . A A . 43 ASP OD2 1 1 7 4689 1 1 44 TYR C C 2.986 9.124 0.579 1.00 . A A . 44 TYR C 1 1 7 4690 1 1 44 TYR CA C 2.019 8.778 1.720 1.00 . A A . 44 TYR CA 1 1 7 4691 1 1 44 TYR CB C 0.913 7.818 1.272 1.00 . A A . 44 TYR CB 1 1 7 4692 1 1 44 TYR CD1 C 0.194 6.795 3.473 1.00 . A A . 44 TYR CD1 1 1 7 4693 1 1 44 TYR CD2 C -1.392 8.177 2.257 1.00 . A A . 44 TYR CD2 1 1 7 4694 1 1 44 TYR CE1 C -0.760 6.573 4.478 1.00 . A A . 44 TYR CE1 1 1 7 4695 1 1 44 TYR CE2 C -2.345 7.964 3.268 1.00 . A A . 44 TYR CE2 1 1 7 4696 1 1 44 TYR CG C -0.134 7.556 2.337 1.00 . A A . 44 TYR CG 1 1 7 4697 1 1 44 TYR CZ C -2.047 7.120 4.353 1.00 . A A . 44 TYR CZ 1 1 7 4698 1 1 44 TYR H H 0.782 10.469 1.571 1.00 . A A . 44 TYR H 1 1 7 4699 1 1 44 TYR HA H 2.561 8.272 2.515 1.00 . A A . 44 TYR HA 1 1 7 4700 1 1 44 TYR HB2 H 0.416 8.221 0.390 1.00 . A A . 44 TYR HB2 1 1 7 4701 1 1 44 TYR HB3 H 1.370 6.873 0.995 1.00 . A A . 44 TYR HB3 1 1 7 4702 1 1 44 TYR HD1 H 1.188 6.398 3.582 1.00 . A A . 44 TYR HD1 1 1 7 4703 1 1 44 TYR HD2 H -1.632 8.817 1.421 1.00 . A A . 44 TYR HD2 1 1 7 4704 1 1 44 TYR HE1 H -0.495 5.974 5.339 1.00 . A A . 44 TYR HE1 1 1 7 4705 1 1 44 TYR HE2 H -3.311 8.439 3.198 1.00 . A A . 44 TYR HE2 1 1 7 4706 1 1 44 TYR HH H -2.676 6.316 6.013 1.00 . A A . 44 TYR HH 1 1 7 4707 1 1 44 TYR N N 1.391 9.992 2.219 1.00 . A A . 44 TYR N 1 1 7 4708 1 1 44 TYR O O 2.615 9.005 -0.588 1.00 . A A . 44 TYR O 1 1 7 4709 1 1 44 TYR OH O -3.012 6.831 5.276 1.00 . A A . 44 TYR OH 1 1 7 4710 1 1 45 PRO C C 5.806 8.921 -0.931 1.00 . A A . 45 PRO C 1 1 7 4711 1 1 45 PRO CA C 5.174 10.046 -0.103 1.00 . A A . 45 PRO CA 1 1 7 4712 1 1 45 PRO CB C 6.245 10.791 0.699 1.00 . A A . 45 PRO CB 1 1 7 4713 1 1 45 PRO CD C 4.760 9.739 2.228 1.00 . A A . 45 PRO CD 1 1 7 4714 1 1 45 PRO CG C 6.243 10.050 2.033 1.00 . A A . 45 PRO CG 1 1 7 4715 1 1 45 PRO HA H 4.693 10.749 -0.786 1.00 . A A . 45 PRO HA 1 1 7 4716 1 1 45 PRO HB2 H 7.225 10.778 0.218 1.00 . A A . 45 PRO HB2 1 1 7 4717 1 1 45 PRO HB3 H 5.926 11.821 0.863 1.00 . A A . 45 PRO HB3 1 1 7 4718 1 1 45 PRO HD2 H 4.653 8.846 2.838 1.00 . A A . 45 PRO HD2 1 1 7 4719 1 1 45 PRO HD3 H 4.277 10.589 2.711 1.00 . A A . 45 PRO HD3 1 1 7 4720 1 1 45 PRO HG2 H 6.802 9.118 1.933 1.00 . A A . 45 PRO HG2 1 1 7 4721 1 1 45 PRO HG3 H 6.653 10.650 2.845 1.00 . A A . 45 PRO HG3 1 1 7 4722 1 1 45 PRO N N 4.217 9.570 0.889 1.00 . A A . 45 PRO N 1 1 7 4723 1 1 45 PRO O O 6.396 9.209 -1.971 1.00 . A A . 45 PRO O 1 1 7 4724 1 1 46 LYS C C 5.390 5.755 -1.948 1.00 . A A . 46 LYS C 1 1 7 4725 1 1 46 LYS CA C 6.391 6.534 -1.094 1.00 . A A . 46 LYS CA 1 1 7 4726 1 1 46 LYS CB C 7.035 5.696 0.022 1.00 . A A . 46 LYS CB 1 1 7 4727 1 1 46 LYS CD C 9.452 5.130 -0.592 1.00 . A A . 46 LYS CD 1 1 7 4728 1 1 46 LYS CE C 9.685 6.346 -1.495 1.00 . A A . 46 LYS CE 1 1 7 4729 1 1 46 LYS CG C 8.002 4.637 -0.519 1.00 . A A . 46 LYS CG 1 1 7 4730 1 1 46 LYS H H 5.216 7.460 0.376 1.00 . A A . 46 LYS H 1 1 7 4731 1 1 46 LYS HA H 7.180 6.878 -1.755 1.00 . A A . 46 LYS HA 1 1 7 4732 1 1 46 LYS HB2 H 7.578 6.353 0.703 1.00 . A A . 46 LYS HB2 1 1 7 4733 1 1 46 LYS HB3 H 6.254 5.198 0.598 1.00 . A A . 46 LYS HB3 1 1 7 4734 1 1 46 LYS HD2 H 9.790 5.369 0.418 1.00 . A A . 46 LYS HD2 1 1 7 4735 1 1 46 LYS HD3 H 10.037 4.300 -0.976 1.00 . A A . 46 LYS HD3 1 1 7 4736 1 1 46 LYS HE2 H 9.251 6.162 -2.480 1.00 . A A . 46 LYS HE2 1 1 7 4737 1 1 46 LYS HE3 H 9.225 7.228 -1.048 1.00 . A A . 46 LYS HE3 1 1 7 4738 1 1 46 LYS HG2 H 7.987 3.795 0.174 1.00 . A A . 46 LYS HG2 1 1 7 4739 1 1 46 LYS HG3 H 7.674 4.278 -1.493 1.00 . A A . 46 LYS HG3 1 1 7 4740 1 1 46 LYS HZ1 H 11.541 6.799 -0.762 1.00 . A A . 46 LYS HZ1 1 1 7 4741 1 1 46 LYS HZ2 H 11.573 5.845 -2.108 1.00 . A A . 46 LYS HZ2 1 1 7 4742 1 1 46 LYS HZ3 H 11.233 7.451 -2.243 1.00 . A A . 46 LYS HZ3 1 1 7 4743 1 1 46 LYS N N 5.718 7.662 -0.477 1.00 . A A . 46 LYS N 1 1 7 4744 1 1 46 LYS NZ N 11.119 6.630 -1.664 1.00 . A A . 46 LYS NZ 1 1 7 4745 1 1 46 LYS O O 5.079 6.230 -3.061 1.00 . A A . 46 LYS O 1 1 7 4746 1 1 46 LYS OXT O 4.946 4.680 -1.496 1.00 . A A . 46 LYS OXT 1 1 8 4747 1 1 1 LYS C C -0.468 4.703 -6.907 1.00 . A A . 1 LYS C 1 1 8 4748 1 1 1 LYS CA C -1.276 5.678 -7.781 1.00 . A A . 1 LYS CA 1 1 8 4749 1 1 1 LYS CB C -0.371 6.654 -8.555 1.00 . A A . 1 LYS CB 1 1 8 4750 1 1 1 LYS CD C 1.437 8.451 -8.406 1.00 . A A . 1 LYS CD 1 1 8 4751 1 1 1 LYS CE C 0.789 9.395 -9.426 1.00 . A A . 1 LYS CE 1 1 8 4752 1 1 1 LYS CG C 0.402 7.617 -7.641 1.00 . A A . 1 LYS CG 1 1 8 4753 1 1 1 LYS H1 H -2.769 7.074 -7.656 1.00 . A A . 1 LYS H1 1 1 8 4754 1 1 1 LYS H2 H -3.029 5.760 -6.714 1.00 . A A . 1 LYS H2 1 1 8 4755 1 1 1 LYS H3 H -1.923 6.901 -6.262 1.00 . A A . 1 LYS H3 1 1 8 4756 1 1 1 LYS HA H -1.793 5.069 -8.522 1.00 . A A . 1 LYS HA 1 1 8 4757 1 1 1 LYS HB2 H 0.333 6.088 -9.165 1.00 . A A . 1 LYS HB2 1 1 8 4758 1 1 1 LYS HB3 H -1.006 7.234 -9.223 1.00 . A A . 1 LYS HB3 1 1 8 4759 1 1 1 LYS HD2 H 1.992 9.049 -7.679 1.00 . A A . 1 LYS HD2 1 1 8 4760 1 1 1 LYS HD3 H 2.138 7.783 -8.911 1.00 . A A . 1 LYS HD3 1 1 8 4761 1 1 1 LYS HE2 H 0.272 8.823 -10.194 1.00 . A A . 1 LYS HE2 1 1 8 4762 1 1 1 LYS HE3 H 0.075 10.036 -8.910 1.00 . A A . 1 LYS HE3 1 1 8 4763 1 1 1 LYS HG2 H -0.297 8.289 -7.142 1.00 . A A . 1 LYS HG2 1 1 8 4764 1 1 1 LYS HG3 H 0.938 7.044 -6.884 1.00 . A A . 1 LYS HG3 1 1 8 4765 1 1 1 LYS HZ1 H 2.285 10.797 -9.403 1.00 . A A . 1 LYS HZ1 1 1 8 4766 1 1 1 LYS HZ2 H 2.441 9.677 -10.603 1.00 . A A . 1 LYS HZ2 1 1 8 4767 1 1 1 LYS HZ3 H 1.317 10.874 -10.734 1.00 . A A . 1 LYS HZ3 1 1 8 4768 1 1 1 LYS N N -2.325 6.408 -7.043 1.00 . A A . 1 LYS N 1 1 8 4769 1 1 1 LYS NZ N 1.786 10.251 -10.091 1.00 . A A . 1 LYS NZ 1 1 8 4770 1 1 1 LYS O O 0.666 4.381 -7.251 1.00 . A A . 1 LYS O 1 1 8 4771 1 1 2 SER C C 0.714 3.902 -4.095 1.00 . A A . 2 SER C 1 1 8 4772 1 1 2 SER CA C -0.463 3.276 -4.854 1.00 . A A . 2 SER CA 1 1 8 4773 1 1 2 SER CB C -0.074 1.956 -5.535 1.00 . A A . 2 SER CB 1 1 8 4774 1 1 2 SER H H -1.996 4.523 -5.593 1.00 . A A . 2 SER H 1 1 8 4775 1 1 2 SER HA H -1.245 3.033 -4.140 1.00 . A A . 2 SER HA 1 1 8 4776 1 1 2 SER HB2 H 0.786 2.099 -6.186 1.00 . A A . 2 SER HB2 1 1 8 4777 1 1 2 SER HB3 H 0.193 1.231 -4.765 1.00 . A A . 2 SER HB3 1 1 8 4778 1 1 2 SER HG H -1.385 2.081 -6.969 1.00 . A A . 2 SER HG 1 1 8 4779 1 1 2 SER N N -1.057 4.222 -5.800 1.00 . A A . 2 SER N 1 1 8 4780 1 1 2 SER O O 1.807 4.031 -4.645 1.00 . A A . 2 SER O 1 1 8 4781 1 1 2 SER OG O -1.155 1.444 -6.288 1.00 . A A . 2 SER OG 1 1 8 4782 1 1 3 CYS C C 1.472 4.742 -0.620 1.00 . A A . 3 CYS C 1 1 8 4783 1 1 3 CYS CA C 1.399 5.163 -2.083 1.00 . A A . 3 CYS CA 1 1 8 4784 1 1 3 CYS CB C 0.943 6.615 -2.193 1.00 . A A . 3 CYS CB 1 1 8 4785 1 1 3 CYS H H -0.394 4.057 -2.400 1.00 . A A . 3 CYS H 1 1 8 4786 1 1 3 CYS HA H 2.403 5.111 -2.497 1.00 . A A . 3 CYS HA 1 1 8 4787 1 1 3 CYS HB2 H -0.101 6.691 -1.888 1.00 . A A . 3 CYS HB2 1 1 8 4788 1 1 3 CYS HB3 H 1.540 7.214 -1.512 1.00 . A A . 3 CYS HB3 1 1 8 4789 1 1 3 CYS N N 0.486 4.305 -2.837 1.00 . A A . 3 CYS N 1 1 8 4790 1 1 3 CYS O O 0.444 4.449 -0.016 1.00 . A A . 3 CYS O 1 1 8 4791 1 1 3 CYS SG S 1.151 7.325 -3.843 1.00 . A A . 3 CYS SG 1 1 8 4792 1 1 4 CYS C C 3.575 5.328 2.156 1.00 . A A . 4 CYS C 1 1 8 4793 1 1 4 CYS CA C 2.998 4.220 1.270 1.00 . A A . 4 CYS CA 1 1 8 4794 1 1 4 CYS CB C 4.004 3.073 1.129 1.00 . A A . 4 CYS CB 1 1 8 4795 1 1 4 CYS H H 3.466 5.089 -0.598 1.00 . A A . 4 CYS H 1 1 8 4796 1 1 4 CYS HA H 2.093 3.837 1.733 1.00 . A A . 4 CYS HA 1 1 8 4797 1 1 4 CYS HB2 H 4.830 3.412 0.504 1.00 . A A . 4 CYS HB2 1 1 8 4798 1 1 4 CYS HB3 H 4.420 2.824 2.104 1.00 . A A . 4 CYS HB3 1 1 8 4799 1 1 4 CYS N N 2.687 4.724 -0.061 1.00 . A A . 4 CYS N 1 1 8 4800 1 1 4 CYS O O 4.121 6.305 1.646 1.00 . A A . 4 CYS O 1 1 8 4801 1 1 4 CYS SG S 3.333 1.543 0.429 1.00 . A A . 4 CYS SG 1 1 8 4802 1 1 5 PRO C C 5.577 5.951 4.521 1.00 . A A . 5 PRO C 1 1 8 4803 1 1 5 PRO CA C 4.059 6.126 4.431 1.00 . A A . 5 PRO CA 1 1 8 4804 1 1 5 PRO CB C 3.378 5.834 5.769 1.00 . A A . 5 PRO CB 1 1 8 4805 1 1 5 PRO CD C 2.716 4.159 4.194 1.00 . A A . 5 PRO CD 1 1 8 4806 1 1 5 PRO CG C 3.029 4.348 5.677 1.00 . A A . 5 PRO CG 1 1 8 4807 1 1 5 PRO HA H 3.840 7.154 4.140 1.00 . A A . 5 PRO HA 1 1 8 4808 1 1 5 PRO HB2 H 4.012 6.059 6.627 1.00 . A A . 5 PRO HB2 1 1 8 4809 1 1 5 PRO HB3 H 2.457 6.413 5.837 1.00 . A A . 5 PRO HB3 1 1 8 4810 1 1 5 PRO HD2 H 2.972 3.152 3.879 1.00 . A A . 5 PRO HD2 1 1 8 4811 1 1 5 PRO HD3 H 1.649 4.316 4.038 1.00 . A A . 5 PRO HD3 1 1 8 4812 1 1 5 PRO HG2 H 3.898 3.748 5.949 1.00 . A A . 5 PRO HG2 1 1 8 4813 1 1 5 PRO HG3 H 2.182 4.087 6.313 1.00 . A A . 5 PRO HG3 1 1 8 4814 1 1 5 PRO N N 3.473 5.187 3.488 1.00 . A A . 5 PRO N 1 1 8 4815 1 1 5 PRO O O 6.289 6.935 4.718 1.00 . A A . 5 PRO O 1 1 8 4816 1 1 6 ASN C C 7.902 3.188 3.784 1.00 . A A . 6 ASN C 1 1 8 4817 1 1 6 ASN CA C 7.466 4.366 4.650 1.00 . A A . 6 ASN CA 1 1 8 4818 1 1 6 ASN CB C 7.682 4.036 6.135 1.00 . A A . 6 ASN CB 1 1 8 4819 1 1 6 ASN CG C 7.451 5.251 7.029 1.00 . A A . 6 ASN CG 1 1 8 4820 1 1 6 ASN H H 5.445 3.947 4.189 1.00 . A A . 6 ASN H 1 1 8 4821 1 1 6 ASN HA H 8.101 5.210 4.386 1.00 . A A . 6 ASN HA 1 1 8 4822 1 1 6 ASN HB2 H 7.017 3.220 6.426 1.00 . A A . 6 ASN HB2 1 1 8 4823 1 1 6 ASN HB3 H 8.711 3.709 6.290 1.00 . A A . 6 ASN HB3 1 1 8 4824 1 1 6 ASN HD21 H 5.716 4.468 7.759 1.00 . A A . 6 ASN HD21 1 1 8 4825 1 1 6 ASN HD22 H 6.152 6.046 8.376 1.00 . A A . 6 ASN HD22 1 1 8 4826 1 1 6 ASN N N 6.071 4.708 4.411 1.00 . A A . 6 ASN N 1 1 8 4827 1 1 6 ASN ND2 N 6.353 5.251 7.788 1.00 . A A . 6 ASN ND2 1 1 8 4828 1 1 6 ASN O O 7.076 2.462 3.232 1.00 . A A . 6 ASN O 1 1 8 4829 1 1 6 ASN OD1 O 8.253 6.183 7.024 1.00 . A A . 6 ASN OD1 1 1 8 4830 1 1 7 THR C C 9.436 0.545 3.802 1.00 . A A . 7 THR C 1 1 8 4831 1 1 7 THR CA C 9.858 1.838 3.095 1.00 . A A . 7 THR CA 1 1 8 4832 1 1 7 THR CB C 11.382 2.026 3.124 1.00 . A A . 7 THR CB 1 1 8 4833 1 1 7 THR CG2 C 12.089 1.019 2.210 1.00 . A A . 7 THR CG2 1 1 8 4834 1 1 7 THR H H 9.838 3.649 4.172 1.00 . A A . 7 THR H 1 1 8 4835 1 1 7 THR HA H 9.534 1.800 2.054 1.00 . A A . 7 THR HA 1 1 8 4836 1 1 7 THR HB H 11.744 1.899 4.145 1.00 . A A . 7 THR HB 1 1 8 4837 1 1 7 THR HG1 H 12.654 3.452 2.753 1.00 . A A . 7 THR HG1 1 1 8 4838 1 1 7 THR HG21 H 11.731 1.128 1.186 1.00 . A A . 7 THR HG21 1 1 8 4839 1 1 7 THR HG22 H 13.164 1.198 2.231 1.00 . A A . 7 THR HG22 1 1 8 4840 1 1 7 THR HG23 H 11.899 0.001 2.549 1.00 . A A . 7 THR HG23 1 1 8 4841 1 1 7 THR N N 9.223 2.988 3.719 1.00 . A A . 7 THR N 1 1 8 4842 1 1 7 THR O O 9.303 -0.491 3.156 1.00 . A A . 7 THR O 1 1 8 4843 1 1 7 THR OG1 O 11.703 3.337 2.699 1.00 . A A . 7 THR OG1 1 1 8 4844 1 1 8 THR C C 7.221 -0.828 5.361 1.00 . A A . 8 THR C 1 1 8 4845 1 1 8 THR CA C 8.630 -0.503 5.876 1.00 . A A . 8 THR CA 1 1 8 4846 1 1 8 THR CB C 8.626 -0.173 7.376 1.00 . A A . 8 THR CB 1 1 8 4847 1 1 8 THR CG2 C 8.205 -1.393 8.202 1.00 . A A . 8 THR CG2 1 1 8 4848 1 1 8 THR H H 9.336 1.481 5.604 1.00 . A A . 8 THR H 1 1 8 4849 1 1 8 THR HA H 9.271 -1.373 5.728 1.00 . A A . 8 THR HA 1 1 8 4850 1 1 8 THR HB H 7.939 0.652 7.575 1.00 . A A . 8 THR HB 1 1 8 4851 1 1 8 THR HG1 H 10.178 1.012 7.327 1.00 . A A . 8 THR HG1 1 1 8 4852 1 1 8 THR HG21 H 8.265 -1.155 9.264 1.00 . A A . 8 THR HG21 1 1 8 4853 1 1 8 THR HG22 H 7.179 -1.677 7.966 1.00 . A A . 8 THR HG22 1 1 8 4854 1 1 8 THR HG23 H 8.867 -2.235 7.990 1.00 . A A . 8 THR HG23 1 1 8 4855 1 1 8 THR N N 9.195 0.607 5.119 1.00 . A A . 8 THR N 1 1 8 4856 1 1 8 THR O O 6.861 -1.996 5.245 1.00 . A A . 8 THR O 1 1 8 4857 1 1 8 THR OG1 O 9.924 0.209 7.788 1.00 . A A . 8 THR OG1 1 1 8 4858 1 1 9 GLY C C 5.277 -0.715 3.067 1.00 . A A . 9 GLY C 1 1 8 4859 1 1 9 GLY CA C 5.138 0.033 4.391 1.00 . A A . 9 GLY CA 1 1 8 4860 1 1 9 GLY H H 6.790 1.143 5.110 1.00 . A A . 9 GLY H 1 1 8 4861 1 1 9 GLY HA2 H 4.479 -0.518 5.063 1.00 . A A . 9 GLY HA2 1 1 8 4862 1 1 9 GLY HA3 H 4.703 1.010 4.197 1.00 . A A . 9 GLY HA3 1 1 8 4863 1 1 9 GLY N N 6.436 0.202 5.022 1.00 . A A . 9 GLY N 1 1 8 4864 1 1 9 GLY O O 4.583 -1.704 2.844 1.00 . A A . 9 GLY O 1 1 8 4865 1 1 10 ARG C C 6.894 -2.397 1.174 1.00 . A A . 10 ARG C 1 1 8 4866 1 1 10 ARG CA C 6.488 -0.942 0.945 1.00 . A A . 10 ARG CA 1 1 8 4867 1 1 10 ARG CB C 7.576 -0.198 0.156 1.00 . A A . 10 ARG CB 1 1 8 4868 1 1 10 ARG CD C 6.156 0.954 -1.609 1.00 . A A . 10 ARG CD 1 1 8 4869 1 1 10 ARG CG C 7.092 1.142 -0.408 1.00 . A A . 10 ARG CG 1 1 8 4870 1 1 10 ARG CZ C 4.683 2.470 -2.955 1.00 . A A . 10 ARG CZ 1 1 8 4871 1 1 10 ARG H H 6.735 0.557 2.448 1.00 . A A . 10 ARG H 1 1 8 4872 1 1 10 ARG HA H 5.572 -0.963 0.360 1.00 . A A . 10 ARG HA 1 1 8 4873 1 1 10 ARG HB2 H 8.429 -0.016 0.807 1.00 . A A . 10 ARG HB2 1 1 8 4874 1 1 10 ARG HB3 H 7.912 -0.820 -0.674 1.00 . A A . 10 ARG HB3 1 1 8 4875 1 1 10 ARG HD2 H 6.694 0.441 -2.408 1.00 . A A . 10 ARG HD2 1 1 8 4876 1 1 10 ARG HD3 H 5.296 0.352 -1.327 1.00 . A A . 10 ARG HD3 1 1 8 4877 1 1 10 ARG HE H 6.195 3.074 -1.764 1.00 . A A . 10 ARG HE 1 1 8 4878 1 1 10 ARG HG2 H 6.593 1.713 0.375 1.00 . A A . 10 ARG HG2 1 1 8 4879 1 1 10 ARG HG3 H 7.964 1.707 -0.742 1.00 . A A . 10 ARG HG3 1 1 8 4880 1 1 10 ARG HH11 H 4.163 0.505 -3.160 1.00 . A A . 10 ARG HH11 1 1 8 4881 1 1 10 ARG HH12 H 3.200 1.634 -4.083 1.00 . A A . 10 ARG HH12 1 1 8 4882 1 1 10 ARG HH21 H 4.944 4.487 -2.927 1.00 . A A . 10 ARG HH21 1 1 8 4883 1 1 10 ARG HH22 H 3.636 3.922 -3.952 1.00 . A A . 10 ARG HH22 1 1 8 4884 1 1 10 ARG N N 6.197 -0.266 2.204 1.00 . A A . 10 ARG N 1 1 8 4885 1 1 10 ARG NE N 5.697 2.257 -2.101 1.00 . A A . 10 ARG NE 1 1 8 4886 1 1 10 ARG NH1 N 3.954 1.454 -3.438 1.00 . A A . 10 ARG NH1 1 1 8 4887 1 1 10 ARG NH2 N 4.404 3.724 -3.325 1.00 . A A . 10 ARG NH2 1 1 8 4888 1 1 10 ARG O O 6.415 -3.274 0.465 1.00 . A A . 10 ARG O 1 1 8 4889 1 1 11 ASN C C 7.010 -4.904 2.844 1.00 . A A . 11 ASN C 1 1 8 4890 1 1 11 ASN CA C 8.200 -4.004 2.503 1.00 . A A . 11 ASN CA 1 1 8 4891 1 1 11 ASN CB C 9.216 -3.927 3.650 1.00 . A A . 11 ASN CB 1 1 8 4892 1 1 11 ASN CG C 9.532 -5.296 4.244 1.00 . A A . 11 ASN CG 1 1 8 4893 1 1 11 ASN H H 8.112 -1.892 2.711 1.00 . A A . 11 ASN H 1 1 8 4894 1 1 11 ASN HA H 8.705 -4.432 1.633 1.00 . A A . 11 ASN HA 1 1 8 4895 1 1 11 ASN HB2 H 10.140 -3.484 3.279 1.00 . A A . 11 ASN HB2 1 1 8 4896 1 1 11 ASN HB3 H 8.830 -3.288 4.440 1.00 . A A . 11 ASN HB3 1 1 8 4897 1 1 11 ASN HD21 H 8.448 -4.876 5.916 1.00 . A A . 11 ASN HD21 1 1 8 4898 1 1 11 ASN HD22 H 9.223 -6.442 5.894 1.00 . A A . 11 ASN HD22 1 1 8 4899 1 1 11 ASN N N 7.754 -2.661 2.161 1.00 . A A . 11 ASN N 1 1 8 4900 1 1 11 ASN ND2 N 9.020 -5.561 5.448 1.00 . A A . 11 ASN ND2 1 1 8 4901 1 1 11 ASN O O 6.862 -5.964 2.240 1.00 . A A . 11 ASN O 1 1 8 4902 1 1 11 ASN OD1 O 10.234 -6.097 3.631 1.00 . A A . 11 ASN OD1 1 1 8 4903 1 1 12 ILE C C 4.060 -5.508 3.042 1.00 . A A . 12 ILE C 1 1 8 4904 1 1 12 ILE CA C 5.011 -5.278 4.221 1.00 . A A . 12 ILE CA 1 1 8 4905 1 1 12 ILE CB C 4.311 -4.601 5.416 1.00 . A A . 12 ILE CB 1 1 8 4906 1 1 12 ILE CD1 C 4.786 -3.583 7.712 1.00 . A A . 12 ILE CD1 1 1 8 4907 1 1 12 ILE CG1 C 5.260 -4.558 6.630 1.00 . A A . 12 ILE CG1 1 1 8 4908 1 1 12 ILE CG2 C 3.028 -5.365 5.787 1.00 . A A . 12 ILE CG2 1 1 8 4909 1 1 12 ILE H H 6.304 -3.584 4.226 1.00 . A A . 12 ILE H 1 1 8 4910 1 1 12 ILE HA H 5.372 -6.252 4.555 1.00 . A A . 12 ILE HA 1 1 8 4911 1 1 12 ILE HB H 4.049 -3.580 5.134 1.00 . A A . 12 ILE HB 1 1 8 4912 1 1 12 ILE HD11 H 4.649 -2.590 7.282 1.00 . A A . 12 ILE HD11 1 1 8 4913 1 1 12 ILE HD12 H 3.851 -3.918 8.159 1.00 . A A . 12 ILE HD12 1 1 8 4914 1 1 12 ILE HD13 H 5.542 -3.528 8.496 1.00 . A A . 12 ILE HD13 1 1 8 4915 1 1 12 ILE HG12 H 5.356 -5.557 7.056 1.00 . A A . 12 ILE HG12 1 1 8 4916 1 1 12 ILE HG13 H 6.252 -4.233 6.325 1.00 . A A . 12 ILE HG13 1 1 8 4917 1 1 12 ILE HG21 H 3.265 -6.410 5.993 1.00 . A A . 12 ILE HG21 1 1 8 4918 1 1 12 ILE HG22 H 2.559 -4.932 6.669 1.00 . A A . 12 ILE HG22 1 1 8 4919 1 1 12 ILE HG23 H 2.301 -5.324 4.976 1.00 . A A . 12 ILE HG23 1 1 8 4920 1 1 12 ILE N N 6.159 -4.488 3.790 1.00 . A A . 12 ILE N 1 1 8 4921 1 1 12 ILE O O 3.611 -6.632 2.821 1.00 . A A . 12 ILE O 1 1 8 4922 1 1 13 TYR C C 3.430 -5.525 0.097 1.00 . A A . 13 TYR C 1 1 8 4923 1 1 13 TYR CA C 2.922 -4.490 1.103 1.00 . A A . 13 TYR CA 1 1 8 4924 1 1 13 TYR CB C 2.843 -3.091 0.479 1.00 . A A . 13 TYR CB 1 1 8 4925 1 1 13 TYR CD1 C 0.604 -3.238 -0.679 1.00 . A A . 13 TYR CD1 1 1 8 4926 1 1 13 TYR CD2 C 2.566 -2.706 -2.016 1.00 . A A . 13 TYR CD2 1 1 8 4927 1 1 13 TYR CE1 C -0.201 -3.148 -1.825 1.00 . A A . 13 TYR CE1 1 1 8 4928 1 1 13 TYR CE2 C 1.757 -2.610 -3.164 1.00 . A A . 13 TYR CE2 1 1 8 4929 1 1 13 TYR CG C 1.987 -3.009 -0.768 1.00 . A A . 13 TYR CG 1 1 8 4930 1 1 13 TYR CZ C 0.370 -2.818 -3.064 1.00 . A A . 13 TYR CZ 1 1 8 4931 1 1 13 TYR H H 4.183 -3.553 2.523 1.00 . A A . 13 TYR H 1 1 8 4932 1 1 13 TYR HA H 1.924 -4.782 1.429 1.00 . A A . 13 TYR HA 1 1 8 4933 1 1 13 TYR HB2 H 2.426 -2.405 1.219 1.00 . A A . 13 TYR HB2 1 1 8 4934 1 1 13 TYR HB3 H 3.850 -2.750 0.244 1.00 . A A . 13 TYR HB3 1 1 8 4935 1 1 13 TYR HD1 H 0.157 -3.478 0.273 1.00 . A A . 13 TYR HD1 1 1 8 4936 1 1 13 TYR HD2 H 3.629 -2.538 -2.097 1.00 . A A . 13 TYR HD2 1 1 8 4937 1 1 13 TYR HE1 H -1.262 -3.323 -1.749 1.00 . A A . 13 TYR HE1 1 1 8 4938 1 1 13 TYR HE2 H 2.204 -2.366 -4.117 1.00 . A A . 13 TYR HE2 1 1 8 4939 1 1 13 TYR HH H -1.358 -2.765 -3.941 1.00 . A A . 13 TYR HH 1 1 8 4940 1 1 13 TYR N N 3.775 -4.446 2.280 1.00 . A A . 13 TYR N 1 1 8 4941 1 1 13 TYR O O 2.669 -6.391 -0.323 1.00 . A A . 13 TYR O 1 1 8 4942 1 1 13 TYR OH O -0.425 -2.700 -4.166 1.00 . A A . 13 TYR OH 1 1 8 4943 1 1 14 ASN C C 5.343 -7.791 -0.737 1.00 . A A . 14 ASN C 1 1 8 4944 1 1 14 ASN CA C 5.349 -6.343 -1.230 1.00 . A A . 14 ASN CA 1 1 8 4945 1 1 14 ASN CB C 6.776 -5.870 -1.546 1.00 . A A . 14 ASN CB 1 1 8 4946 1 1 14 ASN CG C 6.790 -4.830 -2.664 1.00 . A A . 14 ASN CG 1 1 8 4947 1 1 14 ASN H H 5.284 -4.716 0.130 1.00 . A A . 14 ASN H 1 1 8 4948 1 1 14 ASN HA H 4.776 -6.315 -2.158 1.00 . A A . 14 ASN HA 1 1 8 4949 1 1 14 ASN HB2 H 7.262 -5.481 -0.651 1.00 . A A . 14 ASN HB2 1 1 8 4950 1 1 14 ASN HB3 H 7.363 -6.718 -1.895 1.00 . A A . 14 ASN HB3 1 1 8 4951 1 1 14 ASN HD21 H 6.153 -3.361 -1.409 1.00 . A A . 14 ASN HD21 1 1 8 4952 1 1 14 ASN HD22 H 6.419 -2.881 -3.076 1.00 . A A . 14 ASN HD22 1 1 8 4953 1 1 14 ASN N N 4.712 -5.444 -0.275 1.00 . A A . 14 ASN N 1 1 8 4954 1 1 14 ASN ND2 N 6.414 -3.589 -2.358 1.00 . A A . 14 ASN ND2 1 1 8 4955 1 1 14 ASN O O 5.063 -8.696 -1.520 1.00 . A A . 14 ASN O 1 1 8 4956 1 1 14 ASN OD1 O 7.133 -5.145 -3.800 1.00 . A A . 14 ASN OD1 1 1 8 4957 1 1 15 THR C C 4.200 -9.958 1.022 1.00 . A A . 15 THR C 1 1 8 4958 1 1 15 THR CA C 5.607 -9.362 1.130 1.00 . A A . 15 THR CA 1 1 8 4959 1 1 15 THR CB C 6.101 -9.311 2.583 1.00 . A A . 15 THR CB 1 1 8 4960 1 1 15 THR CG2 C 6.105 -10.700 3.232 1.00 . A A . 15 THR CG2 1 1 8 4961 1 1 15 THR H H 5.881 -7.250 1.153 1.00 . A A . 15 THR H 1 1 8 4962 1 1 15 THR HA H 6.291 -9.996 0.564 1.00 . A A . 15 THR HA 1 1 8 4963 1 1 15 THR HB H 5.460 -8.648 3.168 1.00 . A A . 15 THR HB 1 1 8 4964 1 1 15 THR HG1 H 7.697 -8.692 3.515 1.00 . A A . 15 THR HG1 1 1 8 4965 1 1 15 THR HG21 H 6.523 -10.634 4.237 1.00 . A A . 15 THR HG21 1 1 8 4966 1 1 15 THR HG22 H 5.089 -11.091 3.306 1.00 . A A . 15 THR HG22 1 1 8 4967 1 1 15 THR HG23 H 6.712 -11.386 2.639 1.00 . A A . 15 THR HG23 1 1 8 4968 1 1 15 THR N N 5.637 -8.023 0.548 1.00 . A A . 15 THR N 1 1 8 4969 1 1 15 THR O O 4.044 -11.102 0.604 1.00 . A A . 15 THR O 1 1 8 4970 1 1 15 THR OG1 O 7.418 -8.803 2.603 1.00 . A A . 15 THR OG1 1 1 8 4971 1 1 16 CYS C C 1.319 -9.817 -0.111 1.00 . A A . 16 CYS C 1 1 8 4972 1 1 16 CYS CA C 1.783 -9.577 1.332 1.00 . A A . 16 CYS CA 1 1 8 4973 1 1 16 CYS CB C 0.953 -8.517 2.057 1.00 . A A . 16 CYS CB 1 1 8 4974 1 1 16 CYS H H 3.386 -8.238 1.714 1.00 . A A . 16 CYS H 1 1 8 4975 1 1 16 CYS HA H 1.676 -10.513 1.883 1.00 . A A . 16 CYS HA 1 1 8 4976 1 1 16 CYS HB2 H 1.313 -8.468 3.085 1.00 . A A . 16 CYS HB2 1 1 8 4977 1 1 16 CYS HB3 H 1.129 -7.545 1.599 1.00 . A A . 16 CYS HB3 1 1 8 4978 1 1 16 CYS N N 3.182 -9.174 1.384 1.00 . A A . 16 CYS N 1 1 8 4979 1 1 16 CYS O O 0.558 -10.749 -0.366 1.00 . A A . 16 CYS O 1 1 8 4980 1 1 16 CYS SG S -0.835 -8.800 2.133 1.00 . A A . 16 CYS SG 1 1 8 4981 1 1 17 ARG C C 2.125 -10.474 -2.986 1.00 . A A . 17 ARG C 1 1 8 4982 1 1 17 ARG CA C 1.527 -9.162 -2.480 1.00 . A A . 17 ARG CA 1 1 8 4983 1 1 17 ARG CB C 2.078 -7.963 -3.272 1.00 . A A . 17 ARG CB 1 1 8 4984 1 1 17 ARG CD C 0.373 -6.252 -4.167 1.00 . A A . 17 ARG CD 1 1 8 4985 1 1 17 ARG CG C 1.290 -6.670 -3.007 1.00 . A A . 17 ARG CG 1 1 8 4986 1 1 17 ARG CZ C -1.365 -8.050 -4.172 1.00 . A A . 17 ARG CZ 1 1 8 4987 1 1 17 ARG H H 2.390 -8.230 -0.777 1.00 . A A . 17 ARG H 1 1 8 4988 1 1 17 ARG HA H 0.452 -9.223 -2.626 1.00 . A A . 17 ARG HA 1 1 8 4989 1 1 17 ARG HB2 H 3.116 -7.807 -2.980 1.00 . A A . 17 ARG HB2 1 1 8 4990 1 1 17 ARG HB3 H 2.075 -8.190 -4.338 1.00 . A A . 17 ARG HB3 1 1 8 4991 1 1 17 ARG HD2 H -0.324 -5.490 -3.821 1.00 . A A . 17 ARG HD2 1 1 8 4992 1 1 17 ARG HD3 H 0.989 -5.812 -4.951 1.00 . A A . 17 ARG HD3 1 1 8 4993 1 1 17 ARG HE H -0.096 -7.638 -5.697 1.00 . A A . 17 ARG HE 1 1 8 4994 1 1 17 ARG HG2 H 0.705 -6.771 -2.093 1.00 . A A . 17 ARG HG2 1 1 8 4995 1 1 17 ARG HG3 H 2.000 -5.856 -2.855 1.00 . A A . 17 ARG HG3 1 1 8 4996 1 1 17 ARG HH11 H -1.287 -7.027 -2.402 1.00 . A A . 17 ARG HH11 1 1 8 4997 1 1 17 ARG HH12 H -2.445 -8.333 -2.470 1.00 . A A . 17 ARG HH12 1 1 8 4998 1 1 17 ARG HH21 H -1.739 -9.245 -5.791 1.00 . A A . 17 ARG HH21 1 1 8 4999 1 1 17 ARG HH22 H -2.691 -9.582 -4.363 1.00 . A A . 17 ARG HH22 1 1 8 5000 1 1 17 ARG N N 1.787 -8.993 -1.057 1.00 . A A . 17 ARG N 1 1 8 5001 1 1 17 ARG NE N -0.371 -7.370 -4.763 1.00 . A A . 17 ARG NE 1 1 8 5002 1 1 17 ARG NH1 N -1.737 -7.767 -2.918 1.00 . A A . 17 ARG NH1 1 1 8 5003 1 1 17 ARG NH2 N -1.986 -9.031 -4.837 1.00 . A A . 17 ARG NH2 1 1 8 5004 1 1 17 ARG O O 1.462 -11.204 -3.720 1.00 . A A . 17 ARG O 1 1 8 5005 1 1 18 PHE C C 3.344 -13.229 -2.376 1.00 . A A . 18 PHE C 1 1 8 5006 1 1 18 PHE CA C 4.055 -12.003 -2.957 1.00 . A A . 18 PHE CA 1 1 8 5007 1 1 18 PHE CB C 5.518 -11.931 -2.508 1.00 . A A . 18 PHE CB 1 1 8 5008 1 1 18 PHE CD1 C 6.849 -13.229 -4.228 1.00 . A A . 18 PHE CD1 1 1 8 5009 1 1 18 PHE CD2 C 6.537 -14.200 -2.016 1.00 . A A . 18 PHE CD2 1 1 8 5010 1 1 18 PHE CE1 C 7.571 -14.367 -4.625 1.00 . A A . 18 PHE CE1 1 1 8 5011 1 1 18 PHE CE2 C 7.256 -15.339 -2.416 1.00 . A A . 18 PHE CE2 1 1 8 5012 1 1 18 PHE CG C 6.339 -13.138 -2.919 1.00 . A A . 18 PHE CG 1 1 8 5013 1 1 18 PHE CZ C 7.776 -15.422 -3.719 1.00 . A A . 18 PHE CZ 1 1 8 5014 1 1 18 PHE H H 3.855 -10.127 -1.981 1.00 . A A . 18 PHE H 1 1 8 5015 1 1 18 PHE HA H 4.042 -12.082 -4.046 1.00 . A A . 18 PHE HA 1 1 8 5016 1 1 18 PHE HB2 H 5.974 -11.041 -2.946 1.00 . A A . 18 PHE HB2 1 1 8 5017 1 1 18 PHE HB3 H 5.560 -11.824 -1.424 1.00 . A A . 18 PHE HB3 1 1 8 5018 1 1 18 PHE HD1 H 6.682 -12.428 -4.932 1.00 . A A . 18 PHE HD1 1 1 8 5019 1 1 18 PHE HD2 H 6.131 -14.149 -1.016 1.00 . A A . 18 PHE HD2 1 1 8 5020 1 1 18 PHE HE1 H 7.967 -14.431 -5.629 1.00 . A A . 18 PHE HE1 1 1 8 5021 1 1 18 PHE HE2 H 7.405 -16.154 -1.722 1.00 . A A . 18 PHE HE2 1 1 8 5022 1 1 18 PHE HZ H 8.329 -16.298 -4.026 1.00 . A A . 18 PHE HZ 1 1 8 5023 1 1 18 PHE N N 3.366 -10.776 -2.585 1.00 . A A . 18 PHE N 1 1 8 5024 1 1 18 PHE O O 3.162 -14.221 -3.078 1.00 . A A . 18 PHE O 1 1 8 5025 1 1 19 ALA C C 0.851 -14.455 -1.183 1.00 . A A . 19 ALA C 1 1 8 5026 1 1 19 ALA CA C 2.165 -14.201 -0.441 1.00 . A A . 19 ALA CA 1 1 8 5027 1 1 19 ALA CB C 1.908 -13.814 1.018 1.00 . A A . 19 ALA CB 1 1 8 5028 1 1 19 ALA H H 3.117 -12.309 -0.578 1.00 . A A . 19 ALA H 1 1 8 5029 1 1 19 ALA HA H 2.755 -15.119 -0.447 1.00 . A A . 19 ALA HA 1 1 8 5030 1 1 19 ALA HB1 H 1.322 -12.897 1.070 1.00 . A A . 19 ALA HB1 1 1 8 5031 1 1 19 ALA HB2 H 1.361 -14.615 1.516 1.00 . A A . 19 ALA HB2 1 1 8 5032 1 1 19 ALA HB3 H 2.859 -13.662 1.531 1.00 . A A . 19 ALA HB3 1 1 8 5033 1 1 19 ALA N N 2.931 -13.153 -1.103 1.00 . A A . 19 ALA N 1 1 8 5034 1 1 19 ALA O O 0.491 -15.608 -1.420 1.00 . A A . 19 ALA O 1 1 8 5035 1 1 20 GLY C C -2.272 -12.942 -1.742 1.00 . A A . 20 GLY C 1 1 8 5036 1 1 20 GLY CA C -1.001 -13.408 -2.445 1.00 . A A . 20 GLY CA 1 1 8 5037 1 1 20 GLY H H 0.517 -12.463 -1.314 1.00 . A A . 20 GLY H 1 1 8 5038 1 1 20 GLY HA2 H -0.812 -12.733 -3.280 1.00 . A A . 20 GLY HA2 1 1 8 5039 1 1 20 GLY HA3 H -1.161 -14.407 -2.850 1.00 . A A . 20 GLY HA3 1 1 8 5040 1 1 20 GLY N N 0.160 -13.375 -1.569 1.00 . A A . 20 GLY N 1 1 8 5041 1 1 20 GLY O O -3.339 -13.508 -1.973 1.00 . A A . 20 GLY O 1 1 8 5042 1 1 21 GLY C C -3.895 -10.245 -1.522 1.00 . A A . 21 GLY C 1 1 8 5043 1 1 21 GLY CA C -3.351 -11.173 -0.432 1.00 . A A . 21 GLY CA 1 1 8 5044 1 1 21 GLY H H -1.271 -11.465 -0.762 1.00 . A A . 21 GLY H 1 1 8 5045 1 1 21 GLY HA2 H -4.121 -11.883 -0.130 1.00 . A A . 21 GLY HA2 1 1 8 5046 1 1 21 GLY HA3 H -3.065 -10.581 0.436 1.00 . A A . 21 GLY HA3 1 1 8 5047 1 1 21 GLY N N -2.179 -11.880 -0.928 1.00 . A A . 21 GLY N 1 1 8 5048 1 1 21 GLY O O -3.279 -10.101 -2.575 1.00 . A A . 21 GLY O 1 1 8 5049 1 1 22 SER C C -4.802 -7.273 -2.017 1.00 . A A . 22 SER C 1 1 8 5050 1 1 22 SER CA C -5.568 -8.585 -2.190 1.00 . A A . 22 SER CA 1 1 8 5051 1 1 22 SER CB C -7.060 -8.376 -1.929 1.00 . A A . 22 SER CB 1 1 8 5052 1 1 22 SER H H -5.529 -9.749 -0.409 1.00 . A A . 22 SER H 1 1 8 5053 1 1 22 SER HA H -5.457 -8.936 -3.217 1.00 . A A . 22 SER HA 1 1 8 5054 1 1 22 SER HB2 H -7.202 -7.947 -0.938 1.00 . A A . 22 SER HB2 1 1 8 5055 1 1 22 SER HB3 H -7.466 -7.688 -2.670 1.00 . A A . 22 SER HB3 1 1 8 5056 1 1 22 SER HG H -8.682 -9.454 -1.859 1.00 . A A . 22 SER HG 1 1 8 5057 1 1 22 SER N N -5.035 -9.589 -1.274 1.00 . A A . 22 SER N 1 1 8 5058 1 1 22 SER O O -4.294 -7.000 -0.932 1.00 . A A . 22 SER O 1 1 8 5059 1 1 22 SER OG O -7.747 -9.608 -2.012 1.00 . A A . 22 SER OG 1 1 8 5060 1 1 23 ARG C C -4.445 -4.297 -1.942 1.00 . A A . 23 ARG C 1 1 8 5061 1 1 23 ARG CA C -3.976 -5.205 -3.077 1.00 . A A . 23 ARG CA 1 1 8 5062 1 1 23 ARG CB C -4.121 -4.481 -4.420 1.00 . A A . 23 ARG CB 1 1 8 5063 1 1 23 ARG CD C -3.236 -4.356 -6.776 1.00 . A A . 23 ARG CD 1 1 8 5064 1 1 23 ARG CG C -3.473 -5.265 -5.568 1.00 . A A . 23 ARG CG 1 1 8 5065 1 1 23 ARG CZ C -1.960 -2.228 -7.135 1.00 . A A . 23 ARG CZ 1 1 8 5066 1 1 23 ARG H H -5.143 -6.763 -3.948 1.00 . A A . 23 ARG H 1 1 8 5067 1 1 23 ARG HA H -2.916 -5.409 -2.921 1.00 . A A . 23 ARG HA 1 1 8 5068 1 1 23 ARG HB2 H -5.174 -4.308 -4.648 1.00 . A A . 23 ARG HB2 1 1 8 5069 1 1 23 ARG HB3 H -3.629 -3.513 -4.319 1.00 . A A . 23 ARG HB3 1 1 8 5070 1 1 23 ARG HD2 H -2.936 -4.971 -7.624 1.00 . A A . 23 ARG HD2 1 1 8 5071 1 1 23 ARG HD3 H -4.169 -3.845 -7.020 1.00 . A A . 23 ARG HD3 1 1 8 5072 1 1 23 ARG HE H -1.565 -3.602 -5.709 1.00 . A A . 23 ARG HE 1 1 8 5073 1 1 23 ARG HG2 H -2.514 -5.671 -5.248 1.00 . A A . 23 ARG HG2 1 1 8 5074 1 1 23 ARG HG3 H -4.125 -6.088 -5.857 1.00 . A A . 23 ARG HG3 1 1 8 5075 1 1 23 ARG HH11 H -3.379 -2.525 -8.574 1.00 . A A . 23 ARG HH11 1 1 8 5076 1 1 23 ARG HH12 H -2.509 -1.018 -8.690 1.00 . A A . 23 ARG HH12 1 1 8 5077 1 1 23 ARG HH21 H -0.482 -1.668 -5.855 1.00 . A A . 23 ARG HH21 1 1 8 5078 1 1 23 ARG HH22 H -0.898 -0.473 -7.063 1.00 . A A . 23 ARG HH22 1 1 8 5079 1 1 23 ARG N N -4.707 -6.470 -3.085 1.00 . A A . 23 ARG N 1 1 8 5080 1 1 23 ARG NE N -2.167 -3.390 -6.493 1.00 . A A . 23 ARG NE 1 1 8 5081 1 1 23 ARG NH1 N -2.680 -1.891 -8.214 1.00 . A A . 23 ARG NH1 1 1 8 5082 1 1 23 ARG NH2 N -1.018 -1.399 -6.671 1.00 . A A . 23 ARG NH2 1 1 8 5083 1 1 23 ARG O O -3.633 -3.852 -1.137 1.00 . A A . 23 ARG O 1 1 8 5084 1 1 24 GLU C C -6.047 -3.711 0.544 1.00 . A A . 24 GLU C 1 1 8 5085 1 1 24 GLU CA C -6.350 -3.182 -0.860 1.00 . A A . 24 GLU CA 1 1 8 5086 1 1 24 GLU CB C -7.861 -3.063 -1.095 1.00 . A A . 24 GLU CB 1 1 8 5087 1 1 24 GLU CD C -9.669 -2.170 -2.612 1.00 . A A . 24 GLU CD 1 1 8 5088 1 1 24 GLU CG C -8.168 -2.367 -2.429 1.00 . A A . 24 GLU CG 1 1 8 5089 1 1 24 GLU H H -6.358 -4.429 -2.582 1.00 . A A . 24 GLU H 1 1 8 5090 1 1 24 GLU HA H -5.916 -2.184 -0.944 1.00 . A A . 24 GLU HA 1 1 8 5091 1 1 24 GLU HB2 H -8.317 -4.055 -1.090 1.00 . A A . 24 GLU HB2 1 1 8 5092 1 1 24 GLU HB3 H -8.293 -2.478 -0.283 1.00 . A A . 24 GLU HB3 1 1 8 5093 1 1 24 GLU HE2 H -9.556 -0.554 -1.524 1.00 . A A . 24 GLU HE2 1 1 8 5094 1 1 24 GLU HG2 H -7.678 -1.394 -2.458 1.00 . A A . 24 GLU HG2 1 1 8 5095 1 1 24 GLU HG3 H -7.794 -2.969 -3.258 1.00 . A A . 24 GLU HG3 1 1 8 5096 1 1 24 GLU N N -5.752 -4.031 -1.879 1.00 . A A . 24 GLU N 1 1 8 5097 1 1 24 GLU O O -5.631 -2.947 1.408 1.00 . A A . 24 GLU O 1 1 8 5098 1 1 24 GLU OE1 O -10.305 -2.976 -3.288 1.00 . A A . 24 GLU OE1 1 1 8 5099 1 1 24 GLU OE2 O -10.208 -1.079 -1.993 1.00 . A A . 24 GLU OE2 1 1 8 5100 1 1 25 ARG C C -4.579 -5.489 2.520 1.00 . A A . 25 ARG C 1 1 8 5101 1 1 25 ARG CA C -6.031 -5.653 2.065 1.00 . A A . 25 ARG CA 1 1 8 5102 1 1 25 ARG CB C -6.453 -7.126 1.962 1.00 . A A . 25 ARG CB 1 1 8 5103 1 1 25 ARG CD C -5.699 -8.052 4.230 1.00 . A A . 25 ARG CD 1 1 8 5104 1 1 25 ARG CG C -6.872 -7.758 3.293 1.00 . A A . 25 ARG CG 1 1 8 5105 1 1 25 ARG CZ C -5.334 -9.403 6.293 1.00 . A A . 25 ARG CZ 1 1 8 5106 1 1 25 ARG H H -6.560 -5.593 0.007 1.00 . A A . 25 ARG H 1 1 8 5107 1 1 25 ARG HA H -6.680 -5.152 2.788 1.00 . A A . 25 ARG HA 1 1 8 5108 1 1 25 ARG HB2 H -7.334 -7.172 1.323 1.00 . A A . 25 ARG HB2 1 1 8 5109 1 1 25 ARG HB3 H -5.670 -7.723 1.493 1.00 . A A . 25 ARG HB3 1 1 8 5110 1 1 25 ARG HD2 H -4.917 -8.571 3.674 1.00 . A A . 25 ARG HD2 1 1 8 5111 1 1 25 ARG HD3 H -5.305 -7.120 4.634 1.00 . A A . 25 ARG HD3 1 1 8 5112 1 1 25 ARG HE H -7.129 -9.103 5.384 1.00 . A A . 25 ARG HE 1 1 8 5113 1 1 25 ARG HG2 H -7.595 -7.115 3.797 1.00 . A A . 25 ARG HG2 1 1 8 5114 1 1 25 ARG HG3 H -7.363 -8.704 3.060 1.00 . A A . 25 ARG HG3 1 1 8 5115 1 1 25 ARG HH11 H -3.630 -8.560 5.554 1.00 . A A . 25 ARG HH11 1 1 8 5116 1 1 25 ARG HH12 H -3.412 -9.533 6.987 1.00 . A A . 25 ARG HH12 1 1 8 5117 1 1 25 ARG HH21 H -6.841 -10.374 7.273 1.00 . A A . 25 ARG HH21 1 1 8 5118 1 1 25 ARG HH22 H -5.254 -10.571 7.971 1.00 . A A . 25 ARG HH22 1 1 8 5119 1 1 25 ARG N N -6.239 -5.015 0.770 1.00 . A A . 25 ARG N 1 1 8 5120 1 1 25 ARG NE N -6.141 -8.893 5.348 1.00 . A A . 25 ARG NE 1 1 8 5121 1 1 25 ARG NH1 N -4.020 -9.146 6.279 1.00 . A A . 25 ARG NH1 1 1 8 5122 1 1 25 ARG NH2 N -5.850 -10.177 7.257 1.00 . A A . 25 ARG NH2 1 1 8 5123 1 1 25 ARG O O -4.324 -5.012 3.625 1.00 . A A . 25 ARG O 1 1 8 5124 1 1 26 CYS C C -1.842 -4.221 2.159 1.00 . A A . 26 CYS C 1 1 8 5125 1 1 26 CYS CA C -2.199 -5.684 1.883 1.00 . A A . 26 CYS CA 1 1 8 5126 1 1 26 CYS CB C -1.422 -6.207 0.670 1.00 . A A . 26 CYS CB 1 1 8 5127 1 1 26 CYS H H -3.917 -6.240 0.765 1.00 . A A . 26 CYS H 1 1 8 5128 1 1 26 CYS HA H -1.916 -6.261 2.764 1.00 . A A . 26 CYS HA 1 1 8 5129 1 1 26 CYS HB2 H -1.776 -5.700 -0.228 1.00 . A A . 26 CYS HB2 1 1 8 5130 1 1 26 CYS HB3 H -0.371 -5.955 0.802 1.00 . A A . 26 CYS HB3 1 1 8 5131 1 1 26 CYS N N -3.628 -5.854 1.654 1.00 . A A . 26 CYS N 1 1 8 5132 1 1 26 CYS O O -1.018 -3.936 3.028 1.00 . A A . 26 CYS O 1 1 8 5133 1 1 26 CYS SG S -1.520 -7.995 0.392 1.00 . A A . 26 CYS SG 1 1 8 5134 1 1 27 ALA C C -2.683 -1.415 2.981 1.00 . A A . 27 ALA C 1 1 8 5135 1 1 27 ALA CA C -2.229 -1.871 1.594 1.00 . A A . 27 ALA CA 1 1 8 5136 1 1 27 ALA CB C -2.912 -1.094 0.476 1.00 . A A . 27 ALA CB 1 1 8 5137 1 1 27 ALA H H -3.112 -3.583 0.707 1.00 . A A . 27 ALA H 1 1 8 5138 1 1 27 ALA HA H -1.161 -1.679 1.495 1.00 . A A . 27 ALA HA 1 1 8 5139 1 1 27 ALA HB1 H -3.994 -1.192 0.537 1.00 . A A . 27 ALA HB1 1 1 8 5140 1 1 27 ALA HB2 H -2.641 -0.043 0.544 1.00 . A A . 27 ALA HB2 1 1 8 5141 1 1 27 ALA HB3 H -2.562 -1.482 -0.480 1.00 . A A . 27 ALA HB3 1 1 8 5142 1 1 27 ALA N N -2.456 -3.293 1.420 1.00 . A A . 27 ALA N 1 1 8 5143 1 1 27 ALA O O -1.917 -0.765 3.680 1.00 . A A . 27 ALA O 1 1 8 5144 1 1 28 LYS C C -3.435 -2.077 5.809 1.00 . A A . 28 LYS C 1 1 8 5145 1 1 28 LYS CA C -4.388 -1.515 4.750 1.00 . A A . 28 LYS CA 1 1 8 5146 1 1 28 LYS CB C -5.795 -2.104 4.936 1.00 . A A . 28 LYS CB 1 1 8 5147 1 1 28 LYS CD C -7.077 -0.779 3.170 1.00 . A A . 28 LYS CD 1 1 8 5148 1 1 28 LYS CE C -8.205 0.227 2.909 1.00 . A A . 28 LYS CE 1 1 8 5149 1 1 28 LYS CG C -6.911 -1.087 4.662 1.00 . A A . 28 LYS CG 1 1 8 5150 1 1 28 LYS H H -4.492 -2.324 2.789 1.00 . A A . 28 LYS H 1 1 8 5151 1 1 28 LYS HA H -4.432 -0.434 4.888 1.00 . A A . 28 LYS HA 1 1 8 5152 1 1 28 LYS HB2 H -5.931 -2.989 4.313 1.00 . A A . 28 LYS HB2 1 1 8 5153 1 1 28 LYS HB3 H -5.893 -2.419 5.974 1.00 . A A . 28 LYS HB3 1 1 8 5154 1 1 28 LYS HD2 H -6.144 -0.399 2.752 1.00 . A A . 28 LYS HD2 1 1 8 5155 1 1 28 LYS HD3 H -7.345 -1.707 2.667 1.00 . A A . 28 LYS HD3 1 1 8 5156 1 1 28 LYS HE2 H -8.375 0.290 1.834 1.00 . A A . 28 LYS HE2 1 1 8 5157 1 1 28 LYS HE3 H -9.121 -0.120 3.387 1.00 . A A . 28 LYS HE3 1 1 8 5158 1 1 28 LYS HG2 H -7.847 -1.511 5.028 1.00 . A A . 28 LYS HG2 1 1 8 5159 1 1 28 LYS HG3 H -6.701 -0.176 5.222 1.00 . A A . 28 LYS HG3 1 1 8 5160 1 1 28 LYS HZ1 H -7.037 1.905 2.948 1.00 . A A . 28 LYS HZ1 1 1 8 5161 1 1 28 LYS HZ2 H -8.638 2.202 3.205 1.00 . A A . 28 LYS HZ2 1 1 8 5162 1 1 28 LYS HZ3 H -7.723 1.541 4.405 1.00 . A A . 28 LYS HZ3 1 1 8 5163 1 1 28 LYS N N -3.897 -1.788 3.406 1.00 . A A . 28 LYS N 1 1 8 5164 1 1 28 LYS NZ N -7.874 1.573 3.406 1.00 . A A . 28 LYS NZ 1 1 8 5165 1 1 28 LYS O O -3.033 -1.348 6.714 1.00 . A A . 28 LYS O 1 1 8 5166 1 1 29 LEU C C -0.873 -3.298 6.778 1.00 . A A . 29 LEU C 1 1 8 5167 1 1 29 LEU CA C -2.187 -4.066 6.607 1.00 . A A . 29 LEU CA 1 1 8 5168 1 1 29 LEU CB C -1.935 -5.484 6.068 1.00 . A A . 29 LEU CB 1 1 8 5169 1 1 29 LEU CD1 C -1.526 -6.660 8.284 1.00 . A A . 29 LEU CD1 1 1 8 5170 1 1 29 LEU CD2 C -0.590 -7.604 6.157 1.00 . A A . 29 LEU CD2 1 1 8 5171 1 1 29 LEU CG C -0.947 -6.316 6.906 1.00 . A A . 29 LEU CG 1 1 8 5172 1 1 29 LEU H H -3.464 -3.893 4.917 1.00 . A A . 29 LEU H 1 1 8 5173 1 1 29 LEU HA H -2.686 -4.136 7.574 1.00 . A A . 29 LEU HA 1 1 8 5174 1 1 29 LEU HB2 H -2.885 -6.017 6.002 1.00 . A A . 29 LEU HB2 1 1 8 5175 1 1 29 LEU HB3 H -1.526 -5.396 5.063 1.00 . A A . 29 LEU HB3 1 1 8 5176 1 1 29 LEU HD11 H -1.668 -5.753 8.872 1.00 . A A . 29 LEU HD11 1 1 8 5177 1 1 29 LEU HD12 H -2.483 -7.171 8.173 1.00 . A A . 29 LEU HD12 1 1 8 5178 1 1 29 LEU HD13 H -0.836 -7.312 8.821 1.00 . A A . 29 LEU HD13 1 1 8 5179 1 1 29 LEU HD21 H -1.475 -8.225 6.030 1.00 . A A . 29 LEU HD21 1 1 8 5180 1 1 29 LEU HD22 H -0.182 -7.361 5.176 1.00 . A A . 29 LEU HD22 1 1 8 5181 1 1 29 LEU HD23 H 0.159 -8.162 6.718 1.00 . A A . 29 LEU HD23 1 1 8 5182 1 1 29 LEU HG H -0.017 -5.764 7.044 1.00 . A A . 29 LEU HG 1 1 8 5183 1 1 29 LEU N N -3.086 -3.366 5.693 1.00 . A A . 29 LEU N 1 1 8 5184 1 1 29 LEU O O -0.387 -3.142 7.896 1.00 . A A . 29 LEU O 1 1 8 5185 1 1 30 SER C C 0.869 -0.686 6.105 1.00 . A A . 30 SER C 1 1 8 5186 1 1 30 SER CA C 0.980 -2.140 5.635 1.00 . A A . 30 SER CA 1 1 8 5187 1 1 30 SER CB C 1.566 -2.217 4.225 1.00 . A A . 30 SER CB 1 1 8 5188 1 1 30 SER H H -0.786 -2.975 4.787 1.00 . A A . 30 SER H 1 1 8 5189 1 1 30 SER HA H 1.673 -2.655 6.302 1.00 . A A . 30 SER HA 1 1 8 5190 1 1 30 SER HB2 H 2.522 -1.699 4.217 1.00 . A A . 30 SER HB2 1 1 8 5191 1 1 30 SER HB3 H 1.718 -3.257 3.942 1.00 . A A . 30 SER HB3 1 1 8 5192 1 1 30 SER HG H -0.102 -2.131 3.236 1.00 . A A . 30 SER HG 1 1 8 5193 1 1 30 SER N N -0.301 -2.832 5.663 1.00 . A A . 30 SER N 1 1 8 5194 1 1 30 SER O O 1.814 -0.162 6.693 1.00 . A A . 30 SER O 1 1 8 5195 1 1 30 SER OG O 0.709 -1.615 3.285 1.00 . A A . 30 SER OG 1 1 8 5196 1 1 31 GLY C C -0.577 2.197 4.786 1.00 . A A . 31 GLY C 1 1 8 5197 1 1 31 GLY CA C -0.517 1.373 6.078 1.00 . A A . 31 GLY CA 1 1 8 5198 1 1 31 GLY H H -0.990 -0.545 5.329 1.00 . A A . 31 GLY H 1 1 8 5199 1 1 31 GLY HA2 H -1.477 1.461 6.587 1.00 . A A . 31 GLY HA2 1 1 8 5200 1 1 31 GLY HA3 H 0.251 1.797 6.727 1.00 . A A . 31 GLY HA3 1 1 8 5201 1 1 31 GLY N N -0.268 -0.038 5.824 1.00 . A A . 31 GLY N 1 1 8 5202 1 1 31 GLY O O -0.807 3.402 4.854 1.00 . A A . 31 GLY O 1 1 8 5203 1 1 32 CYS C C -1.849 2.427 1.836 1.00 . A A . 32 CYS C 1 1 8 5204 1 1 32 CYS CA C -0.409 2.227 2.321 1.00 . A A . 32 CYS CA 1 1 8 5205 1 1 32 CYS CB C 0.393 1.402 1.304 1.00 . A A . 32 CYS CB 1 1 8 5206 1 1 32 CYS H H -0.259 0.562 3.618 1.00 . A A . 32 CYS H 1 1 8 5207 1 1 32 CYS HA H 0.061 3.203 2.421 1.00 . A A . 32 CYS HA 1 1 8 5208 1 1 32 CYS HB2 H -0.175 0.508 1.054 1.00 . A A . 32 CYS HB2 1 1 8 5209 1 1 32 CYS HB3 H 0.502 1.970 0.383 1.00 . A A . 32 CYS HB3 1 1 8 5210 1 1 32 CYS N N -0.382 1.566 3.618 1.00 . A A . 32 CYS N 1 1 8 5211 1 1 32 CYS O O -2.770 1.765 2.315 1.00 . A A . 32 CYS O 1 1 8 5212 1 1 32 CYS SG S 2.040 0.863 1.850 1.00 . A A . 32 CYS SG 1 1 8 5213 1 1 33 LYS C C -3.234 3.088 -1.218 1.00 . A A . 33 LYS C 1 1 8 5214 1 1 33 LYS CA C -3.293 3.638 0.209 1.00 . A A . 33 LYS CA 1 1 8 5215 1 1 33 LYS CB C -3.512 5.156 0.120 1.00 . A A . 33 LYS CB 1 1 8 5216 1 1 33 LYS CD C -4.293 5.677 2.547 1.00 . A A . 33 LYS CD 1 1 8 5217 1 1 33 LYS CE C -3.817 4.563 3.490 1.00 . A A . 33 LYS CE 1 1 8 5218 1 1 33 LYS CG C -3.304 5.965 1.406 1.00 . A A . 33 LYS CG 1 1 8 5219 1 1 33 LYS H H -1.222 3.839 0.539 1.00 . A A . 33 LYS H 1 1 8 5220 1 1 33 LYS HA H -4.128 3.190 0.749 1.00 . A A . 33 LYS HA 1 1 8 5221 1 1 33 LYS HB2 H -2.805 5.557 -0.608 1.00 . A A . 33 LYS HB2 1 1 8 5222 1 1 33 LYS HB3 H -4.518 5.344 -0.257 1.00 . A A . 33 LYS HB3 1 1 8 5223 1 1 33 LYS HD2 H -4.386 6.596 3.125 1.00 . A A . 33 LYS HD2 1 1 8 5224 1 1 33 LYS HD3 H -5.277 5.437 2.141 1.00 . A A . 33 LYS HD3 1 1 8 5225 1 1 33 LYS HE2 H -4.240 3.614 3.165 1.00 . A A . 33 LYS HE2 1 1 8 5226 1 1 33 LYS HE3 H -2.730 4.501 3.479 1.00 . A A . 33 LYS HE3 1 1 8 5227 1 1 33 LYS HG2 H -2.274 5.861 1.748 1.00 . A A . 33 LYS HG2 1 1 8 5228 1 1 33 LYS HG3 H -3.449 7.007 1.118 1.00 . A A . 33 LYS HG3 1 1 8 5229 1 1 33 LYS HZ1 H -5.224 4.908 4.945 1.00 . A A . 33 LYS HZ1 1 1 8 5230 1 1 33 LYS HZ2 H -3.922 4.033 5.461 1.00 . A A . 33 LYS HZ2 1 1 8 5231 1 1 33 LYS HZ3 H -3.775 5.654 5.220 1.00 . A A . 33 LYS HZ3 1 1 8 5232 1 1 33 LYS N N -2.034 3.346 0.881 1.00 . A A . 33 LYS N 1 1 8 5233 1 1 33 LYS NZ N -4.220 4.808 4.886 1.00 . A A . 33 LYS NZ 1 1 8 5234 1 1 33 LYS O O -2.171 3.117 -1.838 1.00 . A A . 33 LYS O 1 1 8 5235 1 1 34 ILE C C -5.750 3.084 -3.677 1.00 . A A . 34 ILE C 1 1 8 5236 1 1 34 ILE CA C -4.579 2.262 -3.138 1.00 . A A . 34 ILE CA 1 1 8 5237 1 1 34 ILE CB C -4.881 0.754 -3.251 1.00 . A A . 34 ILE CB 1 1 8 5238 1 1 34 ILE CD1 C -2.455 -0.137 -3.315 1.00 . A A . 34 ILE CD1 1 1 8 5239 1 1 34 ILE CG1 C -3.801 -0.111 -2.587 1.00 . A A . 34 ILE CG1 1 1 8 5240 1 1 34 ILE CG2 C -5.089 0.326 -4.712 1.00 . A A . 34 ILE CG2 1 1 8 5241 1 1 34 ILE H H -5.199 2.600 -1.151 1.00 . A A . 34 ILE H 1 1 8 5242 1 1 34 ILE HA H -3.692 2.488 -3.730 1.00 . A A . 34 ILE HA 1 1 8 5243 1 1 34 ILE HB H -5.808 0.549 -2.712 1.00 . A A . 34 ILE HB 1 1 8 5244 1 1 34 ILE HD11 H -2.069 0.872 -3.440 1.00 . A A . 34 ILE HD11 1 1 8 5245 1 1 34 ILE HD12 H -1.744 -0.708 -2.718 1.00 . A A . 34 ILE HD12 1 1 8 5246 1 1 34 ILE HD13 H -2.556 -0.615 -4.288 1.00 . A A . 34 ILE HD13 1 1 8 5247 1 1 34 ILE HG12 H -3.642 0.255 -1.577 1.00 . A A . 34 ILE HG12 1 1 8 5248 1 1 34 ILE HG13 H -4.180 -1.129 -2.513 1.00 . A A . 34 ILE HG13 1 1 8 5249 1 1 34 ILE HG21 H -4.235 0.620 -5.322 1.00 . A A . 34 ILE HG21 1 1 8 5250 1 1 34 ILE HG22 H -5.214 -0.755 -4.764 1.00 . A A . 34 ILE HG22 1 1 8 5251 1 1 34 ILE HG23 H -5.987 0.794 -5.119 1.00 . A A . 34 ILE HG23 1 1 8 5252 1 1 34 ILE N N -4.384 2.643 -1.743 1.00 . A A . 34 ILE N 1 1 8 5253 1 1 34 ILE O O -6.898 2.820 -3.323 1.00 . A A . 34 ILE O 1 1 8 5254 1 1 35 ILE C C -6.007 4.879 -6.756 1.00 . A A . 35 ILE C 1 1 8 5255 1 1 35 ILE CA C -6.457 4.804 -5.298 1.00 . A A . 35 ILE CA 1 1 8 5256 1 1 35 ILE CB C -6.723 6.196 -4.689 1.00 . A A . 35 ILE CB 1 1 8 5257 1 1 35 ILE CD1 C -5.803 8.504 -4.145 1.00 . A A . 35 ILE CD1 1 1 8 5258 1 1 35 ILE CG1 C -5.497 7.127 -4.740 1.00 . A A . 35 ILE CG1 1 1 8 5259 1 1 35 ILE CG2 C -7.248 6.050 -3.254 1.00 . A A . 35 ILE CG2 1 1 8 5260 1 1 35 ILE H H -4.492 4.244 -4.771 1.00 . A A . 35 ILE H 1 1 8 5261 1 1 35 ILE HA H -7.398 4.253 -5.281 1.00 . A A . 35 ILE HA 1 1 8 5262 1 1 35 ILE HB H -7.515 6.658 -5.281 1.00 . A A . 35 ILE HB 1 1 8 5263 1 1 35 ILE HD11 H -6.712 8.908 -4.590 1.00 . A A . 35 ILE HD11 1 1 8 5264 1 1 35 ILE HD12 H -5.920 8.437 -3.064 1.00 . A A . 35 ILE HD12 1 1 8 5265 1 1 35 ILE HD13 H -4.980 9.185 -4.355 1.00 . A A . 35 ILE HD13 1 1 8 5266 1 1 35 ILE HG12 H -4.658 6.683 -4.201 1.00 . A A . 35 ILE HG12 1 1 8 5267 1 1 35 ILE HG13 H -5.205 7.282 -5.778 1.00 . A A . 35 ILE HG13 1 1 8 5268 1 1 35 ILE HG21 H -8.048 5.309 -3.226 1.00 . A A . 35 ILE HG21 1 1 8 5269 1 1 35 ILE HG22 H -6.444 5.738 -2.585 1.00 . A A . 35 ILE HG22 1 1 8 5270 1 1 35 ILE HG23 H -7.656 6.996 -2.901 1.00 . A A . 35 ILE HG23 1 1 8 5271 1 1 35 ILE N N -5.457 4.066 -4.540 1.00 . A A . 35 ILE N 1 1 8 5272 1 1 35 ILE O O -4.817 5.044 -7.028 1.00 . A A . 35 ILE O 1 1 8 5273 1 1 36 SER C C -6.978 6.146 -9.713 1.00 . A A . 36 SER C 1 1 8 5274 1 1 36 SER CA C -6.715 4.755 -9.124 1.00 . A A . 36 SER CA 1 1 8 5275 1 1 36 SER CB C -7.595 3.686 -9.782 1.00 . A A . 36 SER CB 1 1 8 5276 1 1 36 SER H H -7.912 4.601 -7.384 1.00 . A A . 36 SER H 1 1 8 5277 1 1 36 SER HA H -5.674 4.497 -9.329 1.00 . A A . 36 SER HA 1 1 8 5278 1 1 36 SER HB2 H -8.648 3.946 -9.656 1.00 . A A . 36 SER HB2 1 1 8 5279 1 1 36 SER HB3 H -7.371 3.623 -10.849 1.00 . A A . 36 SER HB3 1 1 8 5280 1 1 36 SER HG H -6.440 2.186 -9.325 1.00 . A A . 36 SER HG 1 1 8 5281 1 1 36 SER N N -6.960 4.746 -7.686 1.00 . A A . 36 SER N 1 1 8 5282 1 1 36 SER O O -7.448 6.260 -10.843 1.00 . A A . 36 SER O 1 1 8 5283 1 1 36 SER OG O -7.360 2.426 -9.188 1.00 . A A . 36 SER OG 1 1 8 5284 1 1 37 ALA C C -5.643 9.177 -10.063 1.00 . A A . 37 ALA C 1 1 8 5285 1 1 37 ALA CA C -6.869 8.591 -9.352 1.00 . A A . 37 ALA CA 1 1 8 5286 1 1 37 ALA CB C -7.205 9.414 -8.105 1.00 . A A . 37 ALA CB 1 1 8 5287 1 1 37 ALA H H -6.275 7.041 -8.035 1.00 . A A . 37 ALA H 1 1 8 5288 1 1 37 ALA HA H -7.718 8.659 -10.032 1.00 . A A . 37 ALA HA 1 1 8 5289 1 1 37 ALA HB1 H -6.366 9.397 -7.410 1.00 . A A . 37 ALA HB1 1 1 8 5290 1 1 37 ALA HB2 H -7.418 10.446 -8.384 1.00 . A A . 37 ALA HB2 1 1 8 5291 1 1 37 ALA HB3 H -8.085 8.994 -7.614 1.00 . A A . 37 ALA HB3 1 1 8 5292 1 1 37 ALA N N -6.666 7.203 -8.951 1.00 . A A . 37 ALA N 1 1 8 5293 1 1 37 ALA O O -5.639 10.365 -10.374 1.00 . A A . 37 ALA O 1 1 8 5294 1 1 38 SER C C -2.719 9.937 -9.908 1.00 . A A . 38 SER C 1 1 8 5295 1 1 38 SER CA C -3.296 8.809 -10.782 1.00 . A A . 38 SER CA 1 1 8 5296 1 1 38 SER CB C -3.404 9.173 -12.269 1.00 . A A . 38 SER CB 1 1 8 5297 1 1 38 SER H H -4.684 7.388 -10.075 1.00 . A A . 38 SER H 1 1 8 5298 1 1 38 SER HA H -2.621 7.957 -10.711 1.00 . A A . 38 SER HA 1 1 8 5299 1 1 38 SER HB2 H -3.823 8.329 -12.821 1.00 . A A . 38 SER HB2 1 1 8 5300 1 1 38 SER HB3 H -4.059 10.032 -12.394 1.00 . A A . 38 SER HB3 1 1 8 5301 1 1 38 SER HG H -1.794 10.247 -12.359 1.00 . A A . 38 SER HG 1 1 8 5302 1 1 38 SER N N -4.596 8.367 -10.291 1.00 . A A . 38 SER N 1 1 8 5303 1 1 38 SER O O -2.030 10.827 -10.407 1.00 . A A . 38 SER O 1 1 8 5304 1 1 38 SER OG O -2.133 9.466 -12.808 1.00 . A A . 38 SER OG 1 1 8 5305 1 1 39 THR C C -2.572 10.248 -6.240 1.00 . A A . 39 THR C 1 1 8 5306 1 1 39 THR CA C -2.657 10.914 -7.619 1.00 . A A . 39 THR CA 1 1 8 5307 1 1 39 THR CB C -3.725 12.028 -7.653 1.00 . A A . 39 THR CB 1 1 8 5308 1 1 39 THR CG2 C -3.394 13.213 -6.739 1.00 . A A . 39 THR CG2 1 1 8 5309 1 1 39 THR H H -3.573 9.129 -8.258 1.00 . A A . 39 THR H 1 1 8 5310 1 1 39 THR HA H -1.685 11.343 -7.864 1.00 . A A . 39 THR HA 1 1 8 5311 1 1 39 THR HB H -4.688 11.613 -7.350 1.00 . A A . 39 THR HB 1 1 8 5312 1 1 39 THR HG1 H -2.999 12.750 -9.311 1.00 . A A . 39 THR HG1 1 1 8 5313 1 1 39 THR HG21 H -4.098 14.023 -6.933 1.00 . A A . 39 THR HG21 1 1 8 5314 1 1 39 THR HG22 H -3.492 12.930 -5.691 1.00 . A A . 39 THR HG22 1 1 8 5315 1 1 39 THR HG23 H -2.383 13.569 -6.934 1.00 . A A . 39 THR HG23 1 1 8 5316 1 1 39 THR N N -3.002 9.890 -8.599 1.00 . A A . 39 THR N 1 1 8 5317 1 1 39 THR O O -3.083 9.142 -6.063 1.00 . A A . 39 THR O 1 1 8 5318 1 1 39 THR OG1 O -3.868 12.535 -8.964 1.00 . A A . 39 THR OG1 1 1 8 5319 1 1 40 CYS C C -1.901 11.853 -3.033 1.00 . A A . 40 CYS C 1 1 8 5320 1 1 40 CYS CA C -1.915 10.561 -3.861 1.00 . A A . 40 CYS CA 1 1 8 5321 1 1 40 CYS CB C -0.675 9.722 -3.537 1.00 . A A . 40 CYS CB 1 1 8 5322 1 1 40 CYS H H -1.501 11.806 -5.501 1.00 . A A . 40 CYS H 1 1 8 5323 1 1 40 CYS HA H -2.810 9.981 -3.634 1.00 . A A . 40 CYS HA 1 1 8 5324 1 1 40 CYS HB2 H 0.213 10.249 -3.883 1.00 . A A . 40 CYS HB2 1 1 8 5325 1 1 40 CYS HB3 H -0.599 9.605 -2.457 1.00 . A A . 40 CYS HB3 1 1 8 5326 1 1 40 CYS N N -1.925 10.917 -5.275 1.00 . A A . 40 CYS N 1 1 8 5327 1 1 40 CYS O O -1.307 12.836 -3.473 1.00 . A A . 40 CYS O 1 1 8 5328 1 1 40 CYS SG S -0.687 8.068 -4.265 1.00 . A A . 40 CYS SG 1 1 8 5329 1 1 41 PRO C C -1.193 13.231 -0.284 1.00 . A A . 41 PRO C 1 1 8 5330 1 1 41 PRO CA C -2.550 13.039 -0.972 1.00 . A A . 41 PRO CA 1 1 8 5331 1 1 41 PRO CB C -3.663 12.758 0.042 1.00 . A A . 41 PRO CB 1 1 8 5332 1 1 41 PRO CD C -3.306 10.790 -1.262 1.00 . A A . 41 PRO CD 1 1 8 5333 1 1 41 PRO CG C -3.629 11.235 0.165 1.00 . A A . 41 PRO CG 1 1 8 5334 1 1 41 PRO HA H -2.799 13.939 -1.538 1.00 . A A . 41 PRO HA 1 1 8 5335 1 1 41 PRO HB2 H -3.508 13.256 1.000 1.00 . A A . 41 PRO HB2 1 1 8 5336 1 1 41 PRO HB3 H -4.622 13.057 -0.383 1.00 . A A . 41 PRO HB3 1 1 8 5337 1 1 41 PRO HD2 H -2.757 9.847 -1.249 1.00 . A A . 41 PRO HD2 1 1 8 5338 1 1 41 PRO HD3 H -4.237 10.674 -1.821 1.00 . A A . 41 PRO HD3 1 1 8 5339 1 1 41 PRO HG2 H -2.815 10.951 0.833 1.00 . A A . 41 PRO HG2 1 1 8 5340 1 1 41 PRO HG3 H -4.573 10.826 0.524 1.00 . A A . 41 PRO HG3 1 1 8 5341 1 1 41 PRO N N -2.532 11.875 -1.847 1.00 . A A . 41 PRO N 1 1 8 5342 1 1 41 PRO O O -0.363 12.321 -0.266 1.00 . A A . 41 PRO O 1 1 8 5343 1 1 42 SER C C 0.332 14.177 2.351 1.00 . A A . 42 SER C 1 1 8 5344 1 1 42 SER CA C 0.246 14.830 0.966 1.00 . A A . 42 SER CA 1 1 8 5345 1 1 42 SER CB C 0.300 16.361 1.038 1.00 . A A . 42 SER CB 1 1 8 5346 1 1 42 SER H H -1.714 15.118 0.218 1.00 . A A . 42 SER H 1 1 8 5347 1 1 42 SER HA H 1.105 14.499 0.379 1.00 . A A . 42 SER HA 1 1 8 5348 1 1 42 SER HB2 H 0.257 16.773 0.029 1.00 . A A . 42 SER HB2 1 1 8 5349 1 1 42 SER HB3 H -0.547 16.740 1.612 1.00 . A A . 42 SER HB3 1 1 8 5350 1 1 42 SER HG H 1.511 16.459 2.550 1.00 . A A . 42 SER HG 1 1 8 5351 1 1 42 SER N N -0.977 14.432 0.274 1.00 . A A . 42 SER N 1 1 8 5352 1 1 42 SER O O 0.290 14.862 3.374 1.00 . A A . 42 SER O 1 1 8 5353 1 1 42 SER OG O 1.501 16.788 1.647 1.00 . A A . 42 SER OG 1 1 8 5354 1 1 43 ASP C C 1.308 10.751 3.350 1.00 . A A . 43 ASP C 1 1 8 5355 1 1 43 ASP CA C 0.453 12.007 3.558 1.00 . A A . 43 ASP CA 1 1 8 5356 1 1 43 ASP CB C -0.988 11.614 3.913 1.00 . A A . 43 ASP CB 1 1 8 5357 1 1 43 ASP CG C -1.823 12.812 4.354 1.00 . A A . 43 ASP CG 1 1 8 5358 1 1 43 ASP H H 0.462 12.389 1.468 1.00 . A A . 43 ASP H 1 1 8 5359 1 1 43 ASP HA H 0.883 12.557 4.397 1.00 . A A . 43 ASP HA 1 1 8 5360 1 1 43 ASP HB2 H -1.458 11.161 3.041 1.00 . A A . 43 ASP HB2 1 1 8 5361 1 1 43 ASP HB3 H -0.977 10.885 4.724 1.00 . A A . 43 ASP HB3 1 1 8 5362 1 1 43 ASP HD2 H -2.073 14.084 5.802 1.00 . A A . 43 ASP HD2 1 1 8 5363 1 1 43 ASP N N 0.453 12.847 2.366 1.00 . A A . 43 ASP N 1 1 8 5364 1 1 43 ASP O O 1.858 10.231 4.320 1.00 . A A . 43 ASP O 1 1 8 5365 1 1 43 ASP OD1 O -2.673 13.268 3.593 1.00 . A A . 43 ASP OD1 1 1 8 5366 1 1 43 ASP OD2 O -1.554 13.303 5.597 1.00 . A A . 43 ASP OD2 1 1 8 5367 1 1 44 TYR C C 3.154 9.278 0.685 1.00 . A A . 44 TYR C 1 1 8 5368 1 1 44 TYR CA C 2.097 9.015 1.768 1.00 . A A . 44 TYR CA 1 1 8 5369 1 1 44 TYR CB C 1.041 7.996 1.319 1.00 . A A . 44 TYR CB 1 1 8 5370 1 1 44 TYR CD1 C 0.253 6.911 3.458 1.00 . A A . 44 TYR CD1 1 1 8 5371 1 1 44 TYR CD2 C -1.234 8.462 2.331 1.00 . A A . 44 TYR CD2 1 1 8 5372 1 1 44 TYR CE1 C -0.689 6.742 4.487 1.00 . A A . 44 TYR CE1 1 1 8 5373 1 1 44 TYR CE2 C -2.156 8.337 3.385 1.00 . A A . 44 TYR CE2 1 1 8 5374 1 1 44 TYR CG C -0.027 7.744 2.364 1.00 . A A . 44 TYR CG 1 1 8 5375 1 1 44 TYR CZ C -1.893 7.463 4.454 1.00 . A A . 44 TYR CZ 1 1 8 5376 1 1 44 TYR H H 0.929 10.717 1.349 1.00 . A A . 44 TYR H 1 1 8 5377 1 1 44 TYR HA H 2.596 8.592 2.638 1.00 . A A . 44 TYR HA 1 1 8 5378 1 1 44 TYR HB2 H 0.560 8.346 0.405 1.00 . A A . 44 TYR HB2 1 1 8 5379 1 1 44 TYR HB3 H 1.536 7.053 1.094 1.00 . A A . 44 TYR HB3 1 1 8 5380 1 1 44 TYR HD1 H 1.208 6.427 3.522 1.00 . A A . 44 TYR HD1 1 1 8 5381 1 1 44 TYR HD2 H -1.447 9.123 1.504 1.00 . A A . 44 TYR HD2 1 1 8 5382 1 1 44 TYR HE1 H -0.464 6.076 5.309 1.00 . A A . 44 TYR HE1 1 1 8 5383 1 1 44 TYR HE2 H -3.076 8.900 3.355 1.00 . A A . 44 TYR HE2 1 1 8 5384 1 1 44 TYR HH H -3.513 7.962 5.422 1.00 . A A . 44 TYR HH 1 1 8 5385 1 1 44 TYR N N 1.412 10.257 2.107 1.00 . A A . 44 TYR N 1 1 8 5386 1 1 44 TYR O O 2.929 8.953 -0.477 1.00 . A A . 44 TYR O 1 1 8 5387 1 1 44 TYR OH O -2.810 7.307 5.454 1.00 . A A . 44 TYR OH 1 1 8 5388 1 1 45 PRO C C 6.186 9.131 -0.456 1.00 . A A . 45 PRO C 1 1 8 5389 1 1 45 PRO CA C 5.309 10.282 0.063 1.00 . A A . 45 PRO CA 1 1 8 5390 1 1 45 PRO CB C 6.139 11.362 0.765 1.00 . A A . 45 PRO CB 1 1 8 5391 1 1 45 PRO CD C 4.631 10.389 2.359 1.00 . A A . 45 PRO CD 1 1 8 5392 1 1 45 PRO CG C 6.024 11.006 2.247 1.00 . A A . 45 PRO CG 1 1 8 5393 1 1 45 PRO HA H 4.825 10.741 -0.802 1.00 . A A . 45 PRO HA 1 1 8 5394 1 1 45 PRO HB2 H 7.176 11.393 0.427 1.00 . A A . 45 PRO HB2 1 1 8 5395 1 1 45 PRO HB3 H 5.668 12.332 0.600 1.00 . A A . 45 PRO HB3 1 1 8 5396 1 1 45 PRO HD2 H 4.628 9.602 3.114 1.00 . A A . 45 PRO HD2 1 1 8 5397 1 1 45 PRO HD3 H 3.931 11.179 2.629 1.00 . A A . 45 PRO HD3 1 1 8 5398 1 1 45 PRO HG2 H 6.775 10.263 2.501 1.00 . A A . 45 PRO HG2 1 1 8 5399 1 1 45 PRO HG3 H 6.139 11.882 2.887 1.00 . A A . 45 PRO HG3 1 1 8 5400 1 1 45 PRO N N 4.304 9.877 1.037 1.00 . A A . 45 PRO N 1 1 8 5401 1 1 45 PRO O O 6.971 9.361 -1.373 1.00 . A A . 45 PRO O 1 1 8 5402 1 1 46 LYS C C 6.004 5.831 -1.209 1.00 . A A . 46 LYS C 1 1 8 5403 1 1 46 LYS CA C 6.858 6.750 -0.327 1.00 . A A . 46 LYS CA 1 1 8 5404 1 1 46 LYS CB C 7.413 5.984 0.891 1.00 . A A . 46 LYS CB 1 1 8 5405 1 1 46 LYS CD C 8.263 8.029 2.160 1.00 . A A . 46 LYS CD 1 1 8 5406 1 1 46 LYS CE C 9.241 8.507 3.241 1.00 . A A . 46 LYS CE 1 1 8 5407 1 1 46 LYS CG C 8.616 6.658 1.571 1.00 . A A . 46 LYS CG 1 1 8 5408 1 1 46 LYS H H 5.383 7.749 0.819 1.00 . A A . 46 LYS H 1 1 8 5409 1 1 46 LYS HA H 7.713 7.063 -0.927 1.00 . A A . 46 LYS HA 1 1 8 5410 1 1 46 LYS HB2 H 6.625 5.822 1.625 1.00 . A A . 46 LYS HB2 1 1 8 5411 1 1 46 LYS HB3 H 7.760 5.005 0.557 1.00 . A A . 46 LYS HB3 1 1 8 5412 1 1 46 LYS HD2 H 8.281 8.757 1.349 1.00 . A A . 46 LYS HD2 1 1 8 5413 1 1 46 LYS HD3 H 7.258 7.992 2.580 1.00 . A A . 46 LYS HD3 1 1 8 5414 1 1 46 LYS HE2 H 10.267 8.426 2.880 1.00 . A A . 46 LYS HE2 1 1 8 5415 1 1 46 LYS HE3 H 9.027 9.555 3.453 1.00 . A A . 46 LYS HE3 1 1 8 5416 1 1 46 LYS HG2 H 8.960 5.993 2.361 1.00 . A A . 46 LYS HG2 1 1 8 5417 1 1 46 LYS HG3 H 9.427 6.773 0.849 1.00 . A A . 46 LYS HG3 1 1 8 5418 1 1 46 LYS HZ1 H 9.436 6.813 4.375 1.00 . A A . 46 LYS HZ1 1 1 8 5419 1 1 46 LYS HZ2 H 9.615 8.203 5.236 1.00 . A A . 46 LYS HZ2 1 1 8 5420 1 1 46 LYS HZ3 H 8.113 7.711 4.760 1.00 . A A . 46 LYS HZ3 1 1 8 5421 1 1 46 LYS N N 6.075 7.912 0.100 1.00 . A A . 46 LYS N 1 1 8 5422 1 1 46 LYS NZ N 9.091 7.753 4.498 1.00 . A A . 46 LYS NZ 1 1 8 5423 1 1 46 LYS O O 6.591 4.873 -1.759 1.00 . A A . 46 LYS O 1 1 8 5424 1 1 46 LYS OXT O 4.789 6.083 -1.346 1.00 . A A . 46 LYS OXT 1 1 9 5425 1 1 1 LYS C C -1.405 4.422 -5.954 1.00 . A A . 1 LYS C 1 1 9 5426 1 1 1 LYS CA C -1.496 5.135 -7.305 1.00 . A A . 1 LYS CA 1 1 9 5427 1 1 1 LYS CB C -0.101 5.621 -7.741 1.00 . A A . 1 LYS CB 1 1 9 5428 1 1 1 LYS CD C -0.141 7.930 -8.869 1.00 . A A . 1 LYS CD 1 1 9 5429 1 1 1 LYS CE C 1.173 8.549 -8.367 1.00 . A A . 1 LYS CE 1 1 9 5430 1 1 1 LYS CG C -0.089 6.406 -9.062 1.00 . A A . 1 LYS CG 1 1 9 5431 1 1 1 LYS H1 H -2.562 6.661 -8.169 1.00 . A A . 1 LYS H1 1 1 9 5432 1 1 1 LYS H2 H -3.373 5.867 -6.976 1.00 . A A . 1 LYS H2 1 1 9 5433 1 1 1 LYS H3 H -2.187 6.936 -6.583 1.00 . A A . 1 LYS H3 1 1 9 5434 1 1 1 LYS HA H -1.855 4.416 -8.042 1.00 . A A . 1 LYS HA 1 1 9 5435 1 1 1 LYS HB2 H 0.340 6.216 -6.942 1.00 . A A . 1 LYS HB2 1 1 9 5436 1 1 1 LYS HB3 H 0.530 4.743 -7.888 1.00 . A A . 1 LYS HB3 1 1 9 5437 1 1 1 LYS HD2 H -0.391 8.392 -9.824 1.00 . A A . 1 LYS HD2 1 1 9 5438 1 1 1 LYS HD3 H -0.922 8.179 -8.155 1.00 . A A . 1 LYS HD3 1 1 9 5439 1 1 1 LYS HE2 H 0.994 9.604 -8.153 1.00 . A A . 1 LYS HE2 1 1 9 5440 1 1 1 LYS HE3 H 1.499 8.065 -7.447 1.00 . A A . 1 LYS HE3 1 1 9 5441 1 1 1 LYS HG2 H 0.818 6.149 -9.611 1.00 . A A . 1 LYS HG2 1 1 9 5442 1 1 1 LYS HG3 H -0.935 6.087 -9.672 1.00 . A A . 1 LYS HG3 1 1 9 5443 1 1 1 LYS HZ1 H 1.974 8.955 -10.210 1.00 . A A . 1 LYS HZ1 1 1 9 5444 1 1 1 LYS HZ2 H 3.087 8.897 -8.998 1.00 . A A . 1 LYS HZ2 1 1 9 5445 1 1 1 LYS HZ3 H 2.447 7.502 -9.590 1.00 . A A . 1 LYS HZ3 1 1 9 5446 1 1 1 LYS N N -2.475 6.238 -7.258 1.00 . A A . 1 LYS N 1 1 9 5447 1 1 1 LYS NZ N 2.251 8.467 -9.369 1.00 . A A . 1 LYS NZ 1 1 9 5448 1 1 1 LYS O O -2.057 4.834 -4.995 1.00 . A A . 1 LYS O 1 1 9 5449 1 1 2 SER C C 0.865 3.709 -3.962 1.00 . A A . 2 SER C 1 1 9 5450 1 1 2 SER CA C -0.161 2.783 -4.613 1.00 . A A . 2 SER CA 1 1 9 5451 1 1 2 SER CB C 0.415 1.380 -4.846 1.00 . A A . 2 SER CB 1 1 9 5452 1 1 2 SER H H -0.070 3.080 -6.702 1.00 . A A . 2 SER H 1 1 9 5453 1 1 2 SER HA H -1.035 2.682 -3.976 1.00 . A A . 2 SER HA 1 1 9 5454 1 1 2 SER HB2 H 0.685 0.933 -3.888 1.00 . A A . 2 SER HB2 1 1 9 5455 1 1 2 SER HB3 H -0.345 0.759 -5.321 1.00 . A A . 2 SER HB3 1 1 9 5456 1 1 2 SER HG H 1.776 0.527 -5.947 1.00 . A A . 2 SER HG 1 1 9 5457 1 1 2 SER N N -0.571 3.376 -5.876 1.00 . A A . 2 SER N 1 1 9 5458 1 1 2 SER O O 1.812 4.122 -4.630 1.00 . A A . 2 SER O 1 1 9 5459 1 1 2 SER OG O 1.558 1.423 -5.677 1.00 . A A . 2 SER OG 1 1 9 5460 1 1 3 CYS C C 1.516 4.712 -0.485 1.00 . A A . 3 CYS C 1 1 9 5461 1 1 3 CYS CA C 1.489 5.033 -1.978 1.00 . A A . 3 CYS CA 1 1 9 5462 1 1 3 CYS CB C 0.956 6.442 -2.240 1.00 . A A . 3 CYS CB 1 1 9 5463 1 1 3 CYS H H -0.156 3.701 -2.208 1.00 . A A . 3 CYS H 1 1 9 5464 1 1 3 CYS HA H 2.514 4.991 -2.345 1.00 . A A . 3 CYS HA 1 1 9 5465 1 1 3 CYS HB2 H -0.134 6.430 -2.171 1.00 . A A . 3 CYS HB2 1 1 9 5466 1 1 3 CYS HB3 H 1.335 7.112 -1.472 1.00 . A A . 3 CYS HB3 1 1 9 5467 1 1 3 CYS N N 0.661 4.061 -2.687 1.00 . A A . 3 CYS N 1 1 9 5468 1 1 3 CYS O O 0.463 4.527 0.122 1.00 . A A . 3 CYS O 1 1 9 5469 1 1 3 CYS SG S 1.457 7.133 -3.840 1.00 . A A . 3 CYS SG 1 1 9 5470 1 1 4 CYS C C 3.629 5.295 2.297 1.00 . A A . 4 CYS C 1 1 9 5471 1 1 4 CYS CA C 3.009 4.182 1.443 1.00 . A A . 4 CYS CA 1 1 9 5472 1 1 4 CYS CB C 3.981 3.001 1.364 1.00 . A A . 4 CYS CB 1 1 9 5473 1 1 4 CYS H H 3.534 4.864 -0.478 1.00 . A A . 4 CYS H 1 1 9 5474 1 1 4 CYS HA H 2.087 3.843 1.904 1.00 . A A . 4 CYS HA 1 1 9 5475 1 1 4 CYS HB2 H 4.873 3.325 0.830 1.00 . A A . 4 CYS HB2 1 1 9 5476 1 1 4 CYS HB3 H 4.300 2.712 2.362 1.00 . A A . 4 CYS HB3 1 1 9 5477 1 1 4 CYS N N 2.725 4.640 0.089 1.00 . A A . 4 CYS N 1 1 9 5478 1 1 4 CYS O O 4.263 6.205 1.760 1.00 . A A . 4 CYS O 1 1 9 5479 1 1 4 CYS SG S 3.333 1.518 0.557 1.00 . A A . 4 CYS SG 1 1 9 5480 1 1 5 PRO C C 5.569 5.978 4.710 1.00 . A A . 5 PRO C 1 1 9 5481 1 1 5 PRO CA C 4.058 6.172 4.567 1.00 . A A . 5 PRO CA 1 1 9 5482 1 1 5 PRO CB C 3.356 5.914 5.904 1.00 . A A . 5 PRO CB 1 1 9 5483 1 1 5 PRO CD C 2.668 4.239 4.348 1.00 . A A . 5 PRO CD 1 1 9 5484 1 1 5 PRO CG C 2.992 4.433 5.828 1.00 . A A . 5 PRO CG 1 1 9 5485 1 1 5 PRO HA H 3.859 7.195 4.252 1.00 . A A . 5 PRO HA 1 1 9 5486 1 1 5 PRO HB2 H 3.991 6.141 6.762 1.00 . A A . 5 PRO HB2 1 1 9 5487 1 1 5 PRO HB3 H 2.443 6.506 5.962 1.00 . A A . 5 PRO HB3 1 1 9 5488 1 1 5 PRO HD2 H 2.876 3.213 4.053 1.00 . A A . 5 PRO HD2 1 1 9 5489 1 1 5 PRO HD3 H 1.612 4.449 4.182 1.00 . A A . 5 PRO HD3 1 1 9 5490 1 1 5 PRO HG2 H 3.856 3.826 6.096 1.00 . A A . 5 PRO HG2 1 1 9 5491 1 1 5 PRO HG3 H 2.148 4.182 6.473 1.00 . A A . 5 PRO HG3 1 1 9 5492 1 1 5 PRO N N 3.475 5.219 3.631 1.00 . A A . 5 PRO N 1 1 9 5493 1 1 5 PRO O O 6.288 6.949 4.941 1.00 . A A . 5 PRO O 1 1 9 5494 1 1 6 ASN C C 7.877 3.247 3.963 1.00 . A A . 6 ASN C 1 1 9 5495 1 1 6 ASN CA C 7.409 4.340 4.920 1.00 . A A . 6 ASN CA 1 1 9 5496 1 1 6 ASN CB C 7.498 3.846 6.371 1.00 . A A . 6 ASN CB 1 1 9 5497 1 1 6 ASN CG C 7.127 4.938 7.372 1.00 . A A . 6 ASN CG 1 1 9 5498 1 1 6 ASN H H 5.401 3.979 4.379 1.00 . A A . 6 ASN H 1 1 9 5499 1 1 6 ASN HA H 8.073 5.195 4.814 1.00 . A A . 6 ASN HA 1 1 9 5500 1 1 6 ASN HB2 H 6.843 2.982 6.502 1.00 . A A . 6 ASN HB2 1 1 9 5501 1 1 6 ASN HB3 H 8.520 3.534 6.582 1.00 . A A . 6 ASN HB3 1 1 9 5502 1 1 6 ASN HD21 H 5.453 3.932 7.960 1.00 . A A . 6 ASN HD21 1 1 9 5503 1 1 6 ASN HD22 H 5.738 5.460 8.759 1.00 . A A . 6 ASN HD22 1 1 9 5504 1 1 6 ASN N N 6.039 4.726 4.615 1.00 . A A . 6 ASN N 1 1 9 5505 1 1 6 ASN ND2 N 6.017 4.758 8.089 1.00 . A A . 6 ASN ND2 1 1 9 5506 1 1 6 ASN O O 7.066 2.557 3.345 1.00 . A A . 6 ASN O 1 1 9 5507 1 1 6 ASN OD1 O 7.836 5.936 7.491 1.00 . A A . 6 ASN OD1 1 1 9 5508 1 1 7 THR C C 9.406 0.624 3.843 1.00 . A A . 7 THR C 1 1 9 5509 1 1 7 THR CA C 9.833 1.949 3.202 1.00 . A A . 7 THR CA 1 1 9 5510 1 1 7 THR CB C 11.359 2.127 3.233 1.00 . A A . 7 THR CB 1 1 9 5511 1 1 7 THR CG2 C 12.061 1.148 2.286 1.00 . A A . 7 THR CG2 1 1 9 5512 1 1 7 THR H H 9.809 3.699 4.390 1.00 . A A . 7 THR H 1 1 9 5513 1 1 7 THR HA H 9.506 1.964 2.162 1.00 . A A . 7 THR HA 1 1 9 5514 1 1 7 THR HB H 11.724 1.964 4.248 1.00 . A A . 7 THR HB 1 1 9 5515 1 1 7 THR HG1 H 12.645 3.545 2.877 1.00 . A A . 7 THR HG1 1 1 9 5516 1 1 7 THR HG21 H 13.138 1.312 2.326 1.00 . A A . 7 THR HG21 1 1 9 5517 1 1 7 THR HG22 H 11.854 0.120 2.581 1.00 . A A . 7 THR HG22 1 1 9 5518 1 1 7 THR HG23 H 11.715 1.305 1.262 1.00 . A A . 7 THR HG23 1 1 9 5519 1 1 7 THR N N 9.201 3.066 3.890 1.00 . A A . 7 THR N 1 1 9 5520 1 1 7 THR O O 9.238 -0.371 3.144 1.00 . A A . 7 THR O 1 1 9 5521 1 1 7 THR OG1 O 11.691 3.448 2.851 1.00 . A A . 7 THR OG1 1 1 9 5522 1 1 8 THR C C 7.213 -0.822 5.384 1.00 . A A . 8 THR C 1 1 9 5523 1 1 8 THR CA C 8.633 -0.522 5.885 1.00 . A A . 8 THR CA 1 1 9 5524 1 1 8 THR CB C 8.656 -0.258 7.399 1.00 . A A . 8 THR CB 1 1 9 5525 1 1 8 THR CG2 C 8.277 -1.516 8.189 1.00 . A A . 8 THR CG2 1 1 9 5526 1 1 8 THR H H 9.357 1.463 5.692 1.00 . A A . 8 THR H 1 1 9 5527 1 1 8 THR HA H 9.268 -1.386 5.689 1.00 . A A . 8 THR HA 1 1 9 5528 1 1 8 THR HB H 7.958 0.542 7.644 1.00 . A A . 8 THR HB 1 1 9 5529 1 1 8 THR HG1 H 10.173 0.972 7.396 1.00 . A A . 8 THR HG1 1 1 9 5530 1 1 8 THR HG21 H 8.958 -2.332 7.939 1.00 . A A . 8 THR HG21 1 1 9 5531 1 1 8 THR HG22 H 8.352 -1.311 9.257 1.00 . A A . 8 THR HG22 1 1 9 5532 1 1 8 THR HG23 H 7.256 -1.818 7.961 1.00 . A A . 8 THR HG23 1 1 9 5533 1 1 8 THR N N 9.192 0.617 5.167 1.00 . A A . 8 THR N 1 1 9 5534 1 1 8 THR O O 6.838 -1.984 5.248 1.00 . A A . 8 THR O 1 1 9 5535 1 1 8 THR OG1 O 9.955 0.131 7.803 1.00 . A A . 8 THR OG1 1 1 9 5536 1 1 9 GLY C C 5.227 -0.641 3.120 1.00 . A A . 9 GLY C 1 1 9 5537 1 1 9 GLY CA C 5.124 0.083 4.460 1.00 . A A . 9 GLY CA 1 1 9 5538 1 1 9 GLY H H 6.795 1.158 5.191 1.00 . A A . 9 GLY H 1 1 9 5539 1 1 9 GLY HA2 H 4.466 -0.469 5.133 1.00 . A A . 9 GLY HA2 1 1 9 5540 1 1 9 GLY HA3 H 4.703 1.071 4.292 1.00 . A A . 9 GLY HA3 1 1 9 5541 1 1 9 GLY N N 6.433 0.222 5.078 1.00 . A A . 9 GLY N 1 1 9 5542 1 1 9 GLY O O 4.518 -1.621 2.897 1.00 . A A . 9 GLY O 1 1 9 5543 1 1 10 ARG C C 6.801 -2.294 1.173 1.00 . A A . 10 ARG C 1 1 9 5544 1 1 10 ARG CA C 6.394 -0.836 0.966 1.00 . A A . 10 ARG CA 1 1 9 5545 1 1 10 ARG CB C 7.468 -0.087 0.159 1.00 . A A . 10 ARG CB 1 1 9 5546 1 1 10 ARG CD C 6.040 1.020 -1.638 1.00 . A A . 10 ARG CD 1 1 9 5547 1 1 10 ARG CG C 6.974 1.235 -0.439 1.00 . A A . 10 ARG CG 1 1 9 5548 1 1 10 ARG CZ C 4.665 2.443 -3.165 1.00 . A A . 10 ARG CZ 1 1 9 5549 1 1 10 ARG H H 6.680 0.633 2.491 1.00 . A A . 10 ARG H 1 1 9 5550 1 1 10 ARG HA H 5.465 -0.848 0.400 1.00 . A A . 10 ARG HA 1 1 9 5551 1 1 10 ARG HB2 H 8.322 0.119 0.804 1.00 . A A . 10 ARG HB2 1 1 9 5552 1 1 10 ARG HB3 H 7.811 -0.722 -0.660 1.00 . A A . 10 ARG HB3 1 1 9 5553 1 1 10 ARG HD2 H 6.592 0.513 -2.431 1.00 . A A . 10 ARG HD2 1 1 9 5554 1 1 10 ARG HD3 H 5.194 0.399 -1.355 1.00 . A A . 10 ARG HD3 1 1 9 5555 1 1 10 ARG HE H 5.853 3.146 -1.685 1.00 . A A . 10 ARG HE 1 1 9 5556 1 1 10 ARG HG2 H 6.477 1.815 0.337 1.00 . A A . 10 ARG HG2 1 1 9 5557 1 1 10 ARG HG3 H 7.841 1.800 -0.784 1.00 . A A . 10 ARG HG3 1 1 9 5558 1 1 10 ARG HH11 H 4.266 0.451 -3.372 1.00 . A A . 10 ARG HH11 1 1 9 5559 1 1 10 ARG HH12 H 3.395 1.504 -4.465 1.00 . A A . 10 ARG HH12 1 1 9 5560 1 1 10 ARG HH21 H 4.814 4.484 -3.218 1.00 . A A . 10 ARG HH21 1 1 9 5561 1 1 10 ARG HH22 H 3.684 3.791 -4.351 1.00 . A A . 10 ARG HH22 1 1 9 5562 1 1 10 ARG N N 6.130 -0.179 2.242 1.00 . A A . 10 ARG N 1 1 9 5563 1 1 10 ARG NE N 5.538 2.303 -2.152 1.00 . A A . 10 ARG NE 1 1 9 5564 1 1 10 ARG NH1 N 4.065 1.378 -3.716 1.00 . A A . 10 ARG NH1 1 1 9 5565 1 1 10 ARG NH2 N 4.383 3.664 -3.631 1.00 . A A . 10 ARG NH2 1 1 9 5566 1 1 10 ARG O O 6.303 -3.164 0.464 1.00 . A A . 10 ARG O 1 1 9 5567 1 1 11 ASN C C 6.938 -4.823 2.793 1.00 . A A . 11 ASN C 1 1 9 5568 1 1 11 ASN CA C 8.126 -3.919 2.452 1.00 . A A . 11 ASN CA 1 1 9 5569 1 1 11 ASN CB C 9.160 -3.874 3.583 1.00 . A A . 11 ASN CB 1 1 9 5570 1 1 11 ASN CG C 9.491 -5.263 4.121 1.00 . A A . 11 ASN CG 1 1 9 5571 1 1 11 ASN H H 8.065 -1.806 2.680 1.00 . A A . 11 ASN H 1 1 9 5572 1 1 11 ASN HA H 8.614 -4.334 1.568 1.00 . A A . 11 ASN HA 1 1 9 5573 1 1 11 ASN HB2 H 10.076 -3.415 3.212 1.00 . A A . 11 ASN HB2 1 1 9 5574 1 1 11 ASN HB3 H 8.784 -3.266 4.400 1.00 . A A . 11 ASN HB3 1 1 9 5575 1 1 11 ASN HD21 H 8.438 -4.904 5.828 1.00 . A A . 11 ASN HD21 1 1 9 5576 1 1 11 ASN HD22 H 9.205 -6.474 5.727 1.00 . A A . 11 ASN HD22 1 1 9 5577 1 1 11 ASN N N 7.684 -2.569 2.137 1.00 . A A . 11 ASN N 1 1 9 5578 1 1 11 ASN ND2 N 9.002 -5.572 5.323 1.00 . A A . 11 ASN ND2 1 1 9 5579 1 1 11 ASN O O 6.769 -5.857 2.151 1.00 . A A . 11 ASN O 1 1 9 5580 1 1 11 ASN OD1 O 10.181 -6.039 3.465 1.00 . A A . 11 ASN OD1 1 1 9 5581 1 1 12 ILE C C 4.016 -5.475 3.042 1.00 . A A . 12 ILE C 1 1 9 5582 1 1 12 ILE CA C 4.982 -5.258 4.212 1.00 . A A . 12 ILE CA 1 1 9 5583 1 1 12 ILE CB C 4.292 -4.623 5.437 1.00 . A A . 12 ILE CB 1 1 9 5584 1 1 12 ILE CD1 C 4.773 -3.661 7.759 1.00 . A A . 12 ILE CD1 1 1 9 5585 1 1 12 ILE CG1 C 5.262 -4.580 6.635 1.00 . A A . 12 ILE CG1 1 1 9 5586 1 1 12 ILE CG2 C 3.033 -5.422 5.822 1.00 . A A . 12 ILE CG2 1 1 9 5587 1 1 12 ILE H H 6.270 -3.557 4.246 1.00 . A A . 12 ILE H 1 1 9 5588 1 1 12 ILE HA H 5.363 -6.234 4.517 1.00 . A A . 12 ILE HA 1 1 9 5589 1 1 12 ILE HB H 4.005 -3.603 5.181 1.00 . A A . 12 ILE HB 1 1 9 5590 1 1 12 ILE HD11 H 3.858 -4.044 8.207 1.00 . A A . 12 ILE HD11 1 1 9 5591 1 1 12 ILE HD12 H 5.540 -3.608 8.532 1.00 . A A . 12 ILE HD12 1 1 9 5592 1 1 12 ILE HD13 H 4.596 -2.659 7.367 1.00 . A A . 12 ILE HD13 1 1 9 5593 1 1 12 ILE HG12 H 5.405 -5.588 7.025 1.00 . A A . 12 ILE HG12 1 1 9 5594 1 1 12 ILE HG13 H 6.235 -4.208 6.321 1.00 . A A . 12 ILE HG13 1 1 9 5595 1 1 12 ILE HG21 H 2.319 -5.454 5.000 1.00 . A A . 12 ILE HG21 1 1 9 5596 1 1 12 ILE HG22 H 3.310 -6.443 6.084 1.00 . A A . 12 ILE HG22 1 1 9 5597 1 1 12 ILE HG23 H 2.532 -4.962 6.672 1.00 . A A . 12 ILE HG23 1 1 9 5598 1 1 12 ILE N N 6.113 -4.443 3.778 1.00 . A A . 12 ILE N 1 1 9 5599 1 1 12 ILE O O 3.619 -6.608 2.776 1.00 . A A . 12 ILE O 1 1 9 5600 1 1 13 TYR C C 3.305 -5.438 0.129 1.00 . A A . 13 TYR C 1 1 9 5601 1 1 13 TYR CA C 2.810 -4.416 1.157 1.00 . A A . 13 TYR CA 1 1 9 5602 1 1 13 TYR CB C 2.742 -3.005 0.556 1.00 . A A . 13 TYR CB 1 1 9 5603 1 1 13 TYR CD1 C 0.641 -3.234 -0.836 1.00 . A A . 13 TYR CD1 1 1 9 5604 1 1 13 TYR CD2 C 2.683 -2.480 -1.925 1.00 . A A . 13 TYR CD2 1 1 9 5605 1 1 13 TYR CE1 C -0.042 -3.156 -2.062 1.00 . A A . 13 TYR CE1 1 1 9 5606 1 1 13 TYR CE2 C 1.999 -2.397 -3.150 1.00 . A A . 13 TYR CE2 1 1 9 5607 1 1 13 TYR CG C 2.005 -2.902 -0.765 1.00 . A A . 13 TYR CG 1 1 9 5608 1 1 13 TYR CZ C 0.637 -2.743 -3.222 1.00 . A A . 13 TYR CZ 1 1 9 5609 1 1 13 TYR H H 4.019 -3.494 2.631 1.00 . A A . 13 TYR H 1 1 9 5610 1 1 13 TYR HA H 1.810 -4.709 1.478 1.00 . A A . 13 TYR HA 1 1 9 5611 1 1 13 TYR HB2 H 2.253 -2.345 1.271 1.00 . A A . 13 TYR HB2 1 1 9 5612 1 1 13 TYR HB3 H 3.759 -2.640 0.415 1.00 . A A . 13 TYR HB3 1 1 9 5613 1 1 13 TYR HD1 H 0.117 -3.550 0.050 1.00 . A A . 13 TYR HD1 1 1 9 5614 1 1 13 TYR HD2 H 3.730 -2.218 -1.882 1.00 . A A . 13 TYR HD2 1 1 9 5615 1 1 13 TYR HE1 H -1.088 -3.417 -2.110 1.00 . A A . 13 TYR HE1 1 1 9 5616 1 1 13 TYR HE2 H 2.525 -2.070 -4.035 1.00 . A A . 13 TYR HE2 1 1 9 5617 1 1 13 TYR HH H 0.532 -2.407 -5.145 1.00 . A A . 13 TYR HH 1 1 9 5618 1 1 13 TYR N N 3.664 -4.392 2.336 1.00 . A A . 13 TYR N 1 1 9 5619 1 1 13 TYR O O 2.535 -6.296 -0.298 1.00 . A A . 13 TYR O 1 1 9 5620 1 1 13 TYR OH O -0.026 -2.679 -4.412 1.00 . A A . 13 TYR OH 1 1 9 5621 1 1 14 ASN C C 5.216 -7.695 -0.746 1.00 . A A . 14 ASN C 1 1 9 5622 1 1 14 ASN CA C 5.199 -6.244 -1.231 1.00 . A A . 14 ASN CA 1 1 9 5623 1 1 14 ASN CB C 6.615 -5.764 -1.580 1.00 . A A . 14 ASN CB 1 1 9 5624 1 1 14 ASN CG C 6.593 -4.734 -2.708 1.00 . A A . 14 ASN CG 1 1 9 5625 1 1 14 ASN H H 5.158 -4.625 0.142 1.00 . A A . 14 ASN H 1 1 9 5626 1 1 14 ASN HA H 4.604 -6.219 -2.145 1.00 . A A . 14 ASN HA 1 1 9 5627 1 1 14 ASN HB2 H 7.120 -5.369 -0.698 1.00 . A A . 14 ASN HB2 1 1 9 5628 1 1 14 ASN HB3 H 7.199 -6.609 -1.937 1.00 . A A . 14 ASN HB3 1 1 9 5629 1 1 14 ASN HD21 H 6.282 -3.196 -1.412 1.00 . A A . 14 ASN HD21 1 1 9 5630 1 1 14 ASN HD22 H 6.399 -2.760 -3.109 1.00 . A A . 14 ASN HD22 1 1 9 5631 1 1 14 ASN N N 4.581 -5.351 -0.260 1.00 . A A . 14 ASN N 1 1 9 5632 1 1 14 ASN ND2 N 6.403 -3.457 -2.381 1.00 . A A . 14 ASN ND2 1 1 9 5633 1 1 14 ASN O O 4.926 -8.593 -1.532 1.00 . A A . 14 ASN O 1 1 9 5634 1 1 14 ASN OD1 O 6.744 -5.092 -3.874 1.00 . A A . 14 ASN OD1 1 1 9 5635 1 1 15 THR C C 4.192 -9.923 1.042 1.00 . A A . 15 THR C 1 1 9 5636 1 1 15 THR CA C 5.583 -9.283 1.088 1.00 . A A . 15 THR CA 1 1 9 5637 1 1 15 THR CB C 6.152 -9.240 2.516 1.00 . A A . 15 THR CB 1 1 9 5638 1 1 15 THR CG2 C 6.257 -10.641 3.129 1.00 . A A . 15 THR CG2 1 1 9 5639 1 1 15 THR H H 5.780 -7.162 1.136 1.00 . A A . 15 THR H 1 1 9 5640 1 1 15 THR HA H 6.254 -9.887 0.476 1.00 . A A . 15 THR HA 1 1 9 5641 1 1 15 THR HB H 5.512 -8.625 3.150 1.00 . A A . 15 THR HB 1 1 9 5642 1 1 15 THR HG1 H 8.002 -9.175 1.903 1.00 . A A . 15 THR HG1 1 1 9 5643 1 1 15 THR HG21 H 6.843 -11.291 2.480 1.00 . A A . 15 THR HG21 1 1 9 5644 1 1 15 THR HG22 H 6.745 -10.575 4.102 1.00 . A A . 15 THR HG22 1 1 9 5645 1 1 15 THR HG23 H 5.263 -11.069 3.267 1.00 . A A . 15 THR HG23 1 1 9 5646 1 1 15 THR N N 5.546 -7.937 0.527 1.00 . A A . 15 THR N 1 1 9 5647 1 1 15 THR O O 4.053 -11.078 0.645 1.00 . A A . 15 THR O 1 1 9 5648 1 1 15 THR OG1 O 7.443 -8.664 2.493 1.00 . A A . 15 THR OG1 1 1 9 5649 1 1 16 CYS C C 1.285 -9.860 -0.010 1.00 . A A . 16 CYS C 1 1 9 5650 1 1 16 CYS CA C 1.776 -9.600 1.420 1.00 . A A . 16 CYS CA 1 1 9 5651 1 1 16 CYS CB C 0.938 -8.550 2.155 1.00 . A A . 16 CYS CB 1 1 9 5652 1 1 16 CYS H H 3.352 -8.219 1.745 1.00 . A A . 16 CYS H 1 1 9 5653 1 1 16 CYS HA H 1.701 -10.536 1.977 1.00 . A A . 16 CYS HA 1 1 9 5654 1 1 16 CYS HB2 H 1.256 -8.542 3.198 1.00 . A A . 16 CYS HB2 1 1 9 5655 1 1 16 CYS HB3 H 1.149 -7.567 1.737 1.00 . A A . 16 CYS HB3 1 1 9 5656 1 1 16 CYS N N 3.164 -9.163 1.431 1.00 . A A . 16 CYS N 1 1 9 5657 1 1 16 CYS O O 0.643 -10.877 -0.264 1.00 . A A . 16 CYS O 1 1 9 5658 1 1 16 CYS SG S -0.856 -8.794 2.134 1.00 . A A . 16 CYS SG 1 1 9 5659 1 1 17 ARG C C 1.926 -10.384 -2.917 1.00 . A A . 17 ARG C 1 1 9 5660 1 1 17 ARG CA C 1.282 -9.112 -2.360 1.00 . A A . 17 ARG CA 1 1 9 5661 1 1 17 ARG CB C 1.773 -7.884 -3.141 1.00 . A A . 17 ARG CB 1 1 9 5662 1 1 17 ARG CD C -0.102 -6.434 -4.044 1.00 . A A . 17 ARG CD 1 1 9 5663 1 1 17 ARG CG C 0.907 -6.636 -2.909 1.00 . A A . 17 ARG CG 1 1 9 5664 1 1 17 ARG CZ C -1.553 -8.084 -5.266 1.00 . A A . 17 ARG CZ 1 1 9 5665 1 1 17 ARG H H 2.106 -8.126 -0.666 1.00 . A A . 17 ARG H 1 1 9 5666 1 1 17 ARG HA H 0.204 -9.207 -2.473 1.00 . A A . 17 ARG HA 1 1 9 5667 1 1 17 ARG HB2 H 2.796 -7.664 -2.837 1.00 . A A . 17 ARG HB2 1 1 9 5668 1 1 17 ARG HB3 H 1.791 -8.114 -4.208 1.00 . A A . 17 ARG HB3 1 1 9 5669 1 1 17 ARG HD2 H -0.650 -5.513 -3.855 1.00 . A A . 17 ARG HD2 1 1 9 5670 1 1 17 ARG HD3 H 0.461 -6.311 -4.968 1.00 . A A . 17 ARG HD3 1 1 9 5671 1 1 17 ARG HE H -1.363 -7.951 -3.256 1.00 . A A . 17 ARG HE 1 1 9 5672 1 1 17 ARG HG2 H 0.390 -6.695 -1.951 1.00 . A A . 17 ARG HG2 1 1 9 5673 1 1 17 ARG HG3 H 1.561 -5.763 -2.893 1.00 . A A . 17 ARG HG3 1 1 9 5674 1 1 17 ARG HH11 H -0.606 -6.810 -6.557 1.00 . A A . 17 ARG HH11 1 1 9 5675 1 1 17 ARG HH12 H -1.608 -8.022 -7.309 1.00 . A A . 17 ARG HH12 1 1 9 5676 1 1 17 ARG HH21 H -2.630 -9.502 -4.277 1.00 . A A . 17 ARG HH21 1 1 9 5677 1 1 17 ARG HH22 H -2.762 -9.558 -6.019 1.00 . A A . 17 ARG HH22 1 1 9 5678 1 1 17 ARG N N 1.594 -8.953 -0.944 1.00 . A A . 17 ARG N 1 1 9 5679 1 1 17 ARG NE N -1.060 -7.549 -4.134 1.00 . A A . 17 ARG NE 1 1 9 5680 1 1 17 ARG NH1 N -1.231 -7.598 -6.474 1.00 . A A . 17 ARG NH1 1 1 9 5681 1 1 17 ARG NH2 N -2.389 -9.127 -5.186 1.00 . A A . 17 ARG NH2 1 1 9 5682 1 1 17 ARG O O 1.274 -11.137 -3.636 1.00 . A A . 17 ARG O 1 1 9 5683 1 1 18 PHE C C 3.339 -13.068 -2.459 1.00 . A A . 18 PHE C 1 1 9 5684 1 1 18 PHE CA C 3.959 -11.780 -3.005 1.00 . A A . 18 PHE CA 1 1 9 5685 1 1 18 PHE CB C 5.422 -11.628 -2.569 1.00 . A A . 18 PHE CB 1 1 9 5686 1 1 18 PHE CD1 C 6.697 -13.034 -4.244 1.00 . A A . 18 PHE CD1 1 1 9 5687 1 1 18 PHE CD2 C 6.606 -13.773 -1.925 1.00 . A A . 18 PHE CD2 1 1 9 5688 1 1 18 PHE CE1 C 7.430 -14.186 -4.581 1.00 . A A . 18 PHE CE1 1 1 9 5689 1 1 18 PHE CE2 C 7.343 -14.921 -2.262 1.00 . A A . 18 PHE CE2 1 1 9 5690 1 1 18 PHE CG C 6.287 -12.824 -2.914 1.00 . A A . 18 PHE CG 1 1 9 5691 1 1 18 PHE CZ C 7.755 -15.127 -3.589 1.00 . A A . 18 PHE CZ 1 1 9 5692 1 1 18 PHE H H 3.666 -9.951 -1.974 1.00 . A A . 18 PHE H 1 1 9 5693 1 1 18 PHE HA H 3.935 -11.821 -4.095 1.00 . A A . 18 PHE HA 1 1 9 5694 1 1 18 PHE HB2 H 5.842 -10.746 -3.053 1.00 . A A . 18 PHE HB2 1 1 9 5695 1 1 18 PHE HB3 H 5.461 -11.466 -1.493 1.00 . A A . 18 PHE HB3 1 1 9 5696 1 1 18 PHE HD1 H 6.444 -12.318 -5.011 1.00 . A A . 18 PHE HD1 1 1 9 5697 1 1 18 PHE HD2 H 6.279 -13.630 -0.904 1.00 . A A . 18 PHE HD2 1 1 9 5698 1 1 18 PHE HE1 H 7.738 -14.350 -5.603 1.00 . A A . 18 PHE HE1 1 1 9 5699 1 1 18 PHE HE2 H 7.586 -15.648 -1.501 1.00 . A A . 18 PHE HE2 1 1 9 5700 1 1 18 PHE HZ H 8.320 -16.012 -3.849 1.00 . A A . 18 PHE HZ 1 1 9 5701 1 1 18 PHE N N 3.200 -10.616 -2.576 1.00 . A A . 18 PHE N 1 1 9 5702 1 1 18 PHE O O 3.187 -14.035 -3.204 1.00 . A A . 18 PHE O 1 1 9 5703 1 1 19 ALA C C 0.967 -14.500 -1.274 1.00 . A A . 19 ALA C 1 1 9 5704 1 1 19 ALA CA C 2.274 -14.190 -0.540 1.00 . A A . 19 ALA CA 1 1 9 5705 1 1 19 ALA CB C 2.022 -13.882 0.939 1.00 . A A . 19 ALA CB 1 1 9 5706 1 1 19 ALA H H 3.140 -12.249 -0.610 1.00 . A A . 19 ALA H 1 1 9 5707 1 1 19 ALA HA H 2.920 -15.068 -0.594 1.00 . A A . 19 ALA HA 1 1 9 5708 1 1 19 ALA HB1 H 2.971 -13.687 1.441 1.00 . A A . 19 ALA HB1 1 1 9 5709 1 1 19 ALA HB2 H 1.376 -13.012 1.042 1.00 . A A . 19 ALA HB2 1 1 9 5710 1 1 19 ALA HB3 H 1.540 -14.740 1.409 1.00 . A A . 19 ALA HB3 1 1 9 5711 1 1 19 ALA N N 2.967 -13.074 -1.172 1.00 . A A . 19 ALA N 1 1 9 5712 1 1 19 ALA O O 0.683 -15.663 -1.555 1.00 . A A . 19 ALA O 1 1 9 5713 1 1 20 GLY C C -2.198 -12.884 -1.865 1.00 . A A . 20 GLY C 1 1 9 5714 1 1 20 GLY CA C -0.962 -13.531 -2.485 1.00 . A A . 20 GLY CA 1 1 9 5715 1 1 20 GLY H H 0.500 -12.532 -1.322 1.00 . A A . 20 GLY H 1 1 9 5716 1 1 20 GLY HA2 H -0.728 -13.001 -3.409 1.00 . A A . 20 GLY HA2 1 1 9 5717 1 1 20 GLY HA3 H -1.196 -14.565 -2.738 1.00 . A A . 20 GLY HA3 1 1 9 5718 1 1 20 GLY N N 0.199 -13.454 -1.609 1.00 . A A . 20 GLY N 1 1 9 5719 1 1 20 GLY O O -3.308 -13.380 -2.058 1.00 . A A . 20 GLY O 1 1 9 5720 1 1 21 GLY C C -3.501 -9.873 -1.582 1.00 . A A . 21 GLY C 1 1 9 5721 1 1 21 GLY CA C -3.114 -10.979 -0.604 1.00 . A A . 21 GLY CA 1 1 9 5722 1 1 21 GLY H H -1.084 -11.411 -1.014 1.00 . A A . 21 GLY H 1 1 9 5723 1 1 21 GLY HA2 H -3.977 -11.616 -0.413 1.00 . A A . 21 GLY HA2 1 1 9 5724 1 1 21 GLY HA3 H -2.802 -10.538 0.341 1.00 . A A . 21 GLY HA3 1 1 9 5725 1 1 21 GLY N N -2.020 -11.769 -1.146 1.00 . A A . 21 GLY N 1 1 9 5726 1 1 21 GLY O O -2.676 -9.431 -2.381 1.00 . A A . 21 GLY O 1 1 9 5727 1 1 22 SER C C -4.590 -7.073 -2.200 1.00 . A A . 22 SER C 1 1 9 5728 1 1 22 SER CA C -5.294 -8.412 -2.421 1.00 . A A . 22 SER CA 1 1 9 5729 1 1 22 SER CB C -6.805 -8.268 -2.211 1.00 . A A . 22 SER CB 1 1 9 5730 1 1 22 SER H H -5.386 -9.808 -0.826 1.00 . A A . 22 SER H 1 1 9 5731 1 1 22 SER HA H -5.122 -8.737 -3.449 1.00 . A A . 22 SER HA 1 1 9 5732 1 1 22 SER HB2 H -7.005 -7.890 -1.209 1.00 . A A . 22 SER HB2 1 1 9 5733 1 1 22 SER HB3 H -7.206 -7.562 -2.937 1.00 . A A . 22 SER HB3 1 1 9 5734 1 1 22 SER HG H -7.135 -10.128 -1.724 1.00 . A A . 22 SER HG 1 1 9 5735 1 1 22 SER N N -4.762 -9.426 -1.521 1.00 . A A . 22 SER N 1 1 9 5736 1 1 22 SER O O -4.089 -6.810 -1.109 1.00 . A A . 22 SER O 1 1 9 5737 1 1 22 SER OG O -7.451 -9.511 -2.387 1.00 . A A . 22 SER OG 1 1 9 5738 1 1 23 ARG C C -4.360 -4.093 -2.050 1.00 . A A . 23 ARG C 1 1 9 5739 1 1 23 ARG CA C -3.872 -4.946 -3.220 1.00 . A A . 23 ARG CA 1 1 9 5740 1 1 23 ARG CB C -4.081 -4.213 -4.551 1.00 . A A . 23 ARG CB 1 1 9 5741 1 1 23 ARG CD C -3.622 -4.203 -7.036 1.00 . A A . 23 ARG CD 1 1 9 5742 1 1 23 ARG CG C -3.438 -4.965 -5.723 1.00 . A A . 23 ARG CG 1 1 9 5743 1 1 23 ARG CZ C -5.503 -3.491 -8.507 1.00 . A A . 23 ARG CZ 1 1 9 5744 1 1 23 ARG H H -5.014 -6.506 -4.097 1.00 . A A . 23 ARG H 1 1 9 5745 1 1 23 ARG HA H -2.807 -5.129 -3.080 1.00 . A A . 23 ARG HA 1 1 9 5746 1 1 23 ARG HB2 H -5.149 -4.082 -4.731 1.00 . A A . 23 ARG HB2 1 1 9 5747 1 1 23 ARG HB3 H -3.619 -3.228 -4.474 1.00 . A A . 23 ARG HB3 1 1 9 5748 1 1 23 ARG HD2 H -3.233 -3.191 -6.910 1.00 . A A . 23 ARG HD2 1 1 9 5749 1 1 23 ARG HD3 H -3.049 -4.711 -7.812 1.00 . A A . 23 ARG HD3 1 1 9 5750 1 1 23 ARG HE H -5.684 -4.677 -6.870 1.00 . A A . 23 ARG HE 1 1 9 5751 1 1 23 ARG HG2 H -2.370 -5.060 -5.534 1.00 . A A . 23 ARG HG2 1 1 9 5752 1 1 23 ARG HG3 H -3.870 -5.961 -5.823 1.00 . A A . 23 ARG HG3 1 1 9 5753 1 1 23 ARG HH11 H -3.693 -2.749 -9.094 1.00 . A A . 23 ARG HH11 1 1 9 5754 1 1 23 ARG HH12 H -5.043 -2.283 -10.095 1.00 . A A . 23 ARG HH12 1 1 9 5755 1 1 23 ARG HH21 H -7.435 -4.078 -8.201 1.00 . A A . 23 ARG HH21 1 1 9 5756 1 1 23 ARG HH22 H -7.181 -3.046 -9.586 1.00 . A A . 23 ARG HH22 1 1 9 5757 1 1 23 ARG N N -4.557 -6.232 -3.241 1.00 . A A . 23 ARG N 1 1 9 5758 1 1 23 ARG NE N -5.032 -4.156 -7.439 1.00 . A A . 23 ARG NE 1 1 9 5759 1 1 23 ARG NH1 N -4.681 -2.784 -9.296 1.00 . A A . 23 ARG NH1 1 1 9 5760 1 1 23 ARG NH2 N -6.812 -3.539 -8.786 1.00 . A A . 23 ARG NH2 1 1 9 5761 1 1 23 ARG O O -3.559 -3.663 -1.227 1.00 . A A . 23 ARG O 1 1 9 5762 1 1 24 GLU C C -5.999 -3.685 0.463 1.00 . A A . 24 GLU C 1 1 9 5763 1 1 24 GLU CA C -6.319 -3.111 -0.916 1.00 . A A . 24 GLU CA 1 1 9 5764 1 1 24 GLU CB C -7.836 -3.091 -1.139 1.00 . A A . 24 GLU CB 1 1 9 5765 1 1 24 GLU CD C -9.729 -2.209 -2.591 1.00 . A A . 24 GLU CD 1 1 9 5766 1 1 24 GLU CG C -8.216 -2.294 -2.394 1.00 . A A . 24 GLU CG 1 1 9 5767 1 1 24 GLU H H -6.265 -4.271 -2.693 1.00 . A A . 24 GLU H 1 1 9 5768 1 1 24 GLU HA H -5.943 -2.087 -0.949 1.00 . A A . 24 GLU HA 1 1 9 5769 1 1 24 GLU HB2 H -8.202 -4.116 -1.224 1.00 . A A . 24 GLU HB2 1 1 9 5770 1 1 24 GLU HB3 H -8.309 -2.622 -0.274 1.00 . A A . 24 GLU HB3 1 1 9 5771 1 1 24 GLU HE2 H -9.451 -0.686 -3.783 1.00 . A A . 24 GLU HE2 1 1 9 5772 1 1 24 GLU HG2 H -7.820 -1.282 -2.300 1.00 . A A . 24 GLU HG2 1 1 9 5773 1 1 24 GLU HG3 H -7.782 -2.763 -3.277 1.00 . A A . 24 GLU HG3 1 1 9 5774 1 1 24 GLU N N -5.677 -3.876 -1.975 1.00 . A A . 24 GLU N 1 1 9 5775 1 1 24 GLU O O -5.662 -2.933 1.374 1.00 . A A . 24 GLU O 1 1 9 5776 1 1 24 GLU OE1 O -10.467 -3.003 -2.011 1.00 . A A . 24 GLU OE1 1 1 9 5777 1 1 24 GLU OE2 O -10.163 -1.224 -3.429 1.00 . A A . 24 GLU OE2 1 1 9 5778 1 1 25 ARG C C -4.508 -5.495 2.416 1.00 . A A . 25 ARG C 1 1 9 5779 1 1 25 ARG CA C -5.936 -5.672 1.904 1.00 . A A . 25 ARG CA 1 1 9 5780 1 1 25 ARG CB C -6.314 -7.151 1.766 1.00 . A A . 25 ARG CB 1 1 9 5781 1 1 25 ARG CD C -7.209 -9.146 3.043 1.00 . A A . 25 ARG CD 1 1 9 5782 1 1 25 ARG CG C -6.512 -7.785 3.148 1.00 . A A . 25 ARG CG 1 1 9 5783 1 1 25 ARG CZ C -6.768 -11.341 1.939 1.00 . A A . 25 ARG CZ 1 1 9 5784 1 1 25 ARG H H -6.390 -5.579 -0.163 1.00 . A A . 25 ARG H 1 1 9 5785 1 1 25 ARG HA H -6.622 -5.199 2.609 1.00 . A A . 25 ARG HA 1 1 9 5786 1 1 25 ARG HB2 H -7.251 -7.210 1.215 1.00 . A A . 25 ARG HB2 1 1 9 5787 1 1 25 ARG HB3 H -5.550 -7.694 1.207 1.00 . A A . 25 ARG HB3 1 1 9 5788 1 1 25 ARG HD2 H -7.472 -9.466 4.051 1.00 . A A . 25 ARG HD2 1 1 9 5789 1 1 25 ARG HD3 H -8.126 -9.022 2.466 1.00 . A A . 25 ARG HD3 1 1 9 5790 1 1 25 ARG HE H -5.350 -9.986 2.459 1.00 . A A . 25 ARG HE 1 1 9 5791 1 1 25 ARG HG2 H -5.553 -7.890 3.655 1.00 . A A . 25 ARG HG2 1 1 9 5792 1 1 25 ARG HG3 H -7.153 -7.133 3.744 1.00 . A A . 25 ARG HG3 1 1 9 5793 1 1 25 ARG HH11 H -8.758 -10.986 2.249 1.00 . A A . 25 ARG HH11 1 1 9 5794 1 1 25 ARG HH12 H -8.388 -12.519 1.507 1.00 . A A . 25 ARG HH12 1 1 9 5795 1 1 25 ARG HH21 H -4.886 -12.028 1.542 1.00 . A A . 25 ARG HH21 1 1 9 5796 1 1 25 ARG HH22 H -6.179 -13.110 1.098 1.00 . A A . 25 ARG HH22 1 1 9 5797 1 1 25 ARG N N -6.116 -5.009 0.623 1.00 . A A . 25 ARG N 1 1 9 5798 1 1 25 ARG NE N -6.343 -10.169 2.443 1.00 . A A . 25 ARG NE 1 1 9 5799 1 1 25 ARG NH1 N -8.075 -11.639 1.892 1.00 . A A . 25 ARG NH1 1 1 9 5800 1 1 25 ARG NH2 N -5.874 -12.228 1.482 1.00 . A A . 25 ARG NH2 1 1 9 5801 1 1 25 ARG O O -4.303 -5.053 3.544 1.00 . A A . 25 ARG O 1 1 9 5802 1 1 26 CYS C C -1.765 -4.198 2.137 1.00 . A A . 26 CYS C 1 1 9 5803 1 1 26 CYS CA C -2.112 -5.658 1.853 1.00 . A A . 26 CYS CA 1 1 9 5804 1 1 26 CYS CB C -1.296 -6.178 0.666 1.00 . A A . 26 CYS CB 1 1 9 5805 1 1 26 CYS H H -3.786 -6.178 0.657 1.00 . A A . 26 CYS H 1 1 9 5806 1 1 26 CYS HA H -1.867 -6.235 2.744 1.00 . A A . 26 CYS HA 1 1 9 5807 1 1 26 CYS HB2 H -1.605 -5.656 -0.241 1.00 . A A . 26 CYS HB2 1 1 9 5808 1 1 26 CYS HB3 H -0.248 -5.948 0.841 1.00 . A A . 26 CYS HB3 1 1 9 5809 1 1 26 CYS N N -3.529 -5.823 1.569 1.00 . A A . 26 CYS N 1 1 9 5810 1 1 26 CYS O O -1.001 -3.910 3.057 1.00 . A A . 26 CYS O 1 1 9 5811 1 1 26 CYS SG S -1.423 -7.957 0.364 1.00 . A A . 26 CYS SG 1 1 9 5812 1 1 27 ALA C C -2.565 -1.370 2.855 1.00 . A A . 27 ALA C 1 1 9 5813 1 1 27 ALA CA C -2.076 -1.855 1.491 1.00 . A A . 27 ALA CA 1 1 9 5814 1 1 27 ALA CB C -2.729 -1.100 0.336 1.00 . A A . 27 ALA CB 1 1 9 5815 1 1 27 ALA H H -2.947 -3.574 0.604 1.00 . A A . 27 ALA H 1 1 9 5816 1 1 27 ALA HA H -1.000 -1.688 1.428 1.00 . A A . 27 ALA HA 1 1 9 5817 1 1 27 ALA HB1 H -3.808 -1.249 0.347 1.00 . A A . 27 ALA HB1 1 1 9 5818 1 1 27 ALA HB2 H -2.514 -0.037 0.407 1.00 . A A . 27 ALA HB2 1 1 9 5819 1 1 27 ALA HB3 H -2.316 -1.470 -0.602 1.00 . A A . 27 ALA HB3 1 1 9 5820 1 1 27 ALA N N -2.325 -3.277 1.345 1.00 . A A . 27 ALA N 1 1 9 5821 1 1 27 ALA O O -1.798 -0.764 3.591 1.00 . A A . 27 ALA O 1 1 9 5822 1 1 28 LYS C C -3.548 -1.907 5.652 1.00 . A A . 28 LYS C 1 1 9 5823 1 1 28 LYS CA C -4.388 -1.338 4.509 1.00 . A A . 28 LYS CA 1 1 9 5824 1 1 28 LYS CB C -5.813 -1.891 4.537 1.00 . A A . 28 LYS CB 1 1 9 5825 1 1 28 LYS CD C -8.026 -1.875 5.725 1.00 . A A . 28 LYS CD 1 1 9 5826 1 1 28 LYS CE C -8.784 -1.395 6.966 1.00 . A A . 28 LYS CE 1 1 9 5827 1 1 28 LYS CG C -6.559 -1.442 5.791 1.00 . A A . 28 LYS CG 1 1 9 5828 1 1 28 LYS H H -4.415 -2.183 2.591 1.00 . A A . 28 LYS H 1 1 9 5829 1 1 28 LYS HA H -4.425 -0.251 4.596 1.00 . A A . 28 LYS HA 1 1 9 5830 1 1 28 LYS HB2 H -6.326 -1.513 3.656 1.00 . A A . 28 LYS HB2 1 1 9 5831 1 1 28 LYS HB3 H -5.796 -2.980 4.488 1.00 . A A . 28 LYS HB3 1 1 9 5832 1 1 28 LYS HD2 H -8.483 -1.443 4.834 1.00 . A A . 28 LYS HD2 1 1 9 5833 1 1 28 LYS HD3 H -8.072 -2.964 5.660 1.00 . A A . 28 LYS HD3 1 1 9 5834 1 1 28 LYS HE2 H -8.327 -1.829 7.856 1.00 . A A . 28 LYS HE2 1 1 9 5835 1 1 28 LYS HE3 H -8.721 -0.308 7.030 1.00 . A A . 28 LYS HE3 1 1 9 5836 1 1 28 LYS HG2 H -6.082 -1.886 6.664 1.00 . A A . 28 LYS HG2 1 1 9 5837 1 1 28 LYS HG3 H -6.495 -0.357 5.855 1.00 . A A . 28 LYS HG3 1 1 9 5838 1 1 28 LYS HZ1 H -10.277 -2.791 6.845 1.00 . A A . 28 LYS HZ1 1 1 9 5839 1 1 28 LYS HZ2 H -10.664 -1.481 7.766 1.00 . A A . 28 LYS HZ2 1 1 9 5840 1 1 28 LYS HZ3 H -10.652 -1.356 6.123 1.00 . A A . 28 LYS HZ3 1 1 9 5841 1 1 28 LYS N N -3.814 -1.672 3.220 1.00 . A A . 28 LYS N 1 1 9 5842 1 1 28 LYS NZ N -10.203 -1.786 6.920 1.00 . A A . 28 LYS NZ 1 1 9 5843 1 1 28 LYS O O -3.189 -1.178 6.575 1.00 . A A . 28 LYS O 1 1 9 5844 1 1 29 LEU C C -1.105 -3.228 6.807 1.00 . A A . 29 LEU C 1 1 9 5845 1 1 29 LEU CA C -2.445 -3.928 6.565 1.00 . A A . 29 LEU CA 1 1 9 5846 1 1 29 LEU CB C -2.235 -5.373 6.084 1.00 . A A . 29 LEU CB 1 1 9 5847 1 1 29 LEU CD1 C -2.284 -6.601 8.310 1.00 . A A . 29 LEU CD1 1 1 9 5848 1 1 29 LEU CD2 C -1.061 -7.562 6.350 1.00 . A A . 29 LEU CD2 1 1 9 5849 1 1 29 LEU CG C -1.454 -6.265 7.065 1.00 . A A . 29 LEU CG 1 1 9 5850 1 1 29 LEU H H -3.596 -3.732 4.786 1.00 . A A . 29 LEU H 1 1 9 5851 1 1 29 LEU HA H -3.010 -3.939 7.497 1.00 . A A . 29 LEU HA 1 1 9 5852 1 1 29 LEU HB2 H -3.205 -5.833 5.896 1.00 . A A . 29 LEU HB2 1 1 9 5853 1 1 29 LEU HB3 H -1.686 -5.339 5.144 1.00 . A A . 29 LEU HB3 1 1 9 5854 1 1 29 LEU HD11 H -3.199 -7.118 8.020 1.00 . A A . 29 LEU HD11 1 1 9 5855 1 1 29 LEU HD12 H -1.706 -7.248 8.971 1.00 . A A . 29 LEU HD12 1 1 9 5856 1 1 29 LEU HD13 H -2.540 -5.695 8.856 1.00 . A A . 29 LEU HD13 1 1 9 5857 1 1 29 LEU HD21 H -0.385 -7.337 5.525 1.00 . A A . 29 LEU HD21 1 1 9 5858 1 1 29 LEU HD22 H -0.552 -8.231 7.046 1.00 . A A . 29 LEU HD22 1 1 9 5859 1 1 29 LEU HD23 H -1.949 -8.059 5.960 1.00 . A A . 29 LEU HD23 1 1 9 5860 1 1 29 LEU HG H -0.534 -5.771 7.379 1.00 . A A . 29 LEU HG 1 1 9 5861 1 1 29 LEU N N -3.243 -3.208 5.578 1.00 . A A . 29 LEU N 1 1 9 5862 1 1 29 LEU O O -0.669 -3.113 7.950 1.00 . A A . 29 LEU O 1 1 9 5863 1 1 30 SER C C 0.771 -0.675 6.234 1.00 . A A . 30 SER C 1 1 9 5864 1 1 30 SER CA C 0.857 -2.139 5.792 1.00 . A A . 30 SER CA 1 1 9 5865 1 1 30 SER CB C 1.559 -2.270 4.439 1.00 . A A . 30 SER CB 1 1 9 5866 1 1 30 SER H H -0.905 -2.859 4.825 1.00 . A A . 30 SER H 1 1 9 5867 1 1 30 SER HA H 1.469 -2.675 6.520 1.00 . A A . 30 SER HA 1 1 9 5868 1 1 30 SER HB2 H 2.526 -1.775 4.498 1.00 . A A . 30 SER HB2 1 1 9 5869 1 1 30 SER HB3 H 1.709 -3.322 4.202 1.00 . A A . 30 SER HB3 1 1 9 5870 1 1 30 SER HG H 0.021 -2.219 3.254 1.00 . A A . 30 SER HG 1 1 9 5871 1 1 30 SER N N -0.457 -2.770 5.730 1.00 . A A . 30 SER N 1 1 9 5872 1 1 30 SER O O 1.668 -0.191 6.921 1.00 . A A . 30 SER O 1 1 9 5873 1 1 30 SER OG O 0.804 -1.682 3.406 1.00 . A A . 30 SER OG 1 1 9 5874 1 1 31 GLY C C -0.594 2.260 4.780 1.00 . A A . 31 GLY C 1 1 9 5875 1 1 31 GLY CA C -0.535 1.438 6.074 1.00 . A A . 31 GLY CA 1 1 9 5876 1 1 31 GLY H H -0.979 -0.460 5.257 1.00 . A A . 31 GLY H 1 1 9 5877 1 1 31 GLY HA2 H -1.495 1.531 6.583 1.00 . A A . 31 GLY HA2 1 1 9 5878 1 1 31 GLY HA3 H 0.235 1.858 6.721 1.00 . A A . 31 GLY HA3 1 1 9 5879 1 1 31 GLY N N -0.295 0.023 5.825 1.00 . A A . 31 GLY N 1 1 9 5880 1 1 31 GLY O O -0.808 3.469 4.844 1.00 . A A . 31 GLY O 1 1 9 5881 1 1 32 CYS C C -1.871 2.434 1.806 1.00 . A A . 32 CYS C 1 1 9 5882 1 1 32 CYS CA C -0.435 2.260 2.306 1.00 . A A . 32 CYS CA 1 1 9 5883 1 1 32 CYS CB C 0.361 1.401 1.314 1.00 . A A . 32 CYS CB 1 1 9 5884 1 1 32 CYS H H -0.310 0.613 3.625 1.00 . A A . 32 CYS H 1 1 9 5885 1 1 32 CYS HA H 0.033 3.238 2.394 1.00 . A A . 32 CYS HA 1 1 9 5886 1 1 32 CYS HB2 H -0.230 0.517 1.082 1.00 . A A . 32 CYS HB2 1 1 9 5887 1 1 32 CYS HB3 H 0.497 1.949 0.382 1.00 . A A . 32 CYS HB3 1 1 9 5888 1 1 32 CYS N N -0.416 1.621 3.615 1.00 . A A . 32 CYS N 1 1 9 5889 1 1 32 CYS O O -2.767 1.705 2.229 1.00 . A A . 32 CYS O 1 1 9 5890 1 1 32 CYS SG S 1.974 0.800 1.889 1.00 . A A . 32 CYS SG 1 1 9 5891 1 1 33 LYS C C -3.219 3.132 -1.244 1.00 . A A . 33 LYS C 1 1 9 5892 1 1 33 LYS CA C -3.345 3.615 0.201 1.00 . A A . 33 LYS CA 1 1 9 5893 1 1 33 LYS CB C -3.702 5.109 0.166 1.00 . A A . 33 LYS CB 1 1 9 5894 1 1 33 LYS CD C -4.526 5.489 2.603 1.00 . A A . 33 LYS CD 1 1 9 5895 1 1 33 LYS CE C -3.979 4.383 3.513 1.00 . A A . 33 LYS CE 1 1 9 5896 1 1 33 LYS CG C -3.555 5.880 1.479 1.00 . A A . 33 LYS CG 1 1 9 5897 1 1 33 LYS H H -1.292 3.950 0.597 1.00 . A A . 33 LYS H 1 1 9 5898 1 1 33 LYS HA H -4.155 3.081 0.699 1.00 . A A . 33 LYS HA 1 1 9 5899 1 1 33 LYS HB2 H -3.045 5.602 -0.554 1.00 . A A . 33 LYS HB2 1 1 9 5900 1 1 33 LYS HB3 H -4.727 5.216 -0.193 1.00 . A A . 33 LYS HB3 1 1 9 5901 1 1 33 LYS HD2 H -4.678 6.383 3.208 1.00 . A A . 33 LYS HD2 1 1 9 5902 1 1 33 LYS HD3 H -5.493 5.198 2.188 1.00 . A A . 33 LYS HD3 1 1 9 5903 1 1 33 LYS HE2 H -4.332 3.415 3.162 1.00 . A A . 33 LYS HE2 1 1 9 5904 1 1 33 LYS HE3 H -2.890 4.399 3.508 1.00 . A A . 33 LYS HE3 1 1 9 5905 1 1 33 LYS HG2 H -2.522 5.818 1.821 1.00 . A A . 33 LYS HG2 1 1 9 5906 1 1 33 LYS HG3 H -3.759 6.922 1.232 1.00 . A A . 33 LYS HG3 1 1 9 5907 1 1 33 LYS HZ1 H -4.065 5.458 5.247 1.00 . A A . 33 LYS HZ1 1 1 9 5908 1 1 33 LYS HZ2 H -5.406 4.528 4.979 1.00 . A A . 33 LYS HZ2 1 1 9 5909 1 1 33 LYS HZ3 H -3.995 3.830 5.480 1.00 . A A . 33 LYS HZ3 1 1 9 5910 1 1 33 LYS N N -2.080 3.391 0.893 1.00 . A A . 33 LYS N 1 1 9 5911 1 1 33 LYS NZ N -4.398 4.563 4.913 1.00 . A A . 33 LYS NZ 1 1 9 5912 1 1 33 LYS O O -2.202 3.392 -1.886 1.00 . A A . 33 LYS O 1 1 9 5913 1 1 34 ILE C C -5.660 3.187 -3.600 1.00 . A A . 34 ILE C 1 1 9 5914 1 1 34 ILE CA C -4.501 2.280 -3.187 1.00 . A A . 34 ILE CA 1 1 9 5915 1 1 34 ILE CB C -4.883 0.813 -3.465 1.00 . A A . 34 ILE CB 1 1 9 5916 1 1 34 ILE CD1 C -2.471 -0.105 -3.369 1.00 . A A . 34 ILE CD1 1 1 9 5917 1 1 34 ILE CG1 C -3.909 -0.208 -2.859 1.00 . A A . 34 ILE CG1 1 1 9 5918 1 1 34 ILE CG2 C -5.060 0.576 -4.972 1.00 . A A . 34 ILE CG2 1 1 9 5919 1 1 34 ILE H H -5.050 2.277 -1.152 1.00 . A A . 34 ILE H 1 1 9 5920 1 1 34 ILE HA H -3.609 2.533 -3.763 1.00 . A A . 34 ILE HA 1 1 9 5921 1 1 34 ILE HB H -5.846 0.614 -2.994 1.00 . A A . 34 ILE HB 1 1 9 5922 1 1 34 ILE HD11 H -2.033 0.839 -3.052 1.00 . A A . 34 ILE HD11 1 1 9 5923 1 1 34 ILE HD12 H -1.883 -0.918 -2.944 1.00 . A A . 34 ILE HD12 1 1 9 5924 1 1 34 ILE HD13 H -2.437 -0.183 -4.454 1.00 . A A . 34 ILE HD13 1 1 9 5925 1 1 34 ILE HG12 H -3.909 -0.085 -1.779 1.00 . A A . 34 ILE HG12 1 1 9 5926 1 1 34 ILE HG13 H -4.287 -1.205 -3.074 1.00 . A A . 34 ILE HG13 1 1 9 5927 1 1 34 ILE HG21 H -4.159 0.860 -5.516 1.00 . A A . 34 ILE HG21 1 1 9 5928 1 1 34 ILE HG22 H -5.277 -0.475 -5.159 1.00 . A A . 34 ILE HG22 1 1 9 5929 1 1 34 ILE HG23 H -5.894 1.167 -5.353 1.00 . A A . 34 ILE HG23 1 1 9 5930 1 1 34 ILE N N -4.278 2.497 -1.763 1.00 . A A . 34 ILE N 1 1 9 5931 1 1 34 ILE O O -6.767 3.012 -3.094 1.00 . A A . 34 ILE O 1 1 9 5932 1 1 35 ILE C C -6.255 4.940 -6.671 1.00 . A A . 35 ILE C 1 1 9 5933 1 1 35 ILE CA C -6.490 4.891 -5.163 1.00 . A A . 35 ILE CA 1 1 9 5934 1 1 35 ILE CB C -6.641 6.291 -4.533 1.00 . A A . 35 ILE CB 1 1 9 5935 1 1 35 ILE CD1 C -5.545 8.530 -4.027 1.00 . A A . 35 ILE CD1 1 1 9 5936 1 1 35 ILE CG1 C -5.372 7.150 -4.671 1.00 . A A . 35 ILE CG1 1 1 9 5937 1 1 35 ILE CG2 C -7.068 6.156 -3.064 1.00 . A A . 35 ILE CG2 1 1 9 5938 1 1 35 ILE H H -4.488 4.251 -4.880 1.00 . A A . 35 ILE H 1 1 9 5939 1 1 35 ILE HA H -7.436 4.368 -5.018 1.00 . A A . 35 ILE HA 1 1 9 5940 1 1 35 ILE HB H -7.450 6.796 -5.063 1.00 . A A . 35 ILE HB 1 1 9 5941 1 1 35 ILE HD11 H -5.601 8.439 -2.942 1.00 . A A . 35 ILE HD11 1 1 9 5942 1 1 35 ILE HD12 H -4.692 9.159 -4.269 1.00 . A A . 35 ILE HD12 1 1 9 5943 1 1 35 ILE HD13 H -6.451 9.005 -4.404 1.00 . A A . 35 ILE HD13 1 1 9 5944 1 1 35 ILE HG12 H -4.519 6.651 -4.210 1.00 . A A . 35 ILE HG12 1 1 9 5945 1 1 35 ILE HG13 H -5.160 7.306 -5.728 1.00 . A A . 35 ILE HG13 1 1 9 5946 1 1 35 ILE HG21 H -6.237 5.793 -2.459 1.00 . A A . 35 ILE HG21 1 1 9 5947 1 1 35 ILE HG22 H -7.399 7.118 -2.675 1.00 . A A . 35 ILE HG22 1 1 9 5948 1 1 35 ILE HG23 H -7.903 5.461 -2.983 1.00 . A A . 35 ILE HG23 1 1 9 5949 1 1 35 ILE N N -5.426 4.123 -4.528 1.00 . A A . 35 ILE N 1 1 9 5950 1 1 35 ILE O O -5.122 5.110 -7.122 1.00 . A A . 35 ILE O 1 1 9 5951 1 1 36 SER C C -7.556 6.144 -9.492 1.00 . A A . 36 SER C 1 1 9 5952 1 1 36 SER CA C -7.312 4.748 -8.904 1.00 . A A . 36 SER CA 1 1 9 5953 1 1 36 SER CB C -8.354 3.733 -9.395 1.00 . A A . 36 SER CB 1 1 9 5954 1 1 36 SER H H -8.234 4.666 -6.998 1.00 . A A . 36 SER H 1 1 9 5955 1 1 36 SER HA H -6.335 4.407 -9.251 1.00 . A A . 36 SER HA 1 1 9 5956 1 1 36 SER HB2 H -9.353 4.044 -9.086 1.00 . A A . 36 SER HB2 1 1 9 5957 1 1 36 SER HB3 H -8.325 3.665 -10.482 1.00 . A A . 36 SER HB3 1 1 9 5958 1 1 36 SER HG H -8.172 2.490 -7.907 1.00 . A A . 36 SER HG 1 1 9 5959 1 1 36 SER N N -7.337 4.784 -7.446 1.00 . A A . 36 SER N 1 1 9 5960 1 1 36 SER O O -8.161 6.271 -10.555 1.00 . A A . 36 SER O 1 1 9 5961 1 1 36 SER OG O -8.079 2.454 -8.862 1.00 . A A . 36 SER OG 1 1 9 5962 1 1 37 ALA C C -5.893 9.074 -9.895 1.00 . A A . 37 ALA C 1 1 9 5963 1 1 37 ALA CA C -7.179 8.580 -9.222 1.00 . A A . 37 ALA CA 1 1 9 5964 1 1 37 ALA CB C -7.503 9.427 -7.988 1.00 . A A . 37 ALA CB 1 1 9 5965 1 1 37 ALA H H -6.575 7.005 -7.945 1.00 . A A . 37 ALA H 1 1 9 5966 1 1 37 ALA HA H -7.999 8.699 -9.930 1.00 . A A . 37 ALA HA 1 1 9 5967 1 1 37 ALA HB1 H -8.412 9.058 -7.512 1.00 . A A . 37 ALA HB1 1 1 9 5968 1 1 37 ALA HB2 H -6.680 9.375 -7.274 1.00 . A A . 37 ALA HB2 1 1 9 5969 1 1 37 ALA HB3 H -7.658 10.466 -8.281 1.00 . A A . 37 ALA HB3 1 1 9 5970 1 1 37 ALA N N -7.070 7.187 -8.806 1.00 . A A . 37 ALA N 1 1 9 5971 1 1 37 ALA O O -5.761 10.271 -10.142 1.00 . A A . 37 ALA O 1 1 9 5972 1 1 38 SER C C -2.944 9.619 -9.876 1.00 . A A . 38 SER C 1 1 9 5973 1 1 38 SER CA C -3.601 8.477 -10.665 1.00 . A A . 38 SER CA 1 1 9 5974 1 1 38 SER CB C -3.669 8.738 -12.174 1.00 . A A . 38 SER CB 1 1 9 5975 1 1 38 SER H H -5.133 7.196 -9.985 1.00 . A A . 38 SER H 1 1 9 5976 1 1 38 SER HA H -2.988 7.587 -10.517 1.00 . A A . 38 SER HA 1 1 9 5977 1 1 38 SER HB2 H -4.141 7.887 -12.668 1.00 . A A . 38 SER HB2 1 1 9 5978 1 1 38 SER HB3 H -4.263 9.631 -12.367 1.00 . A A . 38 SER HB3 1 1 9 5979 1 1 38 SER HG H -1.968 9.660 -12.275 1.00 . A A . 38 SER HG 1 1 9 5980 1 1 38 SER N N -4.936 8.169 -10.162 1.00 . A A . 38 SER N 1 1 9 5981 1 1 38 SER O O -2.231 10.445 -10.442 1.00 . A A . 38 SER O 1 1 9 5982 1 1 38 SER OG O -2.372 8.902 -12.708 1.00 . A A . 38 SER OG 1 1 9 5983 1 1 39 THR C C -2.472 10.022 -6.291 1.00 . A A . 39 THR C 1 1 9 5984 1 1 39 THR CA C -2.753 10.688 -7.642 1.00 . A A . 39 THR CA 1 1 9 5985 1 1 39 THR CB C -3.855 11.763 -7.548 1.00 . A A . 39 THR CB 1 1 9 5986 1 1 39 THR CG2 C -3.477 12.952 -6.658 1.00 . A A . 39 THR CG2 1 1 9 5987 1 1 39 THR H H -3.793 8.939 -8.168 1.00 . A A . 39 THR H 1 1 9 5988 1 1 39 THR HA H -1.830 11.142 -8.008 1.00 . A A . 39 THR HA 1 1 9 5989 1 1 39 THR HB H -4.767 11.309 -7.156 1.00 . A A . 39 THR HB 1 1 9 5990 1 1 39 THR HG1 H -4.584 11.594 -9.350 1.00 . A A . 39 THR HG1 1 1 9 5991 1 1 39 THR HG21 H -4.223 13.739 -6.778 1.00 . A A . 39 THR HG21 1 1 9 5992 1 1 39 THR HG22 H -3.465 12.660 -5.609 1.00 . A A . 39 THR HG22 1 1 9 5993 1 1 39 THR HG23 H -2.500 13.344 -6.947 1.00 . A A . 39 THR HG23 1 1 9 5994 1 1 39 THR N N -3.195 9.651 -8.562 1.00 . A A . 39 THR N 1 1 9 5995 1 1 39 THR O O -2.895 8.887 -6.067 1.00 . A A . 39 THR O 1 1 9 5996 1 1 39 THR OG1 O -4.145 12.276 -8.834 1.00 . A A . 39 THR OG1 1 1 9 5997 1 1 40 CYS C C -1.575 11.664 -3.182 1.00 . A A . 40 CYS C 1 1 9 5998 1 1 40 CYS CA C -1.587 10.370 -4.001 1.00 . A A . 40 CYS CA 1 1 9 5999 1 1 40 CYS CB C -0.281 9.601 -3.791 1.00 . A A . 40 CYS CB 1 1 9 6000 1 1 40 CYS H H -1.403 11.631 -5.673 1.00 . A A . 40 CYS H 1 1 9 6001 1 1 40 CYS HA H -2.418 9.736 -3.695 1.00 . A A . 40 CYS HA 1 1 9 6002 1 1 40 CYS HB2 H 0.554 10.190 -4.175 1.00 . A A . 40 CYS HB2 1 1 9 6003 1 1 40 CYS HB3 H -0.137 9.466 -2.720 1.00 . A A . 40 CYS HB3 1 1 9 6004 1 1 40 CYS N N -1.753 10.721 -5.405 1.00 . A A . 40 CYS N 1 1 9 6005 1 1 40 CYS O O -1.041 12.666 -3.657 1.00 . A A . 40 CYS O 1 1 9 6006 1 1 40 CYS SG S -0.246 7.966 -4.563 1.00 . A A . 40 CYS SG 1 1 9 6007 1 1 41 PRO C C -0.907 13.097 -0.398 1.00 . A A . 41 PRO C 1 1 9 6008 1 1 41 PRO CA C -2.230 12.861 -1.132 1.00 . A A . 41 PRO CA 1 1 9 6009 1 1 41 PRO CB C -3.369 12.571 -0.153 1.00 . A A . 41 PRO CB 1 1 9 6010 1 1 41 PRO CD C -2.850 10.564 -1.332 1.00 . A A . 41 PRO CD 1 1 9 6011 1 1 41 PRO CG C -3.226 11.066 0.063 1.00 . A A . 41 PRO CG 1 1 9 6012 1 1 41 PRO HA H -2.477 13.742 -1.729 1.00 . A A . 41 PRO HA 1 1 9 6013 1 1 41 PRO HB2 H -3.296 13.141 0.773 1.00 . A A . 41 PRO HB2 1 1 9 6014 1 1 41 PRO HB3 H -4.324 12.774 -0.640 1.00 . A A . 41 PRO HB3 1 1 9 6015 1 1 41 PRO HD2 H -2.228 9.672 -1.261 1.00 . A A . 41 PRO HD2 1 1 9 6016 1 1 41 PRO HD3 H -3.762 10.345 -1.887 1.00 . A A . 41 PRO HD3 1 1 9 6017 1 1 41 PRO HG2 H -2.404 10.883 0.755 1.00 . A A . 41 PRO HG2 1 1 9 6018 1 1 41 PRO HG3 H -4.143 10.612 0.438 1.00 . A A . 41 PRO HG3 1 1 9 6019 1 1 41 PRO N N -2.156 11.674 -1.969 1.00 . A A . 41 PRO N 1 1 9 6020 1 1 41 PRO O O -0.057 12.207 -0.331 1.00 . A A . 41 PRO O 1 1 9 6021 1 1 42 SER C C 0.419 14.090 2.309 1.00 . A A . 42 SER C 1 1 9 6022 1 1 42 SER CA C 0.429 14.725 0.913 1.00 . A A . 42 SER CA 1 1 9 6023 1 1 42 SER CB C 0.480 16.258 0.956 1.00 . A A . 42 SER CB 1 1 9 6024 1 1 42 SER H H -1.497 14.974 0.064 1.00 . A A . 42 SER H 1 1 9 6025 1 1 42 SER HA H 1.321 14.383 0.387 1.00 . A A . 42 SER HA 1 1 9 6026 1 1 42 SER HB2 H 0.401 16.650 -0.059 1.00 . A A . 42 SER HB2 1 1 9 6027 1 1 42 SER HB3 H -0.350 16.646 1.549 1.00 . A A . 42 SER HB3 1 1 9 6028 1 1 42 SER HG H 2.421 16.407 0.944 1.00 . A A . 42 SER HG 1 1 9 6029 1 1 42 SER N N -0.744 14.307 0.154 1.00 . A A . 42 SER N 1 1 9 6030 1 1 42 SER O O 0.237 14.769 3.317 1.00 . A A . 42 SER O 1 1 9 6031 1 1 42 SER OG O 1.702 16.702 1.508 1.00 . A A . 42 SER OG 1 1 9 6032 1 1 43 ASP C C 1.416 10.683 3.346 1.00 . A A . 43 ASP C 1 1 9 6033 1 1 43 ASP CA C 0.538 11.924 3.529 1.00 . A A . 43 ASP CA 1 1 9 6034 1 1 43 ASP CB C -0.910 11.485 3.792 1.00 . A A . 43 ASP CB 1 1 9 6035 1 1 43 ASP CG C -1.832 12.651 4.139 1.00 . A A . 43 ASP CG 1 1 9 6036 1 1 43 ASP H H 0.726 12.311 1.449 1.00 . A A . 43 ASP H 1 1 9 6037 1 1 43 ASP HA H 0.909 12.476 4.394 1.00 . A A . 43 ASP HA 1 1 9 6038 1 1 43 ASP HB2 H -1.293 10.977 2.909 1.00 . A A . 43 ASP HB2 1 1 9 6039 1 1 43 ASP HB3 H -0.926 10.784 4.628 1.00 . A A . 43 ASP HB3 1 1 9 6040 1 1 43 ASP HD2 H -2.180 14.011 5.481 1.00 . A A . 43 ASP HD2 1 1 9 6041 1 1 43 ASP N N 0.601 12.767 2.342 1.00 . A A . 43 ASP N 1 1 9 6042 1 1 43 ASP O O 2.013 10.212 4.313 1.00 . A A . 43 ASP O 1 1 9 6043 1 1 43 ASP OD1 O -2.725 12.966 3.356 1.00 . A A . 43 ASP OD1 1 1 9 6044 1 1 43 ASP OD2 O -1.591 13.269 5.329 1.00 . A A . 43 ASP OD2 1 1 9 6045 1 1 44 TYR C C 3.159 9.130 0.672 1.00 . A A . 44 TYR C 1 1 9 6046 1 1 44 TYR CA C 2.138 8.892 1.794 1.00 . A A . 44 TYR CA 1 1 9 6047 1 1 44 TYR CB C 1.058 7.876 1.406 1.00 . A A . 44 TYR CB 1 1 9 6048 1 1 44 TYR CD1 C 0.373 7.023 3.680 1.00 . A A . 44 TYR CD1 1 1 9 6049 1 1 44 TYR CD2 C -1.277 8.209 2.354 1.00 . A A . 44 TYR CD2 1 1 9 6050 1 1 44 TYR CE1 C -0.575 6.816 4.695 1.00 . A A . 44 TYR CE1 1 1 9 6051 1 1 44 TYR CE2 C -2.215 8.049 3.390 1.00 . A A . 44 TYR CE2 1 1 9 6052 1 1 44 TYR CG C 0.012 7.663 2.484 1.00 . A A . 44 TYR CG 1 1 9 6053 1 1 44 TYR CZ C -1.880 7.311 4.539 1.00 . A A . 44 TYR CZ 1 1 9 6054 1 1 44 TYR H H 0.938 10.567 1.374 1.00 . A A . 44 TYR H 1 1 9 6055 1 1 44 TYR HA H 2.657 8.490 2.661 1.00 . A A . 44 TYR HA 1 1 9 6056 1 1 44 TYR HB2 H 0.561 8.201 0.492 1.00 . A A . 44 TYR HB2 1 1 9 6057 1 1 44 TYR HB3 H 1.542 6.923 1.206 1.00 . A A . 44 TYR HB3 1 1 9 6058 1 1 44 TYR HD1 H 1.386 6.700 3.823 1.00 . A A . 44 TYR HD1 1 1 9 6059 1 1 44 TYR HD2 H -1.553 8.746 1.458 1.00 . A A . 44 TYR HD2 1 1 9 6060 1 1 44 TYR HE1 H -0.291 6.274 5.586 1.00 . A A . 44 TYR HE1 1 1 9 6061 1 1 44 TYR HE2 H -3.204 8.472 3.285 1.00 . A A . 44 TYR HE2 1 1 9 6062 1 1 44 TYR HH H -2.438 6.697 6.298 1.00 . A A . 44 TYR HH 1 1 9 6063 1 1 44 TYR N N 1.470 10.144 2.119 1.00 . A A . 44 TYR N 1 1 9 6064 1 1 44 TYR O O 2.850 8.892 -0.494 1.00 . A A . 44 TYR O 1 1 9 6065 1 1 44 TYR OH O -2.818 7.071 5.499 1.00 . A A . 44 TYR OH 1 1 9 6066 1 1 45 PRO C C 6.153 9.048 -0.680 1.00 . A A . 45 PRO C 1 1 9 6067 1 1 45 PRO CA C 5.310 10.133 0.009 1.00 . A A . 45 PRO CA 1 1 9 6068 1 1 45 PRO CB C 6.197 11.123 0.771 1.00 . A A . 45 PRO CB 1 1 9 6069 1 1 45 PRO CD C 4.800 9.988 2.338 1.00 . A A . 45 PRO CD 1 1 9 6070 1 1 45 PRO CG C 6.212 10.546 2.181 1.00 . A A . 45 PRO CG 1 1 9 6071 1 1 45 PRO HA H 4.777 10.685 -0.768 1.00 . A A . 45 PRO HA 1 1 9 6072 1 1 45 PRO HB2 H 7.199 11.211 0.349 1.00 . A A . 45 PRO HB2 1 1 9 6073 1 1 45 PRO HB3 H 5.714 12.102 0.791 1.00 . A A . 45 PRO HB3 1 1 9 6074 1 1 45 PRO HD2 H 4.810 9.129 3.008 1.00 . A A . 45 PRO HD2 1 1 9 6075 1 1 45 PRO HD3 H 4.158 10.774 2.734 1.00 . A A . 45 PRO HD3 1 1 9 6076 1 1 45 PRO HG2 H 6.927 9.728 2.217 1.00 . A A . 45 PRO HG2 1 1 9 6077 1 1 45 PRO HG3 H 6.451 11.294 2.938 1.00 . A A . 45 PRO HG3 1 1 9 6078 1 1 45 PRO N N 4.364 9.632 0.996 1.00 . A A . 45 PRO N 1 1 9 6079 1 1 45 PRO O O 6.844 9.377 -1.642 1.00 . A A . 45 PRO O 1 1 9 6080 1 1 46 LYS C C 5.737 5.872 -1.654 1.00 . A A . 46 LYS C 1 1 9 6081 1 1 46 LYS CA C 6.789 6.679 -0.895 1.00 . A A . 46 LYS CA 1 1 9 6082 1 1 46 LYS CB C 7.564 5.788 0.094 1.00 . A A . 46 LYS CB 1 1 9 6083 1 1 46 LYS CD C 9.003 7.553 1.314 1.00 . A A . 46 LYS CD 1 1 9 6084 1 1 46 LYS CE C 8.312 7.235 2.643 1.00 . A A . 46 LYS CE 1 1 9 6085 1 1 46 LYS CG C 8.971 6.319 0.406 1.00 . A A . 46 LYS CG 1 1 9 6086 1 1 46 LYS H H 5.518 7.556 0.560 1.00 . A A . 46 LYS H 1 1 9 6087 1 1 46 LYS HA H 7.517 7.044 -1.621 1.00 . A A . 46 LYS HA 1 1 9 6088 1 1 46 LYS HB2 H 6.984 5.614 1.000 1.00 . A A . 46 LYS HB2 1 1 9 6089 1 1 46 LYS HB3 H 7.723 4.816 -0.376 1.00 . A A . 46 LYS HB3 1 1 9 6090 1 1 46 LYS HD2 H 10.050 7.801 1.485 1.00 . A A . 46 LYS HD2 1 1 9 6091 1 1 46 LYS HD3 H 8.525 8.401 0.823 1.00 . A A . 46 LYS HD3 1 1 9 6092 1 1 46 LYS HE2 H 7.232 7.256 2.502 1.00 . A A . 46 LYS HE2 1 1 9 6093 1 1 46 LYS HE3 H 8.615 6.240 2.961 1.00 . A A . 46 LYS HE3 1 1 9 6094 1 1 46 LYS HG2 H 9.532 5.520 0.894 1.00 . A A . 46 LYS HG2 1 1 9 6095 1 1 46 LYS HG3 H 9.483 6.553 -0.529 1.00 . A A . 46 LYS HG3 1 1 9 6096 1 1 46 LYS HZ1 H 9.650 8.121 3.922 1.00 . A A . 46 LYS HZ1 1 1 9 6097 1 1 46 LYS HZ2 H 8.435 9.125 3.437 1.00 . A A . 46 LYS HZ2 1 1 9 6098 1 1 46 LYS HZ3 H 8.127 7.939 4.540 1.00 . A A . 46 LYS HZ3 1 1 9 6099 1 1 46 LYS N N 6.118 7.788 -0.219 1.00 . A A . 46 LYS N 1 1 9 6100 1 1 46 LYS NZ N 8.663 8.182 3.715 1.00 . A A . 46 LYS NZ 1 1 9 6101 1 1 46 LYS O O 5.245 4.878 -1.084 1.00 . A A . 46 LYS O 1 1 9 6102 1 1 46 LYS OXT O 5.443 6.239 -2.813 1.00 . A A . 46 LYS OXT 1 1 10 6103 1 1 1 LYS C C -1.117 4.020 -6.256 1.00 . A A . 1 LYS C 1 1 10 6104 1 1 1 LYS CA C -1.442 4.194 -7.742 1.00 . A A . 1 LYS CA 1 1 10 6105 1 1 1 LYS CB C -0.825 5.481 -8.309 1.00 . A A . 1 LYS CB 1 1 10 6106 1 1 1 LYS CD C 1.276 6.567 -9.239 1.00 . A A . 1 LYS CD 1 1 10 6107 1 1 1 LYS CE C 1.498 7.709 -8.239 1.00 . A A . 1 LYS CE 1 1 10 6108 1 1 1 LYS CG C 0.672 5.306 -8.598 1.00 . A A . 1 LYS CG 1 1 10 6109 1 1 1 LYS H1 H -3.100 4.272 -8.946 1.00 . A A . 1 LYS H1 1 1 10 6110 1 1 1 LYS H2 H -3.277 3.301 -7.625 1.00 . A A . 1 LYS H2 1 1 10 6111 1 1 1 LYS H3 H -3.335 4.932 -7.453 1.00 . A A . 1 LYS H3 1 1 10 6112 1 1 1 LYS HA H -1.042 3.345 -8.297 1.00 . A A . 1 LYS HA 1 1 10 6113 1 1 1 LYS HB2 H -1.319 5.725 -9.251 1.00 . A A . 1 LYS HB2 1 1 10 6114 1 1 1 LYS HB3 H -0.991 6.301 -7.609 1.00 . A A . 1 LYS HB3 1 1 10 6115 1 1 1 LYS HD2 H 2.232 6.311 -9.700 1.00 . A A . 1 LYS HD2 1 1 10 6116 1 1 1 LYS HD3 H 0.612 6.916 -10.033 1.00 . A A . 1 LYS HD3 1 1 10 6117 1 1 1 LYS HE2 H 1.886 8.572 -8.782 1.00 . A A . 1 LYS HE2 1 1 10 6118 1 1 1 LYS HE3 H 0.555 7.997 -7.776 1.00 . A A . 1 LYS HE3 1 1 10 6119 1 1 1 LYS HG2 H 1.210 5.040 -7.688 1.00 . A A . 1 LYS HG2 1 1 10 6120 1 1 1 LYS HG3 H 0.789 4.488 -9.311 1.00 . A A . 1 LYS HG3 1 1 10 6121 1 1 1 LYS HZ1 H 3.337 7.050 -7.620 1.00 . A A . 1 LYS HZ1 1 1 10 6122 1 1 1 LYS HZ2 H 2.647 8.146 -6.601 1.00 . A A . 1 LYS HZ2 1 1 10 6123 1 1 1 LYS HZ3 H 2.105 6.594 -6.626 1.00 . A A . 1 LYS HZ3 1 1 10 6124 1 1 1 LYS N N -2.898 4.174 -7.961 1.00 . A A . 1 LYS N 1 1 10 6125 1 1 1 LYS NZ N 2.472 7.345 -7.192 1.00 . A A . 1 LYS NZ 1 1 10 6126 1 1 1 LYS O O -1.803 4.594 -5.412 1.00 . A A . 1 LYS O 1 1 10 6127 1 1 2 SER C C 1.204 3.890 -3.978 1.00 . A A . 2 SER C 1 1 10 6128 1 1 2 SER CA C 0.272 2.845 -4.586 1.00 . A A . 2 SER CA 1 1 10 6129 1 1 2 SER CB C 0.967 1.478 -4.599 1.00 . A A . 2 SER CB 1 1 10 6130 1 1 2 SER H H 0.427 2.771 -6.692 1.00 . A A . 2 SER H 1 1 10 6131 1 1 2 SER HA H -0.635 2.778 -3.985 1.00 . A A . 2 SER HA 1 1 10 6132 1 1 2 SER HB2 H 1.250 1.205 -3.581 1.00 . A A . 2 SER HB2 1 1 10 6133 1 1 2 SER HB3 H 0.292 0.718 -4.991 1.00 . A A . 2 SER HB3 1 1 10 6134 1 1 2 SER HG H 2.478 2.411 -5.406 1.00 . A A . 2 SER HG 1 1 10 6135 1 1 2 SER N N -0.100 3.205 -5.948 1.00 . A A . 2 SER N 1 1 10 6136 1 1 2 SER O O 2.160 4.305 -4.634 1.00 . A A . 2 SER O 1 1 10 6137 1 1 2 SER OG O 2.121 1.518 -5.417 1.00 . A A . 2 SER OG 1 1 10 6138 1 1 3 CYS C C 1.748 4.904 -0.502 1.00 . A A . 3 CYS C 1 1 10 6139 1 1 3 CYS CA C 1.740 5.252 -1.989 1.00 . A A . 3 CYS CA 1 1 10 6140 1 1 3 CYS CB C 1.178 6.646 -2.256 1.00 . A A . 3 CYS CB 1 1 10 6141 1 1 3 CYS H H 0.150 3.881 -2.236 1.00 . A A . 3 CYS H 1 1 10 6142 1 1 3 CYS HA H 2.769 5.251 -2.337 1.00 . A A . 3 CYS HA 1 1 10 6143 1 1 3 CYS HB2 H 0.087 6.614 -2.228 1.00 . A A . 3 CYS HB2 1 1 10 6144 1 1 3 CYS HB3 H 1.510 7.308 -1.467 1.00 . A A . 3 CYS HB3 1 1 10 6145 1 1 3 CYS N N 0.952 4.269 -2.720 1.00 . A A . 3 CYS N 1 1 10 6146 1 1 3 CYS O O 0.690 4.680 0.085 1.00 . A A . 3 CYS O 1 1 10 6147 1 1 3 CYS SG S 1.750 7.373 -3.813 1.00 . A A . 3 CYS SG 1 1 10 6148 1 1 4 CYS C C 3.770 5.510 2.313 1.00 . A A . 4 CYS C 1 1 10 6149 1 1 4 CYS CA C 3.199 4.382 1.448 1.00 . A A . 4 CYS CA 1 1 10 6150 1 1 4 CYS CB C 4.199 3.219 1.409 1.00 . A A . 4 CYS CB 1 1 10 6151 1 1 4 CYS H H 3.764 5.119 -0.448 1.00 . A A . 4 CYS H 1 1 10 6152 1 1 4 CYS HA H 2.265 4.032 1.882 1.00 . A A . 4 CYS HA 1 1 10 6153 1 1 4 CYS HB2 H 5.041 3.506 0.780 1.00 . A A . 4 CYS HB2 1 1 10 6154 1 1 4 CYS HB3 H 4.593 3.042 2.409 1.00 . A A . 4 CYS HB3 1 1 10 6155 1 1 4 CYS N N 2.949 4.841 0.088 1.00 . A A . 4 CYS N 1 1 10 6156 1 1 4 CYS O O 4.379 6.445 1.793 1.00 . A A . 4 CYS O 1 1 10 6157 1 1 4 CYS SG S 3.552 1.634 0.816 1.00 . A A . 4 CYS SG 1 1 10 6158 1 1 5 PRO C C 5.717 6.118 4.689 1.00 . A A . 5 PRO C 1 1 10 6159 1 1 5 PRO CA C 4.203 6.327 4.602 1.00 . A A . 5 PRO CA 1 1 10 6160 1 1 5 PRO CB C 3.531 6.010 5.944 1.00 . A A . 5 PRO CB 1 1 10 6161 1 1 5 PRO CD C 2.782 4.428 4.331 1.00 . A A . 5 PRO CD 1 1 10 6162 1 1 5 PRO CG C 3.128 4.544 5.811 1.00 . A A . 5 PRO CG 1 1 10 6163 1 1 5 PRO HA H 3.996 7.363 4.326 1.00 . A A . 5 PRO HA 1 1 10 6164 1 1 5 PRO HB2 H 4.187 6.181 6.797 1.00 . A A . 5 PRO HB2 1 1 10 6165 1 1 5 PRO HB3 H 2.628 6.610 6.052 1.00 . A A . 5 PRO HB3 1 1 10 6166 1 1 5 PRO HD2 H 2.957 3.411 3.991 1.00 . A A . 5 PRO HD2 1 1 10 6167 1 1 5 PRO HD3 H 1.734 4.681 4.194 1.00 . A A . 5 PRO HD3 1 1 10 6168 1 1 5 PRO HG2 H 3.975 3.895 6.030 1.00 . A A . 5 PRO HG2 1 1 10 6169 1 1 5 PRO HG3 H 2.285 4.287 6.455 1.00 . A A . 5 PRO HG3 1 1 10 6170 1 1 5 PRO N N 3.600 5.417 3.644 1.00 . A A . 5 PRO N 1 1 10 6171 1 1 5 PRO O O 6.453 7.086 4.869 1.00 . A A . 5 PRO O 1 1 10 6172 1 1 6 ASN C C 7.941 3.175 4.190 1.00 . A A . 6 ASN C 1 1 10 6173 1 1 6 ASN CA C 7.576 4.509 4.844 1.00 . A A . 6 ASN CA 1 1 10 6174 1 1 6 ASN CB C 7.857 4.490 6.354 1.00 . A A . 6 ASN CB 1 1 10 6175 1 1 6 ASN CG C 6.932 3.529 7.098 1.00 . A A . 6 ASN CG 1 1 10 6176 1 1 6 ASN H H 5.544 4.109 4.405 1.00 . A A . 6 ASN H 1 1 10 6177 1 1 6 ASN HA H 8.218 5.266 4.399 1.00 . A A . 6 ASN HA 1 1 10 6178 1 1 6 ASN HB2 H 8.890 4.186 6.533 1.00 . A A . 6 ASN HB2 1 1 10 6179 1 1 6 ASN HB3 H 7.737 5.496 6.755 1.00 . A A . 6 ASN HB3 1 1 10 6180 1 1 6 ASN HD21 H 5.852 5.079 7.852 1.00 . A A . 6 ASN HD21 1 1 10 6181 1 1 6 ASN HD22 H 5.289 3.487 8.304 1.00 . A A . 6 ASN HD22 1 1 10 6182 1 1 6 ASN N N 6.185 4.865 4.597 1.00 . A A . 6 ASN N 1 1 10 6183 1 1 6 ASN ND2 N 5.949 4.076 7.816 1.00 . A A . 6 ASN ND2 1 1 10 6184 1 1 6 ASN O O 7.082 2.443 3.699 1.00 . A A . 6 ASN O 1 1 10 6185 1 1 6 ASN OD1 O 7.104 2.316 7.020 1.00 . A A . 6 ASN OD1 1 1 10 6186 1 1 7 THR C C 9.394 0.412 4.220 1.00 . A A . 7 THR C 1 1 10 6187 1 1 7 THR CA C 9.858 1.722 3.576 1.00 . A A . 7 THR CA 1 1 10 6188 1 1 7 THR CB C 11.385 1.870 3.642 1.00 . A A . 7 THR CB 1 1 10 6189 1 1 7 THR CG2 C 12.087 0.838 2.752 1.00 . A A . 7 THR CG2 1 1 10 6190 1 1 7 THR H H 9.881 3.555 4.603 1.00 . A A . 7 THR H 1 1 10 6191 1 1 7 THR HA H 9.563 1.718 2.526 1.00 . A A . 7 THR HA 1 1 10 6192 1 1 7 THR HB H 11.721 1.743 4.673 1.00 . A A . 7 THR HB 1 1 10 6193 1 1 7 THR HG1 H 12.708 3.242 3.240 1.00 . A A . 7 THR HG1 1 1 10 6194 1 1 7 THR HG21 H 13.164 1.001 2.780 1.00 . A A . 7 THR HG21 1 1 10 6195 1 1 7 THR HG22 H 11.879 -0.172 3.104 1.00 . A A . 7 THR HG22 1 1 10 6196 1 1 7 THR HG23 H 11.738 0.938 1.723 1.00 . A A . 7 THR HG23 1 1 10 6197 1 1 7 THR N N 9.246 2.884 4.199 1.00 . A A . 7 THR N 1 1 10 6198 1 1 7 THR O O 9.251 -0.587 3.522 1.00 . A A . 7 THR O 1 1 10 6199 1 1 7 THR OG1 O 11.751 3.166 3.212 1.00 . A A . 7 THR OG1 1 1 10 6200 1 1 8 THR C C 7.211 -1.082 5.698 1.00 . A A . 8 THR C 1 1 10 6201 1 1 8 THR CA C 8.625 -0.787 6.206 1.00 . A A . 8 THR CA 1 1 10 6202 1 1 8 THR CB C 8.679 -0.635 7.735 1.00 . A A . 8 THR CB 1 1 10 6203 1 1 8 THR CG2 C 8.358 -1.967 8.421 1.00 . A A . 8 THR CG2 1 1 10 6204 1 1 8 THR H H 9.244 1.251 6.074 1.00 . A A . 8 THR H 1 1 10 6205 1 1 8 THR HA H 9.272 -1.625 5.943 1.00 . A A . 8 THR HA 1 1 10 6206 1 1 8 THR HB H 7.961 0.115 8.065 1.00 . A A . 8 THR HB 1 1 10 6207 1 1 8 THR HG1 H 10.135 0.657 7.812 1.00 . A A . 8 THR HG1 1 1 10 6208 1 1 8 THR HG21 H 8.483 -1.864 9.499 1.00 . A A . 8 THR HG21 1 1 10 6209 1 1 8 THR HG22 H 7.329 -2.259 8.216 1.00 . A A . 8 THR HG22 1 1 10 6210 1 1 8 THR HG23 H 9.028 -2.749 8.063 1.00 . A A . 8 THR HG23 1 1 10 6211 1 1 8 THR N N 9.148 0.400 5.538 1.00 . A A . 8 THR N 1 1 10 6212 1 1 8 THR O O 6.857 -2.240 5.489 1.00 . A A . 8 THR O 1 1 10 6213 1 1 8 THR OG1 O 9.973 -0.232 8.133 1.00 . A A . 8 THR OG1 1 1 10 6214 1 1 9 GLY C C 5.284 -0.835 3.422 1.00 . A A . 9 GLY C 1 1 10 6215 1 1 9 GLY CA C 5.139 -0.135 4.773 1.00 . A A . 9 GLY CA 1 1 10 6216 1 1 9 GLY H H 6.761 0.898 5.666 1.00 . A A . 9 GLY H 1 1 10 6217 1 1 9 GLY HA2 H 4.449 -0.692 5.408 1.00 . A A . 9 GLY HA2 1 1 10 6218 1 1 9 GLY HA3 H 4.740 0.864 4.612 1.00 . A A . 9 GLY HA3 1 1 10 6219 1 1 9 GLY N N 6.421 -0.030 5.446 1.00 . A A . 9 GLY N 1 1 10 6220 1 1 9 GLY O O 4.595 -1.819 3.168 1.00 . A A . 9 GLY O 1 1 10 6221 1 1 10 ARG C C 6.863 -2.470 1.469 1.00 . A A . 10 ARG C 1 1 10 6222 1 1 10 ARG CA C 6.488 -1.000 1.290 1.00 . A A . 10 ARG CA 1 1 10 6223 1 1 10 ARG CB C 7.598 -0.267 0.525 1.00 . A A . 10 ARG CB 1 1 10 6224 1 1 10 ARG CD C 6.248 0.886 -1.292 1.00 . A A . 10 ARG CD 1 1 10 6225 1 1 10 ARG CG C 7.140 1.071 -0.056 1.00 . A A . 10 ARG CG 1 1 10 6226 1 1 10 ARG CZ C 4.882 2.401 -2.748 1.00 . A A . 10 ARG CZ 1 1 10 6227 1 1 10 ARG H H 6.730 0.465 2.828 1.00 . A A . 10 ARG H 1 1 10 6228 1 1 10 ARG HA H 5.574 -0.983 0.700 1.00 . A A . 10 ARG HA 1 1 10 6229 1 1 10 ARG HB2 H 8.440 -0.094 1.191 1.00 . A A . 10 ARG HB2 1 1 10 6230 1 1 10 ARG HB3 H 7.946 -0.894 -0.298 1.00 . A A . 10 ARG HB3 1 1 10 6231 1 1 10 ARG HD2 H 6.830 0.412 -2.083 1.00 . A A . 10 ARG HD2 1 1 10 6232 1 1 10 ARG HD3 H 5.390 0.256 -1.061 1.00 . A A . 10 ARG HD3 1 1 10 6233 1 1 10 ARG HE H 6.189 2.999 -1.329 1.00 . A A . 10 ARG HE 1 1 10 6234 1 1 10 ARG HG2 H 6.621 1.644 0.712 1.00 . A A . 10 ARG HG2 1 1 10 6235 1 1 10 ARG HG3 H 8.024 1.632 -0.360 1.00 . A A . 10 ARG HG3 1 1 10 6236 1 1 10 ARG HH11 H 4.517 0.429 -3.130 1.00 . A A . 10 ARG HH11 1 1 10 6237 1 1 10 ARG HH12 H 3.636 1.548 -4.139 1.00 . A A . 10 ARG HH12 1 1 10 6238 1 1 10 ARG HH21 H 5.010 4.425 -2.558 1.00 . A A . 10 ARG HH21 1 1 10 6239 1 1 10 ARG HH22 H 3.913 3.870 -3.804 1.00 . A A . 10 ARG HH22 1 1 10 6240 1 1 10 ARG N N 6.201 -0.357 2.570 1.00 . A A . 10 ARG N 1 1 10 6241 1 1 10 ARG NE N 5.770 2.186 -1.766 1.00 . A A . 10 ARG NE 1 1 10 6242 1 1 10 ARG NH1 N 4.296 1.379 -3.389 1.00 . A A . 10 ARG NH1 1 1 10 6243 1 1 10 ARG NH2 N 4.589 3.663 -3.081 1.00 . A A . 10 ARG NH2 1 1 10 6244 1 1 10 ARG O O 6.362 -3.311 0.732 1.00 . A A . 10 ARG O 1 1 10 6245 1 1 11 ASN C C 6.928 -5.044 3.008 1.00 . A A . 11 ASN C 1 1 10 6246 1 1 11 ASN CA C 8.141 -4.158 2.704 1.00 . A A . 11 ASN CA 1 1 10 6247 1 1 11 ASN CB C 9.172 -4.175 3.839 1.00 . A A . 11 ASN CB 1 1 10 6248 1 1 11 ASN CG C 9.482 -5.592 4.312 1.00 . A A . 11 ASN CG 1 1 10 6249 1 1 11 ASN H H 8.118 -2.050 3.006 1.00 . A A . 11 ASN H 1 1 10 6250 1 1 11 ASN HA H 8.624 -4.553 1.807 1.00 . A A . 11 ASN HA 1 1 10 6251 1 1 11 ASN HB2 H 10.095 -3.713 3.489 1.00 . A A . 11 ASN HB2 1 1 10 6252 1 1 11 ASN HB3 H 8.803 -3.598 4.683 1.00 . A A . 11 ASN HB3 1 1 10 6253 1 1 11 ASN HD21 H 8.294 -5.355 5.950 1.00 . A A . 11 ASN HD21 1 1 10 6254 1 1 11 ASN HD22 H 9.094 -6.905 5.811 1.00 . A A . 11 ASN HD22 1 1 10 6255 1 1 11 ASN N N 7.731 -2.788 2.434 1.00 . A A . 11 ASN N 1 1 10 6256 1 1 11 ASN ND2 N 8.906 -5.983 5.450 1.00 . A A . 11 ASN ND2 1 1 10 6257 1 1 11 ASN O O 6.757 -6.072 2.359 1.00 . A A . 11 ASN O 1 1 10 6258 1 1 11 ASN OD1 O 10.232 -6.317 3.664 1.00 . A A . 11 ASN OD1 1 1 10 6259 1 1 12 ILE C C 3.971 -5.584 3.150 1.00 . A A . 12 ILE C 1 1 10 6260 1 1 12 ILE CA C 4.902 -5.409 4.354 1.00 . A A . 12 ILE CA 1 1 10 6261 1 1 12 ILE CB C 4.198 -4.736 5.550 1.00 . A A . 12 ILE CB 1 1 10 6262 1 1 12 ILE CD1 C 4.681 -3.734 7.850 1.00 . A A . 12 ILE CD1 1 1 10 6263 1 1 12 ILE CG1 C 5.119 -4.746 6.787 1.00 . A A . 12 ILE CG1 1 1 10 6264 1 1 12 ILE CG2 C 2.884 -5.465 5.883 1.00 . A A . 12 ILE CG2 1 1 10 6265 1 1 12 ILE H H 6.246 -3.758 4.433 1.00 . A A . 12 ILE H 1 1 10 6266 1 1 12 ILE HA H 5.231 -6.400 4.674 1.00 . A A . 12 ILE HA 1 1 10 6267 1 1 12 ILE HB H 3.973 -3.703 5.284 1.00 . A A . 12 ILE HB 1 1 10 6268 1 1 12 ILE HD11 H 4.674 -2.730 7.425 1.00 . A A . 12 ILE HD11 1 1 10 6269 1 1 12 ILE HD12 H 3.689 -3.972 8.233 1.00 . A A . 12 ILE HD12 1 1 10 6270 1 1 12 ILE HD13 H 5.388 -3.761 8.680 1.00 . A A . 12 ILE HD13 1 1 10 6271 1 1 12 ILE HG12 H 5.138 -5.745 7.219 1.00 . A A . 12 ILE HG12 1 1 10 6272 1 1 12 ILE HG13 H 6.139 -4.489 6.506 1.00 . A A . 12 ILE HG13 1 1 10 6273 1 1 12 ILE HG21 H 2.185 -5.410 5.049 1.00 . A A . 12 ILE HG21 1 1 10 6274 1 1 12 ILE HG22 H 3.086 -6.514 6.102 1.00 . A A . 12 ILE HG22 1 1 10 6275 1 1 12 ILE HG23 H 2.401 -5.014 6.748 1.00 . A A . 12 ILE HG23 1 1 10 6276 1 1 12 ILE N N 6.081 -4.641 3.964 1.00 . A A . 12 ILE N 1 1 10 6277 1 1 12 ILE O O 3.519 -6.693 2.876 1.00 . A A . 12 ILE O 1 1 10 6278 1 1 13 TYR C C 3.351 -5.465 0.195 1.00 . A A . 13 TYR C 1 1 10 6279 1 1 13 TYR CA C 2.870 -4.457 1.239 1.00 . A A . 13 TYR CA 1 1 10 6280 1 1 13 TYR CB C 2.856 -3.029 0.677 1.00 . A A . 13 TYR CB 1 1 10 6281 1 1 13 TYR CD1 C 0.709 -3.100 -0.655 1.00 . A A . 13 TYR CD1 1 1 10 6282 1 1 13 TYR CD2 C 2.747 -2.394 -1.780 1.00 . A A . 13 TYR CD2 1 1 10 6283 1 1 13 TYR CE1 C -0.015 -2.901 -1.841 1.00 . A A . 13 TYR CE1 1 1 10 6284 1 1 13 TYR CE2 C 2.018 -2.169 -2.962 1.00 . A A . 13 TYR CE2 1 1 10 6285 1 1 13 TYR CG C 2.092 -2.853 -0.621 1.00 . A A . 13 TYR CG 1 1 10 6286 1 1 13 TYR CZ C 0.635 -2.418 -2.990 1.00 . A A . 13 TYR CZ 1 1 10 6287 1 1 13 TYR H H 4.123 -3.615 2.720 1.00 . A A . 13 TYR H 1 1 10 6288 1 1 13 TYR HA H 1.857 -4.726 1.540 1.00 . A A . 13 TYR HA 1 1 10 6289 1 1 13 TYR HB2 H 2.414 -2.364 1.419 1.00 . A A . 13 TYR HB2 1 1 10 6290 1 1 13 TYR HB3 H 3.883 -2.707 0.520 1.00 . A A . 13 TYR HB3 1 1 10 6291 1 1 13 TYR HD1 H 0.201 -3.431 0.236 1.00 . A A . 13 TYR HD1 1 1 10 6292 1 1 13 TYR HD2 H 3.810 -2.198 -1.765 1.00 . A A . 13 TYR HD2 1 1 10 6293 1 1 13 TYR HE1 H -1.073 -3.104 -1.861 1.00 . A A . 13 TYR HE1 1 1 10 6294 1 1 13 TYR HE2 H 2.521 -1.797 -3.841 1.00 . A A . 13 TYR HE2 1 1 10 6295 1 1 13 TYR HH H -1.020 -2.342 -4.010 1.00 . A A . 13 TYR HH 1 1 10 6296 1 1 13 TYR N N 3.707 -4.488 2.428 1.00 . A A . 13 TYR N 1 1 10 6297 1 1 13 TYR O O 2.565 -6.283 -0.277 1.00 . A A . 13 TYR O 1 1 10 6298 1 1 13 TYR OH O -0.081 -2.183 -4.128 1.00 . A A . 13 TYR OH 1 1 10 6299 1 1 14 ASN C C 5.216 -7.736 -0.734 1.00 . A A . 14 ASN C 1 1 10 6300 1 1 14 ASN CA C 5.253 -6.270 -1.162 1.00 . A A . 14 ASN CA 1 1 10 6301 1 1 14 ASN CB C 6.691 -5.816 -1.451 1.00 . A A . 14 ASN CB 1 1 10 6302 1 1 14 ASN CG C 6.737 -4.714 -2.508 1.00 . A A . 14 ASN CG 1 1 10 6303 1 1 14 ASN H H 5.229 -4.723 0.291 1.00 . A A . 14 ASN H 1 1 10 6304 1 1 14 ASN HA H 4.679 -6.185 -2.086 1.00 . A A . 14 ASN HA 1 1 10 6305 1 1 14 ASN HB2 H 7.189 -5.494 -0.537 1.00 . A A . 14 ASN HB2 1 1 10 6306 1 1 14 ASN HB3 H 7.253 -6.658 -1.851 1.00 . A A . 14 ASN HB3 1 1 10 6307 1 1 14 ASN HD21 H 6.245 -3.283 -1.147 1.00 . A A . 14 ASN HD21 1 1 10 6308 1 1 14 ASN HD22 H 6.500 -2.723 -2.791 1.00 . A A . 14 ASN HD22 1 1 10 6309 1 1 14 ASN N N 4.639 -5.406 -0.162 1.00 . A A . 14 ASN N 1 1 10 6310 1 1 14 ASN ND2 N 6.464 -3.470 -2.116 1.00 . A A . 14 ASN ND2 1 1 10 6311 1 1 14 ASN O O 4.888 -8.595 -1.548 1.00 . A A . 14 ASN O 1 1 10 6312 1 1 14 ASN OD1 O 7.015 -4.984 -3.675 1.00 . A A . 14 ASN OD1 1 1 10 6313 1 1 15 THR C C 4.103 -9.972 0.980 1.00 . A A . 15 THR C 1 1 10 6314 1 1 15 THR CA C 5.520 -9.395 1.049 1.00 . A A . 15 THR CA 1 1 10 6315 1 1 15 THR CB C 6.083 -9.421 2.478 1.00 . A A . 15 THR CB 1 1 10 6316 1 1 15 THR CG2 C 6.100 -10.840 3.054 1.00 . A A . 15 THR CG2 1 1 10 6317 1 1 15 THR H H 5.810 -7.288 1.164 1.00 . A A . 15 THR H 1 1 10 6318 1 1 15 THR HA H 6.165 -10.007 0.417 1.00 . A A . 15 THR HA 1 1 10 6319 1 1 15 THR HB H 5.478 -8.785 3.124 1.00 . A A . 15 THR HB 1 1 10 6320 1 1 15 THR HG1 H 7.938 -9.463 1.883 1.00 . A A . 15 THR HG1 1 1 10 6321 1 1 15 THR HG21 H 6.605 -10.836 4.020 1.00 . A A . 15 THR HG21 1 1 10 6322 1 1 15 THR HG22 H 5.081 -11.202 3.199 1.00 . A A . 15 THR HG22 1 1 10 6323 1 1 15 THR HG23 H 6.629 -11.515 2.379 1.00 . A A . 15 THR HG23 1 1 10 6324 1 1 15 THR N N 5.543 -8.032 0.530 1.00 . A A . 15 THR N 1 1 10 6325 1 1 15 THR O O 3.918 -11.103 0.534 1.00 . A A . 15 THR O 1 1 10 6326 1 1 15 THR OG1 O 7.405 -8.923 2.472 1.00 . A A . 15 THR OG1 1 1 10 6327 1 1 16 CYS C C 1.221 -9.812 -0.057 1.00 . A A . 16 CYS C 1 1 10 6328 1 1 16 CYS CA C 1.702 -9.569 1.378 1.00 . A A . 16 CYS CA 1 1 10 6329 1 1 16 CYS CB C 0.896 -8.486 2.103 1.00 . A A . 16 CYS CB 1 1 10 6330 1 1 16 CYS H H 3.333 -8.267 1.756 1.00 . A A . 16 CYS H 1 1 10 6331 1 1 16 CYS HA H 1.585 -10.500 1.934 1.00 . A A . 16 CYS HA 1 1 10 6332 1 1 16 CYS HB2 H 1.200 -8.495 3.150 1.00 . A A . 16 CYS HB2 1 1 10 6333 1 1 16 CYS HB3 H 1.150 -7.510 1.692 1.00 . A A . 16 CYS HB3 1 1 10 6334 1 1 16 CYS N N 3.107 -9.189 1.405 1.00 . A A . 16 CYS N 1 1 10 6335 1 1 16 CYS O O 0.573 -10.823 -0.326 1.00 . A A . 16 CYS O 1 1 10 6336 1 1 16 CYS SG S -0.905 -8.657 2.060 1.00 . A A . 16 CYS SG 1 1 10 6337 1 1 17 ARG C C 1.823 -10.310 -2.968 1.00 . A A . 17 ARG C 1 1 10 6338 1 1 17 ARG CA C 1.234 -9.023 -2.394 1.00 . A A . 17 ARG CA 1 1 10 6339 1 1 17 ARG CB C 1.777 -7.805 -3.157 1.00 . A A . 17 ARG CB 1 1 10 6340 1 1 17 ARG CD C -0.057 -6.284 -4.012 1.00 . A A . 17 ARG CD 1 1 10 6341 1 1 17 ARG CG C 0.967 -6.526 -2.899 1.00 . A A . 17 ARG CG 1 1 10 6342 1 1 17 ARG CZ C -1.328 -8.104 -5.208 1.00 . A A . 17 ARG CZ 1 1 10 6343 1 1 17 ARG H H 2.073 -8.083 -0.683 1.00 . A A . 17 ARG H 1 1 10 6344 1 1 17 ARG HA H 0.153 -9.072 -2.503 1.00 . A A . 17 ARG HA 1 1 10 6345 1 1 17 ARG HB2 H 2.807 -7.633 -2.849 1.00 . A A . 17 ARG HB2 1 1 10 6346 1 1 17 ARG HB3 H 1.783 -8.017 -4.227 1.00 . A A . 17 ARG HB3 1 1 10 6347 1 1 17 ARG HD2 H -0.589 -5.362 -3.784 1.00 . A A . 17 ARG HD2 1 1 10 6348 1 1 17 ARG HD3 H 0.489 -6.126 -4.940 1.00 . A A . 17 ARG HD3 1 1 10 6349 1 1 17 ARG HE H -1.459 -7.677 -3.238 1.00 . A A . 17 ARG HE 1 1 10 6350 1 1 17 ARG HG2 H 0.463 -6.574 -1.934 1.00 . A A . 17 ARG HG2 1 1 10 6351 1 1 17 ARG HG3 H 1.651 -5.676 -2.889 1.00 . A A . 17 ARG HG3 1 1 10 6352 1 1 17 ARG HH11 H -0.111 -7.085 -6.501 1.00 . A A . 17 ARG HH11 1 1 10 6353 1 1 17 ARG HH12 H -1.017 -8.394 -7.206 1.00 . A A . 17 ARG HH12 1 1 10 6354 1 1 17 ARG HH21 H -2.583 -9.361 -4.209 1.00 . A A . 17 ARG HH21 1 1 10 6355 1 1 17 ARG HH22 H -2.439 -9.672 -5.921 1.00 . A A . 17 ARG HH22 1 1 10 6356 1 1 17 ARG N N 1.551 -8.898 -0.976 1.00 . A A . 17 ARG N 1 1 10 6357 1 1 17 ARG NE N -1.025 -7.391 -4.107 1.00 . A A . 17 ARG NE 1 1 10 6358 1 1 17 ARG NH1 N -0.784 -7.829 -6.403 1.00 . A A . 17 ARG NH1 1 1 10 6359 1 1 17 ARG NH2 N -2.197 -9.118 -5.112 1.00 . A A . 17 ARG NH2 1 1 10 6360 1 1 17 ARG O O 1.123 -11.051 -3.658 1.00 . A A . 17 ARG O 1 1 10 6361 1 1 18 PHE C C 3.186 -13.027 -2.606 1.00 . A A . 18 PHE C 1 1 10 6362 1 1 18 PHE CA C 3.826 -11.744 -3.141 1.00 . A A . 18 PHE CA 1 1 10 6363 1 1 18 PHE CB C 5.297 -11.635 -2.725 1.00 . A A . 18 PHE CB 1 1 10 6364 1 1 18 PHE CD1 C 6.497 -12.987 -4.496 1.00 . A A . 18 PHE CD1 1 1 10 6365 1 1 18 PHE CD2 C 6.539 -13.782 -2.194 1.00 . A A . 18 PHE CD2 1 1 10 6366 1 1 18 PHE CE1 C 7.255 -14.101 -4.895 1.00 . A A . 18 PHE CE1 1 1 10 6367 1 1 18 PHE CE2 C 7.301 -14.894 -2.593 1.00 . A A . 18 PHE CE2 1 1 10 6368 1 1 18 PHE CG C 6.145 -12.820 -3.144 1.00 . A A . 18 PHE CG 1 1 10 6369 1 1 18 PHE CZ C 7.661 -15.053 -3.944 1.00 . A A . 18 PHE CZ 1 1 10 6370 1 1 18 PHE H H 3.607 -9.916 -2.092 1.00 . A A . 18 PHE H 1 1 10 6371 1 1 18 PHE HA H 3.780 -11.766 -4.232 1.00 . A A . 18 PHE HA 1 1 10 6372 1 1 18 PHE HB2 H 5.720 -10.736 -3.175 1.00 . A A . 18 PHE HB2 1 1 10 6373 1 1 18 PHE HB3 H 5.354 -11.521 -1.643 1.00 . A A . 18 PHE HB3 1 1 10 6374 1 1 18 PHE HD1 H 6.181 -12.262 -5.232 1.00 . A A . 18 PHE HD1 1 1 10 6375 1 1 18 PHE HD2 H 6.254 -13.677 -1.157 1.00 . A A . 18 PHE HD2 1 1 10 6376 1 1 18 PHE HE1 H 7.524 -14.228 -5.933 1.00 . A A . 18 PHE HE1 1 1 10 6377 1 1 18 PHE HE2 H 7.607 -15.629 -1.864 1.00 . A A . 18 PHE HE2 1 1 10 6378 1 1 18 PHE HZ H 8.245 -15.908 -4.250 1.00 . A A . 18 PHE HZ 1 1 10 6379 1 1 18 PHE N N 3.103 -10.569 -2.678 1.00 . A A . 18 PHE N 1 1 10 6380 1 1 18 PHE O O 3.020 -13.986 -3.359 1.00 . A A . 18 PHE O 1 1 10 6381 1 1 19 ALA C C 0.798 -14.440 -1.424 1.00 . A A . 19 ALA C 1 1 10 6382 1 1 19 ALA CA C 2.115 -14.153 -0.699 1.00 . A A . 19 ALA CA 1 1 10 6383 1 1 19 ALA CB C 1.884 -13.871 0.788 1.00 . A A . 19 ALA CB 1 1 10 6384 1 1 19 ALA H H 2.992 -12.220 -0.751 1.00 . A A . 19 ALA H 1 1 10 6385 1 1 19 ALA HA H 2.752 -15.037 -0.773 1.00 . A A . 19 ALA HA 1 1 10 6386 1 1 19 ALA HB1 H 2.838 -13.682 1.280 1.00 . A A . 19 ALA HB1 1 1 10 6387 1 1 19 ALA HB2 H 1.235 -13.006 0.917 1.00 . A A . 19 ALA HB2 1 1 10 6388 1 1 19 ALA HB3 H 1.412 -14.739 1.251 1.00 . A A . 19 ALA HB3 1 1 10 6389 1 1 19 ALA N N 2.813 -13.036 -1.320 1.00 . A A . 19 ALA N 1 1 10 6390 1 1 19 ALA O O 0.492 -15.601 -1.695 1.00 . A A . 19 ALA O 1 1 10 6391 1 1 20 GLY C C -2.253 -12.490 -2.211 1.00 . A A . 20 GLY C 1 1 10 6392 1 1 20 GLY CA C -1.161 -13.494 -2.582 1.00 . A A . 20 GLY CA 1 1 10 6393 1 1 20 GLY H H 0.356 -12.461 -1.508 1.00 . A A . 20 GLY H 1 1 10 6394 1 1 20 GLY HA2 H -0.879 -13.333 -3.623 1.00 . A A . 20 GLY HA2 1 1 10 6395 1 1 20 GLY HA3 H -1.594 -14.491 -2.494 1.00 . A A . 20 GLY HA3 1 1 10 6396 1 1 20 GLY N N 0.038 -13.388 -1.761 1.00 . A A . 20 GLY N 1 1 10 6397 1 1 20 GLY O O -3.252 -12.404 -2.923 1.00 . A A . 20 GLY O 1 1 10 6398 1 1 21 GLY C C -3.425 -9.721 -1.610 1.00 . A A . 21 GLY C 1 1 10 6399 1 1 21 GLY CA C -3.125 -10.841 -0.613 1.00 . A A . 21 GLY CA 1 1 10 6400 1 1 21 GLY H H -1.241 -11.812 -0.575 1.00 . A A . 21 GLY H 1 1 10 6401 1 1 21 GLY HA2 H -4.030 -11.418 -0.421 1.00 . A A . 21 GLY HA2 1 1 10 6402 1 1 21 GLY HA3 H -2.790 -10.408 0.327 1.00 . A A . 21 GLY HA3 1 1 10 6403 1 1 21 GLY N N -2.096 -11.744 -1.108 1.00 . A A . 21 GLY N 1 1 10 6404 1 1 21 GLY O O -2.528 -9.257 -2.316 1.00 . A A . 21 GLY O 1 1 10 6405 1 1 22 SER C C -4.464 -6.933 -2.353 1.00 . A A . 22 SER C 1 1 10 6406 1 1 22 SER CA C -5.160 -8.270 -2.604 1.00 . A A . 22 SER CA 1 1 10 6407 1 1 22 SER CB C -6.676 -8.109 -2.458 1.00 . A A . 22 SER CB 1 1 10 6408 1 1 22 SER H H -5.385 -9.720 -1.080 1.00 . A A . 22 SER H 1 1 10 6409 1 1 22 SER HA H -4.944 -8.603 -3.620 1.00 . A A . 22 SER HA 1 1 10 6410 1 1 22 SER HB2 H -6.903 -7.656 -1.493 1.00 . A A . 22 SER HB2 1 1 10 6411 1 1 22 SER HB3 H -7.052 -7.461 -3.250 1.00 . A A . 22 SER HB3 1 1 10 6412 1 1 22 SER HG H -8.261 -9.237 -2.478 1.00 . A A . 22 SER HG 1 1 10 6413 1 1 22 SER N N -4.691 -9.292 -1.676 1.00 . A A . 22 SER N 1 1 10 6414 1 1 22 SER O O -3.993 -6.680 -1.247 1.00 . A A . 22 SER O 1 1 10 6415 1 1 22 SER OG O -7.312 -9.367 -2.542 1.00 . A A . 22 SER OG 1 1 10 6416 1 1 23 ARG C C -4.272 -3.947 -2.139 1.00 . A A . 23 ARG C 1 1 10 6417 1 1 23 ARG CA C -3.732 -4.787 -3.295 1.00 . A A . 23 ARG CA 1 1 10 6418 1 1 23 ARG CB C -3.841 -4.013 -4.614 1.00 . A A . 23 ARG CB 1 1 10 6419 1 1 23 ARG CD C -2.986 -3.866 -6.979 1.00 . A A . 23 ARG CD 1 1 10 6420 1 1 23 ARG CG C -3.303 -4.807 -5.811 1.00 . A A . 23 ARG CG 1 1 10 6421 1 1 23 ARG CZ C -0.497 -3.600 -7.197 1.00 . A A . 23 ARG CZ 1 1 10 6422 1 1 23 ARG H H -4.825 -6.341 -4.258 1.00 . A A . 23 ARG H 1 1 10 6423 1 1 23 ARG HA H -2.678 -4.977 -3.097 1.00 . A A . 23 ARG HA 1 1 10 6424 1 1 23 ARG HB2 H -4.881 -3.747 -4.809 1.00 . A A . 23 ARG HB2 1 1 10 6425 1 1 23 ARG HB3 H -3.270 -3.092 -4.497 1.00 . A A . 23 ARG HB3 1 1 10 6426 1 1 23 ARG HD2 H -2.977 -4.433 -7.910 1.00 . A A . 23 ARG HD2 1 1 10 6427 1 1 23 ARG HD3 H -3.779 -3.122 -7.063 1.00 . A A . 23 ARG HD3 1 1 10 6428 1 1 23 ARG HE H -1.742 -2.311 -6.252 1.00 . A A . 23 ARG HE 1 1 10 6429 1 1 23 ARG HG2 H -2.400 -5.347 -5.533 1.00 . A A . 23 ARG HG2 1 1 10 6430 1 1 23 ARG HG3 H -4.060 -5.527 -6.126 1.00 . A A . 23 ARG HG3 1 1 10 6431 1 1 23 ARG HH11 H -1.182 -5.260 -8.177 1.00 . A A . 23 ARG HH11 1 1 10 6432 1 1 23 ARG HH12 H 0.540 -5.003 -8.263 1.00 . A A . 23 ARG HH12 1 1 10 6433 1 1 23 ARG HH21 H 0.520 -2.088 -6.277 1.00 . A A . 23 ARG HH21 1 1 10 6434 1 1 23 ARG HH22 H 1.508 -3.184 -7.212 1.00 . A A . 23 ARG HH22 1 1 10 6435 1 1 23 ARG N N -4.409 -6.075 -3.378 1.00 . A A . 23 ARG N 1 1 10 6436 1 1 23 ARG NE N -1.702 -3.175 -6.772 1.00 . A A . 23 ARG NE 1 1 10 6437 1 1 23 ARG NH1 N -0.368 -4.720 -7.925 1.00 . A A . 23 ARG NH1 1 1 10 6438 1 1 23 ARG NH2 N 0.598 -2.894 -6.883 1.00 . A A . 23 ARG NH2 1 1 10 6439 1 1 23 ARG O O -3.504 -3.513 -1.284 1.00 . A A . 23 ARG O 1 1 10 6440 1 1 24 GLU C C -5.959 -3.570 0.316 1.00 . A A . 24 GLU C 1 1 10 6441 1 1 24 GLU CA C -6.259 -2.976 -1.061 1.00 . A A . 24 GLU CA 1 1 10 6442 1 1 24 GLU CB C -7.763 -2.958 -1.361 1.00 . A A . 24 GLU CB 1 1 10 6443 1 1 24 GLU CD C -8.678 -2.382 0.965 1.00 . A A . 24 GLU CD 1 1 10 6444 1 1 24 GLU CG C -8.524 -1.948 -0.494 1.00 . A A . 24 GLU CG 1 1 10 6445 1 1 24 GLU H H -6.170 -4.101 -2.846 1.00 . A A . 24 GLU H 1 1 10 6446 1 1 24 GLU HA H -5.885 -1.953 -1.097 1.00 . A A . 24 GLU HA 1 1 10 6447 1 1 24 GLU HB2 H -7.894 -2.652 -2.399 1.00 . A A . 24 GLU HB2 1 1 10 6448 1 1 24 GLU HB3 H -8.192 -3.955 -1.248 1.00 . A A . 24 GLU HB3 1 1 10 6449 1 1 24 GLU HE2 H -8.063 -0.616 1.540 1.00 . A A . 24 GLU HE2 1 1 10 6450 1 1 24 GLU HG2 H -8.014 -0.986 -0.553 1.00 . A A . 24 GLU HG2 1 1 10 6451 1 1 24 GLU HG3 H -9.519 -1.838 -0.923 1.00 . A A . 24 GLU HG3 1 1 10 6452 1 1 24 GLU N N -5.592 -3.733 -2.106 1.00 . A A . 24 GLU N 1 1 10 6453 1 1 24 GLU O O -5.568 -2.844 1.226 1.00 . A A . 24 GLU O 1 1 10 6454 1 1 24 GLU OE1 O -9.056 -3.525 1.218 1.00 . A A . 24 GLU OE1 1 1 10 6455 1 1 24 GLU OE2 O -8.370 -1.448 1.910 1.00 . A A . 24 GLU OE2 1 1 10 6456 1 1 25 ARG C C -4.574 -5.408 2.277 1.00 . A A . 25 ARG C 1 1 10 6457 1 1 25 ARG CA C -5.988 -5.593 1.724 1.00 . A A . 25 ARG CA 1 1 10 6458 1 1 25 ARG CB C -6.323 -7.072 1.500 1.00 . A A . 25 ARG CB 1 1 10 6459 1 1 25 ARG CD C -6.942 -9.257 2.608 1.00 . A A . 25 ARG CD 1 1 10 6460 1 1 25 ARG CG C -6.401 -7.841 2.823 1.00 . A A . 25 ARG CG 1 1 10 6461 1 1 25 ARG CZ C -9.113 -10.324 1.980 1.00 . A A . 25 ARG CZ 1 1 10 6462 1 1 25 ARG H H -6.481 -5.416 -0.329 1.00 . A A . 25 ARG H 1 1 10 6463 1 1 25 ARG HA H -6.701 -5.175 2.435 1.00 . A A . 25 ARG HA 1 1 10 6464 1 1 25 ARG HB2 H -7.284 -7.119 0.993 1.00 . A A . 25 ARG HB2 1 1 10 6465 1 1 25 ARG HB3 H -5.575 -7.537 0.856 1.00 . A A . 25 ARG HB3 1 1 10 6466 1 1 25 ARG HD2 H -6.324 -9.774 1.871 1.00 . A A . 25 ARG HD2 1 1 10 6467 1 1 25 ARG HD3 H -6.879 -9.785 3.559 1.00 . A A . 25 ARG HD3 1 1 10 6468 1 1 25 ARG HE H -8.752 -8.328 2.001 1.00 . A A . 25 ARG HE 1 1 10 6469 1 1 25 ARG HG2 H -5.402 -7.906 3.258 1.00 . A A . 25 ARG HG2 1 1 10 6470 1 1 25 ARG HG3 H -7.052 -7.312 3.521 1.00 . A A . 25 ARG HG3 1 1 10 6471 1 1 25 ARG HH11 H -7.662 -11.675 2.472 1.00 . A A . 25 ARG HH11 1 1 10 6472 1 1 25 ARG HH12 H -9.206 -12.368 2.050 1.00 . A A . 25 ARG HH12 1 1 10 6473 1 1 25 ARG HH21 H -10.768 -9.252 1.440 1.00 . A A . 25 ARG HH21 1 1 10 6474 1 1 25 ARG HH22 H -10.977 -10.984 1.460 1.00 . A A . 25 ARG HH22 1 1 10 6475 1 1 25 ARG N N -6.154 -4.885 0.465 1.00 . A A . 25 ARG N 1 1 10 6476 1 1 25 ARG NE N -8.343 -9.239 2.162 1.00 . A A . 25 ARG NE 1 1 10 6477 1 1 25 ARG NH1 N -8.621 -11.555 2.182 1.00 . A A . 25 ARG NH1 1 1 10 6478 1 1 25 ARG NH2 N -10.388 -10.175 1.593 1.00 . A A . 25 ARG NH2 1 1 10 6479 1 1 25 ARG O O -4.402 -5.025 3.432 1.00 . A A . 25 ARG O 1 1 10 6480 1 1 26 CYS C C -1.824 -4.053 2.091 1.00 . A A . 26 CYS C 1 1 10 6481 1 1 26 CYS CA C -2.165 -5.506 1.768 1.00 . A A . 26 CYS CA 1 1 10 6482 1 1 26 CYS CB C -1.301 -6.011 0.611 1.00 . A A . 26 CYS CB 1 1 10 6483 1 1 26 CYS H H -3.801 -5.984 0.503 1.00 . A A . 26 CYS H 1 1 10 6484 1 1 26 CYS HA H -1.948 -6.102 2.654 1.00 . A A . 26 CYS HA 1 1 10 6485 1 1 26 CYS HB2 H -1.570 -5.479 -0.302 1.00 . A A . 26 CYS HB2 1 1 10 6486 1 1 26 CYS HB3 H -0.260 -5.790 0.836 1.00 . A A . 26 CYS HB3 1 1 10 6487 1 1 26 CYS N N -3.571 -5.667 1.434 1.00 . A A . 26 CYS N 1 1 10 6488 1 1 26 CYS O O -1.048 -3.798 3.009 1.00 . A A . 26 CYS O 1 1 10 6489 1 1 26 CYS SG S -1.418 -7.788 0.290 1.00 . A A . 26 CYS SG 1 1 10 6490 1 1 27 ALA C C -2.674 -1.315 2.984 1.00 . A A . 27 ALA C 1 1 10 6491 1 1 27 ALA CA C -2.182 -1.685 1.586 1.00 . A A . 27 ALA CA 1 1 10 6492 1 1 27 ALA CB C -2.860 -0.861 0.494 1.00 . A A . 27 ALA CB 1 1 10 6493 1 1 27 ALA H H -3.021 -3.366 0.592 1.00 . A A . 27 ALA H 1 1 10 6494 1 1 27 ALA HA H -1.113 -1.479 1.521 1.00 . A A . 27 ALA HA 1 1 10 6495 1 1 27 ALA HB1 H -3.943 -0.971 0.537 1.00 . A A . 27 ALA HB1 1 1 10 6496 1 1 27 ALA HB2 H -2.603 0.190 0.608 1.00 . A A . 27 ALA HB2 1 1 10 6497 1 1 27 ALA HB3 H -2.497 -1.207 -0.472 1.00 . A A . 27 ALA HB3 1 1 10 6498 1 1 27 ALA N N -2.394 -3.101 1.342 1.00 . A A . 27 ALA N 1 1 10 6499 1 1 27 ALA O O -1.934 -0.703 3.746 1.00 . A A . 27 ALA O 1 1 10 6500 1 1 28 LYS C C -3.538 -2.119 5.740 1.00 . A A . 28 LYS C 1 1 10 6501 1 1 28 LYS CA C -4.458 -1.529 4.667 1.00 . A A . 28 LYS CA 1 1 10 6502 1 1 28 LYS CB C -5.853 -2.171 4.694 1.00 . A A . 28 LYS CB 1 1 10 6503 1 1 28 LYS CD C -6.500 -1.613 7.107 1.00 . A A . 28 LYS CD 1 1 10 6504 1 1 28 LYS CE C -7.540 -0.897 7.975 1.00 . A A . 28 LYS CE 1 1 10 6505 1 1 28 LYS CG C -6.839 -1.452 5.619 1.00 . A A . 28 LYS CG 1 1 10 6506 1 1 28 LYS H H -4.460 -2.235 2.677 1.00 . A A . 28 LYS H 1 1 10 6507 1 1 28 LYS HA H -4.555 -0.453 4.823 1.00 . A A . 28 LYS HA 1 1 10 6508 1 1 28 LYS HB2 H -6.270 -2.112 3.691 1.00 . A A . 28 LYS HB2 1 1 10 6509 1 1 28 LYS HB3 H -5.790 -3.227 4.963 1.00 . A A . 28 LYS HB3 1 1 10 6510 1 1 28 LYS HD2 H -6.474 -2.674 7.364 1.00 . A A . 28 LYS HD2 1 1 10 6511 1 1 28 LYS HD3 H -5.529 -1.166 7.313 1.00 . A A . 28 LYS HD3 1 1 10 6512 1 1 28 LYS HE2 H -7.580 0.156 7.694 1.00 . A A . 28 LYS HE2 1 1 10 6513 1 1 28 LYS HE3 H -8.520 -1.347 7.811 1.00 . A A . 28 LYS HE3 1 1 10 6514 1 1 28 LYS HG2 H -6.870 -0.394 5.356 1.00 . A A . 28 LYS HG2 1 1 10 6515 1 1 28 LYS HG3 H -7.820 -1.883 5.426 1.00 . A A . 28 LYS HG3 1 1 10 6516 1 1 28 LYS HZ1 H -6.311 -0.540 9.574 1.00 . A A . 28 LYS HZ1 1 1 10 6517 1 1 28 LYS HZ2 H -7.915 -0.531 9.953 1.00 . A A . 28 LYS HZ2 1 1 10 6518 1 1 28 LYS HZ3 H -7.140 -1.960 9.680 1.00 . A A . 28 LYS HZ3 1 1 10 6519 1 1 28 LYS N N -3.891 -1.732 3.345 1.00 . A A . 28 LYS N 1 1 10 6520 1 1 28 LYS NZ N -7.200 -0.990 9.406 1.00 . A A . 28 LYS NZ 1 1 10 6521 1 1 28 LYS O O -3.123 -1.410 6.656 1.00 . A A . 28 LYS O 1 1 10 6522 1 1 29 LEU C C -1.017 -3.444 6.745 1.00 . A A . 29 LEU C 1 1 10 6523 1 1 29 LEU CA C -2.352 -4.159 6.509 1.00 . A A . 29 LEU CA 1 1 10 6524 1 1 29 LEU CB C -2.141 -5.564 5.923 1.00 . A A . 29 LEU CB 1 1 10 6525 1 1 29 LEU CD1 C -1.835 -6.779 8.132 1.00 . A A . 29 LEU CD1 1 1 10 6526 1 1 29 LEU CD2 C -0.991 -7.784 6.000 1.00 . A A . 29 LEU CD2 1 1 10 6527 1 1 29 LEU CG C -1.226 -6.474 6.759 1.00 . A A . 29 LEU CG 1 1 10 6528 1 1 29 LEU H H -3.602 -3.911 4.814 1.00 . A A . 29 LEU H 1 1 10 6529 1 1 29 LEU HA H -2.874 -4.247 7.461 1.00 . A A . 29 LEU HA 1 1 10 6530 1 1 29 LEU HB2 H -3.112 -6.048 5.810 1.00 . A A . 29 LEU HB2 1 1 10 6531 1 1 29 LEU HB3 H -1.698 -5.458 4.935 1.00 . A A . 29 LEU HB3 1 1 10 6532 1 1 29 LEU HD11 H -2.846 -7.171 8.015 1.00 . A A . 29 LEU HD11 1 1 10 6533 1 1 29 LEU HD12 H -1.224 -7.518 8.649 1.00 . A A . 29 LEU HD12 1 1 10 6534 1 1 29 LEU HD13 H -1.867 -5.875 8.739 1.00 . A A . 29 LEU HD13 1 1 10 6535 1 1 29 LEU HD21 H -0.566 -7.572 5.018 1.00 . A A . 29 LEU HD21 1 1 10 6536 1 1 29 LEU HD22 H -0.290 -8.410 6.554 1.00 . A A . 29 LEU HD22 1 1 10 6537 1 1 29 LEU HD23 H -1.930 -8.323 5.876 1.00 . A A . 29 LEU HD23 1 1 10 6538 1 1 29 LEU HG H -0.254 -5.999 6.899 1.00 . A A . 29 LEU HG 1 1 10 6539 1 1 29 LEU N N -3.212 -3.409 5.602 1.00 . A A . 29 LEU N 1 1 10 6540 1 1 29 LEU O O -0.551 -3.368 7.880 1.00 . A A . 29 LEU O 1 1 10 6541 1 1 30 SER C C 0.779 -0.824 6.258 1.00 . A A . 30 SER C 1 1 10 6542 1 1 30 SER CA C 0.888 -2.258 5.733 1.00 . A A . 30 SER CA 1 1 10 6543 1 1 30 SER CB C 1.539 -2.271 4.351 1.00 . A A . 30 SER CB 1 1 10 6544 1 1 30 SER H H -0.871 -2.991 4.777 1.00 . A A . 30 SER H 1 1 10 6545 1 1 30 SER HA H 1.546 -2.810 6.406 1.00 . A A . 30 SER HA 1 1 10 6546 1 1 30 SER HB2 H 2.493 -1.759 4.419 1.00 . A A . 30 SER HB2 1 1 10 6547 1 1 30 SER HB3 H 1.700 -3.298 4.026 1.00 . A A . 30 SER HB3 1 1 10 6548 1 1 30 SER HG H -0.076 -2.117 3.283 1.00 . A A . 30 SER HG 1 1 10 6549 1 1 30 SER N N -0.406 -2.925 5.675 1.00 . A A . 30 SER N 1 1 10 6550 1 1 30 SER O O 1.726 -0.316 6.856 1.00 . A A . 30 SER O 1 1 10 6551 1 1 30 SER OG O 0.733 -1.609 3.403 1.00 . A A . 30 SER OG 1 1 10 6552 1 1 31 GLY C C -0.310 2.139 5.131 1.00 . A A . 31 GLY C 1 1 10 6553 1 1 31 GLY CA C -0.603 1.225 6.322 1.00 . A A . 31 GLY CA 1 1 10 6554 1 1 31 GLY H H -1.079 -0.656 5.486 1.00 . A A . 31 GLY H 1 1 10 6555 1 1 31 GLY HA2 H -1.657 1.332 6.582 1.00 . A A . 31 GLY HA2 1 1 10 6556 1 1 31 GLY HA3 H -0.005 1.537 7.178 1.00 . A A . 31 GLY HA3 1 1 10 6557 1 1 31 GLY N N -0.359 -0.172 6.006 1.00 . A A . 31 GLY N 1 1 10 6558 1 1 31 GLY O O -0.095 3.333 5.329 1.00 . A A . 31 GLY O 1 1 10 6559 1 1 32 CYS C C -1.644 2.560 2.084 1.00 . A A . 32 CYS C 1 1 10 6560 1 1 32 CYS CA C -0.240 2.335 2.655 1.00 . A A . 32 CYS CA 1 1 10 6561 1 1 32 CYS CB C 0.625 1.556 1.658 1.00 . A A . 32 CYS CB 1 1 10 6562 1 1 32 CYS H H -0.523 0.605 3.822 1.00 . A A . 32 CYS H 1 1 10 6563 1 1 32 CYS HA H 0.227 3.305 2.828 1.00 . A A . 32 CYS HA 1 1 10 6564 1 1 32 CYS HB2 H 0.095 0.656 1.351 1.00 . A A . 32 CYS HB2 1 1 10 6565 1 1 32 CYS HB3 H 0.766 2.165 0.769 1.00 . A A . 32 CYS HB3 1 1 10 6566 1 1 32 CYS N N -0.331 1.594 3.906 1.00 . A A . 32 CYS N 1 1 10 6567 1 1 32 CYS O O -2.603 1.924 2.520 1.00 . A A . 32 CYS O 1 1 10 6568 1 1 32 CYS SG S 2.253 1.044 2.270 1.00 . A A . 32 CYS SG 1 1 10 6569 1 1 33 LYS C C -2.881 3.607 -1.064 1.00 . A A . 33 LYS C 1 1 10 6570 1 1 33 LYS CA C -2.998 3.843 0.446 1.00 . A A . 33 LYS CA 1 1 10 6571 1 1 33 LYS CB C -3.349 5.316 0.737 1.00 . A A . 33 LYS CB 1 1 10 6572 1 1 33 LYS CD C -3.879 4.951 3.219 1.00 . A A . 33 LYS CD 1 1 10 6573 1 1 33 LYS CE C -3.033 4.601 4.450 1.00 . A A . 33 LYS CE 1 1 10 6574 1 1 33 LYS CG C -3.087 5.768 2.184 1.00 . A A . 33 LYS CG 1 1 10 6575 1 1 33 LYS H H -0.926 3.986 0.854 1.00 . A A . 33 LYS H 1 1 10 6576 1 1 33 LYS HA H -3.814 3.217 0.809 1.00 . A A . 33 LYS HA 1 1 10 6577 1 1 33 LYS HB2 H -2.743 5.952 0.089 1.00 . A A . 33 LYS HB2 1 1 10 6578 1 1 33 LYS HB3 H -4.399 5.482 0.492 1.00 . A A . 33 LYS HB3 1 1 10 6579 1 1 33 LYS HD2 H -4.779 5.493 3.511 1.00 . A A . 33 LYS HD2 1 1 10 6580 1 1 33 LYS HD3 H -4.203 4.011 2.783 1.00 . A A . 33 LYS HD3 1 1 10 6581 1 1 33 LYS HE2 H -3.383 3.647 4.841 1.00 . A A . 33 LYS HE2 1 1 10 6582 1 1 33 LYS HE3 H -1.991 4.474 4.164 1.00 . A A . 33 LYS HE3 1 1 10 6583 1 1 33 LYS HG2 H -2.015 5.702 2.366 1.00 . A A . 33 LYS HG2 1 1 10 6584 1 1 33 LYS HG3 H -3.365 6.818 2.285 1.00 . A A . 33 LYS HG3 1 1 10 6585 1 1 33 LYS HZ1 H -2.780 6.508 5.180 1.00 . A A . 33 LYS HZ1 1 1 10 6586 1 1 33 LYS HZ2 H -4.089 5.721 5.804 1.00 . A A . 33 LYS HZ2 1 1 10 6587 1 1 33 LYS HZ3 H -2.569 5.327 6.301 1.00 . A A . 33 LYS HZ3 1 1 10 6588 1 1 33 LYS N N -1.755 3.475 1.113 1.00 . A A . 33 LYS N 1 1 10 6589 1 1 33 LYS NZ N -3.128 5.617 5.511 1.00 . A A . 33 LYS NZ 1 1 10 6590 1 1 33 LYS O O -1.902 4.027 -1.682 1.00 . A A . 33 LYS O 1 1 10 6591 1 1 34 ILE C C -5.341 3.631 -3.434 1.00 . A A . 34 ILE C 1 1 10 6592 1 1 34 ILE CA C -4.100 2.808 -3.080 1.00 . A A . 34 ILE CA 1 1 10 6593 1 1 34 ILE CB C -4.347 1.331 -3.463 1.00 . A A . 34 ILE CB 1 1 10 6594 1 1 34 ILE CD1 C -1.971 0.478 -2.917 1.00 . A A . 34 ILE CD1 1 1 10 6595 1 1 34 ILE CG1 C -3.477 0.313 -2.709 1.00 . A A . 34 ILE CG1 1 1 10 6596 1 1 34 ILE CG2 C -4.226 1.144 -4.982 1.00 . A A . 34 ILE CG2 1 1 10 6597 1 1 34 ILE H H -4.641 2.602 -1.056 1.00 . A A . 34 ILE H 1 1 10 6598 1 1 34 ILE HA H -3.229 3.177 -3.621 1.00 . A A . 34 ILE HA 1 1 10 6599 1 1 34 ILE HB H -5.373 1.075 -3.192 1.00 . A A . 34 ILE HB 1 1 10 6600 1 1 34 ILE HD11 H -1.730 0.412 -3.976 1.00 . A A . 34 ILE HD11 1 1 10 6601 1 1 34 ILE HD12 H -1.640 1.431 -2.512 1.00 . A A . 34 ILE HD12 1 1 10 6602 1 1 34 ILE HD13 H -1.443 -0.317 -2.393 1.00 . A A . 34 ILE HD13 1 1 10 6603 1 1 34 ILE HG12 H -3.700 0.390 -1.647 1.00 . A A . 34 ILE HG12 1 1 10 6604 1 1 34 ILE HG13 H -3.762 -0.688 -3.029 1.00 . A A . 34 ILE HG13 1 1 10 6605 1 1 34 ILE HG21 H -3.231 1.421 -5.327 1.00 . A A . 34 ILE HG21 1 1 10 6606 1 1 34 ILE HG22 H -4.417 0.102 -5.241 1.00 . A A . 34 ILE HG22 1 1 10 6607 1 1 34 ILE HG23 H -4.958 1.768 -5.494 1.00 . A A . 34 ILE HG23 1 1 10 6608 1 1 34 ILE N N -3.898 2.951 -1.643 1.00 . A A . 34 ILE N 1 1 10 6609 1 1 34 ILE O O -6.393 3.411 -2.834 1.00 . A A . 34 ILE O 1 1 10 6610 1 1 35 ILE C C -6.326 5.245 -6.497 1.00 . A A . 35 ILE C 1 1 10 6611 1 1 35 ILE CA C -6.413 5.222 -4.971 1.00 . A A . 35 ILE CA 1 1 10 6612 1 1 35 ILE CB C -6.619 6.632 -4.382 1.00 . A A . 35 ILE CB 1 1 10 6613 1 1 35 ILE CD1 C -5.722 9.009 -4.225 1.00 . A A . 35 ILE CD1 1 1 10 6614 1 1 35 ILE CG1 C -5.420 7.564 -4.630 1.00 . A A . 35 ILE CG1 1 1 10 6615 1 1 35 ILE CG2 C -6.948 6.542 -2.886 1.00 . A A . 35 ILE CG2 1 1 10 6616 1 1 35 ILE H H -4.351 4.715 -4.847 1.00 . A A . 35 ILE H 1 1 10 6617 1 1 35 ILE HA H -7.306 4.642 -4.736 1.00 . A A . 35 ILE HA 1 1 10 6618 1 1 35 ILE HB H -7.488 7.062 -4.882 1.00 . A A . 35 ILE HB 1 1 10 6619 1 1 35 ILE HD11 H -5.829 9.092 -3.145 1.00 . A A . 35 ILE HD11 1 1 10 6620 1 1 35 ILE HD12 H -4.904 9.653 -4.547 1.00 . A A . 35 ILE HD12 1 1 10 6621 1 1 35 ILE HD13 H -6.643 9.342 -4.705 1.00 . A A . 35 ILE HD13 1 1 10 6622 1 1 35 ILE HG12 H -4.546 7.209 -4.082 1.00 . A A . 35 ILE HG12 1 1 10 6623 1 1 35 ILE HG13 H -5.187 7.571 -5.693 1.00 . A A . 35 ILE HG13 1 1 10 6624 1 1 35 ILE HG21 H -7.734 5.802 -2.724 1.00 . A A . 35 ILE HG21 1 1 10 6625 1 1 35 ILE HG22 H -6.062 6.257 -2.318 1.00 . A A . 35 ILE HG22 1 1 10 6626 1 1 35 ILE HG23 H -7.312 7.501 -2.522 1.00 . A A . 35 ILE HG23 1 1 10 6627 1 1 35 ILE N N -5.246 4.547 -4.409 1.00 . A A . 35 ILE N 1 1 10 6628 1 1 35 ILE O O -5.241 5.387 -7.059 1.00 . A A . 35 ILE O 1 1 10 6629 1 1 36 SER C C -7.845 6.475 -9.165 1.00 . A A . 36 SER C 1 1 10 6630 1 1 36 SER CA C -7.600 5.064 -8.613 1.00 . A A . 36 SER CA 1 1 10 6631 1 1 36 SER CB C -8.719 4.081 -8.988 1.00 . A A . 36 SER CB 1 1 10 6632 1 1 36 SER H H -8.334 5.030 -6.626 1.00 . A A . 36 SER H 1 1 10 6633 1 1 36 SER HA H -6.671 4.683 -9.041 1.00 . A A . 36 SER HA 1 1 10 6634 1 1 36 SER HB2 H -8.576 3.138 -8.457 1.00 . A A . 36 SER HB2 1 1 10 6635 1 1 36 SER HB3 H -9.689 4.496 -8.708 1.00 . A A . 36 SER HB3 1 1 10 6636 1 1 36 SER HG H -7.880 3.381 -10.602 1.00 . A A . 36 SER HG 1 1 10 6637 1 1 36 SER N N -7.481 5.106 -7.161 1.00 . A A . 36 SER N 1 1 10 6638 1 1 36 SER O O -8.674 6.668 -10.051 1.00 . A A . 36 SER O 1 1 10 6639 1 1 36 SER OG O -8.710 3.803 -10.373 1.00 . A A . 36 SER OG 1 1 10 6640 1 1 37 ALA C C -5.957 9.216 -9.951 1.00 . A A . 37 ALA C 1 1 10 6641 1 1 37 ALA CA C -7.162 8.853 -9.072 1.00 . A A . 37 ALA CA 1 1 10 6642 1 1 37 ALA CB C -7.210 9.741 -7.826 1.00 . A A . 37 ALA CB 1 1 10 6643 1 1 37 ALA H H -6.459 7.235 -7.900 1.00 . A A . 37 ALA H 1 1 10 6644 1 1 37 ALA HA H -8.067 9.043 -9.648 1.00 . A A . 37 ALA HA 1 1 10 6645 1 1 37 ALA HB1 H -6.305 9.595 -7.235 1.00 . A A . 37 ALA HB1 1 1 10 6646 1 1 37 ALA HB2 H -7.285 10.792 -8.111 1.00 . A A . 37 ALA HB2 1 1 10 6647 1 1 37 ALA HB3 H -8.077 9.478 -7.220 1.00 . A A . 37 ALA HB3 1 1 10 6648 1 1 37 ALA N N -7.109 7.462 -8.638 1.00 . A A . 37 ALA N 1 1 10 6649 1 1 37 ALA O O -5.769 10.390 -10.263 1.00 . A A . 37 ALA O 1 1 10 6650 1 1 38 SER C C -2.991 9.468 -10.133 1.00 . A A . 38 SER C 1 1 10 6651 1 1 38 SER CA C -3.807 8.427 -10.919 1.00 . A A . 38 SER CA 1 1 10 6652 1 1 38 SER CB C -3.975 8.773 -12.403 1.00 . A A . 38 SER CB 1 1 10 6653 1 1 38 SER H H -5.363 7.280 -10.078 1.00 . A A . 38 SER H 1 1 10 6654 1 1 38 SER HA H -3.274 7.477 -10.858 1.00 . A A . 38 SER HA 1 1 10 6655 1 1 38 SER HB2 H -4.570 8.000 -12.892 1.00 . A A . 38 SER HB2 1 1 10 6656 1 1 38 SER HB3 H -4.489 9.729 -12.500 1.00 . A A . 38 SER HB3 1 1 10 6657 1 1 38 SER HG H -2.207 9.538 -12.622 1.00 . A A . 38 SER HG 1 1 10 6658 1 1 38 SER N N -5.119 8.229 -10.310 1.00 . A A . 38 SER N 1 1 10 6659 1 1 38 SER O O -2.265 10.272 -10.714 1.00 . A A . 38 SER O 1 1 10 6660 1 1 38 SER OG O -2.720 8.843 -13.045 1.00 . A A . 38 SER OG 1 1 10 6661 1 1 39 THR C C -2.524 9.712 -6.506 1.00 . A A . 39 THR C 1 1 10 6662 1 1 39 THR CA C -2.657 10.438 -7.852 1.00 . A A . 39 THR CA 1 1 10 6663 1 1 39 THR CB C -3.637 11.636 -7.803 1.00 . A A . 39 THR CB 1 1 10 6664 1 1 39 THR CG2 C -3.182 12.796 -6.908 1.00 . A A . 39 THR CG2 1 1 10 6665 1 1 39 THR H H -3.733 8.726 -8.408 1.00 . A A . 39 THR H 1 1 10 6666 1 1 39 THR HA H -1.670 10.784 -8.161 1.00 . A A . 39 THR HA 1 1 10 6667 1 1 39 THR HB H -4.609 11.294 -7.451 1.00 . A A . 39 THR HB 1 1 10 6668 1 1 39 THR HG1 H -4.294 11.544 -9.638 1.00 . A A . 39 THR HG1 1 1 10 6669 1 1 39 THR HG21 H -3.792 13.674 -7.120 1.00 . A A . 39 THR HG21 1 1 10 6670 1 1 39 THR HG22 H -3.322 12.550 -5.857 1.00 . A A . 39 THR HG22 1 1 10 6671 1 1 39 THR HG23 H -2.138 13.039 -7.103 1.00 . A A . 39 THR HG23 1 1 10 6672 1 1 39 THR N N -3.154 9.454 -8.804 1.00 . A A . 39 THR N 1 1 10 6673 1 1 39 THR O O -2.885 8.538 -6.403 1.00 . A A . 39 THR O 1 1 10 6674 1 1 39 THR OG1 O -3.813 12.177 -9.097 1.00 . A A . 39 THR OG1 1 1 10 6675 1 1 40 CYS C C -2.295 10.909 -3.099 1.00 . A A . 40 CYS C 1 1 10 6676 1 1 40 CYS CA C -1.855 9.864 -4.129 1.00 . A A . 40 CYS CA 1 1 10 6677 1 1 40 CYS CB C -0.402 9.445 -3.908 1.00 . A A . 40 CYS CB 1 1 10 6678 1 1 40 CYS H H -1.687 11.340 -5.628 1.00 . A A . 40 CYS H 1 1 10 6679 1 1 40 CYS HA H -2.489 8.985 -4.021 1.00 . A A . 40 CYS HA 1 1 10 6680 1 1 40 CYS HB2 H 0.269 10.235 -4.247 1.00 . A A . 40 CYS HB2 1 1 10 6681 1 1 40 CYS HB3 H -0.230 9.301 -2.843 1.00 . A A . 40 CYS HB3 1 1 10 6682 1 1 40 CYS N N -1.993 10.390 -5.481 1.00 . A A . 40 CYS N 1 1 10 6683 1 1 40 CYS O O -2.246 12.105 -3.390 1.00 . A A . 40 CYS O 1 1 10 6684 1 1 40 CYS SG S 0.028 7.900 -4.741 1.00 . A A . 40 CYS SG 1 1 10 6685 1 1 41 PRO C C -2.143 12.193 -0.198 1.00 . A A . 41 PRO C 1 1 10 6686 1 1 41 PRO CA C -3.245 11.360 -0.862 1.00 . A A . 41 PRO CA 1 1 10 6687 1 1 41 PRO CB C -3.953 10.444 0.142 1.00 . A A . 41 PRO CB 1 1 10 6688 1 1 41 PRO CD C -2.880 9.084 -1.504 1.00 . A A . 41 PRO CD 1 1 10 6689 1 1 41 PRO CG C -3.227 9.112 -0.019 1.00 . A A . 41 PRO CG 1 1 10 6690 1 1 41 PRO HA H -3.979 12.042 -1.292 1.00 . A A . 41 PRO HA 1 1 10 6691 1 1 41 PRO HB2 H -3.909 10.808 1.170 1.00 . A A . 41 PRO HB2 1 1 10 6692 1 1 41 PRO HB3 H -4.993 10.321 -0.161 1.00 . A A . 41 PRO HB3 1 1 10 6693 1 1 41 PRO HD2 H -1.970 8.504 -1.657 1.00 . A A . 41 PRO HD2 1 1 10 6694 1 1 41 PRO HD3 H -3.706 8.636 -2.054 1.00 . A A . 41 PRO HD3 1 1 10 6695 1 1 41 PRO HG2 H -2.307 9.124 0.560 1.00 . A A . 41 PRO HG2 1 1 10 6696 1 1 41 PRO HG3 H -3.849 8.266 0.275 1.00 . A A . 41 PRO HG3 1 1 10 6697 1 1 41 PRO N N -2.733 10.477 -1.903 1.00 . A A . 41 PRO N 1 1 10 6698 1 1 41 PRO O O -0.961 12.032 -0.497 1.00 . A A . 41 PRO O 1 1 10 6699 1 1 42 SER C C -0.338 14.047 1.368 1.00 . A A . 42 SER C 1 1 10 6700 1 1 42 SER CA C -1.862 14.198 1.320 1.00 . A A . 42 SER CA 1 1 10 6701 1 1 42 SER CB C -2.464 14.469 2.705 1.00 . A A . 42 SER CB 1 1 10 6702 1 1 42 SER H H -3.581 13.089 0.862 1.00 . A A . 42 SER H 1 1 10 6703 1 1 42 SER HA H -2.070 15.080 0.711 1.00 . A A . 42 SER HA 1 1 10 6704 1 1 42 SER HB2 H -3.533 14.660 2.604 1.00 . A A . 42 SER HB2 1 1 10 6705 1 1 42 SER HB3 H -2.320 13.606 3.356 1.00 . A A . 42 SER HB3 1 1 10 6706 1 1 42 SER HG H -2.058 16.372 2.754 1.00 . A A . 42 SER HG 1 1 10 6707 1 1 42 SER N N -2.587 13.096 0.691 1.00 . A A . 42 SER N 1 1 10 6708 1 1 42 SER O O 0.362 14.851 0.755 1.00 . A A . 42 SER O 1 1 10 6709 1 1 42 SER OG O -1.866 15.603 3.296 1.00 . A A . 42 SER OG 1 1 10 6710 1 1 43 ASP C C 1.996 11.436 2.482 1.00 . A A . 43 ASP C 1 1 10 6711 1 1 43 ASP CA C 1.622 12.905 2.287 1.00 . A A . 43 ASP CA 1 1 10 6712 1 1 43 ASP CB C 2.093 13.798 3.446 1.00 . A A . 43 ASP CB 1 1 10 6713 1 1 43 ASP CG C 3.608 13.748 3.643 1.00 . A A . 43 ASP CG 1 1 10 6714 1 1 43 ASP H H -0.429 12.401 2.568 1.00 . A A . 43 ASP H 1 1 10 6715 1 1 43 ASP HA H 2.129 13.240 1.380 1.00 . A A . 43 ASP HA 1 1 10 6716 1 1 43 ASP HB2 H 1.815 14.833 3.237 1.00 . A A . 43 ASP HB2 1 1 10 6717 1 1 43 ASP HB3 H 1.597 13.490 4.367 1.00 . A A . 43 ASP HB3 1 1 10 6718 1 1 43 ASP HD2 H 3.851 14.335 1.793 1.00 . A A . 43 ASP HD2 1 1 10 6719 1 1 43 ASP N N 0.184 13.055 2.104 1.00 . A A . 43 ASP N 1 1 10 6720 1 1 43 ASP O O 2.162 10.970 3.607 1.00 . A A . 43 ASP O 1 1 10 6721 1 1 43 ASP OD1 O 4.063 13.422 4.737 1.00 . A A . 43 ASP OD1 1 1 10 6722 1 1 43 ASP OD2 O 4.369 14.089 2.562 1.00 . A A . 43 ASP OD2 1 1 10 6723 1 1 44 TYR C C 3.715 9.274 0.166 1.00 . A A . 44 TYR C 1 1 10 6724 1 1 44 TYR CA C 2.680 9.367 1.299 1.00 . A A . 44 TYR CA 1 1 10 6725 1 1 44 TYR CB C 1.517 8.387 1.078 1.00 . A A . 44 TYR CB 1 1 10 6726 1 1 44 TYR CD1 C -0.403 9.302 2.459 1.00 . A A . 44 TYR CD1 1 1 10 6727 1 1 44 TYR CD2 C 0.561 7.158 3.069 1.00 . A A . 44 TYR CD2 1 1 10 6728 1 1 44 TYR CE1 C -1.234 9.250 3.590 1.00 . A A . 44 TYR CE1 1 1 10 6729 1 1 44 TYR CE2 C -0.244 7.118 4.221 1.00 . A A . 44 TYR CE2 1 1 10 6730 1 1 44 TYR CG C 0.535 8.281 2.227 1.00 . A A . 44 TYR CG 1 1 10 6731 1 1 44 TYR CZ C -1.124 8.179 4.491 1.00 . A A . 44 TYR CZ 1 1 10 6732 1 1 44 TYR H H 1.950 11.176 0.477 1.00 . A A . 44 TYR H 1 1 10 6733 1 1 44 TYR HA H 3.181 9.103 2.232 1.00 . A A . 44 TYR HA 1 1 10 6734 1 1 44 TYR HB2 H 0.964 8.688 0.190 1.00 . A A . 44 TYR HB2 1 1 10 6735 1 1 44 TYR HB3 H 1.936 7.397 0.901 1.00 . A A . 44 TYR HB3 1 1 10 6736 1 1 44 TYR HD1 H -0.485 10.135 1.777 1.00 . A A . 44 TYR HD1 1 1 10 6737 1 1 44 TYR HD2 H 1.193 6.324 2.825 1.00 . A A . 44 TYR HD2 1 1 10 6738 1 1 44 TYR HE1 H -1.946 10.041 3.765 1.00 . A A . 44 TYR HE1 1 1 10 6739 1 1 44 TYR HE2 H -0.170 6.274 4.894 1.00 . A A . 44 TYR HE2 1 1 10 6740 1 1 44 TYR HH H -2.360 8.988 5.763 1.00 . A A . 44 TYR HH 1 1 10 6741 1 1 44 TYR N N 2.154 10.725 1.358 1.00 . A A . 44 TYR N 1 1 10 6742 1 1 44 TYR O O 3.479 8.582 -0.820 1.00 . A A . 44 TYR O 1 1 10 6743 1 1 44 TYR OH O -1.890 8.162 5.621 1.00 . A A . 44 TYR OH 1 1 10 6744 1 1 45 PRO C C 6.810 8.850 -0.840 1.00 . A A . 45 PRO C 1 1 10 6745 1 1 45 PRO CA C 5.830 10.035 -0.824 1.00 . A A . 45 PRO CA 1 1 10 6746 1 1 45 PRO CB C 6.543 11.373 -0.611 1.00 . A A . 45 PRO CB 1 1 10 6747 1 1 45 PRO CD C 5.247 10.869 1.339 1.00 . A A . 45 PRO CD 1 1 10 6748 1 1 45 PRO CG C 6.573 11.502 0.910 1.00 . A A . 45 PRO CG 1 1 10 6749 1 1 45 PRO HA H 5.326 10.068 -1.791 1.00 . A A . 45 PRO HA 1 1 10 6750 1 1 45 PRO HB2 H 7.539 11.416 -1.054 1.00 . A A . 45 PRO HB2 1 1 10 6751 1 1 45 PRO HB3 H 5.923 12.171 -1.021 1.00 . A A . 45 PRO HB3 1 1 10 6752 1 1 45 PRO HD2 H 5.353 10.343 2.289 1.00 . A A . 45 PRO HD2 1 1 10 6753 1 1 45 PRO HD3 H 4.518 11.670 1.430 1.00 . A A . 45 PRO HD3 1 1 10 6754 1 1 45 PRO HG2 H 7.407 10.922 1.295 1.00 . A A . 45 PRO HG2 1 1 10 6755 1 1 45 PRO HG3 H 6.663 12.539 1.233 1.00 . A A . 45 PRO HG3 1 1 10 6756 1 1 45 PRO N N 4.864 9.966 0.264 1.00 . A A . 45 PRO N 1 1 10 6757 1 1 45 PRO O O 7.784 8.896 -1.588 1.00 . A A . 45 PRO O 1 1 10 6758 1 1 46 LYS C C 6.603 5.434 -0.759 1.00 . A A . 46 LYS C 1 1 10 6759 1 1 46 LYS CA C 7.357 6.566 -0.053 1.00 . A A . 46 LYS CA 1 1 10 6760 1 1 46 LYS CB C 7.755 6.182 1.385 1.00 . A A . 46 LYS CB 1 1 10 6761 1 1 46 LYS CD C 9.458 8.108 1.684 1.00 . A A . 46 LYS CD 1 1 10 6762 1 1 46 LYS CE C 8.613 8.915 2.679 1.00 . A A . 46 LYS CE 1 1 10 6763 1 1 46 LYS CG C 9.197 6.595 1.721 1.00 . A A . 46 LYS CG 1 1 10 6764 1 1 46 LYS H H 5.735 7.785 0.528 1.00 . A A . 46 LYS H 1 1 10 6765 1 1 46 LYS HA H 8.273 6.707 -0.626 1.00 . A A . 46 LYS HA 1 1 10 6766 1 1 46 LYS HB2 H 7.059 6.610 2.105 1.00 . A A . 46 LYS HB2 1 1 10 6767 1 1 46 LYS HB3 H 7.711 5.097 1.494 1.00 . A A . 46 LYS HB3 1 1 10 6768 1 1 46 LYS HD2 H 10.513 8.281 1.909 1.00 . A A . 46 LYS HD2 1 1 10 6769 1 1 46 LYS HD3 H 9.271 8.487 0.679 1.00 . A A . 46 LYS HD3 1 1 10 6770 1 1 46 LYS HE2 H 8.950 9.951 2.652 1.00 . A A . 46 LYS HE2 1 1 10 6771 1 1 46 LYS HE3 H 7.561 8.876 2.399 1.00 . A A . 46 LYS HE3 1 1 10 6772 1 1 46 LYS HG2 H 9.456 6.212 2.706 1.00 . A A . 46 LYS HG2 1 1 10 6773 1 1 46 LYS HG3 H 9.867 6.116 1.004 1.00 . A A . 46 LYS HG3 1 1 10 6774 1 1 46 LYS HZ1 H 8.305 7.530 4.152 1.00 . A A . 46 LYS HZ1 1 1 10 6775 1 1 46 LYS HZ2 H 9.728 8.366 4.311 1.00 . A A . 46 LYS HZ2 1 1 10 6776 1 1 46 LYS HZ3 H 8.287 9.076 4.689 1.00 . A A . 46 LYS HZ3 1 1 10 6777 1 1 46 LYS N N 6.565 7.793 -0.049 1.00 . A A . 46 LYS N 1 1 10 6778 1 1 46 LYS NZ N 8.752 8.434 4.063 1.00 . A A . 46 LYS NZ 1 1 10 6779 1 1 46 LYS O O 5.409 5.609 -1.091 1.00 . A A . 46 LYS O 1 1 10 6780 1 1 46 LYS OXT O 7.252 4.390 -0.980 1.00 . A A . 46 LYS OXT 1 1 stop_ save_
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