NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
563838 | 2m9f | 19292 | cing | 4-filtered-FRED | STAR | entry | full | 254 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2m9f # This FRED archive file contains, for PDB entry <2m9f>: # # - 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_2m9f _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2m9f _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 4049.48 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 $Peptidyl_prolyl_cis_trans_isomerase_NIMA_interacting_1 A . 1 1 2 . 2 $SUGAR__N_ACETYL_D_GLUCOSAMINE_ B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 NAG 1 NAG 1 1 stop_ save_ save_Peptidyl_prolyl_cis_trans_isomerase_NIMA_interacting_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Peptidyl prolyl cis trans isomerase NIMA interacting 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KLPPGWEKRMFANGTVYYFNHITNASQFERPSG _Entity.Number_of_monomers 33 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 LEU . 1 1 3 PRO . 1 1 4 PRO . 1 1 5 GLY . 1 1 6 TRP . 1 1 7 GLU . 1 1 8 LYS . 1 1 9 ARG . 1 1 10 MET . 1 1 11 PHE . 1 1 12 ALA . 1 1 13 ASN . 1 1 14 GLY . 1 1 15 THR . 1 1 16 VAL . 1 1 17 TYR . 1 1 18 TYR . 1 1 19 PHE . 1 1 20 ASN . 1 1 21 HIS . 1 1 22 ILE . 1 1 23 THR . 1 1 24 ASN . 1 1 25 ALA . 1 1 26 SER . 1 1 27 GLN . 1 1 28 PHE . 1 1 29 GLU . 1 1 30 ARG . 1 1 31 PRO . 1 1 32 SER . 1 1 33 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LYS 1 1 1 1 LEU 2 2 1 1 PRO 3 3 1 1 PRO 4 4 1 1 GLY 5 5 1 1 TRP 6 6 1 1 GLU 7 7 1 1 LYS 8 8 1 1 ARG 9 9 1 1 MET 10 10 1 1 PHE 11 11 1 1 ALA 12 12 1 1 ASN 13 13 1 1 GLY 14 14 1 1 THR 15 15 1 1 VAL 16 16 1 1 TYR 17 17 1 1 TYR 18 18 1 1 PHE 19 19 1 1 ASN 20 20 1 1 HIS 21 21 1 1 ILE 22 22 1 1 THR 23 23 1 1 ASN 24 24 1 1 ALA 25 25 1 1 SER 26 26 1 1 GLN 27 27 1 1 PHE 28 28 1 1 GLU 29 29 1 1 ARG 30 30 1 1 PRO 31 31 1 1 SER 32 32 1 1 GLY 33 33 1 1 stop_ save_ save_SUGAR__N_ACETYL_D_GLUCOSAMINE_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "SUGAR N ACETYL D GLUCOSAMINE " _Entity.Type non-polymer 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 NAG $NAG 1 2 stop_ save_ save_NAG _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NAG _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_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 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 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 6 TRP H . 6 TRP H 1 1 1 1 2 1 1 6 TRP HB2 . 6 TRP HB2 1 1 2 1 1 1 1 6 TRP H . 6 TRP H 1 1 2 1 2 1 1 6 TRP HB3 . 6 TRP HB3 1 1 3 1 1 1 1 8 LYS H . 8 LYS H 1 1 3 1 2 1 1 8 LYS HB2 . 8 LYS HB2 1 1 4 1 1 1 1 8 LYS H . 8 LYS H 1 1 4 1 2 1 1 8 LYS HB3 . 8 LYS HB3 1 1 5 1 1 1 1 10 MET H . 10 MET H 1 1 5 1 2 1 1 10 MET HB2 . 10 MET HB2 1 1 6 1 1 1 1 11 PHE H . 11 PHE H 1 1 6 1 2 1 1 11 PHE HB2 . 11 PHE HB2 1 1 7 1 1 1 1 11 PHE H . 11 PHE H 1 1 7 1 2 1 1 11 PHE HB3 . 11 PHE HB3 1 1 8 1 1 1 1 15 THR H . 15 THR H 1 1 8 1 2 1 1 15 THR HB . 15 THR HB 1 1 9 1 1 1 1 19 PHE H . 19 PHE H 1 1 9 1 2 1 1 19 PHE HB3 . 19 PHE HB3 1 1 10 1 1 1 1 19 PHE H . 19 PHE H 1 1 10 1 2 1 1 19 PHE HB2 . 19 PHE HB2 1 1 11 1 1 1 1 20 ASN H . 20 ASN H 1 1 11 1 2 1 1 20 ASN HB2 . 20 ASN HB2 1 1 12 1 1 1 1 20 ASN H . 20 ASN H 1 1 12 1 2 1 1 20 ASN HB3 . 20 ASN HB3 1 1 13 1 1 1 1 22 ILE H . 22 ILE H 1 1 13 1 2 1 1 22 ILE HB . 22 ILE HB 1 1 14 1 1 1 1 26 SER H . 26 SER H 1 1 14 1 2 1 1 26 SER HB2 . 26 SER HB2 1 1 15 1 1 1 1 26 SER H . 26 SER H 1 1 15 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 16 1 1 1 1 28 PHE H . 28 PHE H 1 1 16 1 2 1 1 28 PHE HB2 . 28 PHE HB2 1 1 17 1 1 1 1 28 PHE H . 28 PHE H 1 1 17 1 2 1 1 28 PHE HB3 . 28 PHE HB3 1 1 18 1 1 1 1 9 ARG H . 9 ARG H 1 1 18 1 2 1 1 9 ARG HG2 . 9 ARG HG2 1 1 19 1 1 1 1 9 ARG H . 9 ARG H 1 1 19 1 2 1 1 9 ARG HG3 . 9 ARG HG3 1 1 20 1 1 1 1 11 PHE H . 11 PHE H 1 1 20 1 2 1 1 11 PHE QD . 11 PHE QD 1 1 21 1 1 1 1 11 PHE HA . 11 PHE HA 1 1 21 1 2 1 1 11 PHE QD . 11 PHE QD 1 1 22 1 1 1 1 16 VAL H . 16 VAL H 1 1 22 1 2 1 1 16 VAL MG2 . 16 VAL QG2 1 1 23 1 1 1 1 17 TYR H . 17 TYR H 1 1 23 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 24 1 1 1 1 17 TYR H . 17 TYR H 1 1 24 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 25 1 1 1 1 17 TYR HB3 . 17 TYR HB3 1 1 25 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 26 1 1 1 1 18 TYR H . 18 TYR H 1 1 26 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 27 1 1 1 1 18 TYR H . 18 TYR H 1 1 27 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 28 1 1 1 1 18 TYR HA . 18 TYR HA 1 1 28 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 29 1 1 1 1 18 TYR HA . 18 TYR HA 1 1 29 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 30 1 1 1 1 19 PHE H . 19 PHE H 1 1 30 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 31 1 1 1 1 28 PHE H . 28 PHE H 1 1 31 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 32 1 1 1 1 28 PHE HA . 28 PHE HA 1 1 32 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 33 1 1 1 1 28 PHE HB2 . 28 PHE HB2 1 1 33 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 34 1 1 1 1 28 PHE HB3 . 28 PHE HB3 1 1 34 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 35 1 1 1 1 6 TRP H . 6 TRP H 1 1 35 1 2 1 1 7 GLU H . 7 GLU H 1 1 36 1 1 1 1 7 GLU H . 7 GLU H 1 1 36 1 2 1 1 8 LYS H . 8 LYS H 1 1 37 1 1 1 1 8 LYS H . 8 LYS H 1 1 37 1 2 1 1 9 ARG H . 9 ARG H 1 1 38 1 1 1 1 9 ARG H . 9 ARG H 1 1 38 1 2 1 1 10 MET H . 10 MET H 1 1 39 1 1 1 1 13 ASN H . 13 ASN H 1 1 39 1 2 1 1 14 GLY H . 14 GLY H 1 1 40 1 1 1 1 14 GLY H . 14 GLY H 1 1 40 1 2 1 1 15 THR H . 15 THR H 1 1 41 1 1 1 1 15 THR H . 15 THR H 1 1 41 1 2 1 1 16 VAL H . 16 VAL H 1 1 42 1 1 1 1 17 TYR H . 17 TYR H 1 1 42 1 2 1 1 18 TYR H . 18 TYR H 1 1 43 1 1 1 1 19 PHE H . 19 PHE H 1 1 43 1 2 1 1 20 ASN H . 20 ASN H 1 1 44 1 1 1 1 25 ALA H . 25 ALA H 1 1 44 1 2 1 1 26 SER H . 26 SER H 1 1 45 1 1 1 1 27 GLN H . 27 GLN H 1 1 45 1 2 1 1 28 PHE H . 28 PHE H 1 1 46 1 1 1 1 28 PHE H . 28 PHE H 1 1 46 1 2 1 1 29 GLU H . 29 GLU H 1 1 47 1 1 1 1 5 GLY HA3 . 5 GLY HA3 1 1 47 1 2 1 1 6 TRP H . 6 TRP H 1 1 48 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 48 1 2 1 1 7 GLU H . 7 GLU H 1 1 49 1 1 1 1 7 GLU HA . 7 GLU HA 1 1 49 1 2 1 1 8 LYS H . 8 LYS H 1 1 50 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 50 1 2 1 1 9 ARG H . 9 ARG H 1 1 51 1 1 1 1 9 ARG HA . 9 ARG HA 1 1 51 1 2 1 1 10 MET H . 10 MET H 1 1 52 1 1 1 1 10 MET HA . 10 MET HA 1 1 52 1 2 1 1 11 PHE H . 11 PHE H 1 1 53 1 1 1 1 11 PHE HA . 11 PHE HA 1 1 53 1 2 1 1 12 ALA H . 12 ALA H 1 1 54 1 1 1 1 12 ALA HA . 12 ALA HA 1 1 54 1 2 1 1 13 ASN H . 13 ASN H 1 1 55 1 1 1 1 13 ASN HA . 13 ASN HA 1 1 55 1 2 1 1 14 GLY H . 14 GLY H 1 1 56 1 1 1 1 14 GLY HA2 . 14 GLY HA2 1 1 56 1 2 1 1 15 THR H . 15 THR H 1 1 57 1 1 1 1 15 THR HA . 15 THR HA 1 1 57 1 2 1 1 16 VAL H . 16 VAL H 1 1 58 1 1 1 1 16 VAL HA . 16 VAL HA 1 1 58 1 2 1 1 17 TYR H . 17 TYR H 1 1 59 1 1 1 1 17 TYR HA . 17 TYR HA 1 1 59 1 2 1 1 18 TYR H . 18 TYR H 1 1 60 1 1 1 1 18 TYR HA . 18 TYR HA 1 1 60 1 2 1 1 19 PHE H . 19 PHE H 1 1 61 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 61 1 2 1 1 20 ASN H . 20 ASN H 1 1 62 1 1 1 1 21 HIS HA . 21 HIS HA 1 1 62 1 2 1 1 22 ILE H . 22 ILE H 1 1 63 1 1 1 1 22 ILE HA . 22 ILE HA 1 1 63 1 2 1 1 23 THR H . 23 THR H 1 1 64 1 1 1 1 24 ASN HA . 24 ASN HA 1 1 64 1 2 1 1 25 ALA H . 25 ALA H 1 1 65 1 1 1 1 25 ALA HA . 25 ALA HA 1 1 65 1 2 1 1 26 SER H . 26 SER H 1 1 66 1 1 1 1 26 SER HA . 26 SER HA 1 1 66 1 2 1 1 27 GLN H . 27 GLN H 1 1 67 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 67 1 2 1 1 28 PHE H . 28 PHE H 1 1 68 1 1 1 1 28 PHE HA . 28 PHE HA 1 1 68 1 2 1 1 29 GLU H . 29 GLU H 1 1 69 1 1 1 1 29 GLU HA . 29 GLU HA 1 1 69 1 2 1 1 30 ARG H . 30 ARG H 1 1 70 1 1 1 1 31 PRO HA . 31 PRO HA 1 1 70 1 2 1 1 32 SER H . 32 SER H 1 1 71 1 1 1 1 32 SER HA . 32 SER HA 1 1 71 1 2 1 1 33 GLY H . 33 GLY H 1 1 72 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 72 1 2 1 1 10 MET H . 10 MET H 1 1 73 1 1 1 1 10 MET HB2 . 10 MET HB2 1 1 73 1 2 1 1 11 PHE H . 11 PHE H 1 1 74 1 1 1 1 10 MET HB3 . 10 MET HB3 1 1 74 1 2 1 1 11 PHE H . 11 PHE H 1 1 75 1 1 1 1 11 PHE HB2 . 11 PHE HB2 1 1 75 1 2 1 1 12 ALA H . 12 ALA H 1 1 76 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 76 1 2 1 1 12 ALA H . 12 ALA H 1 1 77 1 1 1 1 12 ALA MB . 12 ALA QB 1 1 77 1 2 1 1 13 ASN H . 13 ASN H 1 1 78 1 1 1 1 13 ASN HB2 . 13 ASN HB2 1 1 78 1 2 1 1 14 GLY H . 14 GLY H 1 1 79 1 1 1 1 13 ASN HB3 . 13 ASN HB3 1 1 79 1 2 1 1 14 GLY H . 14 GLY H 1 1 80 1 1 1 1 15 THR HB . 15 THR HB 1 1 80 1 2 1 1 16 VAL H . 16 VAL H 1 1 81 1 1 1 1 16 VAL HB . 16 VAL HB 1 1 81 1 2 1 1 17 TYR H . 17 TYR H 1 1 82 1 1 1 1 18 TYR HB2 . 18 TYR HB2 1 1 82 1 2 1 1 19 PHE H . 19 PHE H 1 1 83 1 1 1 1 19 PHE HB2 . 19 PHE HB2 1 1 83 1 2 1 1 20 ASN H . 20 ASN H 1 1 84 1 1 1 1 26 SER QB . 26 SER QB 1 1 84 1 2 1 1 27 GLN H . 27 GLN H 1 1 85 1 1 1 1 26 SER HB3 . 26 SER HB3 1 1 85 1 2 1 1 27 GLN H . 27 GLN H 1 1 86 1 1 1 1 31 PRO HB3 . 31 PRO HB3 1 1 86 1 2 1 1 32 SER H . 32 SER H 1 1 87 1 1 1 1 31 PRO HB2 . 31 PRO HB2 1 1 87 1 2 1 1 32 SER H . 32 SER H 1 1 88 1 1 1 1 8 LYS QG . 8 LYS QG 1 1 88 1 2 1 1 9 ARG H . 9 ARG H 1 1 89 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 89 1 2 1 1 12 ALA H . 12 ALA H 1 1 90 1 1 1 1 10 MET HA . 10 MET HA 1 1 90 1 2 1 1 11 PHE QD . 11 PHE QD 1 1 91 1 1 1 1 15 THR MG . 15 THR QG2 1 1 91 1 2 1 1 16 VAL H . 16 VAL H 1 1 92 1 1 1 1 15 THR HA . 15 THR HA 1 1 92 1 2 1 1 16 VAL MG2 . 16 VAL QG2 1 1 93 1 1 1 1 16 VAL MG1 . 16 VAL QG1 1 1 93 1 2 1 1 17 TYR H . 17 TYR H 1 1 94 1 1 1 1 16 VAL MG2 . 16 VAL QG2 1 1 94 1 2 1 1 17 TYR H . 17 TYR H 1 1 95 1 1 1 1 16 VAL HA . 16 VAL HA 1 1 95 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 96 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 96 1 2 1 1 18 TYR HA . 18 TYR HA 1 1 97 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 97 1 2 1 1 19 PHE H . 19 PHE H 1 1 98 1 1 1 1 21 HIS HD2 . 21 HIS HD2 1 1 98 1 2 1 1 22 ILE H . 22 ILE H 1 1 99 1 1 1 1 21 HIS HD2 . 21 HIS HD2 1 1 99 1 2 1 1 22 ILE HA . 22 ILE HA 1 1 100 1 1 1 1 22 ILE MG . 22 ILE QG2 1 1 100 1 2 1 1 23 THR HA . 23 THR HA 1 1 101 1 1 1 1 27 GLN QG . 27 GLN QG 1 1 101 1 2 1 1 28 PHE H . 28 PHE H 1 1 102 1 1 1 1 28 PHE QD . 28 PHE QD 1 1 102 1 2 1 1 29 GLU H . 29 GLU H 1 1 103 1 1 1 1 31 PRO HG2 . 31 PRO HG2 1 1 103 1 2 1 1 32 SER H . 32 SER H 1 1 104 1 1 1 1 11 PHE H . 11 PHE H 1 1 104 1 2 1 1 17 TYR H . 17 TYR H 1 1 105 1 1 1 1 12 ALA HA . 12 ALA HA 1 1 105 1 2 1 1 14 GLY H . 14 GLY H 1 1 106 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 106 1 2 1 1 26 SER HA . 26 SER HA 1 1 107 1 1 1 1 7 GLU HB2 . 7 GLU HB2 1 1 107 1 2 1 1 19 PHE H . 19 PHE H 1 1 108 1 1 1 1 9 ARG H . 9 ARG H 1 1 108 1 2 1 1 16 VAL MG1 . 16 VAL QG1 1 1 109 1 1 1 1 9 ARG H . 9 ARG H 1 1 109 1 2 1 1 16 VAL MG2 . 16 VAL QG2 1 1 110 1 1 1 1 9 ARG H . 9 ARG H 1 1 110 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 111 1 1 1 1 9 ARG H . 9 ARG H 1 1 111 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 112 1 1 1 1 9 ARG H . 9 ARG H 1 1 112 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 113 1 1 1 1 10 MET HA . 10 MET HA 1 1 113 1 2 1 1 16 VAL MG1 . 16 VAL QG1 1 1 114 1 1 1 1 10 MET HA . 10 MET HA 1 1 114 1 2 1 1 16 VAL MG2 . 16 VAL QG2 1 1 115 1 1 1 1 10 MET HA . 10 MET HA 1 1 115 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 116 1 1 1 1 10 MET H . 10 MET H 1 1 116 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 117 1 1 1 1 10 MET HA . 10 MET HA 1 1 117 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 118 1 1 1 1 11 PHE H . 11 PHE H 1 1 118 1 2 1 1 15 THR HB . 15 THR HB 1 1 119 1 1 1 1 11 PHE H . 11 PHE H 1 1 119 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 120 1 1 1 1 11 PHE H . 11 PHE H 1 1 120 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 121 1 1 1 1 11 PHE HA . 11 PHE HA 1 1 121 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 122 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 122 1 2 1 1 13 ASN H . 13 ASN H 1 1 123 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 123 1 2 1 1 15 THR H . 15 THR H 1 1 124 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 124 1 2 1 1 15 THR HA . 15 THR HA 1 1 125 1 1 1 1 12 ALA MB . 12 ALA QB 1 1 125 1 2 1 1 14 GLY H . 14 GLY H 1 1 126 1 1 1 1 15 THR H . 15 THR H 1 1 126 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 127 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 127 1 2 1 1 18 TYR H . 18 TYR H 1 1 128 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 128 1 2 1 1 19 PHE HA . 19 PHE HA 1 1 129 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 129 1 2 1 1 26 SER HA . 26 SER HA 1 1 130 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 130 1 2 1 1 27 GLN H . 27 GLN H 1 1 131 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 131 1 2 1 1 19 PHE H . 19 PHE H 1 1 132 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 132 1 2 1 1 19 PHE HA . 19 PHE HA 1 1 133 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 133 1 2 1 1 26 SER HB2 . 26 SER HB2 1 1 134 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 134 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 135 1 1 1 1 19 PHE HB2 . 19 PHE HB2 1 1 135 1 2 1 1 26 SER HA . 26 SER HA 1 1 136 1 1 1 1 19 PHE HZ . 19 PHE HZ 1 1 136 1 2 1 1 24 ASN H . 24 ASN H 1 1 137 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 137 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 138 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 138 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 139 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 139 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 140 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 140 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 141 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 141 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 142 1 1 1 1 9 ARG HG3 . 9 ARG HG3 1 1 142 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 143 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 143 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 144 1 1 1 1 9 ARG HD2 . 9 ARG HD2 1 1 144 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 145 1 1 1 1 9 ARG HD3 . 9 ARG HD3 1 1 145 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 146 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 146 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 147 1 1 1 1 11 PHE HB2 . 11 PHE HB2 1 1 147 1 2 1 1 15 THR HB . 15 THR HB 1 1 148 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 148 1 2 1 1 15 THR HB . 15 THR HB 1 1 149 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 149 1 2 1 1 15 THR HB . 15 THR HB 1 1 150 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 150 1 2 1 1 15 THR MG . 15 THR QG2 1 1 151 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 151 1 2 1 1 17 TYR HB3 . 17 TYR HB3 1 1 152 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 152 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 153 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 153 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 154 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 154 1 2 1 1 15 THR HB . 15 THR HB 1 1 155 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 155 1 2 1 1 15 THR MG . 15 THR QG2 1 1 156 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 156 1 2 1 1 17 TYR QE . 17 TYR QE 1 1 157 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 157 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 158 1 1 1 1 11 PHE HZ . 11 PHE HZ 1 1 158 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 159 1 1 1 1 11 PHE HZ . 11 PHE HZ 1 1 159 1 2 1 1 28 PHE HZ . 28 PHE HZ 1 1 160 1 1 1 1 15 THR MG . 15 THR QG2 1 1 160 1 2 1 1 17 TYR QD . 17 TYR QD 1 1 161 1 1 1 1 15 THR MG . 15 THR QG2 1 1 161 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 162 1 1 1 1 15 THR MG . 15 THR QG2 1 1 162 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 163 1 1 1 1 15 THR MG . 15 THR QG2 1 1 163 1 2 1 1 28 PHE HZ . 28 PHE HZ 1 1 164 1 1 1 1 17 TYR HB2 . 17 TYR HB2 1 1 164 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 165 1 1 1 1 17 TYR HB3 . 17 TYR HB3 1 1 165 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 166 1 1 1 1 17 TYR HB3 . 17 TYR HB3 1 1 166 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 167 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 167 1 2 1 1 19 PHE HB3 . 19 PHE HB3 1 1 168 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 168 1 2 1 1 26 SER QB . 26 SER QB 1 1 169 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 169 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 170 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 170 1 2 1 1 28 PHE QD . 28 PHE QD 1 1 171 1 1 1 1 17 TYR QD . 17 TYR QD 1 1 171 1 2 1 1 28 PHE QE . 28 PHE QE 1 1 172 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 172 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 173 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 173 1 2 1 1 19 PHE QE . 19 PHE QE 1 1 174 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 174 1 2 1 1 19 PHE HB3 . 19 PHE HB3 1 1 175 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 175 1 2 1 1 19 PHE HB2 . 19 PHE HB2 1 1 176 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 176 1 2 1 1 26 SER QB . 26 SER QB 1 1 177 1 1 1 1 17 TYR QE . 17 TYR QE 1 1 177 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 178 1 1 1 1 19 PHE QD . 19 PHE QD 1 1 178 1 2 1 1 21 HIS HB3 . 21 HIS HB3 1 1 179 1 1 1 1 19 PHE QD . 19 PHE QD 1 1 179 1 2 1 1 21 HIS HB2 . 21 HIS HB2 1 1 180 1 1 1 1 19 PHE QD . 19 PHE QD 1 1 180 1 2 1 1 26 SER HB2 . 26 SER HB2 1 1 181 1 1 1 1 19 PHE QD . 19 PHE QD 1 1 181 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 182 1 1 1 1 19 PHE QE . 19 PHE QE 1 1 182 1 2 1 1 21 HIS HB3 . 21 HIS HB3 1 1 183 1 1 1 1 19 PHE QE . 19 PHE QE 1 1 183 1 2 1 1 21 HIS HB2 . 21 HIS HB2 1 1 184 1 1 1 1 19 PHE QE . 19 PHE QE 1 1 184 1 2 1 1 26 SER HB2 . 26 SER HB2 1 1 185 1 1 1 1 19 PHE QE . 19 PHE QE 1 1 185 1 2 1 1 26 SER HB3 . 26 SER HB3 1 1 186 1 1 1 1 7 GLU H . 7 GLU H 1 1 186 1 2 1 1 19 PHE H . 19 PHE H 1 1 187 1 1 1 1 7 GLU H . 7 GLU H 1 1 187 1 2 1 1 20 ASN HA . 20 ASN HA 1 1 188 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 188 1 2 1 1 19 PHE H . 19 PHE H 1 1 189 1 1 1 1 9 ARG H . 9 ARG H 1 1 189 1 2 1 1 17 TYR H . 17 TYR H 1 1 190 1 1 1 1 9 ARG H . 9 ARG H 1 1 190 1 2 1 1 18 TYR HA . 18 TYR HA 1 1 191 1 1 1 1 9 ARG H . 9 ARG H 1 1 191 1 2 1 1 19 PHE H . 19 PHE H 1 1 192 1 1 1 1 18 TYR H . 18 TYR H 1 1 192 1 2 1 1 27 GLN H . 27 GLN H 1 1 193 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 193 1 2 1 1 27 GLN H . 27 GLN H 1 1 194 1 1 1 1 20 ASN H . 20 ASN H 1 1 194 1 2 1 1 26 SER HA . 26 SER HA 1 1 195 1 1 1 1 5 GLY H . 5 GLY H 1 1 195 1 2 1 1 22 ILE MD . 22 ILE QD1 1 1 196 1 1 1 1 5 GLY HA2 . 5 GLY HA2 1 1 196 1 2 1 1 22 ILE MD . 22 ILE QD1 1 1 197 1 1 1 1 5 GLY HA3 . 5 GLY HA3 1 1 197 1 2 1 1 22 ILE MD . 22 ILE QD1 1 1 198 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 198 1 2 1 1 6 TRP H . 6 TRP H 1 1 199 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 199 1 2 1 1 6 TRP HA . 6 TRP HA 1 1 200 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 200 1 2 1 1 7 GLU HA . 7 GLU HA 1 1 201 1 1 1 1 8 LYS H . 8 LYS H 1 1 201 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 202 1 1 1 1 20 ASN H . 20 ASN H 1 1 202 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 203 1 1 1 1 20 ASN HB2 . 20 ASN HB2 1 1 203 1 2 1 1 25 ALA H . 25 ALA H 1 1 204 1 1 1 1 20 ASN HB3 . 20 ASN HB3 1 1 204 1 2 1 1 25 ALA H . 25 ALA H 1 1 205 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 205 1 2 1 1 30 ARG H . 30 ARG H 1 1 206 1 1 1 1 2 LEU HG . 2 LEU HG 1 1 206 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 207 1 1 1 1 2 LEU MD2 . 2 LEU QD2 1 1 207 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 208 1 1 1 1 2 LEU MD2 . 2 LEU QD2 1 1 208 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 209 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 209 1 2 1 1 6 TRP HB3 . 6 TRP HB3 1 1 210 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 210 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 211 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 211 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 212 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 212 1 2 1 1 30 ARG QB . 30 ARG QB 1 1 213 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 213 1 2 1 1 30 ARG QB . 30 ARG QB 1 1 214 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 214 1 2 1 1 30 ARG HG3 . 30 ARG HG3 1 1 215 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 215 1 2 1 1 31 PRO HG3 . 31 PRO HG3 1 1 216 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 216 1 2 1 1 31 PRO HG2 . 31 PRO HG2 1 1 217 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 217 1 2 1 1 31 PRO HG3 . 31 PRO HG3 1 1 218 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 218 1 2 1 1 31 PRO HD3 . 31 PRO HD3 1 1 219 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 219 1 2 1 1 31 PRO HD3 . 31 PRO HD3 1 1 220 1 1 1 1 20 ASN HB2 . 20 ASN HB2 1 1 220 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 221 1 1 1 1 23 THR HB . 23 THR HB 1 1 221 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 222 1 1 1 1 23 THR HG1 . 23 THR HG1 1 1 222 1 2 1 1 25 ALA MB . 25 ALA QB 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.5 1 1 2 1 . . . . . . . 3.5 1 1 3 1 . . . . . . . 4.0 1 1 4 1 . . . . . . . 3.5 1 1 5 1 . . . . . . . 4.0 1 1 6 1 . . . . . . . 4.0 1 1 7 1 . . . . . . . 4.0 1 1 8 1 . . . . . . . 3.5 1 1 9 1 . . . . . . . 4.0 1 1 10 1 . . . . . . . 4.0 1 1 11 1 . . . . . . . 4.0 1 1 12 1 . . . . . . . 4.0 1 1 13 1 . . . . . . . 3.5 1 1 14 1 . . . . . . . 4.0 1 1 15 1 . . . . . . . 4.0 1 1 16 1 . . . . . . . 4.0 1 1 17 1 . . . . . . . 4.0 1 1 18 1 . . . . . . . 4.5 1 1 19 1 . . . . . . . 4.5 1 1 20 1 . . . . . . . 4.0 1 1 21 1 . . . . . . . 3.5 1 1 22 1 . . . . . . . 4.5 1 1 23 1 . . . . . . . 4.0 1 1 24 1 . . . . . . . 5.0 1 1 25 1 . . . . . . . 3.5 1 1 26 1 . . . . . . . 4.0 1 1 27 1 . . . . . . . 5.0 1 1 28 1 . . . . . . . 3.5 1 1 29 1 . . . . . . . 5.6 1 1 30 1 . . . . . . . 5.0 1 1 31 1 . . . . . . . 4.0 1 1 32 1 . . . . . . . 5.0 1 1 33 1 . . . . . . . 5.0 1 1 34 1 . . . . . . . 5.0 1 1 35 1 . . . . . . . 5.0 1 1 36 1 . . . . . . . 4.5 1 1 37 1 . . . . . . . 5.0 1 1 38 1 . . . . . . . 5.0 1 1 39 1 . . . . . . . 4.5 1 1 40 1 . . . . . . . 4.0 1 1 41 1 . . . . . . . 5.0 1 1 42 1 . . . . . . . 5.0 1 1 43 1 . . . . . . . 5.0 1 1 44 1 . . . . . . . 5.0 1 1 45 1 . . . . . . . 5.0 1 1 46 1 . . . . . . . 4.0 1 1 47 1 . . . . . . . 4.0 1 1 48 1 . . . . . . . 3.0 1 1 49 1 . . . . . . . 3.0 1 1 50 1 . . . . . . . 3.0 1 1 51 1 . . . . . . . 3.0 1 1 52 1 . . . . . . . 3.0 1 1 53 1 . . . . . . . 4.0 1 1 54 1 . . . . . . . 4.5 1 1 55 1 . . . . . . . 4.0 1 1 56 1 . . . . . . . 4.0 1 1 57 1 . . . . . . . 3.0 1 1 58 1 . . . . . . . 3.0 1 1 59 1 . . . . . . . 3.0 1 1 60 1 . . . . . . . 3.0 1 1 61 1 . . . . . . . 3.0 1 1 62 1 . . . . . . . 4.0 1 1 63 1 . . . . . . . 4.0 1 1 64 1 . . . . . . . 4.0 1 1 65 1 . . . . . . . 3.0 1 1 66 1 . . . . . . . 3.0 1 1 67 1 . . . . . . . 3.0 1 1 68 1 . . . . . . . 4.0 1 1 69 1 . . . . . . . 3.0 1 1 70 1 . . . . . . . 3.0 1 1 71 1 . . . . . . . 3.5 1 1 72 1 . . . . . . . 5.0 1 1 73 1 . . . . . . . 4.5 1 1 74 1 . . . . . . . 4.5 1 1 75 1 . . . . . . . 4.5 1 1 76 1 . . . . . . . 4.5 1 1 77 1 . . . . . . . 5.0 1 1 78 1 . . . . . . . 4.5 1 1 79 1 . . . . . . . 5.0 1 1 80 1 . . . . . . . 4.5 1 1 81 1 . . . . . . . 4.5 1 1 82 1 . . . . . . . 4.5 1 1 83 1 . . . . . . . 4.5 1 1 84 1 . . . . . . . 4.0 1 1 85 1 . . . . . . . 4.5 1 1 86 1 . . . . . . . 4.0 1 1 87 1 . . . . . . . 4.0 1 1 88 1 . . . . . . . 4.5 1 1 89 1 . . . . . . . 5.0 1 1 90 1 . . . . . . . 5.0 1 1 91 1 . . . . . . . 5.0 1 1 92 1 . . . . . . . 5.0 1 1 93 1 . . . . . . . 5.0 1 1 94 1 . . . . . . . 4.5 1 1 95 1 . . . . . . . 4.0 1 1 96 1 . . . . . . . 4.5 1 1 97 1 . . . . . . . 5.0 1 1 98 1 . . . . . . . 4.5 1 1 99 1 . . . . . . . 4.5 1 1 100 1 . . . . . . . 5.0 1 1 101 1 . . . . . . . 5.0 1 1 102 1 . . . . . . . 5.4 1 1 103 1 . . . . . . . 5.0 1 1 104 1 . . . . . . . 5.4 1 1 105 1 . . . . . . . 4.5 1 1 106 1 . . . . . . . 4.0 1 1 107 1 . . . . . . . 5.4 1 1 108 1 . . . . . . . 5.0 1 1 109 1 . . . . . . . 5.6 1 1 110 1 . . . . . . . 5.0 1 1 111 1 . . . . . . . 5.0 1 1 112 1 . . . . . . . 5.4 1 1 113 1 . . . . . . . 5.6 1 1 114 1 . . . . . . . 5.0 1 1 115 1 . . . . . . . 4.0 1 1 116 1 . . . . . . . 4.5 1 1 117 1 . . . . . . . 4.0 1 1 118 1 . . . . . . . 5.0 1 1 119 1 . . . . . . . 4.5 1 1 120 1 . . . . . . . 4.0 1 1 121 1 . . . . . . . 4.0 1 1 122 1 . . . . . . . 4.5 1 1 123 1 . . . . . . . 4.5 1 1 124 1 . . . . . . . 5.0 1 1 125 1 . . . . . . . 5.6 1 1 126 1 . . . . . . . 6.0 1 1 127 1 . . . . . . . 4.0 1 1 128 1 . . . . . . . 4.5 1 1 129 1 . . . . . . . 4.0 1 1 130 1 . . . . . . . 4.0 1 1 131 1 . . . . . . . 5.5 1 1 132 1 . . . . . . . 4.5 1 1 133 1 . . . . . . . 4.5 1 1 134 1 . . . . . . . 4.5 1 1 135 1 . . . . . . . 4.5 1 1 136 1 . . . . . . . 4.5 1 1 137 1 . . . . . . . 5.0 1 1 138 1 . . . . . . . 5.0 1 1 139 1 . . . . . . . 6.0 1 1 140 1 . . . . . . . 4.5 1 1 141 1 . . . . . . . 4.0 1 1 142 1 . . . . . . . 4.0 1 1 143 1 . . . . . . . 5.0 1 1 144 1 . . . . . . . 5.0 1 1 145 1 . . . . . . . 5.6 1 1 146 1 . . . . . . . 4.0 1 1 147 1 . . . . . . . 4.0 1 1 148 1 . . . . . . . 4.0 1 1 149 1 . . . . . . . 3.5 1 1 150 1 . . . . . . . 5.0 1 1 151 1 . . . . . . . 4.5 1 1 152 1 . . . . . . . 4.0 1 1 153 1 . . . . . . . 4.0 1 1 154 1 . . . . . . . 5.0 1 1 155 1 . . . . . . . 5.0 1 1 156 1 . . . . . . . 5.0 1 1 157 1 . . . . . . . 5.6 1 1 158 1 . . . . . . . 5.0 1 1 159 1 . . . . . . . 5.0 1 1 160 1 . . . . . . . 5.6 1 1 161 1 . . . . . . . 5.0 1 1 162 1 . . . . . . . 5.0 1 1 163 1 . . . . . . . 5.6 1 1 164 1 . . . . . . . 4.0 1 1 165 1 . . . . . . . 4.0 1 1 166 1 . . . . . . . 4.0 1 1 167 1 . . . . . . . 5.6 1 1 168 1 . . . . . . . 4.0 1 1 169 1 . . . . . . . 4.0 1 1 170 1 . . . . . . . 5.4 1 1 171 1 . . . . . . . 4.5 1 1 172 1 . . . . . . . 4.0 1 1 173 1 . . . . . . . 5.4 1 1 174 1 . . . . . . . 4.5 1 1 175 1 . . . . . . . 4.0 1 1 176 1 . . . . . . . 4.5 1 1 177 1 . . . . . . . 4.0 1 1 178 1 . . . . . . . 4.0 1 1 179 1 . . . . . . . 4.5 1 1 180 1 . . . . . . . 4.0 1 1 181 1 . . . . . . . 4.0 1 1 182 1 . . . . . . . 4.0 1 1 183 1 . . . . . . . 4.0 1 1 184 1 . . . . . . . 6.0 1 1 185 1 . . . . . . . 4.5 1 1 186 1 . . . . . . . 4.0 1 1 187 1 . . . . . . . 4.0 1 1 188 1 . . . . . . . 4.5 1 1 189 1 . . . . . . . 4.0 1 1 190 1 . . . . . . . 4.0 1 1 191 1 . . . . . . . 4.5 1 1 192 1 . . . . . . . 4.0 1 1 193 1 . . . . . . . 4.0 1 1 194 1 . . . . . . . 4.0 1 1 195 1 . . . . . . . 5.6 1 1 196 1 . . . . . . . 5.0 1 1 197 1 . . . . . . . 5.0 1 1 198 1 . . . . . . . 6.0 1 1 199 1 . . . . . . . 6.0 1 1 200 1 . . . . . . . 6.0 1 1 201 1 . . . . . . . 4.5 1 1 202 1 . . . . . . . 5.6 1 1 203 1 . . . . . . . 4.0 1 1 204 1 . . . . . . . 4.0 1 1 205 1 . . . . . . . 5.6 1 1 206 1 . . . . . . . 5.6 1 1 207 1 . . . . . . . 5.0 1 1 208 1 . . . . . . . 5.5 1 1 209 1 . . . . . . . 5.0 1 1 210 1 . . . . . . . 4.5 1 1 211 1 . . . . . . . 5.6 1 1 212 1 . . . . . . . 5.0 1 1 213 1 . . . . . . . 5.0 1 1 214 1 . . . . . . . 4.5 1 1 215 1 . . . . . . . 5.0 1 1 216 1 . . . . . . . 5.4 1 1 217 1 . . . . . . . 6.0 1 1 218 1 . . . . . . . 4.0 1 1 219 1 . . . . . . . 4.5 1 1 220 1 . . . . . . . 5.0 1 1 221 1 . . . . . . . 5.0 1 1 222 1 . . . . . . . 5.0 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 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 3 PRO O . 3 PRO O 1 2 1 1 2 1 1 6 TRP H . 6 TRP H 1 2 2 1 1 1 1 3 PRO O . 3 PRO O 1 2 2 1 2 1 1 6 TRP N . 6 TRP N 1 2 3 1 1 1 1 7 GLU H . 7 GLU H 1 2 3 1 2 1 1 19 PHE O . 19 PHE O 1 2 4 1 1 1 1 7 GLU N . 7 GLU N 1 2 4 1 2 1 1 19 PHE O . 19 PHE O 1 2 5 1 1 1 1 9 ARG H . 9 ARG H 1 2 5 1 2 1 1 17 TYR O . 17 TYR O 1 2 6 1 1 1 1 9 ARG N . 9 ARG N 1 2 6 1 2 1 1 17 TYR O . 17 TYR O 1 2 7 1 1 1 1 11 PHE H . 11 PHE H 1 2 7 1 2 1 1 15 THR O . 15 THR O 1 2 8 1 1 1 1 11 PHE N . 11 PHE N 1 2 8 1 2 1 1 15 THR O . 15 THR O 1 2 9 1 1 1 1 11 PHE O . 11 PHE O 1 2 9 1 2 1 1 14 GLY H . 14 GLY H 1 2 10 1 1 1 1 11 PHE O . 11 PHE O 1 2 10 1 2 1 1 14 GLY N . 14 GLY N 1 2 11 1 1 1 1 11 PHE O . 11 PHE O 1 2 11 1 2 1 1 15 THR H . 15 THR H 1 2 12 1 1 1 1 11 PHE O . 11 PHE O 1 2 12 1 2 1 1 15 THR N . 15 THR N 1 2 13 1 1 1 1 9 ARG O . 9 ARG O 1 2 13 1 2 1 1 17 TYR H . 17 TYR H 1 2 14 1 1 1 1 9 ARG O . 9 ARG O 1 2 14 1 2 1 1 17 TYR N . 17 TYR N 1 2 15 1 1 1 1 18 TYR H . 18 TYR H 1 2 15 1 2 1 1 27 GLN O . 27 GLN O 1 2 16 1 1 1 1 18 TYR N . 18 TYR N 1 2 16 1 2 1 1 27 GLN O . 27 GLN O 1 2 17 1 1 1 1 7 GLU O . 7 GLU O 1 2 17 1 2 1 1 19 PHE H . 19 PHE H 1 2 18 1 1 1 1 7 GLU O . 7 GLU O 1 2 18 1 2 1 1 19 PHE N . 19 PHE N 1 2 19 1 1 1 1 20 ASN H . 20 ASN H 1 2 19 1 2 1 1 25 ALA O . 25 ALA O 1 2 20 1 1 1 1 20 ASN N . 20 ASN N 1 2 20 1 2 1 1 25 ALA O . 25 ALA O 1 2 21 1 1 1 1 5 GLY O . 5 GLY O 1 2 21 1 2 1 1 21 HIS H . 21 HIS H 1 2 22 1 1 1 1 5 GLY O . 5 GLY O 1 2 22 1 2 1 1 21 HIS N . 21 HIS N 1 2 23 1 1 1 1 20 ASN OD1 . 20 ASN OD1 1 2 23 1 2 1 1 22 ILE H . 22 ILE H 1 2 24 1 1 1 1 20 ASN OD1 . 20 ASN OD1 1 2 24 1 2 1 1 22 ILE N . 22 ILE N 1 2 25 1 1 1 1 20 ASN OD1 . 20 ASN OD1 1 2 25 1 2 1 1 23 THR H . 23 THR H 1 2 26 1 1 1 1 20 ASN OD1 . 20 ASN OD1 1 2 26 1 2 1 1 23 THR N . 23 THR N 1 2 27 1 1 1 1 20 ASN O . 20 ASN O 1 2 27 1 2 1 1 24 ASN H . 24 ASN H 1 2 28 1 1 1 1 20 ASN O . 20 ASN O 1 2 28 1 2 1 1 24 ASN N . 24 ASN N 1 2 29 1 1 1 1 23 THR OG1 . 23 THR OG1 1 2 29 1 2 1 1 25 ALA H . 25 ALA H 1 2 30 1 1 1 1 23 THR OG1 . 23 THR OG1 1 2 30 1 2 1 1 25 ALA N . 25 ALA N 1 2 31 1 1 1 1 18 TYR O . 18 TYR O 1 2 31 1 2 1 1 27 GLN H . 27 GLN H 1 2 32 1 1 1 1 18 TYR O . 18 TYR O 1 2 32 1 2 1 1 27 GLN N . 27 GLN N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.5 1 2 2 1 . . . . . . . 3.6 1 2 3 1 . . . . . . . 2.2 1 2 4 1 . . . . . . . 3.0 1 2 5 1 . . . . . . . 2.4 1 2 6 1 . . . . . . . 3.4 1 2 7 1 . . . . . . . 2.4 1 2 8 1 . . . . . . . 3.4 1 2 9 1 . . . . . . . 2.4 1 2 10 1 . . . . . . . 3.4 1 2 11 1 . . . . . . . 3.2 1 2 12 1 . . . . . . . 3.8 1 2 13 1 . . . . . . . 2.3 1 2 14 1 . . . . . . . 3.3 1 2 15 1 . . . . . . . 2.3 1 2 16 1 . . . . . . . 3.3 1 2 17 1 . . . . . . . 2.2 1 2 18 1 . . . . . . . 3.0 1 2 19 1 . . . . . . . 2.3 1 2 20 1 . . . . . . . 3.3 1 2 21 1 . . . . . . . 2.3 1 2 22 1 . . . . . . . 3.3 1 2 23 1 . . . . . . . 2.3 1 2 24 1 . . . . . . . 3.3 1 2 25 1 . . . . . . . 2.3 1 2 26 1 . . . . . . . 3.3 1 2 27 1 . . . . . . . 2.3 1 2 28 1 . . . . . . . 3.3 1 2 29 1 . . . . . . . 2.2 1 2 30 1 . . . . . . . 3.2 1 2 31 1 . . . . . . . 2.4 1 2 32 1 . . . . . . . 3.4 1 2 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 -8.751 0.156 -3.414 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C -8.794 1.633 -3.030 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C -9.307 2.533 -4.168 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C -9.975 4.949 -4.763 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C -8.872 5.244 -5.793 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C -9.574 3.961 -3.655 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H -7.091 1.416 -1.869 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H -7.486 2.996 -2.141 1.00 . A A . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H -6.819 2.122 -3.335 1.00 . A A . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H -9.504 1.700 -2.206 1.00 . A A . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H -8.579 2.554 -4.978 1.00 . A A . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H -10.240 2.121 -4.555 1.00 . A A . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H -10.845 4.553 -5.288 1.00 . A A . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H -10.275 5.888 -4.295 1.00 . A A . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H -8.609 4.318 -6.313 1.00 . A A . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H -9.280 5.938 -6.534 1.00 . A A . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H -10.385 3.916 -2.927 1.00 . A A . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H -8.694 4.349 -3.142 1.00 . A A . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H -7.152 5.117 -4.638 1.00 . A A . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H -7.018 6.161 -5.885 1.00 . A A . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H -7.895 6.596 -4.557 1.00 . A A . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N -7.464 2.066 -2.545 1.00 . A A . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N -7.659 5.835 -5.177 1.00 . A A . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O -9.517 -0.603 -2.837 1.00 . A A . 1 LYS O 1 1 1 25 1 1 2 LEU C C -8.357 -2.358 -5.596 1.00 . A A . 2 LEU C 1 1 1 26 1 1 2 LEU CA C -7.391 -1.581 -4.675 1.00 . A A . 2 LEU CA 1 1 1 27 1 1 2 LEU CB C -7.078 -2.447 -3.436 1.00 . A A . 2 LEU CB 1 1 1 28 1 1 2 LEU CD1 C -5.700 -2.932 -1.411 1.00 . A A . 2 LEU CD1 1 1 1 29 1 1 2 LEU CD2 C -4.757 -1.432 -3.146 1.00 . A A . 2 LEU CD2 1 1 1 30 1 1 2 LEU CG C -6.044 -1.872 -2.455 1.00 . A A . 2 LEU CG 1 1 1 31 1 1 2 LEU H H -7.194 0.504 -4.669 1.00 . A A . 2 LEU H 1 1 1 32 1 1 2 LEU HA H -6.447 -1.469 -5.200 1.00 . A A . 2 LEU HA 1 1 1 33 1 1 2 LEU HB2 H -7.999 -2.647 -2.889 1.00 . A A . 2 LEU HB2 1 1 1 34 1 1 2 LEU HB3 H -6.716 -3.411 -3.786 1.00 . A A . 2 LEU HB3 1 1 1 35 1 1 2 LEU HD11 H -5.204 -3.776 -1.887 1.00 . A A . 2 LEU HD11 1 1 1 36 1 1 2 LEU HD12 H -5.034 -2.510 -0.665 1.00 . A A . 2 LEU HD12 1 1 1 37 1 1 2 LEU HD13 H -6.609 -3.283 -0.921 1.00 . A A . 2 LEU HD13 1 1 1 38 1 1 2 LEU HD21 H -4.051 -1.095 -2.393 1.00 . A A . 2 LEU HD21 1 1 1 39 1 1 2 LEU HD22 H -4.325 -2.256 -3.709 1.00 . A A . 2 LEU HD22 1 1 1 40 1 1 2 LEU HD23 H -4.944 -0.590 -3.812 1.00 . A A . 2 LEU HD23 1 1 1 41 1 1 2 LEU HG H -6.468 -1.009 -1.940 1.00 . A A . 2 LEU HG 1 1 1 42 1 1 2 LEU N N -7.804 -0.225 -4.284 1.00 . A A . 2 LEU N 1 1 1 43 1 1 2 LEU O O -9.487 -2.645 -5.202 1.00 . A A . 2 LEU O 1 1 1 44 1 1 3 PRO C C -8.591 -5.132 -7.098 1.00 . A A . 3 PRO C 1 1 1 45 1 1 3 PRO CA C -8.645 -3.688 -7.664 1.00 . A A . 3 PRO CA 1 1 1 46 1 1 3 PRO CB C -7.970 -3.612 -9.044 1.00 . A A . 3 PRO CB 1 1 1 47 1 1 3 PRO CD C -6.798 -2.163 -7.536 1.00 . A A . 3 PRO CD 1 1 1 48 1 1 3 PRO CG C -7.140 -2.332 -9.012 1.00 . A A . 3 PRO CG 1 1 1 49 1 1 3 PRO HA H -9.681 -3.358 -7.744 1.00 . A A . 3 PRO HA 1 1 1 50 1 1 3 PRO HB2 H -7.309 -4.466 -9.192 1.00 . A A . 3 PRO HB2 1 1 1 51 1 1 3 PRO HB3 H -8.708 -3.575 -9.845 1.00 . A A . 3 PRO HB3 1 1 1 52 1 1 3 PRO HD2 H -5.878 -2.694 -7.297 1.00 . A A . 3 PRO HD2 1 1 1 53 1 1 3 PRO HD3 H -6.686 -1.101 -7.312 1.00 . A A . 3 PRO HD3 1 1 1 54 1 1 3 PRO HG2 H -6.243 -2.411 -9.628 1.00 . A A . 3 PRO HG2 1 1 1 55 1 1 3 PRO HG3 H -7.755 -1.492 -9.338 1.00 . A A . 3 PRO HG3 1 1 1 56 1 1 3 PRO N N -7.911 -2.754 -6.807 1.00 . A A . 3 PRO N 1 1 1 57 1 1 3 PRO O O -7.848 -5.401 -6.147 1.00 . A A . 3 PRO O 1 1 1 58 1 1 4 PRO C C -7.761 -8.060 -7.294 1.00 . A A . 4 PRO C 1 1 1 59 1 1 4 PRO CA C -9.204 -7.524 -7.361 1.00 . A A . 4 PRO CA 1 1 1 60 1 1 4 PRO CB C -10.029 -8.261 -8.422 1.00 . A A . 4 PRO CB 1 1 1 61 1 1 4 PRO CD C -10.286 -5.913 -8.763 1.00 . A A . 4 PRO CD 1 1 1 62 1 1 4 PRO CG C -11.068 -7.222 -8.840 1.00 . A A . 4 PRO CG 1 1 1 63 1 1 4 PRO HA H -9.684 -7.661 -6.391 1.00 . A A . 4 PRO HA 1 1 1 64 1 1 4 PRO HB2 H -9.405 -8.509 -9.282 1.00 . A A . 4 PRO HB2 1 1 1 65 1 1 4 PRO HB3 H -10.497 -9.159 -8.018 1.00 . A A . 4 PRO HB3 1 1 1 66 1 1 4 PRO HD2 H -9.773 -5.742 -9.711 1.00 . A A . 4 PRO HD2 1 1 1 67 1 1 4 PRO HD3 H -10.961 -5.086 -8.541 1.00 . A A . 4 PRO HD3 1 1 1 68 1 1 4 PRO HG2 H -11.449 -7.409 -9.844 1.00 . A A . 4 PRO HG2 1 1 1 69 1 1 4 PRO HG3 H -11.883 -7.205 -8.114 1.00 . A A . 4 PRO HG3 1 1 1 70 1 1 4 PRO N N -9.302 -6.103 -7.707 1.00 . A A . 4 PRO N 1 1 1 71 1 1 4 PRO O O -6.963 -7.868 -8.213 1.00 . A A . 4 PRO O 1 1 1 72 1 1 5 GLY C C -5.014 -8.609 -5.417 1.00 . A A . 5 GLY C 1 1 1 73 1 1 5 GLY CA C -6.157 -9.450 -5.997 1.00 . A A . 5 GLY CA 1 1 1 74 1 1 5 GLY H H -8.119 -8.842 -5.460 1.00 . A A . 5 GLY H 1 1 1 75 1 1 5 GLY HA2 H -6.322 -10.295 -5.329 1.00 . A A . 5 GLY HA2 1 1 1 76 1 1 5 GLY HA3 H -5.818 -9.840 -6.956 1.00 . A A . 5 GLY HA3 1 1 1 77 1 1 5 GLY N N -7.432 -8.749 -6.193 1.00 . A A . 5 GLY N 1 1 1 78 1 1 5 GLY O O -3.963 -9.171 -5.112 1.00 . A A . 5 GLY O 1 1 1 79 1 1 6 TRP C C -4.364 -6.350 -3.132 1.00 . A A . 6 TRP C 1 1 1 80 1 1 6 TRP CA C -4.224 -6.379 -4.662 1.00 . A A . 6 TRP CA 1 1 1 81 1 1 6 TRP CB C -4.438 -4.980 -5.245 1.00 . A A . 6 TRP CB 1 1 1 82 1 1 6 TRP CD1 C -4.990 -5.179 -7.714 1.00 . A A . 6 TRP CD1 1 1 1 83 1 1 6 TRP CD2 C -3.015 -4.187 -7.357 1.00 . A A . 6 TRP CD2 1 1 1 84 1 1 6 TRP CE2 C -3.233 -4.186 -8.768 1.00 . A A . 6 TRP CE2 1 1 1 85 1 1 6 TRP CE3 C -1.798 -3.644 -6.896 1.00 . A A . 6 TRP CE3 1 1 1 86 1 1 6 TRP CG C -4.165 -4.809 -6.710 1.00 . A A . 6 TRP CG 1 1 1 87 1 1 6 TRP CH2 C -1.107 -3.116 -9.183 1.00 . A A . 6 TRP CH2 1 1 1 88 1 1 6 TRP CZ2 C -2.306 -3.654 -9.676 1.00 . A A . 6 TRP CZ2 1 1 1 89 1 1 6 TRP CZ3 C -0.855 -3.128 -7.801 1.00 . A A . 6 TRP CZ3 1 1 1 90 1 1 6 TRP H H -6.083 -6.867 -5.510 1.00 . A A . 6 TRP H 1 1 1 91 1 1 6 TRP HA H -3.217 -6.697 -4.907 1.00 . A A . 6 TRP HA 1 1 1 92 1 1 6 TRP HB2 H -5.466 -4.678 -5.059 1.00 . A A . 6 TRP HB2 1 1 1 93 1 1 6 TRP HB3 H -3.793 -4.293 -4.704 1.00 . A A . 6 TRP HB3 1 1 1 94 1 1 6 TRP HD1 H -5.946 -5.665 -7.579 1.00 . A A . 6 TRP HD1 1 1 1 95 1 1 6 TRP HE1 H -4.897 -4.977 -9.821 1.00 . A A . 6 TRP HE1 1 1 1 96 1 1 6 TRP HE3 H -1.586 -3.635 -5.838 1.00 . A A . 6 TRP HE3 1 1 1 97 1 1 6 TRP HH2 H -0.375 -2.702 -9.863 1.00 . A A . 6 TRP HH2 1 1 1 98 1 1 6 TRP HZ2 H -2.507 -3.669 -10.737 1.00 . A A . 6 TRP HZ2 1 1 1 99 1 1 6 TRP HZ3 H 0.072 -2.735 -7.425 1.00 . A A . 6 TRP HZ3 1 1 1 100 1 1 6 TRP N N -5.196 -7.290 -5.268 1.00 . A A . 6 TRP N 1 1 1 101 1 1 6 TRP NE1 N -4.448 -4.814 -8.930 1.00 . A A . 6 TRP NE1 1 1 1 102 1 1 6 TRP O O -5.472 -6.201 -2.620 1.00 . A A . 6 TRP O 1 1 1 103 1 1 7 GLU C C -1.940 -5.911 -0.353 1.00 . A A . 7 GLU C 1 1 1 104 1 1 7 GLU CA C -3.238 -6.543 -0.927 1.00 . A A . 7 GLU CA 1 1 1 105 1 1 7 GLU CB C -3.453 -8.025 -0.558 1.00 . A A . 7 GLU CB 1 1 1 106 1 1 7 GLU CD C -3.060 -8.037 1.954 1.00 . A A . 7 GLU CD 1 1 1 107 1 1 7 GLU CG C -4.051 -8.306 0.827 1.00 . A A . 7 GLU CG 1 1 1 108 1 1 7 GLU H H -2.360 -6.669 -2.858 1.00 . A A . 7 GLU H 1 1 1 109 1 1 7 GLU HA H -4.085 -5.969 -0.546 1.00 . A A . 7 GLU HA 1 1 1 110 1 1 7 GLU HB2 H -4.158 -8.457 -1.270 1.00 . A A . 7 GLU HB2 1 1 1 111 1 1 7 GLU HB3 H -2.518 -8.560 -0.686 1.00 . A A . 7 GLU HB3 1 1 1 112 1 1 7 GLU HG2 H -4.951 -7.701 0.956 1.00 . A A . 7 GLU HG2 1 1 1 113 1 1 7 GLU HG3 H -4.350 -9.356 0.867 1.00 . A A . 7 GLU HG3 1 1 1 114 1 1 7 GLU N N -3.249 -6.478 -2.399 1.00 . A A . 7 GLU N 1 1 1 115 1 1 7 GLU O O -0.940 -5.799 -1.061 1.00 . A A . 7 GLU O 1 1 1 116 1 1 7 GLU OE1 O -2.040 -8.765 2.001 1.00 . A A . 7 GLU OE1 1 1 1 117 1 1 7 GLU OE2 O -3.287 -7.040 2.675 1.00 . A A . 7 GLU OE2 1 1 1 118 1 1 8 LYS C C 0.439 -5.393 1.769 1.00 . A A . 8 LYS C 1 1 1 119 1 1 8 LYS CA C -0.891 -4.648 1.557 1.00 . A A . 8 LYS CA 1 1 1 120 1 1 8 LYS CB C -1.465 -4.169 2.903 1.00 . A A . 8 LYS CB 1 1 1 121 1 1 8 LYS CD C -1.339 -2.619 4.882 1.00 . A A . 8 LYS CD 1 1 1 122 1 1 8 LYS CE C -0.582 -1.484 5.578 1.00 . A A . 8 LYS CE 1 1 1 123 1 1 8 LYS CG C -0.661 -3.040 3.568 1.00 . A A . 8 LYS CG 1 1 1 124 1 1 8 LYS H H -2.673 -5.786 1.547 1.00 . A A . 8 LYS H 1 1 1 125 1 1 8 LYS HA H -0.695 -3.779 0.929 1.00 . A A . 8 LYS HA 1 1 1 126 1 1 8 LYS HB2 H -2.482 -3.809 2.741 1.00 . A A . 8 LYS HB2 1 1 1 127 1 1 8 LYS HB3 H -1.522 -5.020 3.585 1.00 . A A . 8 LYS HB3 1 1 1 128 1 1 8 LYS HD2 H -2.372 -2.318 4.695 1.00 . A A . 8 LYS HD2 1 1 1 129 1 1 8 LYS HD3 H -1.353 -3.482 5.551 1.00 . A A . 8 LYS HD3 1 1 1 130 1 1 8 LYS HE2 H -0.829 -1.504 6.643 1.00 . A A . 8 LYS HE2 1 1 1 131 1 1 8 LYS HE3 H 0.491 -1.667 5.474 1.00 . A A . 8 LYS HE3 1 1 1 132 1 1 8 LYS HG2 H 0.349 -3.387 3.786 1.00 . A A . 8 LYS HG2 1 1 1 133 1 1 8 LYS HG3 H -0.600 -2.186 2.893 1.00 . A A . 8 LYS HG3 1 1 1 134 1 1 8 LYS HZ1 H -0.901 -0.141 4.011 1.00 . A A . 8 LYS HZ1 1 1 1 135 1 1 8 LYS HZ2 H -1.892 0.118 5.279 1.00 . A A . 8 LYS HZ2 1 1 1 136 1 1 8 LYS HZ3 H -0.329 0.565 5.393 1.00 . A A . 8 LYS HZ3 1 1 1 137 1 1 8 LYS N N -1.940 -5.458 0.910 1.00 . A A . 8 LYS N 1 1 1 138 1 1 8 LYS NZ N -0.932 -0.155 5.027 1.00 . A A . 8 LYS NZ 1 1 1 139 1 1 8 LYS O O 0.460 -6.556 2.167 1.00 . A A . 8 LYS O 1 1 1 140 1 1 9 ARG C C 3.815 -3.970 2.307 1.00 . A A . 9 ARG C 1 1 1 141 1 1 9 ARG CA C 2.952 -5.130 1.774 1.00 . A A . 9 ARG CA 1 1 1 142 1 1 9 ARG CB C 3.564 -5.595 0.438 1.00 . A A . 9 ARG CB 1 1 1 143 1 1 9 ARG CD C 2.739 -8.045 0.363 1.00 . A A . 9 ARG CD 1 1 1 144 1 1 9 ARG CG C 2.865 -6.696 -0.365 1.00 . A A . 9 ARG CG 1 1 1 145 1 1 9 ARG CZ C 0.711 -9.449 -0.197 1.00 . A A . 9 ARG CZ 1 1 1 146 1 1 9 ARG H H 1.468 -3.727 1.237 1.00 . A A . 9 ARG H 1 1 1 147 1 1 9 ARG HA H 2.977 -5.943 2.501 1.00 . A A . 9 ARG HA 1 1 1 148 1 1 9 ARG HB2 H 3.602 -4.715 -0.199 1.00 . A A . 9 ARG HB2 1 1 1 149 1 1 9 ARG HB3 H 4.587 -5.930 0.612 1.00 . A A . 9 ARG HB3 1 1 1 150 1 1 9 ARG HD2 H 3.338 -8.784 -0.172 1.00 . A A . 9 ARG HD2 1 1 1 151 1 1 9 ARG HD3 H 3.162 -7.955 1.364 1.00 . A A . 9 ARG HD3 1 1 1 152 1 1 9 ARG HE H 0.796 -8.042 1.216 1.00 . A A . 9 ARG HE 1 1 1 153 1 1 9 ARG HG2 H 1.906 -6.318 -0.717 1.00 . A A . 9 ARG HG2 1 1 1 154 1 1 9 ARG HG3 H 3.476 -6.876 -1.248 1.00 . A A . 9 ARG HG3 1 1 1 155 1 1 9 ARG HH11 H 2.143 -9.774 -1.562 1.00 . A A . 9 ARG HH11 1 1 1 156 1 1 9 ARG HH12 H 0.673 -10.733 -1.719 1.00 . A A . 9 ARG HH12 1 1 1 157 1 1 9 ARG HH21 H -0.982 -9.414 0.950 1.00 . A A . 9 ARG HH21 1 1 1 158 1 1 9 ARG HH22 H -0.993 -10.467 -0.468 1.00 . A A . 9 ARG HH22 1 1 1 159 1 1 9 ARG N N 1.561 -4.689 1.564 1.00 . A A . 9 ARG N 1 1 1 160 1 1 9 ARG NE N 1.345 -8.509 0.491 1.00 . A A . 9 ARG NE 1 1 1 161 1 1 9 ARG NH1 N 1.229 -10.040 -1.247 1.00 . A A . 9 ARG NH1 1 1 1 162 1 1 9 ARG NH2 N -0.485 -9.842 0.145 1.00 . A A . 9 ARG NH2 1 1 1 163 1 1 9 ARG O O 3.354 -2.830 2.413 1.00 . A A . 9 ARG O 1 1 1 164 1 1 10 MET C C 7.515 -3.669 2.513 1.00 . A A . 10 MET C 1 1 1 165 1 1 10 MET CA C 6.100 -3.236 2.923 1.00 . A A . 10 MET CA 1 1 1 166 1 1 10 MET CB C 6.008 -2.920 4.429 1.00 . A A . 10 MET CB 1 1 1 167 1 1 10 MET CE C 8.518 -5.425 6.702 1.00 . A A . 10 MET CE 1 1 1 168 1 1 10 MET CG C 6.539 -4.011 5.370 1.00 . A A . 10 MET CG 1 1 1 169 1 1 10 MET H H 5.464 -5.174 2.417 1.00 . A A . 10 MET H 1 1 1 170 1 1 10 MET HA H 5.865 -2.324 2.379 1.00 . A A . 10 MET HA 1 1 1 171 1 1 10 MET HB2 H 6.553 -1.998 4.626 1.00 . A A . 10 MET HB2 1 1 1 172 1 1 10 MET HB3 H 4.963 -2.739 4.680 1.00 . A A . 10 MET HB3 1 1 1 173 1 1 10 MET HE1 H 8.211 -6.298 6.127 1.00 . A A . 10 MET HE1 1 1 1 174 1 1 10 MET HE2 H 9.564 -5.532 6.991 1.00 . A A . 10 MET HE2 1 1 1 175 1 1 10 MET HE3 H 7.903 -5.342 7.599 1.00 . A A . 10 MET HE3 1 1 1 176 1 1 10 MET HG2 H 6.031 -3.906 6.329 1.00 . A A . 10 MET HG2 1 1 1 177 1 1 10 MET HG3 H 6.287 -4.992 4.965 1.00 . A A . 10 MET HG3 1 1 1 178 1 1 10 MET N N 5.107 -4.238 2.538 1.00 . A A . 10 MET N 1 1 1 179 1 1 10 MET O O 7.860 -4.850 2.541 1.00 . A A . 10 MET O 1 1 1 180 1 1 10 MET SD S 8.324 -3.935 5.692 1.00 . A A . 10 MET SD 1 1 1 181 1 1 11 PHE C C 10.522 -2.609 3.025 1.00 . A A . 11 PHE C 1 1 1 182 1 1 11 PHE CA C 9.713 -2.784 1.733 1.00 . A A . 11 PHE CA 1 1 1 183 1 1 11 PHE CB C 10.075 -1.673 0.738 1.00 . A A . 11 PHE CB 1 1 1 184 1 1 11 PHE CD1 C 9.880 -2.842 -1.496 1.00 . A A . 11 PHE CD1 1 1 1 185 1 1 11 PHE CD2 C 8.572 -0.818 -1.129 1.00 . A A . 11 PHE CD2 1 1 1 186 1 1 11 PHE CE1 C 9.382 -2.932 -2.808 1.00 . A A . 11 PHE CE1 1 1 1 187 1 1 11 PHE CE2 C 8.093 -0.900 -2.450 1.00 . A A . 11 PHE CE2 1 1 1 188 1 1 11 PHE CG C 9.469 -1.794 -0.647 1.00 . A A . 11 PHE CG 1 1 1 189 1 1 11 PHE CZ C 8.489 -1.958 -3.285 1.00 . A A . 11 PHE CZ 1 1 1 190 1 1 11 PHE H H 7.902 -1.762 1.997 1.00 . A A . 11 PHE H 1 1 1 191 1 1 11 PHE HA H 9.939 -3.748 1.281 1.00 . A A . 11 PHE HA 1 1 1 192 1 1 11 PHE HB2 H 9.815 -0.704 1.167 1.00 . A A . 11 PHE HB2 1 1 1 193 1 1 11 PHE HB3 H 11.152 -1.689 0.606 1.00 . A A . 11 PHE HB3 1 1 1 194 1 1 11 PHE HD1 H 10.601 -3.569 -1.156 1.00 . A A . 11 PHE HD1 1 1 1 195 1 1 11 PHE HD2 H 8.247 0.001 -0.502 1.00 . A A . 11 PHE HD2 1 1 1 196 1 1 11 PHE HE1 H 9.694 -3.739 -3.455 1.00 . A A . 11 PHE HE1 1 1 1 197 1 1 11 PHE HE2 H 7.414 -0.157 -2.834 1.00 . A A . 11 PHE HE2 1 1 1 198 1 1 11 PHE HZ H 8.106 -2.017 -4.294 1.00 . A A . 11 PHE HZ 1 1 1 199 1 1 11 PHE N N 8.293 -2.696 2.039 1.00 . A A . 11 PHE N 1 1 1 200 1 1 11 PHE O O 10.293 -1.647 3.761 1.00 . A A . 11 PHE O 1 1 1 201 1 1 12 ALA C C 13.091 -2.236 4.770 1.00 . A A . 12 ALA C 1 1 1 202 1 1 12 ALA CA C 12.275 -3.522 4.521 1.00 . A A . 12 ALA CA 1 1 1 203 1 1 12 ALA CB C 13.188 -4.753 4.492 1.00 . A A . 12 ALA CB 1 1 1 204 1 1 12 ALA H H 11.632 -4.274 2.648 1.00 . A A . 12 ALA H 1 1 1 205 1 1 12 ALA HA H 11.588 -3.631 5.362 1.00 . A A . 12 ALA HA 1 1 1 206 1 1 12 ALA HB1 H 13.888 -4.684 3.658 1.00 . A A . 12 ALA HB1 1 1 1 207 1 1 12 ALA HB2 H 13.751 -4.812 5.425 1.00 . A A . 12 ALA HB2 1 1 1 208 1 1 12 ALA HB3 H 12.588 -5.659 4.388 1.00 . A A . 12 ALA HB3 1 1 1 209 1 1 12 ALA N N 11.483 -3.506 3.285 1.00 . A A . 12 ALA N 1 1 1 210 1 1 12 ALA O O 13.331 -1.877 5.919 1.00 . A A . 12 ALA O 1 1 1 211 1 1 13 ASN C C 13.046 0.943 4.148 1.00 . A A . 13 ASN C 1 1 1 212 1 1 13 ASN CA C 14.056 -0.167 3.761 1.00 . A A . 13 ASN CA 1 1 1 213 1 1 13 ASN CB C 14.804 0.115 2.437 1.00 . A A . 13 ASN CB 1 1 1 214 1 1 13 ASN CG C 13.973 -0.141 1.184 1.00 . A A . 13 ASN CG 1 1 1 215 1 1 13 ASN H H 13.276 -1.857 2.774 1.00 . A A . 13 ASN H 1 1 1 216 1 1 13 ASN HA H 14.801 -0.166 4.559 1.00 . A A . 13 ASN HA 1 1 1 217 1 1 13 ASN HB2 H 15.167 1.143 2.439 1.00 . A A . 13 ASN HB2 1 1 1 218 1 1 13 ASN HB3 H 15.676 -0.536 2.384 1.00 . A A . 13 ASN HB3 1 1 1 219 1 1 13 ASN HD21 H 14.108 1.818 0.608 1.00 . A A . 13 ASN HD21 1 1 1 220 1 1 13 ASN N N 13.466 -1.509 3.710 1.00 . A A . 13 ASN N 1 1 1 221 1 1 13 ASN ND2 N 13.739 0.891 0.380 1.00 . A A . 13 ASN ND2 1 1 1 222 1 1 13 ASN O O 13.410 2.116 4.155 1.00 . A A . 13 ASN O 1 1 1 223 1 1 13 ASN OD1 O 13.513 -1.262 0.983 1.00 . A A . 13 ASN OD1 1 1 1 224 1 1 14 GLY C C 9.829 2.113 4.055 1.00 . A A . 14 GLY C 1 1 1 225 1 1 14 GLY CA C 10.786 1.474 5.057 1.00 . A A . 14 GLY CA 1 1 1 226 1 1 14 GLY H H 11.513 -0.382 4.374 1.00 . A A . 14 GLY H 1 1 1 227 1 1 14 GLY HA2 H 10.194 0.893 5.765 1.00 . A A . 14 GLY HA2 1 1 1 228 1 1 14 GLY HA3 H 11.283 2.270 5.613 1.00 . A A . 14 GLY HA3 1 1 1 229 1 1 14 GLY N N 11.792 0.591 4.469 1.00 . A A . 14 GLY N 1 1 1 230 1 1 14 GLY O O 9.795 3.338 3.941 1.00 . A A . 14 GLY O 1 1 1 231 1 1 15 THR C C 6.816 0.917 2.272 1.00 . A A . 15 THR C 1 1 1 232 1 1 15 THR CA C 7.951 1.915 2.483 1.00 . A A . 15 THR CA 1 1 1 233 1 1 15 THR CB C 8.524 2.425 1.151 1.00 . A A . 15 THR CB 1 1 1 234 1 1 15 THR CG2 C 7.484 2.917 0.149 1.00 . A A . 15 THR CG2 1 1 1 235 1 1 15 THR H H 9.105 0.319 3.340 1.00 . A A . 15 THR H 1 1 1 236 1 1 15 THR HA H 7.526 2.772 2.998 1.00 . A A . 15 THR HA 1 1 1 237 1 1 15 THR HB H 9.132 1.646 0.693 1.00 . A A . 15 THR HB 1 1 1 238 1 1 15 THR HG1 H 9.526 3.556 2.383 1.00 . A A . 15 THR HG1 1 1 1 239 1 1 15 THR HG21 H 6.837 2.098 -0.162 1.00 . A A . 15 THR HG21 1 1 1 240 1 1 15 THR HG22 H 6.884 3.709 0.597 1.00 . A A . 15 THR HG22 1 1 1 241 1 1 15 THR HG23 H 8.000 3.317 -0.725 1.00 . A A . 15 THR HG23 1 1 1 242 1 1 15 THR N N 9.030 1.334 3.310 1.00 . A A . 15 THR N 1 1 1 243 1 1 15 THR O O 7.066 -0.229 1.916 1.00 . A A . 15 THR O 1 1 1 244 1 1 15 THR OG1 O 9.332 3.546 1.415 1.00 . A A . 15 THR OG1 1 1 1 245 1 1 16 VAL C C 3.788 0.622 0.937 1.00 . A A . 16 VAL C 1 1 1 246 1 1 16 VAL CA C 4.368 0.504 2.343 1.00 . A A . 16 VAL CA 1 1 1 247 1 1 16 VAL CB C 3.330 0.919 3.410 1.00 . A A . 16 VAL CB 1 1 1 248 1 1 16 VAL CG1 C 1.877 0.525 3.104 1.00 . A A . 16 VAL CG1 1 1 1 249 1 1 16 VAL CG2 C 3.699 0.269 4.749 1.00 . A A . 16 VAL CG2 1 1 1 250 1 1 16 VAL H H 5.404 2.325 2.673 1.00 . A A . 16 VAL H 1 1 1 251 1 1 16 VAL HA H 4.632 -0.538 2.512 1.00 . A A . 16 VAL HA 1 1 1 252 1 1 16 VAL HB H 3.358 2.004 3.526 1.00 . A A . 16 VAL HB 1 1 1 253 1 1 16 VAL HG11 H 1.791 -0.557 2.983 1.00 . A A . 16 VAL HG11 1 1 1 254 1 1 16 VAL HG12 H 1.247 0.860 3.922 1.00 . A A . 16 VAL HG12 1 1 1 255 1 1 16 VAL HG13 H 1.527 1.021 2.198 1.00 . A A . 16 VAL HG13 1 1 1 256 1 1 16 VAL HG21 H 3.046 0.644 5.537 1.00 . A A . 16 VAL HG21 1 1 1 257 1 1 16 VAL HG22 H 3.584 -0.813 4.673 1.00 . A A . 16 VAL HG22 1 1 1 258 1 1 16 VAL HG23 H 4.731 0.505 5.009 1.00 . A A . 16 VAL HG23 1 1 1 259 1 1 16 VAL N N 5.566 1.352 2.457 1.00 . A A . 16 VAL N 1 1 1 260 1 1 16 VAL O O 3.753 1.706 0.359 1.00 . A A . 16 VAL O 1 1 1 261 1 1 17 TYR C C 1.615 -1.691 -0.919 1.00 . A A . 17 TYR C 1 1 1 262 1 1 17 TYR CA C 2.691 -0.606 -0.913 1.00 . A A . 17 TYR CA 1 1 1 263 1 1 17 TYR CB C 3.761 -0.885 -1.986 1.00 . A A . 17 TYR CB 1 1 1 264 1 1 17 TYR CD1 C 5.616 -2.229 -0.954 1.00 . A A . 17 TYR CD1 1 1 1 265 1 1 17 TYR CD2 C 4.154 -3.350 -2.554 1.00 . A A . 17 TYR CD2 1 1 1 266 1 1 17 TYR CE1 C 6.384 -3.397 -0.826 1.00 . A A . 17 TYR CE1 1 1 1 267 1 1 17 TYR CE2 C 4.920 -4.526 -2.424 1.00 . A A . 17 TYR CE2 1 1 1 268 1 1 17 TYR CG C 4.515 -2.193 -1.828 1.00 . A A . 17 TYR CG 1 1 1 269 1 1 17 TYR CZ C 6.043 -4.548 -1.568 1.00 . A A . 17 TYR CZ 1 1 1 270 1 1 17 TYR H H 3.294 -1.358 0.965 1.00 . A A . 17 TYR H 1 1 1 271 1 1 17 TYR HA H 2.205 0.341 -1.153 1.00 . A A . 17 TYR HA 1 1 1 272 1 1 17 TYR HB2 H 3.302 -0.860 -2.975 1.00 . A A . 17 TYR HB2 1 1 1 273 1 1 17 TYR HB3 H 4.487 -0.073 -1.964 1.00 . A A . 17 TYR HB3 1 1 1 274 1 1 17 TYR HD1 H 5.886 -1.336 -0.406 1.00 . A A . 17 TYR HD1 1 1 1 275 1 1 17 TYR HD2 H 3.290 -3.359 -3.203 1.00 . A A . 17 TYR HD2 1 1 1 276 1 1 17 TYR HE1 H 7.247 -3.389 -0.181 1.00 . A A . 17 TYR HE1 1 1 1 277 1 1 17 TYR HE2 H 4.643 -5.431 -2.943 1.00 . A A . 17 TYR HE2 1 1 1 278 1 1 17 TYR HH H 7.517 -5.572 -0.845 1.00 . A A . 17 TYR HH 1 1 1 279 1 1 17 TYR N N 3.312 -0.506 0.406 1.00 . A A . 17 TYR N 1 1 1 280 1 1 17 TYR O O 1.378 -2.364 0.084 1.00 . A A . 17 TYR O 1 1 1 281 1 1 17 TYR OH O 6.764 -5.692 -1.427 1.00 . A A . 17 TYR OH 1 1 1 282 1 1 18 TYR C C 0.341 -3.672 -3.553 1.00 . A A . 18 TYR C 1 1 1 283 1 1 18 TYR CA C -0.056 -2.854 -2.324 1.00 . A A . 18 TYR CA 1 1 1 284 1 1 18 TYR CB C -1.408 -2.139 -2.430 1.00 . A A . 18 TYR CB 1 1 1 285 1 1 18 TYR CD1 C -1.142 -0.042 -1.026 1.00 . A A . 18 TYR CD1 1 1 1 286 1 1 18 TYR CD2 C -2.402 -1.913 -0.107 1.00 . A A . 18 TYR CD2 1 1 1 287 1 1 18 TYR CE1 C -1.199 0.616 0.213 1.00 . A A . 18 TYR CE1 1 1 1 288 1 1 18 TYR CE2 C -2.527 -1.226 1.113 1.00 . A A . 18 TYR CE2 1 1 1 289 1 1 18 TYR CG C -1.696 -1.330 -1.175 1.00 . A A . 18 TYR CG 1 1 1 290 1 1 18 TYR CZ C -1.893 0.023 1.289 1.00 . A A . 18 TYR CZ 1 1 1 291 1 1 18 TYR H H 1.135 -1.207 -2.835 1.00 . A A . 18 TYR H 1 1 1 292 1 1 18 TYR HA H -0.109 -3.527 -1.470 1.00 . A A . 18 TYR HA 1 1 1 293 1 1 18 TYR HB2 H -1.408 -1.475 -3.297 1.00 . A A . 18 TYR HB2 1 1 1 294 1 1 18 TYR HB3 H -2.189 -2.886 -2.571 1.00 . A A . 18 TYR HB3 1 1 1 295 1 1 18 TYR HD1 H -0.624 0.421 -1.853 1.00 . A A . 18 TYR HD1 1 1 1 296 1 1 18 TYR HD2 H -2.832 -2.897 -0.212 1.00 . A A . 18 TYR HD2 1 1 1 297 1 1 18 TYR HE1 H -0.715 1.571 0.328 1.00 . A A . 18 TYR HE1 1 1 1 298 1 1 18 TYR HE2 H -3.091 -1.664 1.922 1.00 . A A . 18 TYR HE2 1 1 1 299 1 1 18 TYR HH H -2.805 0.352 3.003 1.00 . A A . 18 TYR HH 1 1 1 300 1 1 18 TYR N N 0.981 -1.867 -2.076 1.00 . A A . 18 TYR N 1 1 1 301 1 1 18 TYR O O 0.747 -3.129 -4.583 1.00 . A A . 18 TYR O 1 1 1 302 1 1 18 TYR OH O -1.975 0.660 2.487 1.00 . A A . 18 TYR OH 1 1 1 303 1 1 19 PHE C C -0.336 -6.897 -4.826 1.00 . A A . 19 PHE C 1 1 1 304 1 1 19 PHE CA C 0.786 -5.992 -4.332 1.00 . A A . 19 PHE CA 1 1 1 305 1 1 19 PHE CB C 1.837 -6.804 -3.582 1.00 . A A . 19 PHE CB 1 1 1 306 1 1 19 PHE CD1 C 3.783 -7.550 -5.020 1.00 . A A . 19 PHE CD1 1 1 1 307 1 1 19 PHE CD2 C 2.088 -9.184 -4.405 1.00 . A A . 19 PHE CD2 1 1 1 308 1 1 19 PHE CE1 C 4.523 -8.557 -5.660 1.00 . A A . 19 PHE CE1 1 1 1 309 1 1 19 PHE CE2 C 2.836 -10.196 -5.033 1.00 . A A . 19 PHE CE2 1 1 1 310 1 1 19 PHE CG C 2.572 -7.863 -4.377 1.00 . A A . 19 PHE CG 1 1 1 311 1 1 19 PHE CZ C 4.060 -9.884 -5.649 1.00 . A A . 19 PHE CZ 1 1 1 312 1 1 19 PHE H H -0.104 -5.360 -2.539 1.00 . A A . 19 PHE H 1 1 1 313 1 1 19 PHE HA H 1.272 -5.502 -5.173 1.00 . A A . 19 PHE HA 1 1 1 314 1 1 19 PHE HB2 H 2.569 -6.103 -3.190 1.00 . A A . 19 PHE HB2 1 1 1 315 1 1 19 PHE HB3 H 1.355 -7.291 -2.734 1.00 . A A . 19 PHE HB3 1 1 1 316 1 1 19 PHE HD1 H 4.159 -6.539 -5.014 1.00 . A A . 19 PHE HD1 1 1 1 317 1 1 19 PHE HD2 H 1.146 -9.417 -3.933 1.00 . A A . 19 PHE HD2 1 1 1 318 1 1 19 PHE HE1 H 5.452 -8.307 -6.153 1.00 . A A . 19 PHE HE1 1 1 1 319 1 1 19 PHE HE2 H 2.485 -11.218 -5.042 1.00 . A A . 19 PHE HE2 1 1 1 320 1 1 19 PHE HZ H 4.629 -10.663 -6.138 1.00 . A A . 19 PHE HZ 1 1 1 321 1 1 19 PHE N N 0.272 -4.993 -3.409 1.00 . A A . 19 PHE N 1 1 1 322 1 1 19 PHE O O -1.081 -7.472 -4.030 1.00 . A A . 19 PHE O 1 1 1 323 1 1 20 ASN C C -0.762 -9.385 -6.763 1.00 . A A . 20 ASN C 1 1 1 324 1 1 20 ASN CA C -1.340 -7.964 -6.791 1.00 . A A . 20 ASN CA 1 1 1 325 1 1 20 ASN CB C -1.614 -7.477 -8.214 1.00 . A A . 20 ASN CB 1 1 1 326 1 1 20 ASN CG C -2.708 -8.316 -8.839 1.00 . A A . 20 ASN CG 1 1 1 327 1 1 20 ASN H H 0.235 -6.556 -6.737 1.00 . A A . 20 ASN H 1 1 1 328 1 1 20 ASN HA H -2.283 -7.971 -6.256 1.00 . A A . 20 ASN HA 1 1 1 329 1 1 20 ASN HB2 H -1.907 -6.436 -8.206 1.00 . A A . 20 ASN HB2 1 1 1 330 1 1 20 ASN HB3 H -0.706 -7.555 -8.808 1.00 . A A . 20 ASN HB3 1 1 1 331 1 1 20 ASN HD21 H -4.169 -7.041 -8.238 1.00 . A A . 20 ASN HD21 1 1 1 332 1 1 20 ASN HD22 H -4.709 -8.476 -9.062 1.00 . A A . 20 ASN HD22 1 1 1 333 1 1 20 ASN N N -0.440 -7.033 -6.144 1.00 . A A . 20 ASN N 1 1 1 334 1 1 20 ASN ND2 N -3.954 -7.916 -8.696 1.00 . A A . 20 ASN ND2 1 1 1 335 1 1 20 ASN O O -0.034 -9.782 -7.676 1.00 . A A . 20 ASN O 1 1 1 336 1 1 20 ASN OD1 O -2.432 -9.356 -9.419 1.00 . A A . 20 ASN OD1 1 1 1 337 1 1 21 HIS C C -1.310 -12.555 -6.652 1.00 . A A . 21 HIS C 1 1 1 338 1 1 21 HIS CA C -0.647 -11.581 -5.652 1.00 . A A . 21 HIS CA 1 1 1 339 1 1 21 HIS CB C -0.611 -12.060 -4.185 1.00 . A A . 21 HIS CB 1 1 1 340 1 1 21 HIS CD2 C -3.124 -12.053 -3.699 1.00 . A A . 21 HIS CD2 1 1 1 341 1 1 21 HIS CE1 C -3.078 -11.291 -1.629 1.00 . A A . 21 HIS CE1 1 1 1 342 1 1 21 HIS CG C -1.832 -11.805 -3.340 1.00 . A A . 21 HIS CG 1 1 1 343 1 1 21 HIS H H -1.759 -9.837 -5.048 1.00 . A A . 21 HIS H 1 1 1 344 1 1 21 HIS HA H 0.395 -11.581 -5.975 1.00 . A A . 21 HIS HA 1 1 1 345 1 1 21 HIS HB2 H -0.386 -13.126 -4.152 1.00 . A A . 21 HIS HB2 1 1 1 346 1 1 21 HIS HB3 H 0.224 -11.559 -3.699 1.00 . A A . 21 HIS HB3 1 1 1 347 1 1 21 HIS HD2 H -3.462 -12.449 -4.646 1.00 . A A . 21 HIS HD2 1 1 1 348 1 1 21 HIS HE1 H -3.412 -10.970 -0.651 1.00 . A A . 21 HIS HE1 1 1 1 349 1 1 21 HIS HE2 H -4.902 -11.778 -2.544 1.00 . A A . 21 HIS HE2 1 1 1 350 1 1 21 HIS N N -1.112 -10.187 -5.751 1.00 . A A . 21 HIS N 1 1 1 351 1 1 21 HIS ND1 N -1.795 -11.326 -2.026 1.00 . A A . 21 HIS ND1 1 1 1 352 1 1 21 HIS NE2 N -3.896 -11.714 -2.610 1.00 . A A . 21 HIS NE2 1 1 1 353 1 1 21 HIS O O -1.316 -13.761 -6.423 1.00 . A A . 21 HIS O 1 1 1 354 1 1 22 ILE C C -1.389 -12.587 -10.141 1.00 . A A . 22 ILE C 1 1 1 355 1 1 22 ILE CA C -2.320 -12.824 -8.924 1.00 . A A . 22 ILE CA 1 1 1 356 1 1 22 ILE CB C -3.815 -12.509 -9.215 1.00 . A A . 22 ILE CB 1 1 1 357 1 1 22 ILE CD1 C -6.177 -12.431 -8.117 1.00 . A A . 22 ILE CD1 1 1 1 358 1 1 22 ILE CG1 C -4.676 -12.698 -7.938 1.00 . A A . 22 ILE CG1 1 1 1 359 1 1 22 ILE CG2 C -4.354 -13.382 -10.366 1.00 . A A . 22 ILE CG2 1 1 1 360 1 1 22 ILE H H -1.864 -11.036 -7.886 1.00 . A A . 22 ILE H 1 1 1 361 1 1 22 ILE HA H -2.250 -13.886 -8.685 1.00 . A A . 22 ILE HA 1 1 1 362 1 1 22 ILE HB H -3.898 -11.468 -9.525 1.00 . A A . 22 ILE HB 1 1 1 363 1 1 22 ILE HD11 H -6.656 -12.406 -7.138 1.00 . A A . 22 ILE HD11 1 1 1 364 1 1 22 ILE HD12 H -6.330 -11.472 -8.613 1.00 . A A . 22 ILE HD12 1 1 1 365 1 1 22 ILE HD13 H -6.639 -13.225 -8.702 1.00 . A A . 22 ILE HD13 1 1 1 366 1 1 22 ILE HG12 H -4.546 -13.714 -7.563 1.00 . A A . 22 ILE HG12 1 1 1 367 1 1 22 ILE HG13 H -4.329 -12.009 -7.169 1.00 . A A . 22 ILE HG13 1 1 1 368 1 1 22 ILE HG21 H -3.797 -13.195 -11.282 1.00 . A A . 22 ILE HG21 1 1 1 369 1 1 22 ILE HG22 H -4.273 -14.438 -10.106 1.00 . A A . 22 ILE HG22 1 1 1 370 1 1 22 ILE HG23 H -5.393 -13.141 -10.581 1.00 . A A . 22 ILE HG23 1 1 1 371 1 1 22 ILE N N -1.847 -12.042 -7.770 1.00 . A A . 22 ILE N 1 1 1 372 1 1 22 ILE O O -1.340 -13.412 -11.049 1.00 . A A . 22 ILE O 1 1 1 373 1 1 23 THR C C 1.679 -10.673 -10.865 1.00 . A A . 23 THR C 1 1 1 374 1 1 23 THR CA C 0.258 -11.074 -11.268 1.00 . A A . 23 THR CA 1 1 1 375 1 1 23 THR CB C -0.343 -9.859 -11.990 1.00 . A A . 23 THR CB 1 1 1 376 1 1 23 THR CG2 C -1.701 -10.143 -12.635 1.00 . A A . 23 THR CG2 1 1 1 377 1 1 23 THR H H -0.705 -10.846 -9.374 1.00 . A A . 23 THR H 1 1 1 378 1 1 23 THR HA H 0.345 -11.888 -11.988 1.00 . A A . 23 THR HA 1 1 1 379 1 1 23 THR HB H 0.344 -9.543 -12.776 1.00 . A A . 23 THR HB 1 1 1 380 1 1 23 THR HG1 H -1.257 -9.039 -10.502 1.00 . A A . 23 THR HG1 1 1 1 381 1 1 23 THR HG21 H -1.600 -10.960 -13.349 1.00 . A A . 23 THR HG21 1 1 1 382 1 1 23 THR HG22 H -2.439 -10.420 -11.882 1.00 . A A . 23 THR HG22 1 1 1 383 1 1 23 THR HG23 H -2.044 -9.252 -13.161 1.00 . A A . 23 THR HG23 1 1 1 384 1 1 23 THR N N -0.602 -11.498 -10.143 1.00 . A A . 23 THR N 1 1 1 385 1 1 23 THR O O 2.570 -10.712 -11.713 1.00 . A A . 23 THR O 1 1 1 386 1 1 23 THR OG1 O -0.487 -8.802 -11.066 1.00 . A A . 23 THR OG1 1 1 1 387 1 1 24 ASN C C 3.207 -8.179 -9.242 1.00 . A A . 24 ASN C 1 1 1 388 1 1 24 ASN CA C 3.095 -9.701 -9.005 1.00 . A A . 24 ASN CA 1 1 1 389 1 1 24 ASN CB C 4.397 -10.452 -9.362 1.00 . A A . 24 ASN CB 1 1 1 390 1 1 24 ASN CG C 4.316 -11.959 -9.170 1.00 . A A . 24 ASN CG 1 1 1 391 1 1 24 ASN H H 1.112 -10.325 -8.950 1.00 . A A . 24 ASN H 1 1 1 392 1 1 24 ASN HA H 2.961 -9.802 -7.930 1.00 . A A . 24 ASN HA 1 1 1 393 1 1 24 ASN HB2 H 4.679 -10.233 -10.391 1.00 . A A . 24 ASN HB2 1 1 1 394 1 1 24 ASN HB3 H 5.201 -10.081 -8.726 1.00 . A A . 24 ASN HB3 1 1 1 395 1 1 24 ASN HD21 H 3.713 -12.206 -11.072 1.00 . A A . 24 ASN HD21 1 1 1 396 1 1 24 ASN HD22 H 3.943 -13.682 -10.108 1.00 . A A . 24 ASN HD22 1 1 1 397 1 1 24 ASN N N 1.898 -10.311 -9.593 1.00 . A A . 24 ASN N 1 1 1 398 1 1 24 ASN ND2 N 3.991 -12.685 -10.220 1.00 . A A . 24 ASN ND2 1 1 1 399 1 1 24 ASN O O 4.247 -7.604 -8.923 1.00 . A A . 24 ASN O 1 1 1 400 1 1 24 ASN OD1 O 4.546 -12.484 -8.092 1.00 . A A . 24 ASN OD1 1 1 1 401 1 1 25 ALA C C 2.225 -5.368 -8.484 1.00 . A A . 25 ALA C 1 1 1 402 1 1 25 ALA CA C 2.201 -6.039 -9.879 1.00 . A A . 25 ALA CA 1 1 1 403 1 1 25 ALA CB C 0.997 -5.577 -10.708 1.00 . A A . 25 ALA CB 1 1 1 404 1 1 25 ALA H H 1.320 -7.981 -10.055 1.00 . A A . 25 ALA H 1 1 1 405 1 1 25 ALA HA H 3.110 -5.750 -10.409 1.00 . A A . 25 ALA HA 1 1 1 406 1 1 25 ALA HB1 H 0.069 -5.798 -10.182 1.00 . A A . 25 ALA HB1 1 1 1 407 1 1 25 ALA HB2 H 1.062 -4.503 -10.883 1.00 . A A . 25 ALA HB2 1 1 1 408 1 1 25 ALA HB3 H 0.993 -6.089 -11.672 1.00 . A A . 25 ALA HB3 1 1 1 409 1 1 25 ALA N N 2.174 -7.505 -9.780 1.00 . A A . 25 ALA N 1 1 1 410 1 1 25 ALA O O 1.689 -5.920 -7.525 1.00 . A A . 25 ALA O 1 1 1 411 1 1 26 SER C C 2.784 -1.931 -7.258 1.00 . A A . 26 SER C 1 1 1 412 1 1 26 SER CA C 2.966 -3.441 -7.091 1.00 . A A . 26 SER CA 1 1 1 413 1 1 26 SER CB C 4.360 -3.683 -6.504 1.00 . A A . 26 SER CB 1 1 1 414 1 1 26 SER H H 3.244 -3.743 -9.172 1.00 . A A . 26 SER H 1 1 1 415 1 1 26 SER HA H 2.231 -3.805 -6.378 1.00 . A A . 26 SER HA 1 1 1 416 1 1 26 SER HB2 H 4.450 -3.143 -5.560 1.00 . A A . 26 SER HB2 1 1 1 417 1 1 26 SER HB3 H 4.504 -4.744 -6.308 1.00 . A A . 26 SER HB3 1 1 1 418 1 1 26 SER HG H 5.015 -2.388 -7.797 1.00 . A A . 26 SER HG 1 1 1 419 1 1 26 SER N N 2.807 -4.166 -8.366 1.00 . A A . 26 SER N 1 1 1 420 1 1 26 SER O O 3.438 -1.342 -8.120 1.00 . A A . 26 SER O 1 1 1 421 1 1 26 SER OG O 5.348 -3.212 -7.402 1.00 . A A . 26 SER OG 1 1 1 422 1 1 27 GLN C C 1.337 0.688 -5.084 1.00 . A A . 27 GLN C 1 1 1 423 1 1 27 GLN CA C 1.612 0.114 -6.486 1.00 . A A . 27 GLN CA 1 1 1 424 1 1 27 GLN CB C 0.386 0.245 -7.410 1.00 . A A . 27 GLN CB 1 1 1 425 1 1 27 GLN CD C -1.046 1.736 -8.879 1.00 . A A . 27 GLN CD 1 1 1 426 1 1 27 GLN CG C 0.052 1.687 -7.818 1.00 . A A . 27 GLN CG 1 1 1 427 1 1 27 GLN H H 1.479 -1.847 -5.688 1.00 . A A . 27 GLN H 1 1 1 428 1 1 27 GLN HA H 2.449 0.659 -6.927 1.00 . A A . 27 GLN HA 1 1 1 429 1 1 27 GLN HB2 H 0.582 -0.316 -8.326 1.00 . A A . 27 GLN HB2 1 1 1 430 1 1 27 GLN HB3 H -0.480 -0.202 -6.918 1.00 . A A . 27 GLN HB3 1 1 1 431 1 1 27 GLN HE21 H -2.486 0.859 -7.697 1.00 . A A . 27 GLN HE21 1 1 1 432 1 1 27 GLN HE22 H -2.909 1.341 -9.335 1.00 . A A . 27 GLN HE22 1 1 1 433 1 1 27 GLN HG2 H -0.281 2.250 -6.949 1.00 . A A . 27 GLN HG2 1 1 1 434 1 1 27 GLN HG3 H 0.947 2.162 -8.222 1.00 . A A . 27 GLN HG3 1 1 1 435 1 1 27 GLN N N 1.956 -1.308 -6.412 1.00 . A A . 27 GLN N 1 1 1 436 1 1 27 GLN NE2 N -2.246 1.272 -8.582 1.00 . A A . 27 GLN NE2 1 1 1 437 1 1 27 GLN O O 0.922 -0.028 -4.176 1.00 . A A . 27 GLN O 1 1 1 438 1 1 27 GLN OE1 O -0.841 2.188 -9.993 1.00 . A A . 27 GLN OE1 1 1 1 439 1 1 28 PHE C C -0.107 3.135 -3.339 1.00 . A A . 28 PHE C 1 1 1 440 1 1 28 PHE CA C 1.349 2.696 -3.622 1.00 . A A . 28 PHE CA 1 1 1 441 1 1 28 PHE CB C 2.320 3.884 -3.582 1.00 . A A . 28 PHE CB 1 1 1 442 1 1 28 PHE CD1 C 4.431 2.685 -2.883 1.00 . A A . 28 PHE CD1 1 1 1 443 1 1 28 PHE CD2 C 4.431 3.879 -5.002 1.00 . A A . 28 PHE CD2 1 1 1 444 1 1 28 PHE CE1 C 5.757 2.284 -3.105 1.00 . A A . 28 PHE CE1 1 1 1 445 1 1 28 PHE CE2 C 5.760 3.475 -5.226 1.00 . A A . 28 PHE CE2 1 1 1 446 1 1 28 PHE CG C 3.764 3.487 -3.826 1.00 . A A . 28 PHE CG 1 1 1 447 1 1 28 PHE CZ C 6.426 2.677 -4.277 1.00 . A A . 28 PHE CZ 1 1 1 448 1 1 28 PHE H H 1.901 2.552 -5.663 1.00 . A A . 28 PHE H 1 1 1 449 1 1 28 PHE HA H 1.641 2.016 -2.820 1.00 . A A . 28 PHE HA 1 1 1 450 1 1 28 PHE HB2 H 2.012 4.625 -4.321 1.00 . A A . 28 PHE HB2 1 1 1 451 1 1 28 PHE HB3 H 2.270 4.351 -2.598 1.00 . A A . 28 PHE HB3 1 1 1 452 1 1 28 PHE HD1 H 3.925 2.363 -1.986 1.00 . A A . 28 PHE HD1 1 1 1 453 1 1 28 PHE HD2 H 3.924 4.488 -5.736 1.00 . A A . 28 PHE HD2 1 1 1 454 1 1 28 PHE HE1 H 6.247 1.672 -2.365 1.00 . A A . 28 PHE HE1 1 1 1 455 1 1 28 PHE HE2 H 6.268 3.778 -6.129 1.00 . A A . 28 PHE HE2 1 1 1 456 1 1 28 PHE HZ H 7.447 2.366 -4.448 1.00 . A A . 28 PHE HZ 1 1 1 457 1 1 28 PHE N N 1.529 1.999 -4.906 1.00 . A A . 28 PHE N 1 1 1 458 1 1 28 PHE O O -0.367 3.823 -2.355 1.00 . A A . 28 PHE O 1 1 1 459 1 1 29 GLU C C -3.121 2.529 -2.867 1.00 . A A . 29 GLU C 1 1 1 460 1 1 29 GLU CA C -2.478 3.136 -4.130 1.00 . A A . 29 GLU CA 1 1 1 461 1 1 29 GLU CB C -3.150 2.674 -5.440 1.00 . A A . 29 GLU CB 1 1 1 462 1 1 29 GLU CD C -5.633 2.982 -4.878 1.00 . A A . 29 GLU CD 1 1 1 463 1 1 29 GLU CG C -4.470 3.372 -5.787 1.00 . A A . 29 GLU CG 1 1 1 464 1 1 29 GLU H H -0.776 2.153 -4.954 1.00 . A A . 29 GLU H 1 1 1 465 1 1 29 GLU HA H -2.543 4.224 -4.073 1.00 . A A . 29 GLU HA 1 1 1 466 1 1 29 GLU HB2 H -2.468 2.905 -6.257 1.00 . A A . 29 GLU HB2 1 1 1 467 1 1 29 GLU HB3 H -3.290 1.592 -5.434 1.00 . A A . 29 GLU HB3 1 1 1 468 1 1 29 GLU HG2 H -4.317 4.453 -5.751 1.00 . A A . 29 GLU HG2 1 1 1 469 1 1 29 GLU HG3 H -4.735 3.113 -6.814 1.00 . A A . 29 GLU HG3 1 1 1 470 1 1 29 GLU N N -1.058 2.764 -4.206 1.00 . A A . 29 GLU N 1 1 1 471 1 1 29 GLU O O -3.328 1.322 -2.793 1.00 . A A . 29 GLU O 1 1 1 472 1 1 29 GLU OE1 O -6.060 1.806 -4.874 1.00 . A A . 29 GLU OE1 1 1 1 473 1 1 29 GLU OE2 O -6.172 3.871 -4.179 1.00 . A A . 29 GLU OE2 1 1 1 474 1 1 30 ARG C C -5.401 2.872 -0.294 1.00 . A A . 30 ARG C 1 1 1 475 1 1 30 ARG CA C -3.871 2.918 -0.534 1.00 . A A . 30 ARG CA 1 1 1 476 1 1 30 ARG CB C -3.120 3.803 0.484 1.00 . A A . 30 ARG CB 1 1 1 477 1 1 30 ARG CD C -2.641 4.067 3.011 1.00 . A A . 30 ARG CD 1 1 1 478 1 1 30 ARG CG C -3.612 3.609 1.922 1.00 . A A . 30 ARG CG 1 1 1 479 1 1 30 ARG CZ C -4.148 4.035 5.034 1.00 . A A . 30 ARG CZ 1 1 1 480 1 1 30 ARG H H -3.280 4.351 -1.989 1.00 . A A . 30 ARG H 1 1 1 481 1 1 30 ARG HA H -3.481 1.910 -0.408 1.00 . A A . 30 ARG HA 1 1 1 482 1 1 30 ARG HB2 H -2.058 3.558 0.428 1.00 . A A . 30 ARG HB2 1 1 1 483 1 1 30 ARG HB3 H -3.241 4.855 0.221 1.00 . A A . 30 ARG HB3 1 1 1 484 1 1 30 ARG HD2 H -1.660 3.628 2.817 1.00 . A A . 30 ARG HD2 1 1 1 485 1 1 30 ARG HD3 H -2.545 5.154 2.994 1.00 . A A . 30 ARG HD3 1 1 1 486 1 1 30 ARG HE H -2.772 2.704 4.663 1.00 . A A . 30 ARG HE 1 1 1 487 1 1 30 ARG HG2 H -4.528 4.183 2.030 1.00 . A A . 30 ARG HG2 1 1 1 488 1 1 30 ARG HG3 H -3.826 2.556 2.092 1.00 . A A . 30 ARG HG3 1 1 1 489 1 1 30 ARG HH11 H -4.681 5.520 3.815 1.00 . A A . 30 ARG HH11 1 1 1 490 1 1 30 ARG HH12 H -5.669 5.323 5.248 1.00 . A A . 30 ARG HH12 1 1 1 491 1 1 30 ARG HH21 H -3.966 2.487 6.209 1.00 . A A . 30 ARG HH21 1 1 1 492 1 1 30 ARG HH22 H -5.440 3.384 6.442 1.00 . A A . 30 ARG HH22 1 1 1 493 1 1 30 ARG N N -3.461 3.365 -1.875 1.00 . A A . 30 ARG N 1 1 1 494 1 1 30 ARG NE N -3.112 3.604 4.329 1.00 . A A . 30 ARG NE 1 1 1 495 1 1 30 ARG NH1 N -4.880 5.065 4.686 1.00 . A A . 30 ARG NH1 1 1 1 496 1 1 30 ARG NH2 N -4.477 3.372 6.110 1.00 . A A . 30 ARG NH2 1 1 1 497 1 1 30 ARG O O -6.115 3.790 -0.700 1.00 . A A . 30 ARG O 1 1 1 498 1 1 31 PRO C C -7.443 2.334 2.213 1.00 . A A . 31 PRO C 1 1 1 499 1 1 31 PRO CA C -7.329 1.698 0.806 1.00 . A A . 31 PRO CA 1 1 1 500 1 1 31 PRO CB C -7.621 0.190 0.801 1.00 . A A . 31 PRO CB 1 1 1 501 1 1 31 PRO CD C -5.272 0.523 0.571 1.00 . A A . 31 PRO CD 1 1 1 502 1 1 31 PRO CG C -6.286 -0.399 1.244 1.00 . A A . 31 PRO CG 1 1 1 503 1 1 31 PRO HA H -8.028 2.208 0.144 1.00 . A A . 31 PRO HA 1 1 1 504 1 1 31 PRO HB2 H -8.437 -0.107 1.460 1.00 . A A . 31 PRO HB2 1 1 1 505 1 1 31 PRO HB3 H -7.843 -0.134 -0.217 1.00 . A A . 31 PRO HB3 1 1 1 506 1 1 31 PRO HD2 H -4.427 0.665 1.237 1.00 . A A . 31 PRO HD2 1 1 1 507 1 1 31 PRO HD3 H -4.940 0.087 -0.372 1.00 . A A . 31 PRO HD3 1 1 1 508 1 1 31 PRO HG2 H -6.181 -0.329 2.325 1.00 . A A . 31 PRO HG2 1 1 1 509 1 1 31 PRO HG3 H -6.178 -1.434 0.932 1.00 . A A . 31 PRO HG3 1 1 1 510 1 1 31 PRO N N -5.946 1.792 0.317 1.00 . A A . 31 PRO N 1 1 1 511 1 1 31 PRO O O -6.641 3.186 2.584 1.00 . A A . 31 PRO O 1 1 1 512 1 1 32 SER C C -7.313 1.864 5.297 1.00 . A A . 32 SER C 1 1 1 513 1 1 32 SER CA C -8.511 2.319 4.442 1.00 . A A . 32 SER CA 1 1 1 514 1 1 32 SER CB C -9.808 1.761 5.037 1.00 . A A . 32 SER CB 1 1 1 515 1 1 32 SER H H -9.089 1.220 2.745 1.00 . A A . 32 SER H 1 1 1 516 1 1 32 SER HA H -8.554 3.407 4.499 1.00 . A A . 32 SER HA 1 1 1 517 1 1 32 SER HB2 H -9.821 1.930 6.115 1.00 . A A . 32 SER HB2 1 1 1 518 1 1 32 SER HB3 H -10.659 2.275 4.588 1.00 . A A . 32 SER HB3 1 1 1 519 1 1 32 SER HG H -10.667 0.018 5.234 1.00 . A A . 32 SER HG 1 1 1 520 1 1 32 SER N N -8.424 1.928 3.027 1.00 . A A . 32 SER N 1 1 1 521 1 1 32 SER O O -7.036 2.500 6.317 1.00 . A A . 32 SER O 1 1 1 522 1 1 32 SER OG O -9.908 0.375 4.762 1.00 . A A . 32 SER OG 1 1 1 523 1 1 33 GLY C C -4.107 0.424 4.929 1.00 . A A . 33 GLY C 1 1 1 524 1 1 33 GLY CA C -5.465 0.172 5.574 1.00 . A A . 33 GLY CA 1 1 1 525 1 1 33 GLY H H -6.884 0.374 4.016 1.00 . A A . 33 GLY H 1 1 1 526 1 1 33 GLY HA2 H -5.424 0.514 6.608 1.00 . A A . 33 GLY HA2 1 1 1 527 1 1 33 GLY HA3 H -5.623 -0.906 5.585 1.00 . A A . 33 GLY HA3 1 1 1 528 1 1 33 GLY N N -6.589 0.813 4.874 1.00 . A A . 33 GLY N 1 1 1 529 1 1 33 GLY O O -3.857 -0.046 3.801 1.00 . A A . 33 GLY O 1 1 1 530 1 1 33 GLY OXT O -3.255 1.079 5.573 1.00 . A A . 33 GLY OXT 1 1 1 531 2 2 1 NAG C1 C 12.599 0.904 -0.518 1.00 . B A . 101 NAG C1 1 1 1 532 2 2 1 NAG C2 C 12.188 2.328 -0.950 1.00 . B A . 101 NAG C2 1 1 1 533 2 2 1 NAG C3 C 10.984 2.181 -1.889 1.00 . B A . 101 NAG C3 1 1 1 534 2 2 1 NAG C4 C 11.376 1.353 -3.116 1.00 . B A . 101 NAG C4 1 1 1 535 2 2 1 NAG C5 C 11.861 -0.033 -2.663 1.00 . B A . 101 NAG C5 1 1 1 536 2 2 1 NAG C6 C 12.316 -0.973 -3.775 1.00 . B A . 101 NAG C6 1 1 1 537 2 2 1 NAG C7 C 12.787 3.813 0.914 1.00 . B A . 101 NAG C7 1 1 1 538 2 2 1 NAG C8 C 12.268 4.826 1.940 1.00 . B A . 101 NAG C8 1 1 1 539 2 2 1 NAG H1 H 11.768 0.398 -0.028 1.00 . B A . 101 NAG H1 1 1 1 540 2 2 1 NAG H2 H 13.016 2.788 -1.492 1.00 . B A . 101 NAG H2 1 1 1 541 2 2 1 NAG H3 H 10.172 1.681 -1.355 1.00 . B A . 101 NAG H3 1 1 1 542 2 2 1 NAG H4 H 12.156 1.867 -3.679 1.00 . B A . 101 NAG H4 1 1 1 543 2 2 1 NAG H5 H 11.054 -0.518 -2.131 1.00 . B A . 101 NAG H5 1 1 1 544 2 2 1 NAG H61 H 12.636 -1.925 -3.351 1.00 . B A . 101 NAG H61 1 1 1 545 2 2 1 NAG H62 H 11.500 -1.165 -4.471 1.00 . B A . 101 NAG H62 1 1 1 546 2 2 1 NAG H81 H 11.409 5.365 1.540 1.00 . B A . 101 NAG H81 1 1 1 547 2 2 1 NAG H82 H 13.055 5.543 2.175 1.00 . B A . 101 NAG H82 1 1 1 548 2 2 1 NAG H83 H 11.983 4.304 2.853 1.00 . B A . 101 NAG H83 1 1 1 549 2 2 1 NAG HN2 H 10.878 3.371 0.373 1.00 . B A . 101 NAG HN2 1 1 1 550 2 2 1 NAG HO3 H 9.942 3.290 -3.106 1.00 . B A . 101 NAG HO3 1 1 1 551 2 2 1 NAG HO4 H 10.449 0.842 -4.790 1.00 . B A . 101 NAG HO4 1 1 1 552 2 2 1 NAG HO6 H 14.113 -0.202 -3.808 1.00 . B A . 101 NAG HO6 1 1 1 553 2 2 1 NAG N2 N 11.863 3.179 0.195 1.00 . B A . 101 NAG N2 1 1 1 554 2 2 1 NAG O3 O 10.522 3.463 -2.354 1.00 . B A . 101 NAG O3 1 1 1 555 2 2 1 NAG O4 O 10.200 1.226 -3.942 1.00 . B A . 101 NAG O4 1 1 1 556 2 2 1 NAG O5 O 12.986 0.155 -1.721 1.00 . B A . 101 NAG O5 1 1 1 557 2 2 1 NAG O6 O 13.420 -0.366 -4.457 1.00 . B A . 101 NAG O6 1 1 1 558 2 2 1 NAG O7 O 13.987 3.580 0.771 1.00 . B A . 101 NAG O7 1 1 2 559 1 1 1 LYS C C -10.246 -4.658 1.415 1.00 . A A . 1 LYS C 1 1 2 560 1 1 1 LYS CA C -10.944 -5.308 2.601 1.00 . A A . 1 LYS CA 1 1 2 561 1 1 1 LYS CB C -10.047 -5.452 3.849 1.00 . A A . 1 LYS CB 1 1 2 562 1 1 1 LYS CD C -10.451 -3.051 4.676 1.00 . A A . 1 LYS CD 1 1 2 563 1 1 1 LYS CE C -9.832 -1.793 5.301 1.00 . A A . 1 LYS CE 1 1 2 564 1 1 1 LYS CG C -9.412 -4.133 4.338 1.00 . A A . 1 LYS CG 1 1 2 565 1 1 1 LYS H1 H -12.065 -7.012 2.931 1.00 . A A . 1 LYS H1 1 1 2 566 1 1 1 LYS H2 H -10.806 -7.246 1.894 1.00 . A A . 1 LYS H2 1 1 2 567 1 1 1 LYS H3 H -12.147 -6.453 1.384 1.00 . A A . 1 LYS H3 1 1 2 568 1 1 1 LYS HA H -11.765 -4.639 2.861 1.00 . A A . 1 LYS HA 1 1 2 569 1 1 1 LYS HB2 H -10.648 -5.864 4.662 1.00 . A A . 1 LYS HB2 1 1 2 570 1 1 1 LYS HB3 H -9.245 -6.163 3.643 1.00 . A A . 1 LYS HB3 1 1 2 571 1 1 1 LYS HD2 H -10.993 -2.760 3.774 1.00 . A A . 1 LYS HD2 1 1 2 572 1 1 1 LYS HD3 H -11.170 -3.462 5.388 1.00 . A A . 1 LYS HD3 1 1 2 573 1 1 1 LYS HE2 H -10.649 -1.121 5.578 1.00 . A A . 1 LYS HE2 1 1 2 574 1 1 1 LYS HE3 H -9.292 -2.060 6.214 1.00 . A A . 1 LYS HE3 1 1 2 575 1 1 1 LYS HG2 H -8.830 -4.348 5.235 1.00 . A A . 1 LYS HG2 1 1 2 576 1 1 1 LYS HG3 H -8.727 -3.755 3.579 1.00 . A A . 1 LYS HG3 1 1 2 577 1 1 1 LYS HZ1 H -7.970 -1.455 4.362 1.00 . A A . 1 LYS HZ1 1 1 2 578 1 1 1 LYS HZ2 H -9.286 -1.113 3.407 1.00 . A A . 1 LYS HZ2 1 1 2 579 1 1 1 LYS HZ3 H -8.839 -0.098 4.592 1.00 . A A . 1 LYS HZ3 1 1 2 580 1 1 1 LYS N N -11.533 -6.602 2.176 1.00 . A A . 1 LYS N 1 1 2 581 1 1 1 LYS NZ N -8.931 -1.088 4.363 1.00 . A A . 1 LYS NZ 1 1 2 582 1 1 1 LYS O O -10.847 -3.798 0.787 1.00 . A A . 1 LYS O 1 1 2 583 1 1 2 LEU C C -9.083 -5.318 -1.369 1.00 . A A . 2 LEU C 1 1 2 584 1 1 2 LEU CA C -8.350 -4.698 -0.149 1.00 . A A . 2 LEU CA 1 1 2 585 1 1 2 LEU CB C -6.879 -5.157 -0.081 1.00 . A A . 2 LEU CB 1 1 2 586 1 1 2 LEU CD1 C -4.708 -5.334 1.154 1.00 . A A . 2 LEU CD1 1 1 2 587 1 1 2 LEU CD2 C -5.972 -3.199 1.316 1.00 . A A . 2 LEU CD2 1 1 2 588 1 1 2 LEU CG C -6.103 -4.718 1.181 1.00 . A A . 2 LEU CG 1 1 2 589 1 1 2 LEU H H -8.553 -5.799 1.630 1.00 . A A . 2 LEU H 1 1 2 590 1 1 2 LEU HA H -8.383 -3.611 -0.221 1.00 . A A . 2 LEU HA 1 1 2 591 1 1 2 LEU HB2 H -6.864 -6.246 -0.131 1.00 . A A . 2 LEU HB2 1 1 2 592 1 1 2 LEU HB3 H -6.355 -4.778 -0.958 1.00 . A A . 2 LEU HB3 1 1 2 593 1 1 2 LEU HD11 H -4.140 -5.022 2.026 1.00 . A A . 2 LEU HD11 1 1 2 594 1 1 2 LEU HD12 H -4.806 -6.419 1.175 1.00 . A A . 2 LEU HD12 1 1 2 595 1 1 2 LEU HD13 H -4.184 -5.038 0.245 1.00 . A A . 2 LEU HD13 1 1 2 596 1 1 2 LEU HD21 H -5.436 -2.791 0.462 1.00 . A A . 2 LEU HD21 1 1 2 597 1 1 2 LEU HD22 H -6.958 -2.740 1.382 1.00 . A A . 2 LEU HD22 1 1 2 598 1 1 2 LEU HD23 H -5.425 -2.955 2.226 1.00 . A A . 2 LEU HD23 1 1 2 599 1 1 2 LEU HG H -6.609 -5.096 2.070 1.00 . A A . 2 LEU HG 1 1 2 600 1 1 2 LEU N N -9.024 -5.091 1.088 1.00 . A A . 2 LEU N 1 1 2 601 1 1 2 LEU O O -9.814 -6.299 -1.188 1.00 . A A . 2 LEU O 1 1 2 602 1 1 3 PRO C C -9.063 -6.705 -4.224 1.00 . A A . 3 PRO C 1 1 2 603 1 1 3 PRO CA C -9.570 -5.302 -3.804 1.00 . A A . 3 PRO CA 1 1 2 604 1 1 3 PRO CB C -9.317 -4.255 -4.903 1.00 . A A . 3 PRO CB 1 1 2 605 1 1 3 PRO CD C -8.211 -3.546 -2.901 1.00 . A A . 3 PRO CD 1 1 2 606 1 1 3 PRO CG C -8.866 -3.001 -4.165 1.00 . A A . 3 PRO CG 1 1 2 607 1 1 3 PRO HA H -10.641 -5.356 -3.610 1.00 . A A . 3 PRO HA 1 1 2 608 1 1 3 PRO HB2 H -8.522 -4.581 -5.571 1.00 . A A . 3 PRO HB2 1 1 2 609 1 1 3 PRO HB3 H -10.223 -4.057 -5.478 1.00 . A A . 3 PRO HB3 1 1 2 610 1 1 3 PRO HD2 H -7.161 -3.767 -3.096 1.00 . A A . 3 PRO HD2 1 1 2 611 1 1 3 PRO HD3 H -8.302 -2.814 -2.102 1.00 . A A . 3 PRO HD3 1 1 2 612 1 1 3 PRO HG2 H -8.168 -2.410 -4.758 1.00 . A A . 3 PRO HG2 1 1 2 613 1 1 3 PRO HG3 H -9.738 -2.405 -3.891 1.00 . A A . 3 PRO HG3 1 1 2 614 1 1 3 PRO N N -8.924 -4.775 -2.595 1.00 . A A . 3 PRO N 1 1 2 615 1 1 3 PRO O O -8.050 -7.175 -3.701 1.00 . A A . 3 PRO O 1 1 2 616 1 1 4 PRO C C -7.877 -8.980 -5.913 1.00 . A A . 4 PRO C 1 1 2 617 1 1 4 PRO CA C -9.376 -8.708 -5.699 1.00 . A A . 4 PRO CA 1 1 2 618 1 1 4 PRO CB C -10.197 -8.900 -6.978 1.00 . A A . 4 PRO CB 1 1 2 619 1 1 4 PRO CD C -10.909 -6.893 -5.903 1.00 . A A . 4 PRO CD 1 1 2 620 1 1 4 PRO CG C -11.454 -8.087 -6.685 1.00 . A A . 4 PRO CG 1 1 2 621 1 1 4 PRO HA H -9.750 -9.419 -4.961 1.00 . A A . 4 PRO HA 1 1 2 622 1 1 4 PRO HB2 H -9.679 -8.466 -7.836 1.00 . A A . 4 PRO HB2 1 1 2 623 1 1 4 PRO HB3 H -10.427 -9.950 -7.158 1.00 . A A . 4 PRO HB3 1 1 2 624 1 1 4 PRO HD2 H -10.630 -6.105 -6.604 1.00 . A A . 4 PRO HD2 1 1 2 625 1 1 4 PRO HD3 H -11.665 -6.530 -5.206 1.00 . A A . 4 PRO HD3 1 1 2 626 1 1 4 PRO HG2 H -11.959 -7.776 -7.599 1.00 . A A . 4 PRO HG2 1 1 2 627 1 1 4 PRO HG3 H -12.126 -8.666 -6.049 1.00 . A A . 4 PRO HG3 1 1 2 628 1 1 4 PRO N N -9.716 -7.367 -5.208 1.00 . A A . 4 PRO N 1 1 2 629 1 1 4 PRO O O -7.247 -8.454 -6.834 1.00 . A A . 4 PRO O 1 1 2 630 1 1 5 GLY C C -4.893 -9.286 -4.509 1.00 . A A . 5 GLY C 1 1 2 631 1 1 5 GLY CA C -5.916 -10.257 -5.103 1.00 . A A . 5 GLY CA 1 1 2 632 1 1 5 GLY H H -7.865 -10.170 -4.274 1.00 . A A . 5 GLY H 1 1 2 633 1 1 5 GLY HA2 H -5.821 -11.204 -4.575 1.00 . A A . 5 GLY HA2 1 1 2 634 1 1 5 GLY HA3 H -5.642 -10.421 -6.145 1.00 . A A . 5 GLY HA3 1 1 2 635 1 1 5 GLY N N -7.309 -9.817 -5.038 1.00 . A A . 5 GLY N 1 1 2 636 1 1 5 GLY O O -3.707 -9.592 -4.568 1.00 . A A . 5 GLY O 1 1 2 637 1 1 6 TRP C C -4.081 -7.460 -1.904 1.00 . A A . 6 TRP C 1 1 2 638 1 1 6 TRP CA C -4.386 -7.160 -3.376 1.00 . A A . 6 TRP CA 1 1 2 639 1 1 6 TRP CB C -4.955 -5.750 -3.542 1.00 . A A . 6 TRP CB 1 1 2 640 1 1 6 TRP CD1 C -5.919 -5.410 -5.858 1.00 . A A . 6 TRP CD1 1 1 2 641 1 1 6 TRP CD2 C -3.894 -4.473 -5.631 1.00 . A A . 6 TRP CD2 1 1 2 642 1 1 6 TRP CE2 C -4.333 -4.200 -6.962 1.00 . A A . 6 TRP CE2 1 1 2 643 1 1 6 TRP CE3 C -2.607 -4.019 -5.277 1.00 . A A . 6 TRP CE3 1 1 2 644 1 1 6 TRP CG C -4.941 -5.227 -4.945 1.00 . A A . 6 TRP CG 1 1 2 645 1 1 6 TRP CH2 C -2.263 -3.071 -7.504 1.00 . A A . 6 TRP CH2 1 1 2 646 1 1 6 TRP CZ2 C -3.540 -3.509 -7.891 1.00 . A A . 6 TRP CZ2 1 1 2 647 1 1 6 TRP CZ3 C -1.799 -3.328 -6.202 1.00 . A A . 6 TRP CZ3 1 1 2 648 1 1 6 TRP H H -6.291 -7.893 -3.902 1.00 . A A . 6 TRP H 1 1 2 649 1 1 6 TRP HA H -3.444 -7.190 -3.917 1.00 . A A . 6 TRP HA 1 1 2 650 1 1 6 TRP HB2 H -5.973 -5.729 -3.157 1.00 . A A . 6 TRP HB2 1 1 2 651 1 1 6 TRP HB3 H -4.367 -5.072 -2.929 1.00 . A A . 6 TRP HB3 1 1 2 652 1 1 6 TRP HD1 H -6.823 -5.978 -5.677 1.00 . A A . 6 TRP HD1 1 1 2 653 1 1 6 TRP HE1 H -6.187 -4.750 -7.849 1.00 . A A . 6 TRP HE1 1 1 2 654 1 1 6 TRP HE3 H -2.239 -4.219 -4.282 1.00 . A A . 6 TRP HE3 1 1 2 655 1 1 6 TRP HH2 H -1.635 -2.537 -8.204 1.00 . A A . 6 TRP HH2 1 1 2 656 1 1 6 TRP HZ2 H -3.904 -3.323 -8.891 1.00 . A A . 6 TRP HZ2 1 1 2 657 1 1 6 TRP HZ3 H -0.817 -2.989 -5.913 1.00 . A A . 6 TRP HZ3 1 1 2 658 1 1 6 TRP N N -5.305 -8.131 -3.967 1.00 . A A . 6 TRP N 1 1 2 659 1 1 6 TRP NE1 N -5.582 -4.780 -7.039 1.00 . A A . 6 TRP NE1 1 1 2 660 1 1 6 TRP O O -4.946 -7.877 -1.136 1.00 . A A . 6 TRP O 1 1 2 661 1 1 7 GLU C C -1.337 -6.262 0.205 1.00 . A A . 7 GLU C 1 1 2 662 1 1 7 GLU CA C -2.244 -7.438 -0.208 1.00 . A A . 7 GLU CA 1 1 2 663 1 1 7 GLU CB C -1.467 -8.767 -0.304 1.00 . A A . 7 GLU CB 1 1 2 664 1 1 7 GLU CD C -1.600 -9.626 2.044 1.00 . A A . 7 GLU CD 1 1 2 665 1 1 7 GLU CG C -2.070 -9.841 0.609 1.00 . A A . 7 GLU CG 1 1 2 666 1 1 7 GLU H H -2.157 -6.930 -2.234 1.00 . A A . 7 GLU H 1 1 2 667 1 1 7 GLU HA H -3.032 -7.535 0.538 1.00 . A A . 7 GLU HA 1 1 2 668 1 1 7 GLU HB2 H -1.483 -9.142 -1.329 1.00 . A A . 7 GLU HB2 1 1 2 669 1 1 7 GLU HB3 H -0.420 -8.609 -0.042 1.00 . A A . 7 GLU HB3 1 1 2 670 1 1 7 GLU HG2 H -3.160 -9.824 0.553 1.00 . A A . 7 GLU HG2 1 1 2 671 1 1 7 GLU HG3 H -1.728 -10.818 0.263 1.00 . A A . 7 GLU HG3 1 1 2 672 1 1 7 GLU N N -2.837 -7.181 -1.518 1.00 . A A . 7 GLU N 1 1 2 673 1 1 7 GLU O O -0.821 -5.561 -0.663 1.00 . A A . 7 GLU O 1 1 2 674 1 1 7 GLU OE1 O -1.847 -8.525 2.593 1.00 . A A . 7 GLU OE1 1 1 2 675 1 1 7 GLU OE2 O -0.830 -10.492 2.530 1.00 . A A . 7 GLU OE2 1 1 2 676 1 1 8 LYS C C 1.074 -5.268 2.400 1.00 . A A . 8 LYS C 1 1 2 677 1 1 8 LYS CA C -0.354 -4.869 2.024 1.00 . A A . 8 LYS CA 1 1 2 678 1 1 8 LYS CB C -1.132 -4.163 3.138 1.00 . A A . 8 LYS CB 1 1 2 679 1 1 8 LYS CD C -2.195 -4.134 5.431 1.00 . A A . 8 LYS CD 1 1 2 680 1 1 8 LYS CE C -3.667 -4.100 4.985 1.00 . A A . 8 LYS CE 1 1 2 681 1 1 8 LYS CG C -1.297 -4.924 4.461 1.00 . A A . 8 LYS CG 1 1 2 682 1 1 8 LYS H H -1.510 -6.710 2.164 1.00 . A A . 8 LYS H 1 1 2 683 1 1 8 LYS HA H -0.262 -4.141 1.216 1.00 . A A . 8 LYS HA 1 1 2 684 1 1 8 LYS HB2 H -0.649 -3.206 3.341 1.00 . A A . 8 LYS HB2 1 1 2 685 1 1 8 LYS HB3 H -2.118 -3.969 2.735 1.00 . A A . 8 LYS HB3 1 1 2 686 1 1 8 LYS HD2 H -2.139 -4.594 6.420 1.00 . A A . 8 LYS HD2 1 1 2 687 1 1 8 LYS HD3 H -1.807 -3.117 5.508 1.00 . A A . 8 LYS HD3 1 1 2 688 1 1 8 LYS HE2 H -3.711 -4.004 3.900 1.00 . A A . 8 LYS HE2 1 1 2 689 1 1 8 LYS HE3 H -4.145 -5.045 5.258 1.00 . A A . 8 LYS HE3 1 1 2 690 1 1 8 LYS HG2 H -1.729 -5.909 4.278 1.00 . A A . 8 LYS HG2 1 1 2 691 1 1 8 LYS HG3 H -0.313 -5.046 4.914 1.00 . A A . 8 LYS HG3 1 1 2 692 1 1 8 LYS HZ1 H -4.395 -2.967 6.588 1.00 . A A . 8 LYS HZ1 1 1 2 693 1 1 8 LYS HZ2 H -3.990 -2.071 5.240 1.00 . A A . 8 LYS HZ2 1 1 2 694 1 1 8 LYS HZ3 H -5.336 -2.846 5.208 1.00 . A A . 8 LYS HZ3 1 1 2 695 1 1 8 LYS N N -1.126 -6.025 1.509 1.00 . A A . 8 LYS N 1 1 2 696 1 1 8 LYS NZ N -4.390 -2.954 5.580 1.00 . A A . 8 LYS NZ 1 1 2 697 1 1 8 LYS O O 1.275 -6.233 3.136 1.00 . A A . 8 LYS O 1 1 2 698 1 1 9 ARG C C 4.376 -3.811 2.514 1.00 . A A . 9 ARG C 1 1 2 699 1 1 9 ARG CA C 3.511 -4.956 2.006 1.00 . A A . 9 ARG CA 1 1 2 700 1 1 9 ARG CB C 4.046 -5.367 0.616 1.00 . A A . 9 ARG CB 1 1 2 701 1 1 9 ARG CD C 3.326 -7.869 0.255 1.00 . A A . 9 ARG CD 1 1 2 702 1 1 9 ARG CG C 3.326 -6.414 -0.243 1.00 . A A . 9 ARG CG 1 1 2 703 1 1 9 ARG CZ C 1.808 -9.035 1.933 1.00 . A A . 9 ARG CZ 1 1 2 704 1 1 9 ARG H H 1.895 -3.579 1.599 1.00 . A A . 9 ARG H 1 1 2 705 1 1 9 ARG HA H 3.638 -5.779 2.709 1.00 . A A . 9 ARG HA 1 1 2 706 1 1 9 ARG HB2 H 4.051 -4.453 0.025 1.00 . A A . 9 ARG HB2 1 1 2 707 1 1 9 ARG HB3 H 5.080 -5.699 0.718 1.00 . A A . 9 ARG HB3 1 1 2 708 1 1 9 ARG HD2 H 2.895 -8.474 -0.543 1.00 . A A . 9 ARG HD2 1 1 2 709 1 1 9 ARG HD3 H 4.358 -8.190 0.408 1.00 . A A . 9 ARG HD3 1 1 2 710 1 1 9 ARG HE H 2.508 -7.241 2.121 1.00 . A A . 9 ARG HE 1 1 2 711 1 1 9 ARG HG2 H 2.321 -6.066 -0.476 1.00 . A A . 9 ARG HG2 1 1 2 712 1 1 9 ARG HG3 H 3.864 -6.441 -1.188 1.00 . A A . 9 ARG HG3 1 1 2 713 1 1 9 ARG HH11 H 1.967 -10.323 0.378 1.00 . A A . 9 ARG HH11 1 1 2 714 1 1 9 ARG HH12 H 0.767 -10.666 1.651 1.00 . A A . 9 ARG HH12 1 1 2 715 1 1 9 ARG HH21 H 1.126 -7.950 3.449 1.00 . A A . 9 ARG HH21 1 1 2 716 1 1 9 ARG HH22 H 0.378 -9.525 3.194 1.00 . A A . 9 ARG HH22 1 1 2 717 1 1 9 ARG N N 2.089 -4.546 1.913 1.00 . A A . 9 ARG N 1 1 2 718 1 1 9 ARG NE N 2.576 -8.043 1.507 1.00 . A A . 9 ARG NE 1 1 2 719 1 1 9 ARG NH1 N 1.567 -10.140 1.276 1.00 . A A . 9 ARG NH1 1 1 2 720 1 1 9 ARG NH2 N 1.183 -8.892 3.068 1.00 . A A . 9 ARG NH2 1 1 2 721 1 1 9 ARG O O 3.881 -2.705 2.645 1.00 . A A . 9 ARG O 1 1 2 722 1 1 10 MET C C 8.036 -3.535 2.704 1.00 . A A . 10 MET C 1 1 2 723 1 1 10 MET CA C 6.664 -3.152 3.288 1.00 . A A . 10 MET CA 1 1 2 724 1 1 10 MET CB C 6.708 -3.377 4.812 1.00 . A A . 10 MET CB 1 1 2 725 1 1 10 MET CE C 6.097 -1.804 7.789 1.00 . A A . 10 MET CE 1 1 2 726 1 1 10 MET CG C 7.595 -2.328 5.494 1.00 . A A . 10 MET CG 1 1 2 727 1 1 10 MET H H 6.031 -4.976 2.480 1.00 . A A . 10 MET H 1 1 2 728 1 1 10 MET HA H 6.393 -2.100 3.097 1.00 . A A . 10 MET HA 1 1 2 729 1 1 10 MET HB2 H 5.703 -3.331 5.227 1.00 . A A . 10 MET HB2 1 1 2 730 1 1 10 MET HB3 H 7.100 -4.371 5.032 1.00 . A A . 10 MET HB3 1 1 2 731 1 1 10 MET HE1 H 6.013 -0.772 7.450 1.00 . A A . 10 MET HE1 1 1 2 732 1 1 10 MET HE2 H 5.297 -2.400 7.355 1.00 . A A . 10 MET HE2 1 1 2 733 1 1 10 MET HE3 H 6.014 -1.829 8.877 1.00 . A A . 10 MET HE3 1 1 2 734 1 1 10 MET HG2 H 8.605 -2.422 5.098 1.00 . A A . 10 MET HG2 1 1 2 735 1 1 10 MET HG3 H 7.229 -1.331 5.247 1.00 . A A . 10 MET HG3 1 1 2 736 1 1 10 MET N N 5.679 -4.053 2.686 1.00 . A A . 10 MET N 1 1 2 737 1 1 10 MET O O 8.457 -4.686 2.809 1.00 . A A . 10 MET O 1 1 2 738 1 1 10 MET SD S 7.707 -2.473 7.297 1.00 . A A . 10 MET SD 1 1 2 739 1 1 11 PHE C C 11.094 -2.857 2.671 1.00 . A A . 11 PHE C 1 1 2 740 1 1 11 PHE CA C 10.069 -2.745 1.530 1.00 . A A . 11 PHE CA 1 1 2 741 1 1 11 PHE CB C 10.389 -1.549 0.627 1.00 . A A . 11 PHE CB 1 1 2 742 1 1 11 PHE CD1 C 10.137 -2.578 -1.663 1.00 . A A . 11 PHE CD1 1 1 2 743 1 1 11 PHE CD2 C 8.748 -0.654 -1.105 1.00 . A A . 11 PHE CD2 1 1 2 744 1 1 11 PHE CE1 C 9.604 -2.591 -2.963 1.00 . A A . 11 PHE CE1 1 1 2 745 1 1 11 PHE CE2 C 8.222 -0.667 -2.409 1.00 . A A . 11 PHE CE2 1 1 2 746 1 1 11 PHE CG C 9.724 -1.602 -0.734 1.00 . A A . 11 PHE CG 1 1 2 747 1 1 11 PHE CZ C 8.655 -1.626 -3.339 1.00 . A A . 11 PHE CZ 1 1 2 748 1 1 11 PHE H H 8.288 -1.678 1.940 1.00 . A A . 11 PHE H 1 1 2 749 1 1 11 PHE HA H 10.123 -3.640 0.915 1.00 . A A . 11 PHE HA 1 1 2 750 1 1 11 PHE HB2 H 10.107 -0.634 1.143 1.00 . A A . 11 PHE HB2 1 1 2 751 1 1 11 PHE HB3 H 11.466 -1.506 0.459 1.00 . A A . 11 PHE HB3 1 1 2 752 1 1 11 PHE HD1 H 10.886 -3.307 -1.393 1.00 . A A . 11 PHE HD1 1 1 2 753 1 1 11 PHE HD2 H 8.382 0.082 -0.400 1.00 . A A . 11 PHE HD2 1 1 2 754 1 1 11 PHE HE1 H 9.929 -3.333 -3.679 1.00 . A A . 11 PHE HE1 1 1 2 755 1 1 11 PHE HE2 H 7.475 0.049 -2.707 1.00 . A A . 11 PHE HE2 1 1 2 756 1 1 11 PHE HZ H 8.255 -1.616 -4.341 1.00 . A A . 11 PHE HZ 1 1 2 757 1 1 11 PHE N N 8.710 -2.592 2.045 1.00 . A A . 11 PHE N 1 1 2 758 1 1 11 PHE O O 10.842 -2.408 3.788 1.00 . A A . 11 PHE O 1 1 2 759 1 1 12 ALA C C 13.897 -2.229 3.986 1.00 . A A . 12 ALA C 1 1 2 760 1 1 12 ALA CA C 13.382 -3.539 3.347 1.00 . A A . 12 ALA CA 1 1 2 761 1 1 12 ALA CB C 14.523 -4.297 2.659 1.00 . A A . 12 ALA CB 1 1 2 762 1 1 12 ALA H H 12.470 -3.718 1.443 1.00 . A A . 12 ALA H 1 1 2 763 1 1 12 ALA HA H 13.007 -4.160 4.162 1.00 . A A . 12 ALA HA 1 1 2 764 1 1 12 ALA HB1 H 14.159 -5.250 2.273 1.00 . A A . 12 ALA HB1 1 1 2 765 1 1 12 ALA HB2 H 14.929 -3.704 1.839 1.00 . A A . 12 ALA HB2 1 1 2 766 1 1 12 ALA HB3 H 15.317 -4.496 3.380 1.00 . A A . 12 ALA HB3 1 1 2 767 1 1 12 ALA N N 12.296 -3.367 2.372 1.00 . A A . 12 ALA N 1 1 2 768 1 1 12 ALA O O 14.624 -2.274 4.974 1.00 . A A . 12 ALA O 1 1 2 769 1 1 13 ASN C C 12.582 0.767 4.911 1.00 . A A . 13 ASN C 1 1 2 770 1 1 13 ASN CA C 13.747 0.261 4.020 1.00 . A A . 13 ASN CA 1 1 2 771 1 1 13 ASN CB C 14.063 1.227 2.855 1.00 . A A . 13 ASN CB 1 1 2 772 1 1 13 ASN CG C 12.927 1.350 1.845 1.00 . A A . 13 ASN CG 1 1 2 773 1 1 13 ASN H H 12.895 -1.105 2.646 1.00 . A A . 13 ASN H 1 1 2 774 1 1 13 ASN HA H 14.627 0.211 4.664 1.00 . A A . 13 ASN HA 1 1 2 775 1 1 13 ASN HB2 H 14.278 2.219 3.255 1.00 . A A . 13 ASN HB2 1 1 2 776 1 1 13 ASN HB3 H 14.958 0.873 2.342 1.00 . A A . 13 ASN HB3 1 1 2 777 1 1 13 ASN HD21 H 14.180 1.918 0.338 1.00 . A A . 13 ASN HD21 1 1 2 778 1 1 13 ASN N N 13.504 -1.068 3.449 1.00 . A A . 13 ASN N 1 1 2 779 1 1 13 ASN ND2 N 13.231 1.710 0.600 1.00 . A A . 13 ASN ND2 1 1 2 780 1 1 13 ASN O O 12.652 1.886 5.411 1.00 . A A . 13 ASN O 1 1 2 781 1 1 13 ASN OD1 O 11.776 1.077 2.179 1.00 . A A . 13 ASN OD1 1 1 2 782 1 1 14 GLY C C 9.169 0.960 5.034 1.00 . A A . 14 GLY C 1 1 2 783 1 1 14 GLY CA C 10.310 0.332 5.849 1.00 . A A . 14 GLY CA 1 1 2 784 1 1 14 GLY H H 11.493 -0.943 4.647 1.00 . A A . 14 GLY H 1 1 2 785 1 1 14 GLY HA2 H 9.926 -0.573 6.317 1.00 . A A . 14 GLY HA2 1 1 2 786 1 1 14 GLY HA3 H 10.582 1.030 6.643 1.00 . A A . 14 GLY HA3 1 1 2 787 1 1 14 GLY N N 11.508 -0.022 5.080 1.00 . A A . 14 GLY N 1 1 2 788 1 1 14 GLY O O 8.234 1.489 5.628 1.00 . A A . 14 GLY O 1 1 2 789 1 1 15 THR C C 7.129 0.791 2.454 1.00 . A A . 15 THR C 1 1 2 790 1 1 15 THR CA C 8.279 1.695 2.846 1.00 . A A . 15 THR CA 1 1 2 791 1 1 15 THR CB C 8.980 2.227 1.589 1.00 . A A . 15 THR CB 1 1 2 792 1 1 15 THR CG2 C 8.112 3.112 0.692 1.00 . A A . 15 THR CG2 1 1 2 793 1 1 15 THR H H 9.912 0.375 3.209 1.00 . A A . 15 THR H 1 1 2 794 1 1 15 THR HA H 7.888 2.550 3.385 1.00 . A A . 15 THR HA 1 1 2 795 1 1 15 THR HB H 9.338 1.393 0.994 1.00 . A A . 15 THR HB 1 1 2 796 1 1 15 THR HG1 H 10.768 2.295 2.238 1.00 . A A . 15 THR HG1 1 1 2 797 1 1 15 THR HG21 H 7.864 4.038 1.210 1.00 . A A . 15 THR HG21 1 1 2 798 1 1 15 THR HG22 H 8.659 3.338 -0.226 1.00 . A A . 15 THR HG22 1 1 2 799 1 1 15 THR HG23 H 7.195 2.592 0.422 1.00 . A A . 15 THR HG23 1 1 2 800 1 1 15 THR N N 9.216 0.933 3.693 1.00 . A A . 15 THR N 1 1 2 801 1 1 15 THR O O 7.368 -0.202 1.774 1.00 . A A . 15 THR O 1 1 2 802 1 1 15 THR OG1 O 10.097 2.976 1.989 1.00 . A A . 15 THR OG1 1 1 2 803 1 1 16 VAL C C 4.094 0.596 1.212 1.00 . A A . 16 VAL C 1 1 2 804 1 1 16 VAL CA C 4.779 0.209 2.510 1.00 . A A . 16 VAL CA 1 1 2 805 1 1 16 VAL CB C 3.738 0.051 3.637 1.00 . A A . 16 VAL CB 1 1 2 806 1 1 16 VAL CG1 C 4.309 -0.552 4.919 1.00 . A A . 16 VAL CG1 1 1 2 807 1 1 16 VAL CG2 C 3.049 1.345 3.961 1.00 . A A . 16 VAL CG2 1 1 2 808 1 1 16 VAL H H 5.696 1.956 3.354 1.00 . A A . 16 VAL H 1 1 2 809 1 1 16 VAL HA H 5.180 -0.778 2.333 1.00 . A A . 16 VAL HA 1 1 2 810 1 1 16 VAL HB H 2.941 -0.606 3.296 1.00 . A A . 16 VAL HB 1 1 2 811 1 1 16 VAL HG11 H 4.604 -1.569 4.703 1.00 . A A . 16 VAL HG11 1 1 2 812 1 1 16 VAL HG12 H 5.158 0.029 5.275 1.00 . A A . 16 VAL HG12 1 1 2 813 1 1 16 VAL HG13 H 3.535 -0.591 5.685 1.00 . A A . 16 VAL HG13 1 1 2 814 1 1 16 VAL HG21 H 2.285 1.127 4.701 1.00 . A A . 16 VAL HG21 1 1 2 815 1 1 16 VAL HG22 H 3.793 2.040 4.335 1.00 . A A . 16 VAL HG22 1 1 2 816 1 1 16 VAL HG23 H 2.571 1.696 3.052 1.00 . A A . 16 VAL HG23 1 1 2 817 1 1 16 VAL N N 5.889 1.116 2.826 1.00 . A A . 16 VAL N 1 1 2 818 1 1 16 VAL O O 4.149 1.730 0.739 1.00 . A A . 16 VAL O 1 1 2 819 1 1 17 TYR C C 1.732 -1.528 -0.593 1.00 . A A . 17 TYR C 1 1 2 820 1 1 17 TYR CA C 2.786 -0.422 -0.633 1.00 . A A . 17 TYR CA 1 1 2 821 1 1 17 TYR CB C 3.816 -0.659 -1.759 1.00 . A A . 17 TYR CB 1 1 2 822 1 1 17 TYR CD1 C 5.732 -2.014 -0.847 1.00 . A A . 17 TYR CD1 1 1 2 823 1 1 17 TYR CD2 C 4.253 -3.087 -2.463 1.00 . A A . 17 TYR CD2 1 1 2 824 1 1 17 TYR CE1 C 6.538 -3.162 -0.803 1.00 . A A . 17 TYR CE1 1 1 2 825 1 1 17 TYR CE2 C 5.060 -4.245 -2.436 1.00 . A A . 17 TYR CE2 1 1 2 826 1 1 17 TYR CG C 4.602 -1.961 -1.684 1.00 . A A . 17 TYR CG 1 1 2 827 1 1 17 TYR CZ C 6.217 -4.273 -1.616 1.00 . A A . 17 TYR CZ 1 1 2 828 1 1 17 TYR H H 3.439 -1.310 1.142 1.00 . A A . 17 TYR H 1 1 2 829 1 1 17 TYR HA H 2.290 0.537 -0.790 1.00 . A A . 17 TYR HA 1 1 2 830 1 1 17 TYR HB2 H 3.320 -0.595 -2.726 1.00 . A A . 17 TYR HB2 1 1 2 831 1 1 17 TYR HB3 H 4.543 0.154 -1.729 1.00 . A A . 17 TYR HB3 1 1 2 832 1 1 17 TYR HD1 H 6.000 -1.152 -0.255 1.00 . A A . 17 TYR HD1 1 1 2 833 1 1 17 TYR HD2 H 3.369 -3.070 -3.085 1.00 . A A . 17 TYR HD2 1 1 2 834 1 1 17 TYR HE1 H 7.414 -3.163 -0.165 1.00 . A A . 17 TYR HE1 1 1 2 835 1 1 17 TYR HE2 H 4.770 -5.118 -3.016 1.00 . A A . 17 TYR HE2 1 1 2 836 1 1 17 TYR HH H 6.799 -6.003 -2.275 1.00 . A A . 17 TYR HH 1 1 2 837 1 1 17 TYR N N 3.475 -0.426 0.641 1.00 . A A . 17 TYR N 1 1 2 838 1 1 17 TYR O O 1.634 -2.286 0.376 1.00 . A A . 17 TYR O 1 1 2 839 1 1 17 TYR OH O 6.995 -5.387 -1.567 1.00 . A A . 17 TYR OH 1 1 2 840 1 1 18 TYR C C 0.492 -3.525 -3.148 1.00 . A A . 18 TYR C 1 1 2 841 1 1 18 TYR CA C 0.067 -2.753 -1.912 1.00 . A A . 18 TYR CA 1 1 2 842 1 1 18 TYR CB C -1.360 -2.211 -1.997 1.00 . A A . 18 TYR CB 1 1 2 843 1 1 18 TYR CD1 C -1.324 -0.169 -0.523 1.00 . A A . 18 TYR CD1 1 1 2 844 1 1 18 TYR CD2 C -2.327 -2.222 0.338 1.00 . A A . 18 TYR CD2 1 1 2 845 1 1 18 TYR CE1 C -1.489 0.443 0.728 1.00 . A A . 18 TYR CE1 1 1 2 846 1 1 18 TYR CE2 C -2.577 -1.571 1.559 1.00 . A A . 18 TYR CE2 1 1 2 847 1 1 18 TYR CG C -1.726 -1.506 -0.713 1.00 . A A . 18 TYR CG 1 1 2 848 1 1 18 TYR CZ C -2.149 -0.244 1.767 1.00 . A A . 18 TYR CZ 1 1 2 849 1 1 18 TYR H H 1.044 -0.949 -2.405 1.00 . A A . 18 TYR H 1 1 2 850 1 1 18 TYR HA H 0.111 -3.429 -1.063 1.00 . A A . 18 TYR HA 1 1 2 851 1 1 18 TYR HB2 H -1.443 -1.518 -2.836 1.00 . A A . 18 TYR HB2 1 1 2 852 1 1 18 TYR HB3 H -2.051 -3.038 -2.162 1.00 . A A . 18 TYR HB3 1 1 2 853 1 1 18 TYR HD1 H -0.839 0.372 -1.325 1.00 . A A . 18 TYR HD1 1 1 2 854 1 1 18 TYR HD2 H -2.566 -3.275 0.228 1.00 . A A . 18 TYR HD2 1 1 2 855 1 1 18 TYR HE1 H -1.134 1.446 0.888 1.00 . A A . 18 TYR HE1 1 1 2 856 1 1 18 TYR HE2 H -3.057 -2.096 2.360 1.00 . A A . 18 TYR HE2 1 1 2 857 1 1 18 TYR HH H -3.102 -0.107 3.482 1.00 . A A . 18 TYR HH 1 1 2 858 1 1 18 TYR N N 0.997 -1.664 -1.687 1.00 . A A . 18 TYR N 1 1 2 859 1 1 18 TYR O O 0.963 -2.948 -4.126 1.00 . A A . 18 TYR O 1 1 2 860 1 1 18 TYR OH O -2.381 0.372 2.956 1.00 . A A . 18 TYR OH 1 1 2 861 1 1 19 PHE C C -0.335 -6.723 -4.450 1.00 . A A . 19 PHE C 1 1 2 862 1 1 19 PHE CA C 0.814 -5.814 -4.040 1.00 . A A . 19 PHE CA 1 1 2 863 1 1 19 PHE CB C 1.927 -6.630 -3.389 1.00 . A A . 19 PHE CB 1 1 2 864 1 1 19 PHE CD1 C 3.641 -7.120 -5.153 1.00 . A A . 19 PHE CD1 1 1 2 865 1 1 19 PHE CD2 C 2.206 -8.943 -4.406 1.00 . A A . 19 PHE CD2 1 1 2 866 1 1 19 PHE CE1 C 4.278 -7.985 -6.053 1.00 . A A . 19 PHE CE1 1 1 2 867 1 1 19 PHE CE2 C 2.848 -9.811 -5.306 1.00 . A A . 19 PHE CE2 1 1 2 868 1 1 19 PHE CG C 2.605 -7.594 -4.333 1.00 . A A . 19 PHE CG 1 1 2 869 1 1 19 PHE CZ C 3.874 -9.330 -6.138 1.00 . A A . 19 PHE CZ 1 1 2 870 1 1 19 PHE H H -0.029 -5.213 -2.197 1.00 . A A . 19 PHE H 1 1 2 871 1 1 19 PHE HA H 1.217 -5.307 -4.916 1.00 . A A . 19 PHE HA 1 1 2 872 1 1 19 PHE HB2 H 2.674 -5.933 -3.018 1.00 . A A . 19 PHE HB2 1 1 2 873 1 1 19 PHE HB3 H 1.526 -7.183 -2.537 1.00 . A A . 19 PHE HB3 1 1 2 874 1 1 19 PHE HD1 H 3.947 -6.086 -5.100 1.00 . A A . 19 PHE HD1 1 1 2 875 1 1 19 PHE HD2 H 1.404 -9.321 -3.783 1.00 . A A . 19 PHE HD2 1 1 2 876 1 1 19 PHE HE1 H 5.074 -7.595 -6.667 1.00 . A A . 19 PHE HE1 1 1 2 877 1 1 19 PHE HE2 H 2.558 -10.849 -5.363 1.00 . A A . 19 PHE HE2 1 1 2 878 1 1 19 PHE HZ H 4.340 -10.003 -6.843 1.00 . A A . 19 PHE HZ 1 1 2 879 1 1 19 PHE N N 0.346 -4.841 -3.068 1.00 . A A . 19 PHE N 1 1 2 880 1 1 19 PHE O O -1.000 -7.288 -3.584 1.00 . A A . 19 PHE O 1 1 2 881 1 1 20 ASN C C -0.870 -9.208 -6.446 1.00 . A A . 20 ASN C 1 1 2 882 1 1 20 ASN CA C -1.537 -7.843 -6.244 1.00 . A A . 20 ASN CA 1 1 2 883 1 1 20 ASN CB C -2.216 -7.321 -7.507 1.00 . A A . 20 ASN CB 1 1 2 884 1 1 20 ASN CG C -3.436 -8.179 -7.796 1.00 . A A . 20 ASN CG 1 1 2 885 1 1 20 ASN H H 0.032 -6.420 -6.429 1.00 . A A . 20 ASN H 1 1 2 886 1 1 20 ASN HA H -2.314 -7.956 -5.495 1.00 . A A . 20 ASN HA 1 1 2 887 1 1 20 ASN HB2 H -2.516 -6.286 -7.367 1.00 . A A . 20 ASN HB2 1 1 2 888 1 1 20 ASN HB3 H -1.521 -7.367 -8.340 1.00 . A A . 20 ASN HB3 1 1 2 889 1 1 20 ASN HD21 H -4.704 -6.737 -7.132 1.00 . A A . 20 ASN HD21 1 1 2 890 1 1 20 ASN HD22 H -5.462 -8.234 -7.581 1.00 . A A . 20 ASN HD22 1 1 2 891 1 1 20 ASN N N -0.568 -6.882 -5.750 1.00 . A A . 20 ASN N 1 1 2 892 1 1 20 ASN ND2 N -4.618 -7.667 -7.520 1.00 . A A . 20 ASN ND2 1 1 2 893 1 1 20 ASN O O -0.124 -9.405 -7.403 1.00 . A A . 20 ASN O 1 1 2 894 1 1 20 ASN OD1 O -3.316 -9.332 -8.187 1.00 . A A . 20 ASN OD1 1 1 2 895 1 1 21 HIS C C -1.171 -12.413 -6.703 1.00 . A A . 21 HIS C 1 1 2 896 1 1 21 HIS CA C -0.549 -11.504 -5.627 1.00 . A A . 21 HIS CA 1 1 2 897 1 1 21 HIS CB C -0.538 -12.134 -4.227 1.00 . A A . 21 HIS CB 1 1 2 898 1 1 21 HIS CD2 C -2.843 -13.241 -4.034 1.00 . A A . 21 HIS CD2 1 1 2 899 1 1 21 HIS CE1 C -3.620 -12.115 -2.301 1.00 . A A . 21 HIS CE1 1 1 2 900 1 1 21 HIS CG C -1.900 -12.346 -3.619 1.00 . A A . 21 HIS CG 1 1 2 901 1 1 21 HIS H H -1.838 -9.989 -4.832 1.00 . A A . 21 HIS H 1 1 2 902 1 1 21 HIS HA H 0.489 -11.390 -5.931 1.00 . A A . 21 HIS HA 1 1 2 903 1 1 21 HIS HB2 H -0.008 -13.083 -4.264 1.00 . A A . 21 HIS HB2 1 1 2 904 1 1 21 HIS HB3 H 0.030 -11.481 -3.562 1.00 . A A . 21 HIS HB3 1 1 2 905 1 1 21 HIS HD2 H -2.746 -13.934 -4.859 1.00 . A A . 21 HIS HD2 1 1 2 906 1 1 21 HIS HE1 H -4.268 -11.766 -1.508 1.00 . A A . 21 HIS HE1 1 1 2 907 1 1 21 HIS HE2 H -4.787 -13.600 -3.218 1.00 . A A . 21 HIS HE2 1 1 2 908 1 1 21 HIS N N -1.138 -10.164 -5.555 1.00 . A A . 21 HIS N 1 1 2 909 1 1 21 HIS ND1 N -2.387 -11.643 -2.521 1.00 . A A . 21 HIS ND1 1 1 2 910 1 1 21 HIS NE2 N -3.923 -13.079 -3.192 1.00 . A A . 21 HIS NE2 1 1 2 911 1 1 21 HIS O O -0.799 -13.581 -6.780 1.00 . A A . 21 HIS O 1 1 2 912 1 1 22 ILE C C -1.916 -12.047 -10.003 1.00 . A A . 22 ILE C 1 1 2 913 1 1 22 ILE CA C -2.595 -12.595 -8.732 1.00 . A A . 22 ILE CA 1 1 2 914 1 1 22 ILE CB C -4.143 -12.520 -8.800 1.00 . A A . 22 ILE CB 1 1 2 915 1 1 22 ILE CD1 C -6.311 -12.989 -7.446 1.00 . A A . 22 ILE CD1 1 1 2 916 1 1 22 ILE CG1 C -4.778 -13.059 -7.493 1.00 . A A . 22 ILE CG1 1 1 2 917 1 1 22 ILE CG2 C -4.665 -13.303 -10.021 1.00 . A A . 22 ILE CG2 1 1 2 918 1 1 22 ILE H H -2.396 -10.941 -7.413 1.00 . A A . 22 ILE H 1 1 2 919 1 1 22 ILE HA H -2.327 -13.650 -8.668 1.00 . A A . 22 ILE HA 1 1 2 920 1 1 22 ILE HB H -4.443 -11.480 -8.922 1.00 . A A . 22 ILE HB 1 1 2 921 1 1 22 ILE HD11 H -6.650 -13.224 -6.436 1.00 . A A . 22 ILE HD11 1 1 2 922 1 1 22 ILE HD12 H -6.648 -11.985 -7.708 1.00 . A A . 22 ILE HD12 1 1 2 923 1 1 22 ILE HD13 H -6.748 -13.714 -8.132 1.00 . A A . 22 ILE HD13 1 1 2 924 1 1 22 ILE HG12 H -4.470 -14.093 -7.340 1.00 . A A . 22 ILE HG12 1 1 2 925 1 1 22 ILE HG13 H -4.412 -12.474 -6.648 1.00 . A A . 22 ILE HG13 1 1 2 926 1 1 22 ILE HG21 H -5.747 -13.208 -10.104 1.00 . A A . 22 ILE HG21 1 1 2 927 1 1 22 ILE HG22 H -4.240 -12.907 -10.943 1.00 . A A . 22 ILE HG22 1 1 2 928 1 1 22 ILE HG23 H -4.401 -14.357 -9.932 1.00 . A A . 22 ILE HG23 1 1 2 929 1 1 22 ILE N N -2.085 -11.900 -7.540 1.00 . A A . 22 ILE N 1 1 2 930 1 1 22 ILE O O -1.587 -12.829 -10.892 1.00 . A A . 22 ILE O 1 1 2 931 1 1 23 THR C C 0.373 -9.647 -11.139 1.00 . A A . 23 THR C 1 1 2 932 1 1 23 THR CA C -1.089 -10.083 -11.284 1.00 . A A . 23 THR CA 1 1 2 933 1 1 23 THR CB C -1.905 -8.853 -11.716 1.00 . A A . 23 THR CB 1 1 2 934 1 1 23 THR CG2 C -3.404 -9.129 -11.856 1.00 . A A . 23 THR CG2 1 1 2 935 1 1 23 THR H H -2.031 -10.120 -9.358 1.00 . A A . 23 THR H 1 1 2 936 1 1 23 THR HA H -1.116 -10.788 -12.115 1.00 . A A . 23 THR HA 1 1 2 937 1 1 23 THR HB H -1.534 -8.518 -12.685 1.00 . A A . 23 THR HB 1 1 2 938 1 1 23 THR HG1 H -2.308 -7.087 -11.072 1.00 . A A . 23 THR HG1 1 1 2 939 1 1 23 THR HG21 H -3.847 -9.341 -10.883 1.00 . A A . 23 THR HG21 1 1 2 940 1 1 23 THR HG22 H -3.898 -8.261 -12.292 1.00 . A A . 23 THR HG22 1 1 2 941 1 1 23 THR HG23 H -3.556 -9.985 -12.514 1.00 . A A . 23 THR HG23 1 1 2 942 1 1 23 THR N N -1.670 -10.729 -10.089 1.00 . A A . 23 THR N 1 1 2 943 1 1 23 THR O O 0.969 -9.227 -12.129 1.00 . A A . 23 THR O 1 1 2 944 1 1 23 THR OG1 O -1.731 -7.803 -10.791 1.00 . A A . 23 THR OG1 1 1 2 945 1 1 24 ASN C C 2.330 -7.601 -9.690 1.00 . A A . 24 ASN C 1 1 2 946 1 1 24 ASN CA C 2.259 -9.145 -9.577 1.00 . A A . 24 ASN CA 1 1 2 947 1 1 24 ASN CB C 3.367 -9.910 -10.342 1.00 . A A . 24 ASN CB 1 1 2 948 1 1 24 ASN CG C 4.694 -10.006 -9.602 1.00 . A A . 24 ASN CG 1 1 2 949 1 1 24 ASN H H 0.405 -9.992 -9.123 1.00 . A A . 24 ASN H 1 1 2 950 1 1 24 ASN HA H 2.390 -9.362 -8.516 1.00 . A A . 24 ASN HA 1 1 2 951 1 1 24 ASN HB2 H 3.034 -10.933 -10.527 1.00 . A A . 24 ASN HB2 1 1 2 952 1 1 24 ASN HB3 H 3.534 -9.434 -11.308 1.00 . A A . 24 ASN HB3 1 1 2 953 1 1 24 ASN HD21 H 4.902 -8.002 -9.544 1.00 . A A . 24 ASN HD21 1 1 2 954 1 1 24 ASN HD22 H 6.244 -8.974 -8.890 1.00 . A A . 24 ASN HD22 1 1 2 955 1 1 24 ASN N N 0.952 -9.704 -9.931 1.00 . A A . 24 ASN N 1 1 2 956 1 1 24 ASN ND2 N 5.352 -8.897 -9.344 1.00 . A A . 24 ASN ND2 1 1 2 957 1 1 24 ASN O O 3.423 -7.034 -9.606 1.00 . A A . 24 ASN O 1 1 2 958 1 1 24 ASN OD1 O 5.147 -11.079 -9.241 1.00 . A A . 24 ASN OD1 1 1 2 959 1 1 25 ALA C C 1.530 -4.918 -8.389 1.00 . A A . 25 ALA C 1 1 2 960 1 1 25 ALA CA C 1.188 -5.431 -9.803 1.00 . A A . 25 ALA CA 1 1 2 961 1 1 25 ALA CB C -0.186 -4.922 -10.254 1.00 . A A . 25 ALA CB 1 1 2 962 1 1 25 ALA H H 0.310 -7.369 -9.989 1.00 . A A . 25 ALA H 1 1 2 963 1 1 25 ALA HA H 1.940 -5.049 -10.496 1.00 . A A . 25 ALA HA 1 1 2 964 1 1 25 ALA HB1 H -0.958 -5.270 -9.568 1.00 . A A . 25 ALA HB1 1 1 2 965 1 1 25 ALA HB2 H -0.189 -3.832 -10.268 1.00 . A A . 25 ALA HB2 1 1 2 966 1 1 25 ALA HB3 H -0.401 -5.285 -11.261 1.00 . A A . 25 ALA HB3 1 1 2 967 1 1 25 ALA N N 1.201 -6.896 -9.871 1.00 . A A . 25 ALA N 1 1 2 968 1 1 25 ALA O O 1.284 -5.599 -7.393 1.00 . A A . 25 ALA O 1 1 2 969 1 1 26 SER C C 2.002 -1.508 -7.116 1.00 . A A . 26 SER C 1 1 2 970 1 1 26 SER CA C 2.316 -3.001 -7.020 1.00 . A A . 26 SER CA 1 1 2 971 1 1 26 SER CB C 3.786 -3.166 -6.616 1.00 . A A . 26 SER CB 1 1 2 972 1 1 26 SER H H 2.227 -3.147 -9.125 1.00 . A A . 26 SER H 1 1 2 973 1 1 26 SER HA H 1.702 -3.444 -6.244 1.00 . A A . 26 SER HA 1 1 2 974 1 1 26 SER HB2 H 3.967 -2.607 -5.697 1.00 . A A . 26 SER HB2 1 1 2 975 1 1 26 SER HB3 H 4.007 -4.217 -6.421 1.00 . A A . 26 SER HB3 1 1 2 976 1 1 26 SER HG H 4.244 -1.854 -7.981 1.00 . A A . 26 SER HG 1 1 2 977 1 1 26 SER N N 2.033 -3.682 -8.291 1.00 . A A . 26 SER N 1 1 2 978 1 1 26 SER O O 2.361 -0.886 -8.117 1.00 . A A . 26 SER O 1 1 2 979 1 1 26 SER OG O 4.632 -2.670 -7.636 1.00 . A A . 26 SER OG 1 1 2 980 1 1 27 GLN C C 1.262 1.051 -4.581 1.00 . A A . 27 GLN C 1 1 2 981 1 1 27 GLN CA C 1.060 0.493 -5.997 1.00 . A A . 27 GLN CA 1 1 2 982 1 1 27 GLN CB C -0.405 0.695 -6.452 1.00 . A A . 27 GLN CB 1 1 2 983 1 1 27 GLN CD C -0.275 3.024 -7.552 1.00 . A A . 27 GLN CD 1 1 2 984 1 1 27 GLN CG C -0.532 1.526 -7.742 1.00 . A A . 27 GLN CG 1 1 2 985 1 1 27 GLN H H 1.178 -1.500 -5.252 1.00 . A A . 27 GLN H 1 1 2 986 1 1 27 GLN HA H 1.723 1.048 -6.664 1.00 . A A . 27 GLN HA 1 1 2 987 1 1 27 GLN HB2 H -0.871 -0.275 -6.629 1.00 . A A . 27 GLN HB2 1 1 2 988 1 1 27 GLN HB3 H -0.982 1.183 -5.663 1.00 . A A . 27 GLN HB3 1 1 2 989 1 1 27 GLN HE21 H -1.404 3.573 -9.170 1.00 . A A . 27 GLN HE21 1 1 2 990 1 1 27 GLN HE22 H -0.652 4.840 -8.213 1.00 . A A . 27 GLN HE22 1 1 2 991 1 1 27 GLN HG2 H 0.150 1.138 -8.500 1.00 . A A . 27 GLN HG2 1 1 2 992 1 1 27 GLN HG3 H -1.547 1.402 -8.117 1.00 . A A . 27 GLN HG3 1 1 2 993 1 1 27 GLN N N 1.405 -0.931 -6.068 1.00 . A A . 27 GLN N 1 1 2 994 1 1 27 GLN NE2 N -0.827 3.866 -8.401 1.00 . A A . 27 GLN NE2 1 1 2 995 1 1 27 GLN O O 1.018 0.364 -3.592 1.00 . A A . 27 GLN O 1 1 2 996 1 1 27 GLN OE1 O 0.399 3.468 -6.633 1.00 . A A . 27 GLN OE1 1 1 2 997 1 1 28 PHE C C 0.332 3.707 -2.913 1.00 . A A . 28 PHE C 1 1 2 998 1 1 28 PHE CA C 1.700 3.086 -3.243 1.00 . A A . 28 PHE CA 1 1 2 999 1 1 28 PHE CB C 2.770 4.180 -3.352 1.00 . A A . 28 PHE CB 1 1 2 1000 1 1 28 PHE CD1 C 4.766 2.917 -2.453 1.00 . A A . 28 PHE CD1 1 1 2 1001 1 1 28 PHE CD2 C 4.931 3.907 -4.669 1.00 . A A . 28 PHE CD2 1 1 2 1002 1 1 28 PHE CE1 C 6.086 2.453 -2.559 1.00 . A A . 28 PHE CE1 1 1 2 1003 1 1 28 PHE CE2 C 6.253 3.437 -4.777 1.00 . A A . 28 PHE CE2 1 1 2 1004 1 1 28 PHE CG C 4.185 3.652 -3.502 1.00 . A A . 28 PHE CG 1 1 2 1005 1 1 28 PHE CZ C 6.834 2.716 -3.720 1.00 . A A . 28 PHE CZ 1 1 2 1006 1 1 28 PHE H H 1.732 2.855 -5.352 1.00 . A A . 28 PHE H 1 1 2 1007 1 1 28 PHE HA H 1.971 2.424 -2.418 1.00 . A A . 28 PHE HA 1 1 2 1008 1 1 28 PHE HB2 H 2.529 4.834 -4.191 1.00 . A A . 28 PHE HB2 1 1 2 1009 1 1 28 PHE HB3 H 2.743 4.784 -2.445 1.00 . A A . 28 PHE HB3 1 1 2 1010 1 1 28 PHE HD1 H 4.203 2.703 -1.556 1.00 . A A . 28 PHE HD1 1 1 2 1011 1 1 28 PHE HD2 H 4.495 4.469 -5.483 1.00 . A A . 28 PHE HD2 1 1 2 1012 1 1 28 PHE HE1 H 6.514 1.895 -1.743 1.00 . A A . 28 PHE HE1 1 1 2 1013 1 1 28 PHE HE2 H 6.826 3.636 -5.672 1.00 . A A . 28 PHE HE2 1 1 2 1014 1 1 28 PHE HZ H 7.854 2.367 -3.797 1.00 . A A . 28 PHE HZ 1 1 2 1015 1 1 28 PHE N N 1.661 2.322 -4.491 1.00 . A A . 28 PHE N 1 1 2 1016 1 1 28 PHE O O 0.054 3.986 -1.747 1.00 . A A . 28 PHE O 1 1 2 1017 1 1 29 GLU C C -2.683 3.247 -2.877 1.00 . A A . 29 GLU C 1 1 2 1018 1 1 29 GLU CA C -1.930 4.309 -3.696 1.00 . A A . 29 GLU CA 1 1 2 1019 1 1 29 GLU CB C -2.631 4.543 -5.049 1.00 . A A . 29 GLU CB 1 1 2 1020 1 1 29 GLU CD C -2.996 7.017 -4.828 1.00 . A A . 29 GLU CD 1 1 2 1021 1 1 29 GLU CG C -2.327 5.919 -5.660 1.00 . A A . 29 GLU CG 1 1 2 1022 1 1 29 GLU H H -0.253 3.697 -4.871 1.00 . A A . 29 GLU H 1 1 2 1023 1 1 29 GLU HA H -1.930 5.239 -3.129 1.00 . A A . 29 GLU HA 1 1 2 1024 1 1 29 GLU HB2 H -2.340 3.760 -5.750 1.00 . A A . 29 GLU HB2 1 1 2 1025 1 1 29 GLU HB3 H -3.711 4.466 -4.908 1.00 . A A . 29 GLU HB3 1 1 2 1026 1 1 29 GLU HG2 H -1.247 6.074 -5.708 1.00 . A A . 29 GLU HG2 1 1 2 1027 1 1 29 GLU HG3 H -2.720 5.948 -6.679 1.00 . A A . 29 GLU HG3 1 1 2 1028 1 1 29 GLU N N -0.542 3.894 -3.915 1.00 . A A . 29 GLU N 1 1 2 1029 1 1 29 GLU O O -2.985 2.162 -3.374 1.00 . A A . 29 GLU O 1 1 2 1030 1 1 29 GLU OE1 O -4.240 7.138 -4.886 1.00 . A A . 29 GLU OE1 1 1 2 1031 1 1 29 GLU OE2 O -2.317 7.615 -3.965 1.00 . A A . 29 GLU OE2 1 1 2 1032 1 1 30 ARG C C -5.113 2.398 -0.947 1.00 . A A . 30 ARG C 1 1 2 1033 1 1 30 ARG CA C -3.630 2.677 -0.651 1.00 . A A . 30 ARG CA 1 1 2 1034 1 1 30 ARG CB C -3.337 3.116 0.798 1.00 . A A . 30 ARG CB 1 1 2 1035 1 1 30 ARG CD C -3.915 5.661 0.814 1.00 . A A . 30 ARG CD 1 1 2 1036 1 1 30 ARG CG C -4.070 4.283 1.473 1.00 . A A . 30 ARG CG 1 1 2 1037 1 1 30 ARG CZ C -4.455 6.430 -1.517 1.00 . A A . 30 ARG CZ 1 1 2 1038 1 1 30 ARG H H -2.659 4.463 -1.270 1.00 . A A . 30 ARG H 1 1 2 1039 1 1 30 ARG HA H -3.102 1.737 -0.772 1.00 . A A . 30 ARG HA 1 1 2 1040 1 1 30 ARG HB2 H -3.531 2.249 1.428 1.00 . A A . 30 ARG HB2 1 1 2 1041 1 1 30 ARG HB3 H -2.271 3.332 0.870 1.00 . A A . 30 ARG HB3 1 1 2 1042 1 1 30 ARG HD2 H -4.249 6.425 1.519 1.00 . A A . 30 ARG HD2 1 1 2 1043 1 1 30 ARG HD3 H -2.860 5.828 0.594 1.00 . A A . 30 ARG HD3 1 1 2 1044 1 1 30 ARG HE H -5.452 5.052 -0.507 1.00 . A A . 30 ARG HE 1 1 2 1045 1 1 30 ARG HG2 H -5.128 4.045 1.587 1.00 . A A . 30 ARG HG2 1 1 2 1046 1 1 30 ARG HG3 H -3.633 4.338 2.469 1.00 . A A . 30 ARG HG3 1 1 2 1047 1 1 30 ARG HH11 H -2.894 7.464 -0.782 1.00 . A A . 30 ARG HH11 1 1 2 1048 1 1 30 ARG HH12 H -3.110 7.577 -2.524 1.00 . A A . 30 ARG HH12 1 1 2 1049 1 1 30 ARG HH21 H -5.937 5.559 -2.581 1.00 . A A . 30 ARG HH21 1 1 2 1050 1 1 30 ARG HH22 H -4.911 6.682 -3.471 1.00 . A A . 30 ARG HH22 1 1 2 1051 1 1 30 ARG N N -3.002 3.582 -1.618 1.00 . A A . 30 ARG N 1 1 2 1052 1 1 30 ARG NE N -4.730 5.762 -0.407 1.00 . A A . 30 ARG NE 1 1 2 1053 1 1 30 ARG NH1 N -3.438 7.255 -1.593 1.00 . A A . 30 ARG NH1 1 1 2 1054 1 1 30 ARG NH2 N -5.175 6.211 -2.586 1.00 . A A . 30 ARG NH2 1 1 2 1055 1 1 30 ARG O O -5.938 3.313 -0.822 1.00 . A A . 30 ARG O 1 1 2 1056 1 1 31 PRO C C -7.675 0.456 -0.468 1.00 . A A . 31 PRO C 1 1 2 1057 1 1 31 PRO CA C -6.867 0.847 -1.702 1.00 . A A . 31 PRO CA 1 1 2 1058 1 1 31 PRO CB C -6.748 -0.245 -2.733 1.00 . A A . 31 PRO CB 1 1 2 1059 1 1 31 PRO CD C -4.664 -0.018 -1.539 1.00 . A A . 31 PRO CD 1 1 2 1060 1 1 31 PRO CG C -5.533 -1.051 -2.264 1.00 . A A . 31 PRO CG 1 1 2 1061 1 1 31 PRO HA H -7.345 1.706 -2.178 1.00 . A A . 31 PRO HA 1 1 2 1062 1 1 31 PRO HB2 H -7.662 -0.825 -2.799 1.00 . A A . 31 PRO HB2 1 1 2 1063 1 1 31 PRO HB3 H -6.544 0.265 -3.667 1.00 . A A . 31 PRO HB3 1 1 2 1064 1 1 31 PRO HD2 H -4.346 -0.414 -0.574 1.00 . A A . 31 PRO HD2 1 1 2 1065 1 1 31 PRO HD3 H -3.791 0.214 -2.147 1.00 . A A . 31 PRO HD3 1 1 2 1066 1 1 31 PRO HG2 H -5.849 -1.824 -1.566 1.00 . A A . 31 PRO HG2 1 1 2 1067 1 1 31 PRO HG3 H -4.995 -1.500 -3.100 1.00 . A A . 31 PRO HG3 1 1 2 1068 1 1 31 PRO N N -5.496 1.166 -1.343 1.00 . A A . 31 PRO N 1 1 2 1069 1 1 31 PRO O O -7.836 -0.709 -0.096 1.00 . A A . 31 PRO O 1 1 2 1070 1 1 32 SER C C -8.056 1.408 2.730 1.00 . A A . 32 SER C 1 1 2 1071 1 1 32 SER CA C -8.902 1.576 1.454 1.00 . A A . 32 SER CA 1 1 2 1072 1 1 32 SER CB C -10.083 0.588 1.480 1.00 . A A . 32 SER CB 1 1 2 1073 1 1 32 SER H H -7.902 2.358 -0.317 1.00 . A A . 32 SER H 1 1 2 1074 1 1 32 SER HA H -9.332 2.577 1.511 1.00 . A A . 32 SER HA 1 1 2 1075 1 1 32 SER HB2 H -10.756 0.850 2.299 1.00 . A A . 32 SER HB2 1 1 2 1076 1 1 32 SER HB3 H -10.636 0.647 0.541 1.00 . A A . 32 SER HB3 1 1 2 1077 1 1 32 SER HG H -8.955 -0.889 0.948 1.00 . A A . 32 SER HG 1 1 2 1078 1 1 32 SER N N -8.157 1.511 0.179 1.00 . A A . 32 SER N 1 1 2 1079 1 1 32 SER O O -8.599 1.563 3.826 1.00 . A A . 32 SER O 1 1 2 1080 1 1 32 SER OG O -9.614 -0.735 1.679 1.00 . A A . 32 SER OG 1 1 2 1081 1 1 33 GLY C C -5.416 -0.521 4.084 1.00 . A A . 33 GLY C 1 1 2 1082 1 1 33 GLY CA C -5.846 0.909 3.768 1.00 . A A . 33 GLY CA 1 1 2 1083 1 1 33 GLY H H -6.393 0.875 1.705 1.00 . A A . 33 GLY H 1 1 2 1084 1 1 33 GLY HA2 H -4.945 1.489 3.567 1.00 . A A . 33 GLY HA2 1 1 2 1085 1 1 33 GLY HA3 H -6.297 1.320 4.670 1.00 . A A . 33 GLY HA3 1 1 2 1086 1 1 33 GLY N N -6.766 1.050 2.626 1.00 . A A . 33 GLY N 1 1 2 1087 1 1 33 GLY O O -4.184 -0.739 4.151 1.00 . A A . 33 GLY O 1 1 2 1088 1 1 33 GLY OXT O -6.280 -1.395 4.340 1.00 . A A . 33 GLY OXT 1 1 2 1089 2 2 1 NAG C1 C 12.301 1.497 -0.500 1.00 . B A . 101 NAG C1 1 1 2 1090 2 2 1 NAG C2 C 11.920 2.782 -1.268 1.00 . B A . 101 NAG C2 1 1 2 1091 2 2 1 NAG C3 C 10.910 2.337 -2.339 1.00 . B A . 101 NAG C3 1 1 2 1092 2 2 1 NAG C4 C 11.646 1.435 -3.319 1.00 . B A . 101 NAG C4 1 1 2 1093 2 2 1 NAG C5 C 12.181 0.184 -2.617 1.00 . B A . 101 NAG C5 1 1 2 1094 2 2 1 NAG C6 C 13.014 -0.722 -3.527 1.00 . B A . 101 NAG C6 1 1 2 1095 2 2 1 NAG C7 C 11.230 5.084 -0.737 1.00 . B A . 101 NAG C7 1 1 2 1096 2 2 1 NAG C8 C 10.740 6.050 0.353 1.00 . B A . 101 NAG C8 1 1 2 1097 2 2 1 NAG H1 H 11.396 1.020 -0.125 1.00 . B A . 101 NAG H1 1 1 2 1098 2 2 1 NAG H2 H 12.805 3.201 -1.751 1.00 . B A . 101 NAG H2 1 1 2 1099 2 2 1 NAG H3 H 10.091 1.781 -1.868 1.00 . B A . 101 NAG H3 1 1 2 1100 2 2 1 NAG H4 H 12.449 2.003 -3.781 1.00 . B A . 101 NAG H4 1 1 2 1101 2 2 1 NAG H5 H 11.324 -0.383 -2.276 1.00 . B A . 101 NAG H5 1 1 2 1102 2 2 1 NAG H61 H 13.294 -1.628 -2.990 1.00 . B A . 101 NAG H61 1 1 2 1103 2 2 1 NAG H62 H 12.437 -1.012 -4.404 1.00 . B A . 101 NAG H62 1 1 2 1104 2 2 1 NAG H81 H 9.682 5.871 0.550 1.00 . B A . 101 NAG H81 1 1 2 1105 2 2 1 NAG H82 H 10.873 7.079 0.021 1.00 . B A . 101 NAG H82 1 1 2 1106 2 2 1 NAG H83 H 11.310 5.893 1.270 1.00 . B A . 101 NAG H83 1 1 2 1107 2 2 1 NAG HN2 H 11.015 3.514 0.525 1.00 . B A . 101 NAG HN2 1 1 2 1108 2 2 1 NAG HO3 H 10.756 4.296 -2.745 1.00 . B A . 101 NAG HO3 1 1 2 1109 2 2 1 NAG HO4 H 10.205 1.893 -4.492 1.00 . B A . 101 NAG HO4 1 1 2 1110 2 2 1 NAG HO6 H 14.701 -0.585 -4.548 1.00 . B A . 101 NAG HO6 1 1 2 1111 2 2 1 NAG N2 N 11.364 3.807 -0.383 1.00 . B A . 101 NAG N2 1 1 2 1112 2 2 1 NAG O3 O 10.381 3.452 -3.102 1.00 . B A . 101 NAG O3 1 1 2 1113 2 2 1 NAG O4 O 10.681 1.070 -4.312 1.00 . B A . 101 NAG O4 1 1 2 1114 2 2 1 NAG O5 O 12.972 0.571 -1.417 1.00 . B A . 101 NAG O5 1 1 2 1115 2 2 1 NAG O6 O 14.202 -0.029 -3.946 1.00 . B A . 101 NAG O6 1 1 2 1116 2 2 1 NAG O7 O 11.459 5.449 -1.888 1.00 . B A . 101 NAG O7 1 1 3 1117 1 1 1 LYS C C -7.740 0.698 -2.252 1.00 . A A . 1 LYS C 1 1 3 1118 1 1 1 LYS CA C -8.513 2.013 -2.117 1.00 . A A . 1 LYS CA 1 1 3 1119 1 1 1 LYS CB C -9.195 2.408 -3.444 1.00 . A A . 1 LYS CB 1 1 3 1120 1 1 1 LYS CD C -10.058 4.807 -2.817 1.00 . A A . 1 LYS CD 1 1 3 1121 1 1 1 LYS CE C -9.206 5.626 -3.802 1.00 . A A . 1 LYS CE 1 1 3 1122 1 1 1 LYS CG C -10.380 3.384 -3.300 1.00 . A A . 1 LYS CG 1 1 3 1123 1 1 1 LYS H1 H -6.977 3.362 -2.448 1.00 . A A . 1 LYS H1 1 1 3 1124 1 1 1 LYS H2 H -6.942 2.682 -0.968 1.00 . A A . 1 LYS H2 1 1 3 1125 1 1 1 LYS H3 H -8.005 3.873 -1.259 1.00 . A A . 1 LYS H3 1 1 3 1126 1 1 1 LYS HA H -9.272 1.866 -1.347 1.00 . A A . 1 LYS HA 1 1 3 1127 1 1 1 LYS HB2 H -8.455 2.821 -4.132 1.00 . A A . 1 LYS HB2 1 1 3 1128 1 1 1 LYS HB3 H -9.595 1.506 -3.909 1.00 . A A . 1 LYS HB3 1 1 3 1129 1 1 1 LYS HD2 H -11.003 5.337 -2.684 1.00 . A A . 1 LYS HD2 1 1 3 1130 1 1 1 LYS HD3 H -9.597 4.764 -1.834 1.00 . A A . 1 LYS HD3 1 1 3 1131 1 1 1 LYS HE2 H -8.893 4.994 -4.637 1.00 . A A . 1 LYS HE2 1 1 3 1132 1 1 1 LYS HE3 H -9.837 6.423 -4.203 1.00 . A A . 1 LYS HE3 1 1 3 1133 1 1 1 LYS HG2 H -10.873 3.462 -4.270 1.00 . A A . 1 LYS HG2 1 1 3 1134 1 1 1 LYS HG3 H -11.097 2.943 -2.607 1.00 . A A . 1 LYS HG3 1 1 3 1135 1 1 1 LYS HZ1 H -8.236 6.516 -2.191 1.00 . A A . 1 LYS HZ1 1 1 3 1136 1 1 1 LYS HZ2 H -7.244 5.546 -3.135 1.00 . A A . 1 LYS HZ2 1 1 3 1137 1 1 1 LYS HZ3 H -7.687 7.033 -3.659 1.00 . A A . 1 LYS HZ3 1 1 3 1138 1 1 1 LYS N N -7.565 3.058 -1.675 1.00 . A A . 1 LYS N 1 1 3 1139 1 1 1 LYS NZ N -8.015 6.224 -3.157 1.00 . A A . 1 LYS NZ 1 1 3 1140 1 1 1 LYS O O -6.515 0.731 -2.187 1.00 . A A . 1 LYS O 1 1 3 1141 1 1 2 LEU C C -8.586 -2.605 -3.631 1.00 . A A . 2 LEU C 1 1 3 1142 1 1 2 LEU CA C -7.720 -1.711 -2.716 1.00 . A A . 2 LEU CA 1 1 3 1143 1 1 2 LEU CB C -7.388 -2.401 -1.375 1.00 . A A . 2 LEU CB 1 1 3 1144 1 1 2 LEU CD1 C -5.093 -3.194 -2.081 1.00 . A A . 2 LEU CD1 1 1 3 1145 1 1 2 LEU CD2 C -6.217 -4.269 -0.133 1.00 . A A . 2 LEU CD2 1 1 3 1146 1 1 2 LEU CG C -6.439 -3.609 -1.490 1.00 . A A . 2 LEU CG 1 1 3 1147 1 1 2 LEU H H -9.421 -0.487 -2.433 1.00 . A A . 2 LEU H 1 1 3 1148 1 1 2 LEU HA H -6.783 -1.474 -3.211 1.00 . A A . 2 LEU HA 1 1 3 1149 1 1 2 LEU HB2 H -6.913 -1.667 -0.723 1.00 . A A . 2 LEU HB2 1 1 3 1150 1 1 2 LEU HB3 H -8.317 -2.722 -0.900 1.00 . A A . 2 LEU HB3 1 1 3 1151 1 1 2 LEU HD11 H -4.667 -2.365 -1.513 1.00 . A A . 2 LEU HD11 1 1 3 1152 1 1 2 LEU HD12 H -4.425 -4.047 -2.050 1.00 . A A . 2 LEU HD12 1 1 3 1153 1 1 2 LEU HD13 H -5.198 -2.895 -3.121 1.00 . A A . 2 LEU HD13 1 1 3 1154 1 1 2 LEU HD21 H -5.628 -3.619 0.504 1.00 . A A . 2 LEU HD21 1 1 3 1155 1 1 2 LEU HD22 H -7.175 -4.488 0.338 1.00 . A A . 2 LEU HD22 1 1 3 1156 1 1 2 LEU HD23 H -5.683 -5.209 -0.267 1.00 . A A . 2 LEU HD23 1 1 3 1157 1 1 2 LEU HG H -6.873 -4.370 -2.122 1.00 . A A . 2 LEU HG 1 1 3 1158 1 1 2 LEU N N -8.411 -0.450 -2.421 1.00 . A A . 2 LEU N 1 1 3 1159 1 1 2 LEU O O -9.695 -2.954 -3.222 1.00 . A A . 2 LEU O 1 1 3 1160 1 1 3 PRO C C -8.688 -5.377 -5.348 1.00 . A A . 3 PRO C 1 1 3 1161 1 1 3 PRO CA C -8.865 -3.887 -5.728 1.00 . A A . 3 PRO CA 1 1 3 1162 1 1 3 PRO CB C -8.336 -3.626 -7.149 1.00 . A A . 3 PRO CB 1 1 3 1163 1 1 3 PRO CD C -7.004 -2.399 -5.565 1.00 . A A . 3 PRO CD 1 1 3 1164 1 1 3 PRO CG C -7.428 -2.402 -7.029 1.00 . A A . 3 PRO CG 1 1 3 1165 1 1 3 PRO HA H -9.921 -3.622 -5.691 1.00 . A A . 3 PRO HA 1 1 3 1166 1 1 3 PRO HB2 H -7.758 -4.478 -7.507 1.00 . A A . 3 PRO HB2 1 1 3 1167 1 1 3 PRO HB3 H -9.156 -3.430 -7.840 1.00 . A A . 3 PRO HB3 1 1 3 1168 1 1 3 PRO HD2 H -6.122 -3.025 -5.429 1.00 . A A . 3 PRO HD2 1 1 3 1169 1 1 3 PRO HD3 H -6.793 -1.374 -5.260 1.00 . A A . 3 PRO HD3 1 1 3 1170 1 1 3 PRO HG2 H -6.570 -2.462 -7.698 1.00 . A A . 3 PRO HG2 1 1 3 1171 1 1 3 PRO HG3 H -8.008 -1.501 -7.236 1.00 . A A . 3 PRO HG3 1 1 3 1172 1 1 3 PRO N N -8.129 -2.977 -4.846 1.00 . A A . 3 PRO N 1 1 3 1173 1 1 3 PRO O O -7.753 -5.725 -4.622 1.00 . A A . 3 PRO O 1 1 3 1174 1 1 4 PRO C C -7.968 -8.256 -6.092 1.00 . A A . 4 PRO C 1 1 3 1175 1 1 4 PRO CA C -9.371 -7.735 -5.741 1.00 . A A . 4 PRO CA 1 1 3 1176 1 1 4 PRO CB C -10.432 -8.362 -6.655 1.00 . A A . 4 PRO CB 1 1 3 1177 1 1 4 PRO CD C -10.701 -5.991 -6.701 1.00 . A A . 4 PRO CD 1 1 3 1178 1 1 4 PRO CG C -11.510 -7.285 -6.742 1.00 . A A . 4 PRO CG 1 1 3 1179 1 1 4 PRO HA H -9.605 -7.986 -4.706 1.00 . A A . 4 PRO HA 1 1 3 1180 1 1 4 PRO HB2 H -10.020 -8.535 -7.651 1.00 . A A . 4 PRO HB2 1 1 3 1181 1 1 4 PRO HB3 H -10.823 -9.292 -6.240 1.00 . A A . 4 PRO HB3 1 1 3 1182 1 1 4 PRO HD2 H -10.392 -5.720 -7.712 1.00 . A A . 4 PRO HD2 1 1 3 1183 1 1 4 PRO HD3 H -11.303 -5.196 -6.262 1.00 . A A . 4 PRO HD3 1 1 3 1184 1 1 4 PRO HG2 H -12.095 -7.369 -7.658 1.00 . A A . 4 PRO HG2 1 1 3 1185 1 1 4 PRO HG3 H -12.156 -7.341 -5.864 1.00 . A A . 4 PRO HG3 1 1 3 1186 1 1 4 PRO N N -9.522 -6.287 -5.897 1.00 . A A . 4 PRO N 1 1 3 1187 1 1 4 PRO O O -7.397 -7.902 -7.124 1.00 . A A . 4 PRO O 1 1 3 1188 1 1 5 GLY C C -4.886 -8.985 -5.086 1.00 . A A . 5 GLY C 1 1 3 1189 1 1 5 GLY CA C -6.135 -9.799 -5.453 1.00 . A A . 5 GLY CA 1 1 3 1190 1 1 5 GLY H H -7.924 -9.361 -4.392 1.00 . A A . 5 GLY H 1 1 3 1191 1 1 5 GLY HA2 H -6.117 -10.715 -4.865 1.00 . A A . 5 GLY HA2 1 1 3 1192 1 1 5 GLY HA3 H -6.054 -10.073 -6.505 1.00 . A A . 5 GLY HA3 1 1 3 1193 1 1 5 GLY N N -7.419 -9.123 -5.233 1.00 . A A . 5 GLY N 1 1 3 1194 1 1 5 GLY O O -3.783 -9.510 -5.215 1.00 . A A . 5 GLY O 1 1 3 1195 1 1 6 TRP C C -3.802 -7.082 -2.602 1.00 . A A . 6 TRP C 1 1 3 1196 1 1 6 TRP CA C -3.949 -6.902 -4.123 1.00 . A A . 6 TRP CA 1 1 3 1197 1 1 6 TRP CB C -4.231 -5.442 -4.487 1.00 . A A . 6 TRP CB 1 1 3 1198 1 1 6 TRP CD1 C -5.255 -5.387 -6.804 1.00 . A A . 6 TRP CD1 1 1 3 1199 1 1 6 TRP CD2 C -3.270 -4.349 -6.728 1.00 . A A . 6 TRP CD2 1 1 3 1200 1 1 6 TRP CE2 C -3.764 -4.211 -8.060 1.00 . A A . 6 TRP CE2 1 1 3 1201 1 1 6 TRP CE3 C -2.000 -3.799 -6.457 1.00 . A A . 6 TRP CE3 1 1 3 1202 1 1 6 TRP CG C -4.253 -5.094 -5.946 1.00 . A A . 6 TRP CG 1 1 3 1203 1 1 6 TRP CH2 C -1.779 -3.026 -8.767 1.00 . A A . 6 TRP CH2 1 1 3 1204 1 1 6 TRP CZ2 C -3.045 -3.552 -9.069 1.00 . A A . 6 TRP CZ2 1 1 3 1205 1 1 6 TRP CZ3 C -1.259 -3.159 -7.468 1.00 . A A . 6 TRP CZ3 1 1 3 1206 1 1 6 TRP H H -5.953 -7.313 -4.563 1.00 . A A . 6 TRP H 1 1 3 1207 1 1 6 TRP HA H -3.013 -7.188 -4.588 1.00 . A A . 6 TRP HA 1 1 3 1208 1 1 6 TRP HB2 H -5.195 -5.162 -4.061 1.00 . A A . 6 TRP HB2 1 1 3 1209 1 1 6 TRP HB3 H -3.469 -4.833 -4.016 1.00 . A A . 6 TRP HB3 1 1 3 1210 1 1 6 TRP HD1 H -6.153 -5.920 -6.530 1.00 . A A . 6 TRP HD1 1 1 3 1211 1 1 6 TRP HE1 H -5.601 -4.932 -8.843 1.00 . A A . 6 TRP HE1 1 1 3 1212 1 1 6 TRP HE3 H -1.582 -3.888 -5.466 1.00 . A A . 6 TRP HE3 1 1 3 1213 1 1 6 TRP HH2 H -1.201 -2.530 -9.534 1.00 . A A . 6 TRP HH2 1 1 3 1214 1 1 6 TRP HZ2 H -3.451 -3.470 -10.066 1.00 . A A . 6 TRP HZ2 1 1 3 1215 1 1 6 TRP HZ3 H -0.276 -2.778 -7.242 1.00 . A A . 6 TRP HZ3 1 1 3 1216 1 1 6 TRP N N -5.034 -7.729 -4.646 1.00 . A A . 6 TRP N 1 1 3 1217 1 1 6 TRP NE1 N -4.975 -4.867 -8.051 1.00 . A A . 6 TRP NE1 1 1 3 1218 1 1 6 TRP O O -4.792 -7.000 -1.877 1.00 . A A . 6 TRP O 1 1 3 1219 1 1 7 GLU C C -1.124 -6.918 -0.100 1.00 . A A . 7 GLU C 1 1 3 1220 1 1 7 GLU CA C -2.314 -7.693 -0.711 1.00 . A A . 7 GLU CA 1 1 3 1221 1 1 7 GLU CB C -2.092 -9.220 -0.661 1.00 . A A . 7 GLU CB 1 1 3 1222 1 1 7 GLU CD C -2.522 -9.492 1.823 1.00 . A A . 7 GLU CD 1 1 3 1223 1 1 7 GLU CG C -2.922 -9.927 0.416 1.00 . A A . 7 GLU CG 1 1 3 1224 1 1 7 GLU H H -1.810 -7.461 -2.759 1.00 . A A . 7 GLU H 1 1 3 1225 1 1 7 GLU HA H -3.198 -7.452 -0.116 1.00 . A A . 7 GLU HA 1 1 3 1226 1 1 7 GLU HB2 H -2.371 -9.663 -1.618 1.00 . A A . 7 GLU HB2 1 1 3 1227 1 1 7 GLU HB3 H -1.037 -9.434 -0.506 1.00 . A A . 7 GLU HB3 1 1 3 1228 1 1 7 GLU HG2 H -3.981 -9.718 0.250 1.00 . A A . 7 GLU HG2 1 1 3 1229 1 1 7 GLU HG3 H -2.774 -11.004 0.316 1.00 . A A . 7 GLU HG3 1 1 3 1230 1 1 7 GLU N N -2.579 -7.316 -2.108 1.00 . A A . 7 GLU N 1 1 3 1231 1 1 7 GLU O O -0.164 -6.593 -0.796 1.00 . A A . 7 GLU O 1 1 3 1232 1 1 7 GLU OE1 O -3.030 -8.451 2.304 1.00 . A A . 7 GLU OE1 1 1 3 1233 1 1 7 GLU OE2 O -1.659 -10.156 2.445 1.00 . A A . 7 GLU OE2 1 1 3 1234 1 1 8 LYS C C 1.188 -6.223 2.075 1.00 . A A . 8 LYS C 1 1 3 1235 1 1 8 LYS CA C -0.270 -5.731 1.957 1.00 . A A . 8 LYS CA 1 1 3 1236 1 1 8 LYS CB C -0.887 -5.471 3.344 1.00 . A A . 8 LYS CB 1 1 3 1237 1 1 8 LYS CD C -2.036 -6.788 5.225 1.00 . A A . 8 LYS CD 1 1 3 1238 1 1 8 LYS CE C -2.197 -8.189 5.834 1.00 . A A . 8 LYS CE 1 1 3 1239 1 1 8 LYS CG C -0.860 -6.719 4.242 1.00 . A A . 8 LYS CG 1 1 3 1240 1 1 8 LYS H H -1.951 -7.052 1.732 1.00 . A A . 8 LYS H 1 1 3 1241 1 1 8 LYS HA H -0.251 -4.777 1.424 1.00 . A A . 8 LYS HA 1 1 3 1242 1 1 8 LYS HB2 H -0.350 -4.661 3.840 1.00 . A A . 8 LYS HB2 1 1 3 1243 1 1 8 LYS HB3 H -1.918 -5.148 3.204 1.00 . A A . 8 LYS HB3 1 1 3 1244 1 1 8 LYS HD2 H -1.873 -6.062 6.023 1.00 . A A . 8 LYS HD2 1 1 3 1245 1 1 8 LYS HD3 H -2.962 -6.529 4.709 1.00 . A A . 8 LYS HD3 1 1 3 1246 1 1 8 LYS HE2 H -1.262 -8.491 6.313 1.00 . A A . 8 LYS HE2 1 1 3 1247 1 1 8 LYS HE3 H -2.969 -8.128 6.603 1.00 . A A . 8 LYS HE3 1 1 3 1248 1 1 8 LYS HG2 H -0.881 -7.604 3.611 1.00 . A A . 8 LYS HG2 1 1 3 1249 1 1 8 LYS HG3 H 0.086 -6.727 4.787 1.00 . A A . 8 LYS HG3 1 1 3 1250 1 1 8 LYS HZ1 H -3.178 -8.762 4.081 1.00 . A A . 8 LYS HZ1 1 1 3 1251 1 1 8 LYS HZ2 H -1.835 -9.522 4.227 1.00 . A A . 8 LYS HZ2 1 1 3 1252 1 1 8 LYS HZ3 H -3.074 -9.990 5.210 1.00 . A A . 8 LYS HZ3 1 1 3 1253 1 1 8 LYS N N -1.178 -6.632 1.209 1.00 . A A . 8 LYS N 1 1 3 1254 1 1 8 LYS NZ N -2.605 -9.191 4.816 1.00 . A A . 8 LYS NZ 1 1 3 1255 1 1 8 LYS O O 1.458 -7.306 2.601 1.00 . A A . 8 LYS O 1 1 3 1256 1 1 9 ARG C C 4.389 -4.522 2.263 1.00 . A A . 9 ARG C 1 1 3 1257 1 1 9 ARG CA C 3.611 -5.706 1.658 1.00 . A A . 9 ARG CA 1 1 3 1258 1 1 9 ARG CB C 4.158 -5.946 0.235 1.00 . A A . 9 ARG CB 1 1 3 1259 1 1 9 ARG CD C 3.562 -8.443 -0.400 1.00 . A A . 9 ARG CD 1 1 3 1260 1 1 9 ARG CG C 3.508 -6.944 -0.734 1.00 . A A . 9 ARG CG 1 1 3 1261 1 1 9 ARG CZ C 1.634 -9.730 0.647 1.00 . A A . 9 ARG CZ 1 1 3 1262 1 1 9 ARG H H 1.867 -4.501 1.319 1.00 . A A . 9 ARG H 1 1 3 1263 1 1 9 ARG HA H 3.815 -6.581 2.277 1.00 . A A . 9 ARG HA 1 1 3 1264 1 1 9 ARG HB2 H 4.107 -4.979 -0.260 1.00 . A A . 9 ARG HB2 1 1 3 1265 1 1 9 ARG HB3 H 5.211 -6.221 0.307 1.00 . A A . 9 ARG HB3 1 1 3 1266 1 1 9 ARG HD2 H 3.354 -8.994 -1.317 1.00 . A A . 9 ARG HD2 1 1 3 1267 1 1 9 ARG HD3 H 4.571 -8.702 -0.070 1.00 . A A . 9 ARG HD3 1 1 3 1268 1 1 9 ARG HE H 2.536 -8.190 1.437 1.00 . A A . 9 ARG HE 1 1 3 1269 1 1 9 ARG HG2 H 2.486 -6.628 -0.932 1.00 . A A . 9 ARG HG2 1 1 3 1270 1 1 9 ARG HG3 H 4.059 -6.841 -1.666 1.00 . A A . 9 ARG HG3 1 1 3 1271 1 1 9 ARG HH11 H 2.065 -10.590 -1.110 1.00 . A A . 9 ARG HH11 1 1 3 1272 1 1 9 ARG HH12 H 0.691 -11.254 -0.245 1.00 . A A . 9 ARG HH12 1 1 3 1273 1 1 9 ARG HH21 H 0.968 -8.958 2.328 1.00 . A A . 9 ARG HH21 1 1 3 1274 1 1 9 ARG HH22 H -0.055 -10.241 1.790 1.00 . A A . 9 ARG HH22 1 1 3 1275 1 1 9 ARG N N 2.159 -5.424 1.632 1.00 . A A . 9 ARG N 1 1 3 1276 1 1 9 ARG NE N 2.593 -8.813 0.638 1.00 . A A . 9 ARG NE 1 1 3 1277 1 1 9 ARG NH1 N 1.449 -10.599 -0.319 1.00 . A A . 9 ARG NH1 1 1 3 1278 1 1 9 ARG NH2 N 0.833 -9.732 1.681 1.00 . A A . 9 ARG NH2 1 1 3 1279 1 1 9 ARG O O 3.823 -3.461 2.527 1.00 . A A . 9 ARG O 1 1 3 1280 1 1 10 MET C C 8.035 -3.848 2.356 1.00 . A A . 10 MET C 1 1 3 1281 1 1 10 MET CA C 6.616 -3.651 2.908 1.00 . A A . 10 MET CA 1 1 3 1282 1 1 10 MET CB C 6.632 -3.716 4.446 1.00 . A A . 10 MET CB 1 1 3 1283 1 1 10 MET CE C 6.014 -2.559 7.517 1.00 . A A . 10 MET CE 1 1 3 1284 1 1 10 MET CG C 7.406 -2.546 5.069 1.00 . A A . 10 MET CG 1 1 3 1285 1 1 10 MET H H 6.140 -5.552 2.126 1.00 . A A . 10 MET H 1 1 3 1286 1 1 10 MET HA H 6.247 -2.676 2.602 1.00 . A A . 10 MET HA 1 1 3 1287 1 1 10 MET HB2 H 5.608 -3.692 4.817 1.00 . A A . 10 MET HB2 1 1 3 1288 1 1 10 MET HB3 H 7.090 -4.655 4.762 1.00 . A A . 10 MET HB3 1 1 3 1289 1 1 10 MET HE1 H 5.394 -3.359 7.113 1.00 . A A . 10 MET HE1 1 1 3 1290 1 1 10 MET HE2 H 6.049 -2.651 8.603 1.00 . A A . 10 MET HE2 1 1 3 1291 1 1 10 MET HE3 H 5.585 -1.592 7.258 1.00 . A A . 10 MET HE3 1 1 3 1292 1 1 10 MET HG2 H 8.385 -2.483 4.598 1.00 . A A . 10 MET HG2 1 1 3 1293 1 1 10 MET HG3 H 6.876 -1.617 4.862 1.00 . A A . 10 MET HG3 1 1 3 1294 1 1 10 MET N N 5.713 -4.675 2.385 1.00 . A A . 10 MET N 1 1 3 1295 1 1 10 MET O O 8.600 -4.937 2.422 1.00 . A A . 10 MET O 1 1 3 1296 1 1 10 MET SD S 7.697 -2.678 6.856 1.00 . A A . 10 MET SD 1 1 3 1297 1 1 11 PHE C C 10.876 -2.552 2.636 1.00 . A A . 11 PHE C 1 1 3 1298 1 1 11 PHE CA C 9.989 -2.656 1.387 1.00 . A A . 11 PHE CA 1 1 3 1299 1 1 11 PHE CB C 10.153 -1.405 0.514 1.00 . A A . 11 PHE CB 1 1 3 1300 1 1 11 PHE CD1 C 10.013 -2.316 -1.840 1.00 . A A . 11 PHE CD1 1 1 3 1301 1 1 11 PHE CD2 C 8.391 -0.633 -1.150 1.00 . A A . 11 PHE CD2 1 1 3 1302 1 1 11 PHE CE1 C 9.442 -2.350 -3.123 1.00 . A A . 11 PHE CE1 1 1 3 1303 1 1 11 PHE CE2 C 7.833 -0.659 -2.442 1.00 . A A . 11 PHE CE2 1 1 3 1304 1 1 11 PHE CG C 9.484 -1.470 -0.844 1.00 . A A . 11 PHE CG 1 1 3 1305 1 1 11 PHE CZ C 8.351 -1.519 -3.424 1.00 . A A . 11 PHE CZ 1 1 3 1306 1 1 11 PHE H H 8.050 -1.919 1.756 1.00 . A A . 11 PHE H 1 1 3 1307 1 1 11 PHE HA H 10.282 -3.525 0.801 1.00 . A A . 11 PHE HA 1 1 3 1308 1 1 11 PHE HB2 H 9.797 -0.531 1.061 1.00 . A A . 11 PHE HB2 1 1 3 1309 1 1 11 PHE HB3 H 11.214 -1.263 0.333 1.00 . A A . 11 PHE HB3 1 1 3 1310 1 1 11 PHE HD1 H 10.886 -2.918 -1.640 1.00 . A A . 11 PHE HD1 1 1 3 1311 1 1 11 PHE HD2 H 7.975 0.030 -0.401 1.00 . A A . 11 PHE HD2 1 1 3 1312 1 1 11 PHE HE1 H 9.850 -2.999 -3.885 1.00 . A A . 11 PHE HE1 1 1 3 1313 1 1 11 PHE HE2 H 6.993 -0.031 -2.691 1.00 . A A . 11 PHE HE2 1 1 3 1314 1 1 11 PHE HZ H 7.913 -1.537 -4.413 1.00 . A A . 11 PHE HZ 1 1 3 1315 1 1 11 PHE N N 8.593 -2.776 1.790 1.00 . A A . 11 PHE N 1 1 3 1316 1 1 11 PHE O O 10.589 -1.741 3.520 1.00 . A A . 11 PHE O 1 1 3 1317 1 1 12 ALA C C 13.498 -2.098 4.278 1.00 . A A . 12 ALA C 1 1 3 1318 1 1 12 ALA CA C 12.830 -3.431 3.883 1.00 . A A . 12 ALA CA 1 1 3 1319 1 1 12 ALA CB C 13.883 -4.514 3.619 1.00 . A A . 12 ALA CB 1 1 3 1320 1 1 12 ALA H H 12.148 -3.989 1.958 1.00 . A A . 12 ALA H 1 1 3 1321 1 1 12 ALA HA H 12.225 -3.748 4.735 1.00 . A A . 12 ALA HA 1 1 3 1322 1 1 12 ALA HB1 H 14.507 -4.232 2.771 1.00 . A A . 12 ALA HB1 1 1 3 1323 1 1 12 ALA HB2 H 14.514 -4.630 4.502 1.00 . A A . 12 ALA HB2 1 1 3 1324 1 1 12 ALA HB3 H 13.393 -5.466 3.411 1.00 . A A . 12 ALA HB3 1 1 3 1325 1 1 12 ALA N N 11.954 -3.343 2.708 1.00 . A A . 12 ALA N 1 1 3 1326 1 1 12 ALA O O 13.757 -1.863 5.455 1.00 . A A . 12 ALA O 1 1 3 1327 1 1 13 ASN C C 13.032 1.114 4.062 1.00 . A A . 13 ASN C 1 1 3 1328 1 1 13 ASN CA C 14.148 0.191 3.508 1.00 . A A . 13 ASN CA 1 1 3 1329 1 1 13 ASN CB C 14.785 0.711 2.199 1.00 . A A . 13 ASN CB 1 1 3 1330 1 1 13 ASN CG C 13.918 0.509 0.961 1.00 . A A . 13 ASN CG 1 1 3 1331 1 1 13 ASN H H 13.514 -1.448 2.349 1.00 . A A . 13 ASN H 1 1 3 1332 1 1 13 ASN HA H 14.927 0.191 4.272 1.00 . A A . 13 ASN HA 1 1 3 1333 1 1 13 ASN HB2 H 15.031 1.768 2.312 1.00 . A A . 13 ASN HB2 1 1 3 1334 1 1 13 ASN HB3 H 15.720 0.179 2.030 1.00 . A A . 13 ASN HB3 1 1 3 1335 1 1 13 ASN HD21 H 13.831 2.522 0.597 1.00 . A A . 13 ASN HD21 1 1 3 1336 1 1 13 ASN N N 13.720 -1.200 3.312 1.00 . A A . 13 ASN N 1 1 3 1337 1 1 13 ASN ND2 N 13.537 1.591 0.292 1.00 . A A . 13 ASN ND2 1 1 3 1338 1 1 13 ASN O O 13.241 2.320 4.164 1.00 . A A . 13 ASN O 1 1 3 1339 1 1 13 ASN OD1 O 13.557 -0.626 0.655 1.00 . A A . 13 ASN OD1 1 1 3 1340 1 1 14 GLY C C 9.721 1.888 4.260 1.00 . A A . 14 GLY C 1 1 3 1341 1 1 14 GLY CA C 10.789 1.246 5.142 1.00 . A A . 14 GLY CA 1 1 3 1342 1 1 14 GLY H H 11.703 -0.420 4.234 1.00 . A A . 14 GLY H 1 1 3 1343 1 1 14 GLY HA2 H 10.300 0.518 5.790 1.00 . A A . 14 GLY HA2 1 1 3 1344 1 1 14 GLY HA3 H 11.219 2.022 5.778 1.00 . A A . 14 GLY HA3 1 1 3 1345 1 1 14 GLY N N 11.859 0.568 4.413 1.00 . A A . 14 GLY N 1 1 3 1346 1 1 14 GLY O O 9.568 3.109 4.274 1.00 . A A . 14 GLY O 1 1 3 1347 1 1 15 THR C C 6.732 0.578 2.524 1.00 . A A . 15 THR C 1 1 3 1348 1 1 15 THR CA C 7.776 1.661 2.776 1.00 . A A . 15 THR CA 1 1 3 1349 1 1 15 THR CB C 8.205 2.359 1.474 1.00 . A A . 15 THR CB 1 1 3 1350 1 1 15 THR CG2 C 7.054 2.919 0.644 1.00 . A A . 15 THR CG2 1 1 3 1351 1 1 15 THR H H 9.129 0.113 3.395 1.00 . A A . 15 THR H 1 1 3 1352 1 1 15 THR HA H 7.305 2.415 3.399 1.00 . A A . 15 THR HA 1 1 3 1353 1 1 15 THR HB H 8.794 1.673 0.867 1.00 . A A . 15 THR HB 1 1 3 1354 1 1 15 THR HG1 H 9.199 3.433 2.759 1.00 . A A . 15 THR HG1 1 1 3 1355 1 1 15 THR HG21 H 7.466 3.426 -0.228 1.00 . A A . 15 THR HG21 1 1 3 1356 1 1 15 THR HG22 H 6.395 2.118 0.316 1.00 . A A . 15 THR HG22 1 1 3 1357 1 1 15 THR HG23 H 6.491 3.640 1.237 1.00 . A A . 15 THR HG23 1 1 3 1358 1 1 15 THR N N 8.956 1.113 3.477 1.00 . A A . 15 THR N 1 1 3 1359 1 1 15 THR O O 7.065 -0.478 1.997 1.00 . A A . 15 THR O 1 1 3 1360 1 1 15 THR OG1 O 8.987 3.484 1.795 1.00 . A A . 15 THR OG1 1 1 3 1361 1 1 16 VAL C C 3.648 0.112 1.391 1.00 . A A . 16 VAL C 1 1 3 1362 1 1 16 VAL CA C 4.359 -0.116 2.722 1.00 . A A . 16 VAL CA 1 1 3 1363 1 1 16 VAL CB C 3.374 0.011 3.908 1.00 . A A . 16 VAL CB 1 1 3 1364 1 1 16 VAL CG1 C 1.977 -0.585 3.666 1.00 . A A . 16 VAL CG1 1 1 3 1365 1 1 16 VAL CG2 C 3.966 -0.714 5.120 1.00 . A A . 16 VAL CG2 1 1 3 1366 1 1 16 VAL H H 5.220 1.756 3.224 1.00 . A A . 16 VAL H 1 1 3 1367 1 1 16 VAL HA H 4.753 -1.129 2.718 1.00 . A A . 16 VAL HA 1 1 3 1368 1 1 16 VAL HB H 3.247 1.066 4.153 1.00 . A A . 16 VAL HB 1 1 3 1369 1 1 16 VAL HG11 H 2.056 -1.633 3.373 1.00 . A A . 16 VAL HG11 1 1 3 1370 1 1 16 VAL HG12 H 1.384 -0.519 4.579 1.00 . A A . 16 VAL HG12 1 1 3 1371 1 1 16 VAL HG13 H 1.455 -0.028 2.889 1.00 . A A . 16 VAL HG13 1 1 3 1372 1 1 16 VAL HG21 H 4.950 -0.308 5.352 1.00 . A A . 16 VAL HG21 1 1 3 1373 1 1 16 VAL HG22 H 3.318 -0.579 5.986 1.00 . A A . 16 VAL HG22 1 1 3 1374 1 1 16 VAL HG23 H 4.048 -1.781 4.900 1.00 . A A . 16 VAL HG23 1 1 3 1375 1 1 16 VAL N N 5.464 0.845 2.862 1.00 . A A . 16 VAL N 1 1 3 1376 1 1 16 VAL O O 3.473 1.246 0.947 1.00 . A A . 16 VAL O 1 1 3 1377 1 1 17 TYR C C 1.546 -2.206 -0.531 1.00 . A A . 17 TYR C 1 1 3 1378 1 1 17 TYR CA C 2.482 -0.996 -0.483 1.00 . A A . 17 TYR CA 1 1 3 1379 1 1 17 TYR CB C 3.478 -1.018 -1.661 1.00 . A A . 17 TYR CB 1 1 3 1380 1 1 17 TYR CD1 C 5.551 -2.260 -0.940 1.00 . A A . 17 TYR CD1 1 1 3 1381 1 1 17 TYR CD2 C 4.107 -3.311 -2.602 1.00 . A A . 17 TYR CD2 1 1 3 1382 1 1 17 TYR CE1 C 6.452 -3.333 -1.031 1.00 . A A . 17 TYR CE1 1 1 3 1383 1 1 17 TYR CE2 C 5.010 -4.391 -2.703 1.00 . A A . 17 TYR CE2 1 1 3 1384 1 1 17 TYR CG C 4.388 -2.235 -1.732 1.00 . A A . 17 TYR CG 1 1 3 1385 1 1 17 TYR CZ C 6.192 -4.394 -1.928 1.00 . A A . 17 TYR CZ 1 1 3 1386 1 1 17 TYR H H 3.355 -1.897 1.218 1.00 . A A . 17 TYR H 1 1 3 1387 1 1 17 TYR HA H 1.876 -0.092 -0.554 1.00 . A A . 17 TYR HA 1 1 3 1388 1 1 17 TYR HB2 H 2.935 -0.931 -2.600 1.00 . A A . 17 TYR HB2 1 1 3 1389 1 1 17 TYR HB3 H 4.113 -0.134 -1.589 1.00 . A A . 17 TYR HB3 1 1 3 1390 1 1 17 TYR HD1 H 5.764 -1.426 -0.283 1.00 . A A . 17 TYR HD1 1 1 3 1391 1 1 17 TYR HD2 H 3.206 -3.312 -3.198 1.00 . A A . 17 TYR HD2 1 1 3 1392 1 1 17 TYR HE1 H 7.350 -3.314 -0.433 1.00 . A A . 17 TYR HE1 1 1 3 1393 1 1 17 TYR HE2 H 4.813 -5.235 -3.352 1.00 . A A . 17 TYR HE2 1 1 3 1394 1 1 17 TYR HH H 7.879 -5.263 -1.561 1.00 . A A . 17 TYR HH 1 1 3 1395 1 1 17 TYR N N 3.235 -0.992 0.768 1.00 . A A . 17 TYR N 1 1 3 1396 1 1 17 TYR O O 1.543 -3.042 0.372 1.00 . A A . 17 TYR O 1 1 3 1397 1 1 17 TYR OH O 7.055 -5.440 -2.018 1.00 . A A . 17 TYR OH 1 1 3 1398 1 1 18 TYR C C 0.348 -4.094 -3.250 1.00 . A A . 18 TYR C 1 1 3 1399 1 1 18 TYR CA C -0.071 -3.465 -1.922 1.00 . A A . 18 TYR CA 1 1 3 1400 1 1 18 TYR CB C -1.550 -3.059 -1.874 1.00 . A A . 18 TYR CB 1 1 3 1401 1 1 18 TYR CD1 C -1.467 -1.603 0.182 1.00 . A A . 18 TYR CD1 1 1 3 1402 1 1 18 TYR CD2 C -2.850 -3.592 0.256 1.00 . A A . 18 TYR CD2 1 1 3 1403 1 1 18 TYR CE1 C -1.656 -1.404 1.551 1.00 . A A . 18 TYR CE1 1 1 3 1404 1 1 18 TYR CE2 C -3.152 -3.332 1.599 1.00 . A A . 18 TYR CE2 1 1 3 1405 1 1 18 TYR CG C -1.994 -2.735 -0.459 1.00 . A A . 18 TYR CG 1 1 3 1406 1 1 18 TYR CZ C -2.507 -2.271 2.274 1.00 . A A . 18 TYR CZ 1 1 3 1407 1 1 18 TYR H H 0.693 -1.520 -2.227 1.00 . A A . 18 TYR H 1 1 3 1408 1 1 18 TYR HA H 0.068 -4.214 -1.145 1.00 . A A . 18 TYR HA 1 1 3 1409 1 1 18 TYR HB2 H -1.720 -2.197 -2.521 1.00 . A A . 18 TYR HB2 1 1 3 1410 1 1 18 TYR HB3 H -2.143 -3.891 -2.251 1.00 . A A . 18 TYR HB3 1 1 3 1411 1 1 18 TYR HD1 H -0.861 -0.905 -0.367 1.00 . A A . 18 TYR HD1 1 1 3 1412 1 1 18 TYR HD2 H -3.315 -4.448 -0.200 1.00 . A A . 18 TYR HD2 1 1 3 1413 1 1 18 TYR HE1 H -1.126 -0.576 1.984 1.00 . A A . 18 TYR HE1 1 1 3 1414 1 1 18 TYR HE2 H -3.876 -3.969 2.084 1.00 . A A . 18 TYR HE2 1 1 3 1415 1 1 18 TYR HH H -2.167 -1.388 3.965 1.00 . A A . 18 TYR HH 1 1 3 1416 1 1 18 TYR N N 0.789 -2.328 -1.620 1.00 . A A . 18 TYR N 1 1 3 1417 1 1 18 TYR O O 0.720 -3.410 -4.206 1.00 . A A . 18 TYR O 1 1 3 1418 1 1 18 TYR OH O -2.731 -2.072 3.601 1.00 . A A . 18 TYR OH 1 1 3 1419 1 1 19 PHE C C -0.235 -7.198 -4.884 1.00 . A A . 19 PHE C 1 1 3 1420 1 1 19 PHE CA C 0.836 -6.270 -4.332 1.00 . A A . 19 PHE CA 1 1 3 1421 1 1 19 PHE CB C 1.986 -7.056 -3.709 1.00 . A A . 19 PHE CB 1 1 3 1422 1 1 19 PHE CD1 C 2.289 -9.368 -4.702 1.00 . A A . 19 PHE CD1 1 1 3 1423 1 1 19 PHE CD2 C 3.857 -7.602 -5.303 1.00 . A A . 19 PHE CD2 1 1 3 1424 1 1 19 PHE CE1 C 3.032 -10.286 -5.465 1.00 . A A . 19 PHE CE1 1 1 3 1425 1 1 19 PHE CE2 C 4.604 -8.520 -6.054 1.00 . A A . 19 PHE CE2 1 1 3 1426 1 1 19 PHE CG C 2.709 -8.026 -4.614 1.00 . A A . 19 PHE CG 1 1 3 1427 1 1 19 PHE CZ C 4.196 -9.864 -6.132 1.00 . A A . 19 PHE CZ 1 1 3 1428 1 1 19 PHE H H 0.016 -5.907 -2.431 1.00 . A A . 19 PHE H 1 1 3 1429 1 1 19 PHE HA H 1.236 -5.659 -5.139 1.00 . A A . 19 PHE HA 1 1 3 1430 1 1 19 PHE HB2 H 2.710 -6.328 -3.350 1.00 . A A . 19 PHE HB2 1 1 3 1431 1 1 19 PHE HB3 H 1.607 -7.613 -2.850 1.00 . A A . 19 PHE HB3 1 1 3 1432 1 1 19 PHE HD1 H 1.403 -9.698 -4.177 1.00 . A A . 19 PHE HD1 1 1 3 1433 1 1 19 PHE HD2 H 4.184 -6.575 -5.246 1.00 . A A . 19 PHE HD2 1 1 3 1434 1 1 19 PHE HE1 H 2.718 -11.319 -5.531 1.00 . A A . 19 PHE HE1 1 1 3 1435 1 1 19 PHE HE2 H 5.490 -8.170 -6.563 1.00 . A A . 19 PHE HE2 1 1 3 1436 1 1 19 PHE HZ H 4.761 -10.570 -6.723 1.00 . A A . 19 PHE HZ 1 1 3 1437 1 1 19 PHE N N 0.296 -5.422 -3.281 1.00 . A A . 19 PHE N 1 1 3 1438 1 1 19 PHE O O -0.773 -8.034 -4.159 1.00 . A A . 19 PHE O 1 1 3 1439 1 1 20 ASN C C -0.782 -9.300 -7.091 1.00 . A A . 20 ASN C 1 1 3 1440 1 1 20 ASN CA C -1.423 -7.919 -6.910 1.00 . A A . 20 ASN CA 1 1 3 1441 1 1 20 ASN CB C -1.757 -7.270 -8.251 1.00 . A A . 20 ASN CB 1 1 3 1442 1 1 20 ASN CG C -2.822 -8.084 -8.948 1.00 . A A . 20 ASN CG 1 1 3 1443 1 1 20 ASN H H -0.065 -6.321 -6.703 1.00 . A A . 20 ASN H 1 1 3 1444 1 1 20 ASN HA H -2.350 -8.036 -6.360 1.00 . A A . 20 ASN HA 1 1 3 1445 1 1 20 ASN HB2 H -2.099 -6.254 -8.111 1.00 . A A . 20 ASN HB2 1 1 3 1446 1 1 20 ASN HB3 H -0.862 -7.228 -8.869 1.00 . A A . 20 ASN HB3 1 1 3 1447 1 1 20 ASN HD21 H -4.353 -7.056 -8.074 1.00 . A A . 20 ASN HD21 1 1 3 1448 1 1 20 ASN HD22 H -4.786 -8.385 -9.131 1.00 . A A . 20 ASN HD22 1 1 3 1449 1 1 20 ASN N N -0.550 -7.036 -6.166 1.00 . A A . 20 ASN N 1 1 3 1450 1 1 20 ASN ND2 N -4.086 -7.811 -8.693 1.00 . A A . 20 ASN ND2 1 1 3 1451 1 1 20 ASN O O -0.013 -9.517 -8.030 1.00 . A A . 20 ASN O 1 1 3 1452 1 1 20 ASN OD1 O -2.507 -9.010 -9.682 1.00 . A A . 20 ASN OD1 1 1 3 1453 1 1 21 HIS C C -1.058 -12.450 -7.492 1.00 . A A . 21 HIS C 1 1 3 1454 1 1 21 HIS CA C -0.549 -11.612 -6.301 1.00 . A A . 21 HIS CA 1 1 3 1455 1 1 21 HIS CB C -0.711 -12.318 -4.945 1.00 . A A . 21 HIS CB 1 1 3 1456 1 1 21 HIS CD2 C -3.092 -13.259 -5.084 1.00 . A A . 21 HIS CD2 1 1 3 1457 1 1 21 HIS CE1 C -3.936 -12.334 -3.265 1.00 . A A . 21 HIS CE1 1 1 3 1458 1 1 21 HIS CG C -2.133 -12.498 -4.478 1.00 . A A . 21 HIS CG 1 1 3 1459 1 1 21 HIS H H -1.795 -10.059 -5.494 1.00 . A A . 21 HIS H 1 1 3 1460 1 1 21 HIS HA H 0.523 -11.508 -6.473 1.00 . A A . 21 HIS HA 1 1 3 1461 1 1 21 HIS HB2 H -0.223 -13.291 -4.988 1.00 . A A . 21 HIS HB2 1 1 3 1462 1 1 21 HIS HB3 H -0.182 -11.731 -4.192 1.00 . A A . 21 HIS HB3 1 1 3 1463 1 1 21 HIS HD2 H -2.970 -13.844 -5.984 1.00 . A A . 21 HIS HD2 1 1 3 1464 1 1 21 HIS HE1 H -4.625 -12.059 -2.479 1.00 . A A . 21 HIS HE1 1 1 3 1465 1 1 21 HIS HE2 H -5.112 -13.589 -4.471 1.00 . A A . 21 HIS HE2 1 1 3 1466 1 1 21 HIS N N -1.115 -10.261 -6.227 1.00 . A A . 21 HIS N 1 1 3 1467 1 1 21 HIS ND1 N -2.663 -11.923 -3.326 1.00 . A A . 21 HIS ND1 1 1 3 1468 1 1 21 HIS NE2 N -4.224 -13.138 -4.307 1.00 . A A . 21 HIS NE2 1 1 3 1469 1 1 21 HIS O O -0.736 -13.631 -7.575 1.00 . A A . 21 HIS O 1 1 3 1470 1 1 22 ILE C C -1.304 -12.070 -10.831 1.00 . A A . 22 ILE C 1 1 3 1471 1 1 22 ILE CA C -2.250 -12.487 -9.678 1.00 . A A . 22 ILE CA 1 1 3 1472 1 1 22 ILE CB C -3.744 -12.154 -9.966 1.00 . A A . 22 ILE CB 1 1 3 1473 1 1 22 ILE CD1 C -6.113 -12.047 -8.889 1.00 . A A . 22 ILE CD1 1 1 3 1474 1 1 22 ILE CG1 C -4.642 -12.454 -8.734 1.00 . A A . 22 ILE CG1 1 1 3 1475 1 1 22 ILE CG2 C -4.257 -12.924 -11.198 1.00 . A A . 22 ILE CG2 1 1 3 1476 1 1 22 ILE H H -2.076 -10.881 -8.312 1.00 . A A . 22 ILE H 1 1 3 1477 1 1 22 ILE HA H -2.168 -13.571 -9.578 1.00 . A A . 22 ILE HA 1 1 3 1478 1 1 22 ILE HB H -3.826 -11.090 -10.187 1.00 . A A . 22 ILE HB 1 1 3 1479 1 1 22 ILE HD11 H -6.619 -12.159 -7.930 1.00 . A A . 22 ILE HD11 1 1 3 1480 1 1 22 ILE HD12 H -6.180 -11.005 -9.204 1.00 . A A . 22 ILE HD12 1 1 3 1481 1 1 22 ILE HD13 H -6.616 -12.685 -9.616 1.00 . A A . 22 ILE HD13 1 1 3 1482 1 1 22 ILE HG12 H -4.593 -13.519 -8.502 1.00 . A A . 22 ILE HG12 1 1 3 1483 1 1 22 ILE HG13 H -4.272 -11.906 -7.867 1.00 . A A . 22 ILE HG13 1 1 3 1484 1 1 22 ILE HG21 H -3.682 -12.658 -12.083 1.00 . A A . 22 ILE HG21 1 1 3 1485 1 1 22 ILE HG22 H -4.177 -13.999 -11.029 1.00 . A A . 22 ILE HG22 1 1 3 1486 1 1 22 ILE HG23 H -5.293 -12.668 -11.410 1.00 . A A . 22 ILE HG23 1 1 3 1487 1 1 22 ILE N N -1.831 -11.859 -8.418 1.00 . A A . 22 ILE N 1 1 3 1488 1 1 22 ILE O O -1.218 -12.766 -11.840 1.00 . A A . 22 ILE O 1 1 3 1489 1 1 23 THR C C 1.660 -9.906 -11.316 1.00 . A A . 23 THR C 1 1 3 1490 1 1 23 THR CA C 0.259 -10.350 -11.746 1.00 . A A . 23 THR CA 1 1 3 1491 1 1 23 THR CB C -0.431 -9.100 -12.316 1.00 . A A . 23 THR CB 1 1 3 1492 1 1 23 THR CG2 C -1.779 -9.390 -12.978 1.00 . A A . 23 THR CG2 1 1 3 1493 1 1 23 THR H H -0.695 -10.426 -9.826 1.00 . A A . 23 THR H 1 1 3 1494 1 1 23 THR HA H 0.388 -11.064 -12.559 1.00 . A A . 23 THR HA 1 1 3 1495 1 1 23 THR HB H 0.222 -8.650 -13.065 1.00 . A A . 23 THR HB 1 1 3 1496 1 1 23 THR HG1 H -1.372 -8.516 -10.734 1.00 . A A . 23 THR HG1 1 1 3 1497 1 1 23 THR HG21 H -1.642 -10.116 -13.779 1.00 . A A . 23 THR HG21 1 1 3 1498 1 1 23 THR HG22 H -2.490 -9.789 -12.256 1.00 . A A . 23 THR HG22 1 1 3 1499 1 1 23 THR HG23 H -2.179 -8.468 -13.400 1.00 . A A . 23 THR HG23 1 1 3 1500 1 1 23 THR N N -0.560 -10.961 -10.677 1.00 . A A . 23 THR N 1 1 3 1501 1 1 23 THR O O 2.522 -9.749 -12.178 1.00 . A A . 23 THR O 1 1 3 1502 1 1 23 THR OG1 O -0.627 -8.168 -11.274 1.00 . A A . 23 THR OG1 1 1 3 1503 1 1 24 ASN C C 3.044 -7.577 -9.359 1.00 . A A . 24 ASN C 1 1 3 1504 1 1 24 ASN CA C 3.064 -9.122 -9.356 1.00 . A A . 24 ASN CA 1 1 3 1505 1 1 24 ASN CB C 4.410 -9.690 -9.861 1.00 . A A . 24 ASN CB 1 1 3 1506 1 1 24 ASN CG C 4.471 -11.209 -9.918 1.00 . A A . 24 ASN CG 1 1 3 1507 1 1 24 ASN H H 1.138 -9.900 -9.356 1.00 . A A . 24 ASN H 1 1 3 1508 1 1 24 ASN HA H 2.978 -9.401 -8.308 1.00 . A A . 24 ASN HA 1 1 3 1509 1 1 24 ASN HB2 H 4.632 -9.284 -10.848 1.00 . A A . 24 ASN HB2 1 1 3 1510 1 1 24 ASN HB3 H 5.204 -9.354 -9.194 1.00 . A A . 24 ASN HB3 1 1 3 1511 1 1 24 ASN HD21 H 3.753 -11.204 -11.796 1.00 . A A . 24 ASN HD21 1 1 3 1512 1 1 24 ASN HD22 H 4.173 -12.789 -11.103 1.00 . A A . 24 ASN HD22 1 1 3 1513 1 1 24 ASN N N 1.896 -9.727 -10.008 1.00 . A A . 24 ASN N 1 1 3 1514 1 1 24 ASN ND2 N 4.130 -11.787 -11.052 1.00 . A A . 24 ASN ND2 1 1 3 1515 1 1 24 ASN O O 4.022 -6.965 -8.932 1.00 . A A . 24 ASN O 1 1 3 1516 1 1 24 ASN OD1 O 4.833 -11.877 -8.964 1.00 . A A . 24 ASN OD1 1 1 3 1517 1 1 25 ALA C C 1.888 -4.879 -8.393 1.00 . A A . 25 ALA C 1 1 3 1518 1 1 25 ALA CA C 1.897 -5.456 -9.826 1.00 . A A . 25 ALA CA 1 1 3 1519 1 1 25 ALA CB C 0.663 -5.011 -10.618 1.00 . A A . 25 ALA CB 1 1 3 1520 1 1 25 ALA H H 1.155 -7.424 -10.174 1.00 . A A . 25 ALA H 1 1 3 1521 1 1 25 ALA HA H 2.781 -5.077 -10.342 1.00 . A A . 25 ALA HA 1 1 3 1522 1 1 25 ALA HB1 H 0.691 -5.440 -11.621 1.00 . A A . 25 ALA HB1 1 1 3 1523 1 1 25 ALA HB2 H -0.248 -5.339 -10.116 1.00 . A A . 25 ALA HB2 1 1 3 1524 1 1 25 ALA HB3 H 0.651 -3.925 -10.700 1.00 . A A . 25 ALA HB3 1 1 3 1525 1 1 25 ALA N N 1.967 -6.921 -9.827 1.00 . A A . 25 ALA N 1 1 3 1526 1 1 25 ALA O O 1.091 -5.301 -7.562 1.00 . A A . 25 ALA O 1 1 3 1527 1 1 26 SER C C 2.580 -1.798 -6.786 1.00 . A A . 26 SER C 1 1 3 1528 1 1 26 SER CA C 2.930 -3.290 -6.775 1.00 . A A . 26 SER CA 1 1 3 1529 1 1 26 SER CB C 4.387 -3.462 -6.329 1.00 . A A . 26 SER CB 1 1 3 1530 1 1 26 SER H H 3.429 -3.614 -8.799 1.00 . A A . 26 SER H 1 1 3 1531 1 1 26 SER HA H 2.298 -3.797 -6.050 1.00 . A A . 26 SER HA 1 1 3 1532 1 1 26 SER HB2 H 4.521 -3.014 -5.345 1.00 . A A . 26 SER HB2 1 1 3 1533 1 1 26 SER HB3 H 4.633 -4.522 -6.268 1.00 . A A . 26 SER HB3 1 1 3 1534 1 1 26 SER HG H 4.844 -1.961 -7.469 1.00 . A A . 26 SER HG 1 1 3 1535 1 1 26 SER N N 2.753 -3.898 -8.104 1.00 . A A . 26 SER N 1 1 3 1536 1 1 26 SER O O 3.200 -1.047 -7.545 1.00 . A A . 26 SER O 1 1 3 1537 1 1 26 SER OG O 5.245 -2.821 -7.254 1.00 . A A . 26 SER OG 1 1 3 1538 1 1 27 GLN C C 0.945 0.493 -4.410 1.00 . A A . 27 GLN C 1 1 3 1539 1 1 27 GLN CA C 1.189 0.042 -5.858 1.00 . A A . 27 GLN CA 1 1 3 1540 1 1 27 GLN CB C -0.098 0.254 -6.683 1.00 . A A . 27 GLN CB 1 1 3 1541 1 1 27 GLN CD C 0.925 1.326 -8.757 1.00 . A A . 27 GLN CD 1 1 3 1542 1 1 27 GLN CG C 0.093 0.171 -8.207 1.00 . A A . 27 GLN CG 1 1 3 1543 1 1 27 GLN H H 1.187 -2.014 -5.303 1.00 . A A . 27 GLN H 1 1 3 1544 1 1 27 GLN HA H 1.972 0.688 -6.255 1.00 . A A . 27 GLN HA 1 1 3 1545 1 1 27 GLN HB2 H -0.839 -0.486 -6.376 1.00 . A A . 27 GLN HB2 1 1 3 1546 1 1 27 GLN HB3 H -0.509 1.239 -6.455 1.00 . A A . 27 GLN HB3 1 1 3 1547 1 1 27 GLN HE21 H 2.702 0.331 -8.518 1.00 . A A . 27 GLN HE21 1 1 3 1548 1 1 27 GLN HE22 H 2.742 1.954 -9.233 1.00 . A A . 27 GLN HE22 1 1 3 1549 1 1 27 GLN HG2 H 0.554 -0.778 -8.478 1.00 . A A . 27 GLN HG2 1 1 3 1550 1 1 27 GLN HG3 H -0.889 0.206 -8.678 1.00 . A A . 27 GLN HG3 1 1 3 1551 1 1 27 GLN N N 1.629 -1.359 -5.949 1.00 . A A . 27 GLN N 1 1 3 1552 1 1 27 GLN NE2 N 2.232 1.177 -8.850 1.00 . A A . 27 GLN NE2 1 1 3 1553 1 1 27 GLN O O 0.597 -0.296 -3.534 1.00 . A A . 27 GLN O 1 1 3 1554 1 1 27 GLN OE1 O 0.417 2.383 -9.090 1.00 . A A . 27 GLN OE1 1 1 3 1555 1 1 28 PHE C C -0.502 2.753 -2.452 1.00 . A A . 28 PHE C 1 1 3 1556 1 1 28 PHE CA C 0.950 2.447 -2.867 1.00 . A A . 28 PHE CA 1 1 3 1557 1 1 28 PHE CB C 1.830 3.704 -2.855 1.00 . A A . 28 PHE CB 1 1 3 1558 1 1 28 PHE CD1 C 4.070 2.679 -2.301 1.00 . A A . 28 PHE CD1 1 1 3 1559 1 1 28 PHE CD2 C 3.800 3.783 -4.456 1.00 . A A . 28 PHE CD2 1 1 3 1560 1 1 28 PHE CE1 C 5.388 2.343 -2.639 1.00 . A A . 28 PHE CE1 1 1 3 1561 1 1 28 PHE CE2 C 5.121 3.438 -4.795 1.00 . A A . 28 PHE CE2 1 1 3 1562 1 1 28 PHE CG C 3.273 3.403 -3.207 1.00 . A A . 28 PHE CG 1 1 3 1563 1 1 28 PHE CZ C 5.916 2.716 -3.887 1.00 . A A . 28 PHE CZ 1 1 3 1564 1 1 28 PHE H H 1.366 2.403 -4.937 1.00 . A A . 28 PHE H 1 1 3 1565 1 1 28 PHE HA H 1.349 1.763 -2.116 1.00 . A A . 28 PHE HA 1 1 3 1566 1 1 28 PHE HB2 H 1.425 4.437 -3.554 1.00 . A A . 28 PHE HB2 1 1 3 1567 1 1 28 PHE HB3 H 1.817 4.143 -1.858 1.00 . A A . 28 PHE HB3 1 1 3 1568 1 1 28 PHE HD1 H 3.669 2.364 -1.348 1.00 . A A . 28 PHE HD1 1 1 3 1569 1 1 28 PHE HD2 H 3.190 4.328 -5.161 1.00 . A A . 28 PHE HD2 1 1 3 1570 1 1 28 PHE HE1 H 5.981 1.790 -1.931 1.00 . A A . 28 PHE HE1 1 1 3 1571 1 1 28 PHE HE2 H 5.524 3.727 -5.755 1.00 . A A . 28 PHE HE2 1 1 3 1572 1 1 28 PHE HZ H 6.929 2.445 -4.150 1.00 . A A . 28 PHE HZ 1 1 3 1573 1 1 28 PHE N N 1.078 1.801 -4.179 1.00 . A A . 28 PHE N 1 1 3 1574 1 1 28 PHE O O -0.726 3.402 -1.426 1.00 . A A . 28 PHE O 1 1 3 1575 1 1 29 GLU C C -3.201 1.399 -1.711 1.00 . A A . 29 GLU C 1 1 3 1576 1 1 29 GLU CA C -2.903 2.383 -2.851 1.00 . A A . 29 GLU CA 1 1 3 1577 1 1 29 GLU CB C -3.845 2.202 -4.057 1.00 . A A . 29 GLU CB 1 1 3 1578 1 1 29 GLU CD C -4.898 4.517 -3.805 1.00 . A A . 29 GLU CD 1 1 3 1579 1 1 29 GLU CG C -4.180 3.536 -4.748 1.00 . A A . 29 GLU CG 1 1 3 1580 1 1 29 GLU H H -1.258 1.784 -4.061 1.00 . A A . 29 GLU H 1 1 3 1581 1 1 29 GLU HA H -3.086 3.368 -2.454 1.00 . A A . 29 GLU HA 1 1 3 1582 1 1 29 GLU HB2 H -3.397 1.516 -4.778 1.00 . A A . 29 GLU HB2 1 1 3 1583 1 1 29 GLU HB3 H -4.782 1.766 -3.720 1.00 . A A . 29 GLU HB3 1 1 3 1584 1 1 29 GLU HG2 H -3.256 3.987 -5.119 1.00 . A A . 29 GLU HG2 1 1 3 1585 1 1 29 GLU HG3 H -4.821 3.333 -5.608 1.00 . A A . 29 GLU HG3 1 1 3 1586 1 1 29 GLU N N -1.495 2.324 -3.244 1.00 . A A . 29 GLU N 1 1 3 1587 1 1 29 GLU O O -3.198 0.183 -1.896 1.00 . A A . 29 GLU O 1 1 3 1588 1 1 29 GLU OE1 O -6.117 4.359 -3.555 1.00 . A A . 29 GLU OE1 1 1 3 1589 1 1 29 GLU OE2 O -4.219 5.399 -3.225 1.00 . A A . 29 GLU OE2 1 1 3 1590 1 1 30 ARG C C -5.397 1.345 0.837 1.00 . A A . 30 ARG C 1 1 3 1591 1 1 30 ARG CA C -3.871 1.271 0.699 1.00 . A A . 30 ARG CA 1 1 3 1592 1 1 30 ARG CB C -3.208 1.872 1.970 1.00 . A A . 30 ARG CB 1 1 3 1593 1 1 30 ARG CD C -2.424 4.362 1.857 1.00 . A A . 30 ARG CD 1 1 3 1594 1 1 30 ARG CG C -2.039 2.867 1.796 1.00 . A A . 30 ARG CG 1 1 3 1595 1 1 30 ARG CZ C -3.735 5.179 -0.143 1.00 . A A . 30 ARG CZ 1 1 3 1596 1 1 30 ARG H H -3.414 2.968 -0.458 1.00 . A A . 30 ARG H 1 1 3 1597 1 1 30 ARG HA H -3.572 0.228 0.599 1.00 . A A . 30 ARG HA 1 1 3 1598 1 1 30 ARG HB2 H -3.966 2.353 2.589 1.00 . A A . 30 ARG HB2 1 1 3 1599 1 1 30 ARG HB3 H -2.839 1.033 2.559 1.00 . A A . 30 ARG HB3 1 1 3 1600 1 1 30 ARG HD2 H -2.602 4.616 2.903 1.00 . A A . 30 ARG HD2 1 1 3 1601 1 1 30 ARG HD3 H -1.575 4.959 1.520 1.00 . A A . 30 ARG HD3 1 1 3 1602 1 1 30 ARG HE H -4.512 4.801 1.619 1.00 . A A . 30 ARG HE 1 1 3 1603 1 1 30 ARG HG2 H -1.339 2.697 2.615 1.00 . A A . 30 ARG HG2 1 1 3 1604 1 1 30 ARG HG3 H -1.483 2.655 0.887 1.00 . A A . 30 ARG HG3 1 1 3 1605 1 1 30 ARG HH11 H -1.828 4.807 -0.799 1.00 . A A . 30 ARG HH11 1 1 3 1606 1 1 30 ARG HH12 H -3.001 5.484 -1.943 1.00 . A A . 30 ARG HH12 1 1 3 1607 1 1 30 ARG HH21 H -5.805 5.405 -0.204 1.00 . A A . 30 ARG HH21 1 1 3 1608 1 1 30 ARG HH22 H -4.862 5.661 -1.678 1.00 . A A . 30 ARG HH22 1 1 3 1609 1 1 30 ARG N N -3.458 1.965 -0.524 1.00 . A A . 30 ARG N 1 1 3 1610 1 1 30 ARG NE N -3.636 4.732 1.099 1.00 . A A . 30 ARG NE 1 1 3 1611 1 1 30 ARG NH1 N -2.730 5.244 -0.979 1.00 . A A . 30 ARG NH1 1 1 3 1612 1 1 30 ARG NH2 N -4.885 5.503 -0.664 1.00 . A A . 30 ARG NH2 1 1 3 1613 1 1 30 ARG O O -5.977 2.336 0.397 1.00 . A A . 30 ARG O 1 1 3 1614 1 1 31 PRO C C -7.987 1.770 2.437 1.00 . A A . 31 PRO C 1 1 3 1615 1 1 31 PRO CA C -7.494 0.451 1.839 1.00 . A A . 31 PRO CA 1 1 3 1616 1 1 31 PRO CB C -7.754 -0.737 2.776 1.00 . A A . 31 PRO CB 1 1 3 1617 1 1 31 PRO CD C -5.485 -0.841 2.015 1.00 . A A . 31 PRO CD 1 1 3 1618 1 1 31 PRO CG C -6.663 -1.732 2.383 1.00 . A A . 31 PRO CG 1 1 3 1619 1 1 31 PRO HA H -8.016 0.322 0.917 1.00 . A A . 31 PRO HA 1 1 3 1620 1 1 31 PRO HB2 H -7.610 -0.440 3.817 1.00 . A A . 31 PRO HB2 1 1 3 1621 1 1 31 PRO HB3 H -8.752 -1.153 2.632 1.00 . A A . 31 PRO HB3 1 1 3 1622 1 1 31 PRO HD2 H -4.878 -0.645 2.900 1.00 . A A . 31 PRO HD2 1 1 3 1623 1 1 31 PRO HD3 H -4.895 -1.325 1.237 1.00 . A A . 31 PRO HD3 1 1 3 1624 1 1 31 PRO HG2 H -6.397 -2.433 3.175 1.00 . A A . 31 PRO HG2 1 1 3 1625 1 1 31 PRO HG3 H -6.990 -2.279 1.504 1.00 . A A . 31 PRO HG3 1 1 3 1626 1 1 31 PRO N N -6.057 0.401 1.536 1.00 . A A . 31 PRO N 1 1 3 1627 1 1 31 PRO O O -9.073 2.260 2.143 1.00 . A A . 31 PRO O 1 1 3 1628 1 1 32 SER C C -7.075 4.792 2.865 1.00 . A A . 32 SER C 1 1 3 1629 1 1 32 SER CA C -7.162 3.646 3.886 1.00 . A A . 32 SER CA 1 1 3 1630 1 1 32 SER CB C -6.022 3.759 4.911 1.00 . A A . 32 SER CB 1 1 3 1631 1 1 32 SER H H -6.289 1.755 3.303 1.00 . A A . 32 SER H 1 1 3 1632 1 1 32 SER HA H -8.109 3.729 4.419 1.00 . A A . 32 SER HA 1 1 3 1633 1 1 32 SER HB2 H -5.064 3.784 4.391 1.00 . A A . 32 SER HB2 1 1 3 1634 1 1 32 SER HB3 H -6.133 4.682 5.483 1.00 . A A . 32 SER HB3 1 1 3 1635 1 1 32 SER HG H -6.775 2.709 6.381 1.00 . A A . 32 SER HG 1 1 3 1636 1 1 32 SER N N -7.103 2.339 3.238 1.00 . A A . 32 SER N 1 1 3 1637 1 1 32 SER O O -5.974 5.211 2.500 1.00 . A A . 32 SER O 1 1 3 1638 1 1 32 SER OG O -6.016 2.651 5.793 1.00 . A A . 32 SER OG 1 1 3 1639 1 1 33 GLY C C -8.203 6.260 0.096 1.00 . A A . 33 GLY C 1 1 3 1640 1 1 33 GLY CA C -8.353 6.511 1.591 1.00 . A A . 33 GLY CA 1 1 3 1641 1 1 33 GLY H H -9.089 4.825 2.677 1.00 . A A . 33 GLY H 1 1 3 1642 1 1 33 GLY HA2 H -9.328 6.970 1.750 1.00 . A A . 33 GLY HA2 1 1 3 1643 1 1 33 GLY HA3 H -7.588 7.232 1.879 1.00 . A A . 33 GLY HA3 1 1 3 1644 1 1 33 GLY N N -8.234 5.304 2.428 1.00 . A A . 33 GLY N 1 1 3 1645 1 1 33 GLY O O -8.773 7.032 -0.699 1.00 . A A . 33 GLY O 1 1 3 1646 1 1 33 GLY OXT O -7.503 5.305 -0.299 1.00 . A A . 33 GLY OXT 1 1 3 1647 2 2 1 NAG C1 C 12.336 1.572 -0.524 1.00 . B A . 101 NAG C1 1 1 3 1648 2 2 1 NAG C2 C 11.774 2.983 -0.791 1.00 . B A . 101 NAG C2 1 1 3 1649 2 2 1 NAG C3 C 10.528 2.816 -1.669 1.00 . B A . 101 NAG C3 1 1 3 1650 2 2 1 NAG C4 C 10.912 2.148 -2.989 1.00 . B A . 101 NAG C4 1 1 3 1651 2 2 1 NAG C5 C 11.536 0.776 -2.713 1.00 . B A . 101 NAG C5 1 1 3 1652 2 2 1 NAG C6 C 12.007 0.002 -3.940 1.00 . B A . 101 NAG C6 1 1 3 1653 2 2 1 NAG C7 C 12.327 4.320 1.195 1.00 . B A . 101 NAG C7 1 1 3 1654 2 2 1 NAG C8 C 11.768 5.116 2.381 1.00 . B A . 101 NAG C8 1 1 3 1655 2 2 1 NAG H1 H 11.591 0.948 -0.031 1.00 . B A . 101 NAG H1 1 1 3 1656 2 2 1 NAG H2 H 12.521 3.573 -1.325 1.00 . B A . 101 NAG H2 1 1 3 1657 2 2 1 NAG H3 H 9.805 2.186 -1.142 1.00 . B A . 101 NAG H3 1 1 3 1658 2 2 1 NAG H4 H 11.599 2.781 -3.553 1.00 . B A . 101 NAG H4 1 1 3 1659 2 2 1 NAG H5 H 10.801 0.174 -2.197 1.00 . B A . 101 NAG H5 1 1 3 1660 2 2 1 NAG H61 H 12.286 -1.010 -3.647 1.00 . B A . 101 NAG H61 1 1 3 1661 2 2 1 NAG H62 H 11.221 -0.065 -4.690 1.00 . B A . 101 NAG H62 1 1 3 1662 2 2 1 NAG H81 H 11.605 4.447 3.224 1.00 . B A . 101 NAG H81 1 1 3 1663 2 2 1 NAG H82 H 10.828 5.595 2.105 1.00 . B A . 101 NAG H82 1 1 3 1664 2 2 1 NAG H83 H 12.483 5.887 2.673 1.00 . B A . 101 NAG H83 1 1 3 1665 2 2 1 NAG HN2 H 10.477 3.609 0.801 1.00 . B A . 101 NAG HN2 1 1 3 1666 2 2 1 NAG HO3 H 9.791 4.596 -1.152 1.00 . B A . 101 NAG HO3 1 1 3 1667 2 2 1 NAG HO4 H 9.256 2.867 -3.623 1.00 . B A . 101 NAG HO4 1 1 3 1668 2 2 1 NAG HO6 H 13.754 0.828 -3.719 1.00 . B A . 101 NAG HO6 1 1 3 1669 2 2 1 NAG N2 N 11.430 3.679 0.449 1.00 . B A . 101 NAG N2 1 1 3 1670 2 2 1 NAG O3 O 9.917 4.094 -1.966 1.00 . B A . 101 NAG O3 1 1 3 1671 2 2 1 NAG O4 O 9.686 2.005 -3.714 1.00 . B A . 101 NAG O4 1 1 3 1672 2 2 1 NAG O5 O 12.698 0.969 -1.813 1.00 . B A . 101 NAG O5 1 1 3 1673 2 2 1 NAG O6 O 13.166 0.664 -4.465 1.00 . B A . 101 NAG O6 1 1 3 1674 2 2 1 NAG O7 O 13.530 4.263 0.942 1.00 . B A . 101 NAG O7 1 1 4 1675 1 1 1 LYS C C -8.152 0.068 -3.901 1.00 . A A . 1 LYS C 1 1 4 1676 1 1 1 LYS CA C -8.955 1.257 -3.374 1.00 . A A . 1 LYS CA 1 1 4 1677 1 1 1 LYS CB C -9.933 1.814 -4.436 1.00 . A A . 1 LYS CB 1 1 4 1678 1 1 1 LYS CD C -9.380 4.228 -5.161 1.00 . A A . 1 LYS CD 1 1 4 1679 1 1 1 LYS CE C -8.701 5.132 -6.199 1.00 . A A . 1 LYS CE 1 1 4 1680 1 1 1 LYS CG C -9.340 2.734 -5.531 1.00 . A A . 1 LYS CG 1 1 4 1681 1 1 1 LYS H1 H -7.498 1.963 -2.073 1.00 . A A . 1 LYS H1 1 1 4 1682 1 1 1 LYS H2 H -8.569 3.095 -2.527 1.00 . A A . 1 LYS H2 1 1 4 1683 1 1 1 LYS H3 H -7.384 2.606 -3.575 1.00 . A A . 1 LYS H3 1 1 4 1684 1 1 1 LYS HA H -9.555 0.892 -2.541 1.00 . A A . 1 LYS HA 1 1 4 1685 1 1 1 LYS HB2 H -10.405 0.961 -4.928 1.00 . A A . 1 LYS HB2 1 1 4 1686 1 1 1 LYS HB3 H -10.730 2.354 -3.922 1.00 . A A . 1 LYS HB3 1 1 4 1687 1 1 1 LYS HD2 H -10.427 4.530 -5.084 1.00 . A A . 1 LYS HD2 1 1 4 1688 1 1 1 LYS HD3 H -8.915 4.401 -4.193 1.00 . A A . 1 LYS HD3 1 1 4 1689 1 1 1 LYS HE2 H -9.077 4.891 -7.197 1.00 . A A . 1 LYS HE2 1 1 4 1690 1 1 1 LYS HE3 H -8.984 6.164 -5.973 1.00 . A A . 1 LYS HE3 1 1 4 1691 1 1 1 LYS HG2 H -8.321 2.434 -5.764 1.00 . A A . 1 LYS HG2 1 1 4 1692 1 1 1 LYS HG3 H -9.932 2.603 -6.438 1.00 . A A . 1 LYS HG3 1 1 4 1693 1 1 1 LYS HZ1 H -6.862 4.180 -6.631 1.00 . A A . 1 LYS HZ1 1 1 4 1694 1 1 1 LYS HZ2 H -6.756 5.820 -6.571 1.00 . A A . 1 LYS HZ2 1 1 4 1695 1 1 1 LYS HZ3 H -6.861 4.831 -5.227 1.00 . A A . 1 LYS HZ3 1 1 4 1696 1 1 1 LYS N N -8.045 2.302 -2.859 1.00 . A A . 1 LYS N 1 1 4 1697 1 1 1 LYS NZ N -7.223 5.024 -6.164 1.00 . A A . 1 LYS NZ 1 1 4 1698 1 1 1 LYS O O -7.478 0.214 -4.909 1.00 . A A . 1 LYS O 1 1 4 1699 1 1 2 LEU C C -8.367 -3.139 -4.651 1.00 . A A . 2 LEU C 1 1 4 1700 1 1 2 LEU CA C -7.500 -2.302 -3.686 1.00 . A A . 2 LEU CA 1 1 4 1701 1 1 2 LEU CB C -7.110 -3.192 -2.488 1.00 . A A . 2 LEU CB 1 1 4 1702 1 1 2 LEU CD1 C -5.553 -3.780 -0.622 1.00 . A A . 2 LEU CD1 1 1 4 1703 1 1 2 LEU CD2 C -4.821 -2.054 -2.245 1.00 . A A . 2 LEU CD2 1 1 4 1704 1 1 2 LEU CG C -6.035 -2.648 -1.532 1.00 . A A . 2 LEU CG 1 1 4 1705 1 1 2 LEU H H -8.789 -1.201 -2.417 1.00 . A A . 2 LEU H 1 1 4 1706 1 1 2 LEU HA H -6.583 -2.018 -4.200 1.00 . A A . 2 LEU HA 1 1 4 1707 1 1 2 LEU HB2 H -8.005 -3.421 -1.907 1.00 . A A . 2 LEU HB2 1 1 4 1708 1 1 2 LEU HB3 H -6.748 -4.137 -2.891 1.00 . A A . 2 LEU HB3 1 1 4 1709 1 1 2 LEU HD11 H -5.061 -4.550 -1.216 1.00 . A A . 2 LEU HD11 1 1 4 1710 1 1 2 LEU HD12 H -4.848 -3.396 0.112 1.00 . A A . 2 LEU HD12 1 1 4 1711 1 1 2 LEU HD13 H -6.399 -4.223 -0.098 1.00 . A A . 2 LEU HD13 1 1 4 1712 1 1 2 LEU HD21 H -4.376 -2.784 -2.917 1.00 . A A . 2 LEU HD21 1 1 4 1713 1 1 2 LEU HD22 H -5.106 -1.166 -2.807 1.00 . A A . 2 LEU HD22 1 1 4 1714 1 1 2 LEU HD23 H -4.088 -1.744 -1.505 1.00 . A A . 2 LEU HD23 1 1 4 1715 1 1 2 LEU HG H -6.468 -1.871 -0.908 1.00 . A A . 2 LEU HG 1 1 4 1716 1 1 2 LEU N N -8.197 -1.090 -3.226 1.00 . A A . 2 LEU N 1 1 4 1717 1 1 2 LEU O O -9.442 -3.582 -4.243 1.00 . A A . 2 LEU O 1 1 4 1718 1 1 3 PRO C C -8.430 -5.802 -6.308 1.00 . A A . 3 PRO C 1 1 4 1719 1 1 3 PRO CA C -8.589 -4.340 -6.800 1.00 . A A . 3 PRO CA 1 1 4 1720 1 1 3 PRO CB C -7.933 -4.153 -8.177 1.00 . A A . 3 PRO CB 1 1 4 1721 1 1 3 PRO CD C -6.864 -2.687 -6.607 1.00 . A A . 3 PRO CD 1 1 4 1722 1 1 3 PRO CG C -7.198 -2.817 -8.088 1.00 . A A . 3 PRO CG 1 1 4 1723 1 1 3 PRO HA H -9.648 -4.086 -6.865 1.00 . A A . 3 PRO HA 1 1 4 1724 1 1 3 PRO HB2 H -7.214 -4.948 -8.367 1.00 . A A . 3 PRO HB2 1 1 4 1725 1 1 3 PRO HB3 H -8.679 -4.133 -8.972 1.00 . A A . 3 PRO HB3 1 1 4 1726 1 1 3 PRO HD2 H -5.913 -3.170 -6.390 1.00 . A A . 3 PRO HD2 1 1 4 1727 1 1 3 PRO HD3 H -6.812 -1.633 -6.343 1.00 . A A . 3 PRO HD3 1 1 4 1728 1 1 3 PRO HG2 H -6.302 -2.801 -8.708 1.00 . A A . 3 PRO HG2 1 1 4 1729 1 1 3 PRO HG3 H -7.876 -2.010 -8.375 1.00 . A A . 3 PRO HG3 1 1 4 1730 1 1 3 PRO N N -7.936 -3.378 -5.908 1.00 . A A . 3 PRO N 1 1 4 1731 1 1 3 PRO O O -7.610 -6.078 -5.425 1.00 . A A . 3 PRO O 1 1 4 1732 1 1 4 PRO C C -7.520 -8.691 -6.660 1.00 . A A . 4 PRO C 1 1 4 1733 1 1 4 PRO CA C -8.980 -8.204 -6.625 1.00 . A A . 4 PRO CA 1 1 4 1734 1 1 4 PRO CB C -9.837 -8.932 -7.668 1.00 . A A . 4 PRO CB 1 1 4 1735 1 1 4 PRO CD C -10.189 -6.583 -7.907 1.00 . A A . 4 PRO CD 1 1 4 1736 1 1 4 PRO CG C -10.928 -7.915 -7.994 1.00 . A A . 4 PRO CG 1 1 4 1737 1 1 4 PRO HA H -9.400 -8.393 -5.636 1.00 . A A . 4 PRO HA 1 1 4 1738 1 1 4 PRO HB2 H -9.252 -9.130 -8.568 1.00 . A A . 4 PRO HB2 1 1 4 1739 1 1 4 PRO HB3 H -10.254 -9.859 -7.273 1.00 . A A . 4 PRO HB3 1 1 4 1740 1 1 4 PRO HD2 H -9.734 -6.355 -8.872 1.00 . A A . 4 PRO HD2 1 1 4 1741 1 1 4 PRO HD3 H -10.880 -5.792 -7.616 1.00 . A A . 4 PRO HD3 1 1 4 1742 1 1 4 PRO HG2 H -11.354 -8.079 -8.984 1.00 . A A . 4 PRO HG2 1 1 4 1743 1 1 4 PRO HG3 H -11.705 -7.954 -7.229 1.00 . A A . 4 PRO HG3 1 1 4 1744 1 1 4 PRO N N -9.143 -6.776 -6.912 1.00 . A A . 4 PRO N 1 1 4 1745 1 1 4 PRO O O -6.775 -8.406 -7.599 1.00 . A A . 4 PRO O 1 1 4 1746 1 1 5 GLY C C -4.679 -9.158 -4.953 1.00 . A A . 5 GLY C 1 1 4 1747 1 1 5 GLY CA C -5.788 -10.057 -5.514 1.00 . A A . 5 GLY CA 1 1 4 1748 1 1 5 GLY H H -7.762 -9.611 -4.869 1.00 . A A . 5 GLY H 1 1 4 1749 1 1 5 GLY HA2 H -5.865 -10.935 -4.873 1.00 . A A . 5 GLY HA2 1 1 4 1750 1 1 5 GLY HA3 H -5.471 -10.388 -6.504 1.00 . A A . 5 GLY HA3 1 1 4 1751 1 1 5 GLY N N -7.114 -9.435 -5.623 1.00 . A A . 5 GLY N 1 1 4 1752 1 1 5 GLY O O -3.569 -9.647 -4.737 1.00 . A A . 5 GLY O 1 1 4 1753 1 1 6 TRP C C -4.071 -7.037 -2.559 1.00 . A A . 6 TRP C 1 1 4 1754 1 1 6 TRP CA C -4.024 -6.933 -4.087 1.00 . A A . 6 TRP CA 1 1 4 1755 1 1 6 TRP CB C -4.375 -5.504 -4.509 1.00 . A A . 6 TRP CB 1 1 4 1756 1 1 6 TRP CD1 C -4.834 -5.563 -7.006 1.00 . A A . 6 TRP CD1 1 1 4 1757 1 1 6 TRP CD2 C -3.133 -4.204 -6.470 1.00 . A A . 6 TRP CD2 1 1 4 1758 1 1 6 TRP CE2 C -3.297 -4.124 -7.885 1.00 . A A . 6 TRP CE2 1 1 4 1759 1 1 6 TRP CE3 C -2.137 -3.388 -5.892 1.00 . A A . 6 TRP CE3 1 1 4 1760 1 1 6 TRP CG C -4.119 -5.139 -5.940 1.00 . A A . 6 TRP CG 1 1 4 1761 1 1 6 TRP CH2 C -1.514 -2.501 -8.082 1.00 . A A . 6 TRP CH2 1 1 4 1762 1 1 6 TRP CZ2 C -2.498 -3.298 -8.690 1.00 . A A . 6 TRP CZ2 1 1 4 1763 1 1 6 TRP CZ3 C -1.345 -2.541 -6.686 1.00 . A A . 6 TRP CZ3 1 1 4 1764 1 1 6 TRP H H -5.881 -7.497 -4.893 1.00 . A A . 6 TRP H 1 1 4 1765 1 1 6 TRP HA H -3.010 -7.142 -4.409 1.00 . A A . 6 TRP HA 1 1 4 1766 1 1 6 TRP HB2 H -5.423 -5.314 -4.286 1.00 . A A . 6 TRP HB2 1 1 4 1767 1 1 6 TRP HB3 H -3.791 -4.827 -3.890 1.00 . A A . 6 TRP HB3 1 1 4 1768 1 1 6 TRP HD1 H -5.688 -6.225 -6.946 1.00 . A A . 6 TRP HD1 1 1 4 1769 1 1 6 TRP HE1 H -4.723 -5.141 -9.083 1.00 . A A . 6 TRP HE1 1 1 4 1770 1 1 6 TRP HE3 H -1.995 -3.399 -4.823 1.00 . A A . 6 TRP HE3 1 1 4 1771 1 1 6 TRP HH2 H -0.893 -1.850 -8.683 1.00 . A A . 6 TRP HH2 1 1 4 1772 1 1 6 TRP HZ2 H -2.647 -3.268 -9.758 1.00 . A A . 6 TRP HZ2 1 1 4 1773 1 1 6 TRP HZ3 H -0.608 -1.914 -6.209 1.00 . A A . 6 TRP HZ3 1 1 4 1774 1 1 6 TRP N N -4.954 -7.867 -4.721 1.00 . A A . 6 TRP N 1 1 4 1775 1 1 6 TRP NE1 N -4.338 -4.986 -8.160 1.00 . A A . 6 TRP NE1 1 1 4 1776 1 1 6 TRP O O -5.152 -7.062 -1.974 1.00 . A A . 6 TRP O 1 1 4 1777 1 1 7 GLU C C -1.455 -6.263 -0.038 1.00 . A A . 7 GLU C 1 1 4 1778 1 1 7 GLU CA C -2.792 -6.908 -0.450 1.00 . A A . 7 GLU CA 1 1 4 1779 1 1 7 GLU CB C -2.977 -8.289 0.225 1.00 . A A . 7 GLU CB 1 1 4 1780 1 1 7 GLU CD C -3.886 -7.526 2.503 1.00 . A A . 7 GLU CD 1 1 4 1781 1 1 7 GLU CG C -4.143 -8.341 1.228 1.00 . A A . 7 GLU CG 1 1 4 1782 1 1 7 GLU H H -2.032 -7.088 -2.440 1.00 . A A . 7 GLU H 1 1 4 1783 1 1 7 GLU HA H -3.590 -6.246 -0.108 1.00 . A A . 7 GLU HA 1 1 4 1784 1 1 7 GLU HB2 H -3.178 -9.036 -0.543 1.00 . A A . 7 GLU HB2 1 1 4 1785 1 1 7 GLU HB3 H -2.058 -8.588 0.731 1.00 . A A . 7 GLU HB3 1 1 4 1786 1 1 7 GLU HG2 H -5.052 -7.980 0.744 1.00 . A A . 7 GLU HG2 1 1 4 1787 1 1 7 GLU HG3 H -4.307 -9.386 1.499 1.00 . A A . 7 GLU HG3 1 1 4 1788 1 1 7 GLU N N -2.901 -7.033 -1.909 1.00 . A A . 7 GLU N 1 1 4 1789 1 1 7 GLU O O -0.492 -6.252 -0.815 1.00 . A A . 7 GLU O 1 1 4 1790 1 1 7 GLU OE1 O -3.766 -6.279 2.416 1.00 . A A . 7 GLU OE1 1 1 4 1791 1 1 7 GLU OE2 O -3.770 -8.112 3.603 1.00 . A A . 7 GLU OE2 1 1 4 1792 1 1 8 LYS C C 1.078 -5.796 1.675 1.00 . A A . 8 LYS C 1 1 4 1793 1 1 8 LYS CA C -0.266 -5.077 1.840 1.00 . A A . 8 LYS CA 1 1 4 1794 1 1 8 LYS CB C -0.597 -4.836 3.325 1.00 . A A . 8 LYS CB 1 1 4 1795 1 1 8 LYS CD C -1.161 -5.953 5.594 1.00 . A A . 8 LYS CD 1 1 4 1796 1 1 8 LYS CE C -2.516 -5.253 5.782 1.00 . A A . 8 LYS CE 1 1 4 1797 1 1 8 LYS CG C -0.688 -6.140 4.143 1.00 . A A . 8 LYS CG 1 1 4 1798 1 1 8 LYS H H -2.238 -5.878 1.771 1.00 . A A . 8 LYS H 1 1 4 1799 1 1 8 LYS HA H -0.172 -4.102 1.359 1.00 . A A . 8 LYS HA 1 1 4 1800 1 1 8 LYS HB2 H 0.170 -4.196 3.763 1.00 . A A . 8 LYS HB2 1 1 4 1801 1 1 8 LYS HB3 H -1.549 -4.309 3.381 1.00 . A A . 8 LYS HB3 1 1 4 1802 1 1 8 LYS HD2 H -1.214 -6.939 6.060 1.00 . A A . 8 LYS HD2 1 1 4 1803 1 1 8 LYS HD3 H -0.405 -5.380 6.132 1.00 . A A . 8 LYS HD3 1 1 4 1804 1 1 8 LYS HE2 H -2.746 -5.258 6.850 1.00 . A A . 8 LYS HE2 1 1 4 1805 1 1 8 LYS HE3 H -2.427 -4.210 5.465 1.00 . A A . 8 LYS HE3 1 1 4 1806 1 1 8 LYS HG2 H -1.357 -6.840 3.650 1.00 . A A . 8 LYS HG2 1 1 4 1807 1 1 8 LYS HG3 H 0.300 -6.599 4.176 1.00 . A A . 8 LYS HG3 1 1 4 1808 1 1 8 LYS HZ1 H -3.573 -5.740 4.029 1.00 . A A . 8 LYS HZ1 1 1 4 1809 1 1 8 LYS HZ2 H -3.565 -6.929 5.020 1.00 . A A . 8 LYS HZ2 1 1 4 1810 1 1 8 LYS HZ3 H -4.535 -5.622 5.362 1.00 . A A . 8 LYS HZ3 1 1 4 1811 1 1 8 LYS N N -1.388 -5.784 1.210 1.00 . A A . 8 LYS N 1 1 4 1812 1 1 8 LYS NZ N -3.622 -5.904 5.042 1.00 . A A . 8 LYS NZ 1 1 4 1813 1 1 8 LYS O O 1.164 -7.024 1.671 1.00 . A A . 8 LYS O 1 1 4 1814 1 1 9 ARG C C 4.491 -4.396 1.760 1.00 . A A . 9 ARG C 1 1 4 1815 1 1 9 ARG CA C 3.499 -5.422 1.191 1.00 . A A . 9 ARG CA 1 1 4 1816 1 1 9 ARG CB C 3.555 -5.443 -0.337 1.00 . A A . 9 ARG CB 1 1 4 1817 1 1 9 ARG CD C 3.964 -8.004 -0.606 1.00 . A A . 9 ARG CD 1 1 4 1818 1 1 9 ARG CG C 4.406 -6.562 -0.912 1.00 . A A . 9 ARG CG 1 1 4 1819 1 1 9 ARG CZ C 1.697 -9.093 -1.005 1.00 . A A . 9 ARG CZ 1 1 4 1820 1 1 9 ARG H H 2.023 -4.025 1.280 1.00 . A A . 9 ARG H 1 1 4 1821 1 1 9 ARG HA H 3.700 -6.402 1.624 1.00 . A A . 9 ARG HA 1 1 4 1822 1 1 9 ARG HB2 H 2.557 -5.533 -0.771 1.00 . A A . 9 ARG HB2 1 1 4 1823 1 1 9 ARG HB3 H 3.938 -4.484 -0.675 1.00 . A A . 9 ARG HB3 1 1 4 1824 1 1 9 ARG HD2 H 4.367 -8.644 -1.393 1.00 . A A . 9 ARG HD2 1 1 4 1825 1 1 9 ARG HD3 H 4.418 -8.288 0.341 1.00 . A A . 9 ARG HD3 1 1 4 1826 1 1 9 ARG HE H 2.005 -7.508 0.100 1.00 . A A . 9 ARG HE 1 1 4 1827 1 1 9 ARG HG2 H 4.366 -6.408 -1.979 1.00 . A A . 9 ARG HG2 1 1 4 1828 1 1 9 ARG HG3 H 5.431 -6.424 -0.576 1.00 . A A . 9 ARG HG3 1 1 4 1829 1 1 9 ARG HH11 H 3.103 -10.442 -1.471 1.00 . A A . 9 ARG HH11 1 1 4 1830 1 1 9 ARG HH12 H 1.430 -10.910 -1.775 1.00 . A A . 9 ARG HH12 1 1 4 1831 1 1 9 ARG HH21 H 0.061 -7.944 -0.855 1.00 . A A . 9 ARG HH21 1 1 4 1832 1 1 9 ARG HH22 H -0.200 -9.586 -1.451 1.00 . A A . 9 ARG HH22 1 1 4 1833 1 1 9 ARG N N 2.140 -5.012 1.487 1.00 . A A . 9 ARG N 1 1 4 1834 1 1 9 ARG NE N 2.497 -8.160 -0.509 1.00 . A A . 9 ARG NE 1 1 4 1835 1 1 9 ARG NH1 N 2.122 -10.232 -1.492 1.00 . A A . 9 ARG NH1 1 1 4 1836 1 1 9 ARG NH2 N 0.409 -8.885 -1.036 1.00 . A A . 9 ARG NH2 1 1 4 1837 1 1 9 ARG O O 4.089 -3.297 2.149 1.00 . A A . 9 ARG O 1 1 4 1838 1 1 10 MET C C 8.183 -4.025 1.631 1.00 . A A . 10 MET C 1 1 4 1839 1 1 10 MET CA C 6.816 -3.824 2.292 1.00 . A A . 10 MET CA 1 1 4 1840 1 1 10 MET CB C 6.912 -4.005 3.822 1.00 . A A . 10 MET CB 1 1 4 1841 1 1 10 MET CE C 7.260 -8.121 4.699 1.00 . A A . 10 MET CE 1 1 4 1842 1 1 10 MET CG C 7.388 -5.385 4.309 1.00 . A A . 10 MET CG 1 1 4 1843 1 1 10 MET H H 6.101 -5.602 1.396 1.00 . A A . 10 MET H 1 1 4 1844 1 1 10 MET HA H 6.511 -2.796 2.104 1.00 . A A . 10 MET HA 1 1 4 1845 1 1 10 MET HB2 H 7.609 -3.258 4.205 1.00 . A A . 10 MET HB2 1 1 4 1846 1 1 10 MET HB3 H 5.939 -3.799 4.269 1.00 . A A . 10 MET HB3 1 1 4 1847 1 1 10 MET HE1 H 7.495 -7.930 5.746 1.00 . A A . 10 MET HE1 1 1 4 1848 1 1 10 MET HE2 H 6.711 -9.060 4.619 1.00 . A A . 10 MET HE2 1 1 4 1849 1 1 10 MET HE3 H 8.185 -8.194 4.126 1.00 . A A . 10 MET HE3 1 1 4 1850 1 1 10 MET HG2 H 8.341 -5.622 3.835 1.00 . A A . 10 MET HG2 1 1 4 1851 1 1 10 MET HG3 H 7.571 -5.311 5.382 1.00 . A A . 10 MET HG3 1 1 4 1852 1 1 10 MET N N 5.790 -4.700 1.727 1.00 . A A . 10 MET N 1 1 4 1853 1 1 10 MET O O 8.579 -5.141 1.299 1.00 . A A . 10 MET O 1 1 4 1854 1 1 10 MET SD S 6.244 -6.771 4.047 1.00 . A A . 10 MET SD 1 1 4 1855 1 1 11 PHE C C 11.240 -3.032 2.079 1.00 . A A . 11 PHE C 1 1 4 1856 1 1 11 PHE CA C 10.257 -2.865 0.915 1.00 . A A . 11 PHE CA 1 1 4 1857 1 1 11 PHE CB C 10.498 -1.521 0.215 1.00 . A A . 11 PHE CB 1 1 4 1858 1 1 11 PHE CD1 C 10.075 -2.083 -2.214 1.00 . A A . 11 PHE CD1 1 1 4 1859 1 1 11 PHE CD2 C 8.693 -0.370 -1.174 1.00 . A A . 11 PHE CD2 1 1 4 1860 1 1 11 PHE CE1 C 9.393 -1.902 -3.430 1.00 . A A . 11 PHE CE1 1 1 4 1861 1 1 11 PHE CE2 C 8.030 -0.173 -2.400 1.00 . A A . 11 PHE CE2 1 1 4 1862 1 1 11 PHE CG C 9.721 -1.331 -1.075 1.00 . A A . 11 PHE CG 1 1 4 1863 1 1 11 PHE CZ C 8.371 -0.944 -3.522 1.00 . A A . 11 PHE CZ 1 1 4 1864 1 1 11 PHE H H 8.456 -2.021 1.649 1.00 . A A . 11 PHE H 1 1 4 1865 1 1 11 PHE HA H 10.415 -3.662 0.191 1.00 . A A . 11 PHE HA 1 1 4 1866 1 1 11 PHE HB2 H 10.268 -0.713 0.908 1.00 . A A . 11 PHE HB2 1 1 4 1867 1 1 11 PHE HB3 H 11.559 -1.444 -0.027 1.00 . A A . 11 PHE HB3 1 1 4 1868 1 1 11 PHE HD1 H 10.895 -2.781 -2.168 1.00 . A A . 11 PHE HD1 1 1 4 1869 1 1 11 PHE HD2 H 8.401 0.230 -0.326 1.00 . A A . 11 PHE HD2 1 1 4 1870 1 1 11 PHE HE1 H 9.663 -2.487 -4.299 1.00 . A A . 11 PHE HE1 1 1 4 1871 1 1 11 PHE HE2 H 7.244 0.561 -2.485 1.00 . A A . 11 PHE HE2 1 1 4 1872 1 1 11 PHE HZ H 7.849 -0.791 -4.456 1.00 . A A . 11 PHE HZ 1 1 4 1873 1 1 11 PHE N N 8.884 -2.911 1.408 1.00 . A A . 11 PHE N 1 1 4 1874 1 1 11 PHE O O 11.001 -2.515 3.172 1.00 . A A . 11 PHE O 1 1 4 1875 1 1 12 ALA C C 14.044 -2.556 3.375 1.00 . A A . 12 ALA C 1 1 4 1876 1 1 12 ALA CA C 13.462 -3.867 2.804 1.00 . A A . 12 ALA CA 1 1 4 1877 1 1 12 ALA CB C 14.562 -4.717 2.156 1.00 . A A . 12 ALA CB 1 1 4 1878 1 1 12 ALA H H 12.543 -4.079 0.911 1.00 . A A . 12 ALA H 1 1 4 1879 1 1 12 ALA HA H 13.051 -4.426 3.645 1.00 . A A . 12 ALA HA 1 1 4 1880 1 1 12 ALA HB1 H 14.147 -5.666 1.814 1.00 . A A . 12 ALA HB1 1 1 4 1881 1 1 12 ALA HB2 H 15.000 -4.185 1.311 1.00 . A A . 12 ALA HB2 1 1 4 1882 1 1 12 ALA HB3 H 15.344 -4.921 2.889 1.00 . A A . 12 ALA HB3 1 1 4 1883 1 1 12 ALA N N 12.392 -3.666 1.818 1.00 . A A . 12 ALA N 1 1 4 1884 1 1 12 ALA O O 14.629 -2.564 4.454 1.00 . A A . 12 ALA O 1 1 4 1885 1 1 13 ASN C C 13.222 0.363 4.362 1.00 . A A . 13 ASN C 1 1 4 1886 1 1 13 ASN CA C 14.124 -0.081 3.192 1.00 . A A . 13 ASN CA 1 1 4 1887 1 1 13 ASN CB C 13.891 0.926 2.053 1.00 . A A . 13 ASN CB 1 1 4 1888 1 1 13 ASN CG C 14.724 0.714 0.793 1.00 . A A . 13 ASN CG 1 1 4 1889 1 1 13 ASN H H 13.376 -1.499 1.795 1.00 . A A . 13 ASN H 1 1 4 1890 1 1 13 ASN HA H 15.164 -0.035 3.520 1.00 . A A . 13 ASN HA 1 1 4 1891 1 1 13 ASN HB2 H 12.831 0.916 1.810 1.00 . A A . 13 ASN HB2 1 1 4 1892 1 1 13 ASN HB3 H 14.136 1.921 2.422 1.00 . A A . 13 ASN HB3 1 1 4 1893 1 1 13 ASN HD21 H 14.996 1.173 -1.088 1.00 . A A . 13 ASN HD21 1 1 4 1894 1 1 13 ASN N N 13.825 -1.425 2.693 1.00 . A A . 13 ASN N 1 1 4 1895 1 1 13 ASN ND2 N 14.313 1.236 -0.354 1.00 . A A . 13 ASN ND2 1 1 4 1896 1 1 13 ASN O O 13.494 1.393 4.973 1.00 . A A . 13 ASN O 1 1 4 1897 1 1 13 ASN OD1 O 15.809 0.155 0.836 1.00 . A A . 13 ASN OD1 1 1 4 1898 1 1 14 GLY C C 10.127 1.010 4.815 1.00 . A A . 14 GLY C 1 1 4 1899 1 1 14 GLY CA C 11.080 0.066 5.551 1.00 . A A . 14 GLY CA 1 1 4 1900 1 1 14 GLY H H 11.948 -1.213 4.105 1.00 . A A . 14 GLY H 1 1 4 1901 1 1 14 GLY HA2 H 10.526 -0.805 5.905 1.00 . A A . 14 GLY HA2 1 1 4 1902 1 1 14 GLY HA3 H 11.513 0.587 6.405 1.00 . A A . 14 GLY HA3 1 1 4 1903 1 1 14 GLY N N 12.126 -0.360 4.629 1.00 . A A . 14 GLY N 1 1 4 1904 1 1 14 GLY O O 10.138 2.221 5.028 1.00 . A A . 14 GLY O 1 1 4 1905 1 1 15 THR C C 7.223 0.417 2.656 1.00 . A A . 15 THR C 1 1 4 1906 1 1 15 THR CA C 8.373 1.307 3.114 1.00 . A A . 15 THR CA 1 1 4 1907 1 1 15 THR CB C 9.043 2.027 1.931 1.00 . A A . 15 THR CB 1 1 4 1908 1 1 15 THR CG2 C 8.081 2.968 1.202 1.00 . A A . 15 THR CG2 1 1 4 1909 1 1 15 THR H H 9.407 -0.491 3.610 1.00 . A A . 15 THR H 1 1 4 1910 1 1 15 THR HA H 7.963 2.070 3.772 1.00 . A A . 15 THR HA 1 1 4 1911 1 1 15 THR HB H 9.428 1.294 1.226 1.00 . A A . 15 THR HB 1 1 4 1912 1 1 15 THR HG1 H 10.151 2.739 3.363 1.00 . A A . 15 THR HG1 1 1 4 1913 1 1 15 THR HG21 H 7.246 2.407 0.783 1.00 . A A . 15 THR HG21 1 1 4 1914 1 1 15 THR HG22 H 7.700 3.720 1.892 1.00 . A A . 15 THR HG22 1 1 4 1915 1 1 15 THR HG23 H 8.605 3.467 0.387 1.00 . A A . 15 THR HG23 1 1 4 1916 1 1 15 THR N N 9.349 0.492 3.856 1.00 . A A . 15 THR N 1 1 4 1917 1 1 15 THR O O 7.463 -0.575 1.972 1.00 . A A . 15 THR O 1 1 4 1918 1 1 15 THR OG1 O 10.129 2.806 2.385 1.00 . A A . 15 THR OG1 1 1 4 1919 1 1 16 VAL C C 4.085 0.315 1.553 1.00 . A A . 16 VAL C 1 1 4 1920 1 1 16 VAL CA C 4.806 -0.096 2.835 1.00 . A A . 16 VAL CA 1 1 4 1921 1 1 16 VAL CB C 3.868 -0.022 4.063 1.00 . A A . 16 VAL CB 1 1 4 1922 1 1 16 VAL CG1 C 2.468 -0.615 3.834 1.00 . A A . 16 VAL CG1 1 1 4 1923 1 1 16 VAL CG2 C 4.502 -0.787 5.233 1.00 . A A . 16 VAL CG2 1 1 4 1924 1 1 16 VAL H H 5.838 1.609 3.559 1.00 . A A . 16 VAL H 1 1 4 1925 1 1 16 VAL HA H 5.124 -1.131 2.724 1.00 . A A . 16 VAL HA 1 1 4 1926 1 1 16 VAL HB H 3.746 1.024 4.352 1.00 . A A . 16 VAL HB 1 1 4 1927 1 1 16 VAL HG11 H 2.544 -1.651 3.500 1.00 . A A . 16 VAL HG11 1 1 4 1928 1 1 16 VAL HG12 H 1.897 -0.585 4.762 1.00 . A A . 16 VAL HG12 1 1 4 1929 1 1 16 VAL HG13 H 1.925 -0.034 3.088 1.00 . A A . 16 VAL HG13 1 1 4 1930 1 1 16 VAL HG21 H 3.878 -0.688 6.120 1.00 . A A . 16 VAL HG21 1 1 4 1931 1 1 16 VAL HG22 H 4.588 -1.844 4.975 1.00 . A A . 16 VAL HG22 1 1 4 1932 1 1 16 VAL HG23 H 5.490 -0.389 5.460 1.00 . A A . 16 VAL HG23 1 1 4 1933 1 1 16 VAL N N 5.989 0.752 3.048 1.00 . A A . 16 VAL N 1 1 4 1934 1 1 16 VAL O O 3.978 1.496 1.228 1.00 . A A . 16 VAL O 1 1 4 1935 1 1 17 TYR C C 1.833 -1.734 -0.510 1.00 . A A . 17 TYR C 1 1 4 1936 1 1 17 TYR CA C 2.830 -0.574 -0.413 1.00 . A A . 17 TYR CA 1 1 4 1937 1 1 17 TYR CB C 3.795 -0.547 -1.612 1.00 . A A . 17 TYR CB 1 1 4 1938 1 1 17 TYR CD1 C 5.775 -1.972 -1.066 1.00 . A A . 17 TYR CD1 1 1 4 1939 1 1 17 TYR CD2 C 4.239 -2.777 -2.785 1.00 . A A . 17 TYR CD2 1 1 4 1940 1 1 17 TYR CE1 C 6.618 -3.072 -1.288 1.00 . A A . 17 TYR CE1 1 1 4 1941 1 1 17 TYR CE2 C 5.070 -3.899 -2.982 1.00 . A A . 17 TYR CE2 1 1 4 1942 1 1 17 TYR CG C 4.607 -1.806 -1.827 1.00 . A A . 17 TYR CG 1 1 4 1943 1 1 17 TYR CZ C 6.270 -4.037 -2.254 1.00 . A A . 17 TYR CZ 1 1 4 1944 1 1 17 TYR H H 3.665 -1.637 1.204 1.00 . A A . 17 TYR H 1 1 4 1945 1 1 17 TYR HA H 2.262 0.357 -0.403 1.00 . A A . 17 TYR HA 1 1 4 1946 1 1 17 TYR HB2 H 3.244 -0.322 -2.522 1.00 . A A . 17 TYR HB2 1 1 4 1947 1 1 17 TYR HB3 H 4.501 0.271 -1.464 1.00 . A A . 17 TYR HB3 1 1 4 1948 1 1 17 TYR HD1 H 6.031 -1.218 -0.334 1.00 . A A . 17 TYR HD1 1 1 4 1949 1 1 17 TYR HD2 H 3.326 -2.678 -3.363 1.00 . A A . 17 TYR HD2 1 1 4 1950 1 1 17 TYR HE1 H 7.537 -3.157 -0.739 1.00 . A A . 17 TYR HE1 1 1 4 1951 1 1 17 TYR HE2 H 4.804 -4.688 -3.664 1.00 . A A . 17 TYR HE2 1 1 4 1952 1 1 17 TYR HH H 7.868 -5.082 -1.930 1.00 . A A . 17 TYR HH 1 1 4 1953 1 1 17 TYR N N 3.589 -0.690 0.833 1.00 . A A . 17 TYR N 1 1 4 1954 1 1 17 TYR O O 1.700 -2.520 0.426 1.00 . A A . 17 TYR O 1 1 4 1955 1 1 17 TYR OH O 7.065 -5.122 -2.453 1.00 . A A . 17 TYR OH 1 1 4 1956 1 1 18 TYR C C 0.525 -3.632 -3.200 1.00 . A A . 18 TYR C 1 1 4 1957 1 1 18 TYR CA C 0.169 -2.925 -1.891 1.00 . A A . 18 TYR CA 1 1 4 1958 1 1 18 TYR CB C -1.249 -2.342 -1.849 1.00 . A A . 18 TYR CB 1 1 4 1959 1 1 18 TYR CD1 C -1.060 -0.388 -0.243 1.00 . A A . 18 TYR CD1 1 1 4 1960 1 1 18 TYR CD2 C -2.147 -2.426 0.524 1.00 . A A . 18 TYR CD2 1 1 4 1961 1 1 18 TYR CE1 C -1.130 0.153 1.049 1.00 . A A . 18 TYR CE1 1 1 4 1962 1 1 18 TYR CE2 C -2.261 -1.875 1.813 1.00 . A A . 18 TYR CE2 1 1 4 1963 1 1 18 TYR CG C -1.531 -1.691 -0.503 1.00 . A A . 18 TYR CG 1 1 4 1964 1 1 18 TYR CZ C -1.733 -0.593 2.085 1.00 . A A . 18 TYR CZ 1 1 4 1965 1 1 18 TYR H H 1.181 -1.129 -2.343 1.00 . A A . 18 TYR H 1 1 4 1966 1 1 18 TYR HA H 0.235 -3.667 -1.094 1.00 . A A . 18 TYR HA 1 1 4 1967 1 1 18 TYR HB2 H -1.361 -1.602 -2.643 1.00 . A A . 18 TYR HB2 1 1 4 1968 1 1 18 TYR HB3 H -1.967 -3.142 -2.024 1.00 . A A . 18 TYR HB3 1 1 4 1969 1 1 18 TYR HD1 H -0.615 0.192 -1.040 1.00 . A A . 18 TYR HD1 1 1 4 1970 1 1 18 TYR HD2 H -2.513 -3.423 0.329 1.00 . A A . 18 TYR HD2 1 1 4 1971 1 1 18 TYR HE1 H -0.708 1.130 1.213 1.00 . A A . 18 TYR HE1 1 1 4 1972 1 1 18 TYR HE2 H -2.730 -2.436 2.601 1.00 . A A . 18 TYR HE2 1 1 4 1973 1 1 18 TYR HH H -1.269 0.697 3.443 1.00 . A A . 18 TYR HH 1 1 4 1974 1 1 18 TYR N N 1.130 -1.856 -1.634 1.00 . A A . 18 TYR N 1 1 4 1975 1 1 18 TYR O O 0.939 -3.003 -4.175 1.00 . A A . 18 TYR O 1 1 4 1976 1 1 18 TYR OH O -1.824 -0.077 3.339 1.00 . A A . 18 TYR OH 1 1 4 1977 1 1 19 PHE C C -0.168 -6.907 -4.600 1.00 . A A . 19 PHE C 1 1 4 1978 1 1 19 PHE CA C 0.877 -5.852 -4.246 1.00 . A A . 19 PHE CA 1 1 4 1979 1 1 19 PHE CB C 2.168 -6.491 -3.722 1.00 . A A . 19 PHE CB 1 1 4 1980 1 1 19 PHE CD1 C 2.465 -8.868 -4.574 1.00 . A A . 19 PHE CD1 1 1 4 1981 1 1 19 PHE CD2 C 4.057 -7.174 -5.278 1.00 . A A . 19 PHE CD2 1 1 4 1982 1 1 19 PHE CE1 C 3.223 -9.847 -5.244 1.00 . A A . 19 PHE CE1 1 1 4 1983 1 1 19 PHE CE2 C 4.791 -8.144 -5.976 1.00 . A A . 19 PHE CE2 1 1 4 1984 1 1 19 PHE CG C 2.883 -7.522 -4.581 1.00 . A A . 19 PHE CG 1 1 4 1985 1 1 19 PHE CZ C 4.383 -9.486 -5.946 1.00 . A A . 19 PHE CZ 1 1 4 1986 1 1 19 PHE H H 0.067 -5.421 -2.348 1.00 . A A . 19 PHE H 1 1 4 1987 1 1 19 PHE HA H 1.113 -5.278 -5.142 1.00 . A A . 19 PHE HA 1 1 4 1988 1 1 19 PHE HB2 H 2.859 -5.679 -3.511 1.00 . A A . 19 PHE HB2 1 1 4 1989 1 1 19 PHE HB3 H 1.936 -6.961 -2.772 1.00 . A A . 19 PHE HB3 1 1 4 1990 1 1 19 PHE HD1 H 1.581 -9.162 -4.026 1.00 . A A . 19 PHE HD1 1 1 4 1991 1 1 19 PHE HD2 H 4.440 -6.170 -5.270 1.00 . A A . 19 PHE HD2 1 1 4 1992 1 1 19 PHE HE1 H 2.937 -10.886 -5.214 1.00 . A A . 19 PHE HE1 1 1 4 1993 1 1 19 PHE HE2 H 5.681 -7.850 -6.514 1.00 . A A . 19 PHE HE2 1 1 4 1994 1 1 19 PHE HZ H 4.962 -10.240 -6.459 1.00 . A A . 19 PHE HZ 1 1 4 1995 1 1 19 PHE N N 0.395 -4.961 -3.195 1.00 . A A . 19 PHE N 1 1 4 1996 1 1 19 PHE O O -0.695 -7.607 -3.732 1.00 . A A . 19 PHE O 1 1 4 1997 1 1 20 ASN C C -0.472 -9.352 -6.624 1.00 . A A . 20 ASN C 1 1 4 1998 1 1 20 ASN CA C -1.248 -8.036 -6.528 1.00 . A A . 20 ASN CA 1 1 4 1999 1 1 20 ASN CB C -1.672 -7.536 -7.909 1.00 . A A . 20 ASN CB 1 1 4 2000 1 1 20 ASN CG C -2.677 -8.487 -8.518 1.00 . A A . 20 ASN CG 1 1 4 2001 1 1 20 ASN H H 0.006 -6.368 -6.538 1.00 . A A . 20 ASN H 1 1 4 2002 1 1 20 ASN HA H -2.141 -8.203 -5.937 1.00 . A A . 20 ASN HA 1 1 4 2003 1 1 20 ASN HB2 H -2.101 -6.543 -7.833 1.00 . A A . 20 ASN HB2 1 1 4 2004 1 1 20 ASN HB3 H -0.804 -7.466 -8.563 1.00 . A A . 20 ASN HB3 1 1 4 2005 1 1 20 ASN HD21 H -4.221 -7.454 -7.732 1.00 . A A . 20 ASN HD21 1 1 4 2006 1 1 20 ASN HD22 H -4.667 -8.871 -8.631 1.00 . A A . 20 ASN HD22 1 1 4 2007 1 1 20 ASN N N -0.447 -7.011 -5.896 1.00 . A A . 20 ASN N 1 1 4 2008 1 1 20 ASN ND2 N -3.948 -8.256 -8.279 1.00 . A A . 20 ASN ND2 1 1 4 2009 1 1 20 ASN O O 0.244 -9.591 -7.600 1.00 . A A . 20 ASN O 1 1 4 2010 1 1 20 ASN OD1 O -2.307 -9.449 -9.175 1.00 . A A . 20 ASN OD1 1 1 4 2011 1 1 21 HIS C C -0.615 -12.579 -6.636 1.00 . A A . 21 HIS C 1 1 4 2012 1 1 21 HIS CA C 0.020 -11.559 -5.669 1.00 . A A . 21 HIS CA 1 1 4 2013 1 1 21 HIS CB C 0.280 -12.061 -4.241 1.00 . A A . 21 HIS CB 1 1 4 2014 1 1 21 HIS CD2 C -2.106 -12.537 -3.480 1.00 . A A . 21 HIS CD2 1 1 4 2015 1 1 21 HIS CE1 C -2.063 -11.496 -1.534 1.00 . A A . 21 HIS CE1 1 1 4 2016 1 1 21 HIS CG C -0.880 -11.972 -3.292 1.00 . A A . 21 HIS CG 1 1 4 2017 1 1 21 HIS H H -1.300 -10.045 -4.899 1.00 . A A . 21 HIS H 1 1 4 2018 1 1 21 HIS HA H 1.006 -11.405 -6.105 1.00 . A A . 21 HIS HA 1 1 4 2019 1 1 21 HIS HB2 H 0.646 -13.087 -4.265 1.00 . A A . 21 HIS HB2 1 1 4 2020 1 1 21 HIS HB3 H 1.084 -11.460 -3.822 1.00 . A A . 21 HIS HB3 1 1 4 2021 1 1 21 HIS HD2 H -2.414 -13.121 -4.339 1.00 . A A . 21 HIS HD2 1 1 4 2022 1 1 21 HIS HE1 H -2.375 -11.129 -0.564 1.00 . A A . 21 HIS HE1 1 1 4 2023 1 1 21 HIS HE2 H -3.799 -12.489 -2.175 1.00 . A A . 21 HIS HE2 1 1 4 2024 1 1 21 HIS N N -0.646 -10.248 -5.650 1.00 . A A . 21 HIS N 1 1 4 2025 1 1 21 HIS ND1 N -0.846 -11.304 -2.067 1.00 . A A . 21 HIS ND1 1 1 4 2026 1 1 21 HIS NE2 N -2.843 -12.221 -2.360 1.00 . A A . 21 HIS NE2 1 1 4 2027 1 1 21 HIS O O -0.555 -13.783 -6.402 1.00 . A A . 21 HIS O 1 1 4 2028 1 1 22 ILE C C -0.881 -12.466 -10.143 1.00 . A A . 22 ILE C 1 1 4 2029 1 1 22 ILE CA C -1.679 -12.875 -8.878 1.00 . A A . 22 ILE CA 1 1 4 2030 1 1 22 ILE CB C -3.219 -12.740 -9.050 1.00 . A A . 22 ILE CB 1 1 4 2031 1 1 22 ILE CD1 C -5.489 -12.968 -7.795 1.00 . A A . 22 ILE CD1 1 1 4 2032 1 1 22 ILE CG1 C -3.958 -13.070 -7.727 1.00 . A A . 22 ILE CG1 1 1 4 2033 1 1 22 ILE CG2 C -3.724 -13.638 -10.195 1.00 . A A . 22 ILE CG2 1 1 4 2034 1 1 22 ILE H H -1.298 -11.082 -7.822 1.00 . A A . 22 ILE H 1 1 4 2035 1 1 22 ILE HA H -1.462 -13.927 -8.688 1.00 . A A . 22 ILE HA 1 1 4 2036 1 1 22 ILE HB H -3.452 -11.710 -9.313 1.00 . A A . 22 ILE HB 1 1 4 2037 1 1 22 ILE HD11 H -5.900 -13.783 -8.389 1.00 . A A . 22 ILE HD11 1 1 4 2038 1 1 22 ILE HD12 H -5.899 -13.038 -6.788 1.00 . A A . 22 ILE HD12 1 1 4 2039 1 1 22 ILE HD13 H -5.779 -12.012 -8.233 1.00 . A A . 22 ILE HD13 1 1 4 2040 1 1 22 ILE HG12 H -3.690 -14.078 -7.406 1.00 . A A . 22 ILE HG12 1 1 4 2041 1 1 22 ILE HG13 H -3.635 -12.374 -6.953 1.00 . A A . 22 ILE HG13 1 1 4 2042 1 1 22 ILE HG21 H -3.504 -14.685 -9.977 1.00 . A A . 22 ILE HG21 1 1 4 2043 1 1 22 ILE HG22 H -4.796 -13.516 -10.340 1.00 . A A . 22 ILE HG22 1 1 4 2044 1 1 22 ILE HG23 H -3.249 -13.363 -11.137 1.00 . A A . 22 ILE HG23 1 1 4 2045 1 1 22 ILE N N -1.211 -12.087 -7.731 1.00 . A A . 22 ILE N 1 1 4 2046 1 1 22 ILE O O -0.755 -13.257 -11.074 1.00 . A A . 22 ILE O 1 1 4 2047 1 1 23 THR C C 1.708 -9.947 -11.033 1.00 . A A . 23 THR C 1 1 4 2048 1 1 23 THR CA C 0.383 -10.660 -11.337 1.00 . A A . 23 THR CA 1 1 4 2049 1 1 23 THR CB C -0.522 -9.613 -12.008 1.00 . A A . 23 THR CB 1 1 4 2050 1 1 23 THR CG2 C -1.851 -10.178 -12.517 1.00 . A A . 23 THR CG2 1 1 4 2051 1 1 23 THR H H -0.465 -10.640 -9.381 1.00 . A A . 23 THR H 1 1 4 2052 1 1 23 THR HA H 0.597 -11.441 -12.067 1.00 . A A . 23 THR HA 1 1 4 2053 1 1 23 THR HB H 0.010 -9.186 -12.858 1.00 . A A . 23 THR HB 1 1 4 2054 1 1 23 THR HG1 H -1.423 -8.955 -10.425 1.00 . A A . 23 THR HG1 1 1 4 2055 1 1 23 THR HG21 H -2.460 -10.543 -11.691 1.00 . A A . 23 THR HG21 1 1 4 2056 1 1 23 THR HG22 H -2.396 -9.395 -13.043 1.00 . A A . 23 THR HG22 1 1 4 2057 1 1 23 THR HG23 H -1.657 -10.999 -13.207 1.00 . A A . 23 THR HG23 1 1 4 2058 1 1 23 THR N N -0.291 -11.256 -10.164 1.00 . A A . 23 THR N 1 1 4 2059 1 1 23 THR O O 2.484 -9.722 -11.961 1.00 . A A . 23 THR O 1 1 4 2060 1 1 23 THR OG1 O -0.794 -8.581 -11.084 1.00 . A A . 23 THR OG1 1 1 4 2061 1 1 24 ASN C C 2.777 -7.241 -9.356 1.00 . A A . 24 ASN C 1 1 4 2062 1 1 24 ASN CA C 3.057 -8.757 -9.234 1.00 . A A . 24 ASN CA 1 1 4 2063 1 1 24 ASN CB C 4.454 -9.115 -9.792 1.00 . A A . 24 ASN CB 1 1 4 2064 1 1 24 ASN CG C 4.799 -10.596 -9.749 1.00 . A A . 24 ASN CG 1 1 4 2065 1 1 24 ASN H H 1.295 -9.850 -9.051 1.00 . A A . 24 ASN H 1 1 4 2066 1 1 24 ASN HA H 3.087 -8.953 -8.163 1.00 . A A . 24 ASN HA 1 1 4 2067 1 1 24 ASN HB2 H 4.541 -8.759 -10.817 1.00 . A A . 24 ASN HB2 1 1 4 2068 1 1 24 ASN HB3 H 5.208 -8.587 -9.206 1.00 . A A . 24 ASN HB3 1 1 4 2069 1 1 24 ASN HD21 H 3.973 -10.878 -11.562 1.00 . A A . 24 ASN HD21 1 1 4 2070 1 1 24 ASN HD22 H 4.741 -12.292 -10.804 1.00 . A A . 24 ASN HD22 1 1 4 2071 1 1 24 ASN N N 1.979 -9.609 -9.763 1.00 . A A . 24 ASN N 1 1 4 2072 1 1 24 ASN ND2 N 4.501 -11.317 -10.810 1.00 . A A . 24 ASN ND2 1 1 4 2073 1 1 24 ASN O O 3.595 -6.442 -8.880 1.00 . A A . 24 ASN O 1 1 4 2074 1 1 24 ASN OD1 O 5.348 -11.107 -8.787 1.00 . A A . 24 ASN OD1 1 1 4 2075 1 1 25 ALA C C 1.333 -4.774 -8.639 1.00 . A A . 25 ALA C 1 1 4 2076 1 1 25 ALA CA C 1.315 -5.392 -10.046 1.00 . A A . 25 ALA CA 1 1 4 2077 1 1 25 ALA CB C -0.039 -5.220 -10.742 1.00 . A A . 25 ALA CB 1 1 4 2078 1 1 25 ALA H H 0.948 -7.478 -10.292 1.00 . A A . 25 ALA H 1 1 4 2079 1 1 25 ALA HA H 2.080 -4.905 -10.653 1.00 . A A . 25 ALA HA 1 1 4 2080 1 1 25 ALA HB1 H -0.011 -5.688 -11.728 1.00 . A A . 25 ALA HB1 1 1 4 2081 1 1 25 ALA HB2 H -0.830 -5.681 -10.150 1.00 . A A . 25 ALA HB2 1 1 4 2082 1 1 25 ALA HB3 H -0.258 -4.158 -10.860 1.00 . A A . 25 ALA HB3 1 1 4 2083 1 1 25 ALA N N 1.640 -6.820 -9.947 1.00 . A A . 25 ALA N 1 1 4 2084 1 1 25 ALA O O 0.723 -5.310 -7.718 1.00 . A A . 25 ALA O 1 1 4 2085 1 1 26 SER C C 2.439 -1.599 -7.140 1.00 . A A . 26 SER C 1 1 4 2086 1 1 26 SER CA C 2.319 -3.119 -7.126 1.00 . A A . 26 SER CA 1 1 4 2087 1 1 26 SER CB C 3.570 -3.795 -6.536 1.00 . A A . 26 SER CB 1 1 4 2088 1 1 26 SER H H 2.548 -3.224 -9.217 1.00 . A A . 26 SER H 1 1 4 2089 1 1 26 SER HA H 1.502 -3.360 -6.449 1.00 . A A . 26 SER HA 1 1 4 2090 1 1 26 SER HB2 H 4.082 -3.100 -5.869 1.00 . A A . 26 SER HB2 1 1 4 2091 1 1 26 SER HB3 H 3.226 -4.638 -5.942 1.00 . A A . 26 SER HB3 1 1 4 2092 1 1 26 SER HG H 4.106 -5.061 -7.975 1.00 . A A . 26 SER HG 1 1 4 2093 1 1 26 SER N N 2.044 -3.661 -8.458 1.00 . A A . 26 SER N 1 1 4 2094 1 1 26 SER O O 2.991 -1.017 -8.072 1.00 . A A . 26 SER O 1 1 4 2095 1 1 26 SER OG O 4.489 -4.291 -7.500 1.00 . A A . 26 SER OG 1 1 4 2096 1 1 27 GLN C C 1.423 0.855 -4.510 1.00 . A A . 27 GLN C 1 1 4 2097 1 1 27 GLN CA C 1.754 0.486 -5.964 1.00 . A A . 27 GLN CA 1 1 4 2098 1 1 27 GLN CB C 0.647 1.025 -6.908 1.00 . A A . 27 GLN CB 1 1 4 2099 1 1 27 GLN CD C 1.881 3.151 -7.699 1.00 . A A . 27 GLN CD 1 1 4 2100 1 1 27 GLN CG C 1.192 1.842 -8.093 1.00 . A A . 27 GLN CG 1 1 4 2101 1 1 27 GLN H H 1.463 -1.517 -5.352 1.00 . A A . 27 GLN H 1 1 4 2102 1 1 27 GLN HA H 2.711 0.946 -6.215 1.00 . A A . 27 GLN HA 1 1 4 2103 1 1 27 GLN HB2 H 0.063 0.194 -7.306 1.00 . A A . 27 GLN HB2 1 1 4 2104 1 1 27 GLN HB3 H -0.050 1.657 -6.357 1.00 . A A . 27 GLN HB3 1 1 4 2105 1 1 27 GLN HE21 H 2.374 3.624 -9.628 1.00 . A A . 27 GLN HE21 1 1 4 2106 1 1 27 GLN HE22 H 2.843 4.740 -8.354 1.00 . A A . 27 GLN HE22 1 1 4 2107 1 1 27 GLN HG2 H 1.893 1.235 -8.664 1.00 . A A . 27 GLN HG2 1 1 4 2108 1 1 27 GLN HG3 H 0.358 2.086 -8.753 1.00 . A A . 27 GLN HG3 1 1 4 2109 1 1 27 GLN N N 1.872 -0.966 -6.108 1.00 . A A . 27 GLN N 1 1 4 2110 1 1 27 GLN NE2 N 2.402 3.889 -8.659 1.00 . A A . 27 GLN NE2 1 1 4 2111 1 1 27 GLN O O 1.013 0.013 -3.714 1.00 . A A . 27 GLN O 1 1 4 2112 1 1 27 GLN OE1 O 1.965 3.536 -6.542 1.00 . A A . 27 GLN OE1 1 1 4 2113 1 1 28 PHE C C -0.352 2.914 -2.695 1.00 . A A . 28 PHE C 1 1 4 2114 1 1 28 PHE CA C 1.171 2.704 -2.873 1.00 . A A . 28 PHE CA 1 1 4 2115 1 1 28 PHE CB C 1.977 3.990 -2.658 1.00 . A A . 28 PHE CB 1 1 4 2116 1 1 28 PHE CD1 C 4.184 3.033 -1.863 1.00 . A A . 28 PHE CD1 1 1 4 2117 1 1 28 PHE CD2 C 4.140 4.275 -3.957 1.00 . A A . 28 PHE CD2 1 1 4 2118 1 1 28 PHE CE1 C 5.555 2.792 -2.034 1.00 . A A . 28 PHE CE1 1 1 4 2119 1 1 28 PHE CE2 C 5.513 4.027 -4.130 1.00 . A A . 28 PHE CE2 1 1 4 2120 1 1 28 PHE CG C 3.472 3.782 -2.821 1.00 . A A . 28 PHE CG 1 1 4 2121 1 1 28 PHE CZ C 6.223 3.285 -3.168 1.00 . A A . 28 PHE CZ 1 1 4 2122 1 1 28 PHE H H 1.838 2.798 -4.896 1.00 . A A . 28 PHE H 1 1 4 2123 1 1 28 PHE HA H 1.491 1.998 -2.106 1.00 . A A . 28 PHE HA 1 1 4 2124 1 1 28 PHE HB2 H 1.633 4.753 -3.359 1.00 . A A . 28 PHE HB2 1 1 4 2125 1 1 28 PHE HB3 H 1.802 4.356 -1.647 1.00 . A A . 28 PHE HB3 1 1 4 2126 1 1 28 PHE HD1 H 3.691 2.610 -1.000 1.00 . A A . 28 PHE HD1 1 1 4 2127 1 1 28 PHE HD2 H 3.597 4.829 -4.709 1.00 . A A . 28 PHE HD2 1 1 4 2128 1 1 28 PHE HE1 H 6.074 2.208 -1.292 1.00 . A A . 28 PHE HE1 1 1 4 2129 1 1 28 PHE HE2 H 6.019 4.397 -5.008 1.00 . A A . 28 PHE HE2 1 1 4 2130 1 1 28 PHE HZ H 7.275 3.085 -3.307 1.00 . A A . 28 PHE HZ 1 1 4 2131 1 1 28 PHE N N 1.530 2.141 -4.179 1.00 . A A . 28 PHE N 1 1 4 2132 1 1 28 PHE O O -0.781 3.466 -1.685 1.00 . A A . 28 PHE O 1 1 4 2133 1 1 29 GLU C C -3.126 1.748 -2.352 1.00 . A A . 29 GLU C 1 1 4 2134 1 1 29 GLU CA C -2.635 2.453 -3.629 1.00 . A A . 29 GLU CA 1 1 4 2135 1 1 29 GLU CB C -3.123 1.725 -4.900 1.00 . A A . 29 GLU CB 1 1 4 2136 1 1 29 GLU CD C -5.463 2.693 -5.323 1.00 . A A . 29 GLU CD 1 1 4 2137 1 1 29 GLU CG C -4.634 1.452 -4.985 1.00 . A A . 29 GLU CG 1 1 4 2138 1 1 29 GLU H H -0.736 2.026 -4.458 1.00 . A A . 29 GLU H 1 1 4 2139 1 1 29 GLU HA H -3.017 3.473 -3.644 1.00 . A A . 29 GLU HA 1 1 4 2140 1 1 29 GLU HB2 H -2.818 2.299 -5.777 1.00 . A A . 29 GLU HB2 1 1 4 2141 1 1 29 GLU HB3 H -2.614 0.760 -4.953 1.00 . A A . 29 GLU HB3 1 1 4 2142 1 1 29 GLU HG2 H -4.793 0.707 -5.768 1.00 . A A . 29 GLU HG2 1 1 4 2143 1 1 29 GLU HG3 H -4.991 1.014 -4.052 1.00 . A A . 29 GLU HG3 1 1 4 2144 1 1 29 GLU N N -1.168 2.480 -3.670 1.00 . A A . 29 GLU N 1 1 4 2145 1 1 29 GLU O O -3.013 0.533 -2.224 1.00 . A A . 29 GLU O 1 1 4 2146 1 1 29 GLU OE1 O -5.572 3.041 -6.518 1.00 . A A . 29 GLU OE1 1 1 4 2147 1 1 29 GLU OE2 O -6.057 3.313 -4.403 1.00 . A A . 29 GLU OE2 1 1 4 2148 1 1 30 ARG C C -5.587 1.749 -0.017 1.00 . A A . 30 ARG C 1 1 4 2149 1 1 30 ARG CA C -4.081 2.082 -0.070 1.00 . A A . 30 ARG CA 1 1 4 2150 1 1 30 ARG CB C -3.650 3.233 0.860 1.00 . A A . 30 ARG CB 1 1 4 2151 1 1 30 ARG CD C -3.407 4.232 3.162 1.00 . A A . 30 ARG CD 1 1 4 2152 1 1 30 ARG CG C -3.962 3.055 2.349 1.00 . A A . 30 ARG CG 1 1 4 2153 1 1 30 ARG CZ C -5.164 4.893 4.818 1.00 . A A . 30 ARG CZ 1 1 4 2154 1 1 30 ARG H H -3.779 3.504 -1.615 1.00 . A A . 30 ARG H 1 1 4 2155 1 1 30 ARG HA H -3.508 1.189 0.177 1.00 . A A . 30 ARG HA 1 1 4 2156 1 1 30 ARG HB2 H -2.569 3.360 0.754 1.00 . A A . 30 ARG HB2 1 1 4 2157 1 1 30 ARG HB3 H -4.131 4.153 0.522 1.00 . A A . 30 ARG HB3 1 1 4 2158 1 1 30 ARG HD2 H -2.326 4.116 3.262 1.00 . A A . 30 ARG HD2 1 1 4 2159 1 1 30 ARG HD3 H -3.589 5.167 2.630 1.00 . A A . 30 ARG HD3 1 1 4 2160 1 1 30 ARG HE H -3.548 3.824 5.252 1.00 . A A . 30 ARG HE 1 1 4 2161 1 1 30 ARG HG2 H -5.044 3.005 2.481 1.00 . A A . 30 ARG HG2 1 1 4 2162 1 1 30 ARG HG3 H -3.505 2.136 2.714 1.00 . A A . 30 ARG HG3 1 1 4 2163 1 1 30 ARG HH11 H -5.537 5.654 2.991 1.00 . A A . 30 ARG HH11 1 1 4 2164 1 1 30 ARG HH12 H -6.745 6.017 4.212 1.00 . A A . 30 ARG HH12 1 1 4 2165 1 1 30 ARG HH21 H -5.158 4.319 6.771 1.00 . A A . 30 ARG HH21 1 1 4 2166 1 1 30 ARG HH22 H -6.549 5.243 6.245 1.00 . A A . 30 ARG HH22 1 1 4 2167 1 1 30 ARG N N -3.700 2.517 -1.422 1.00 . A A . 30 ARG N 1 1 4 2168 1 1 30 ARG NE N -4.021 4.294 4.500 1.00 . A A . 30 ARG NE 1 1 4 2169 1 1 30 ARG NH1 N -5.861 5.559 3.930 1.00 . A A . 30 ARG NH1 1 1 4 2170 1 1 30 ARG NH2 N -5.622 4.823 6.043 1.00 . A A . 30 ARG NH2 1 1 4 2171 1 1 30 ARG O O -6.335 2.347 -0.789 1.00 . A A . 30 ARG O 1 1 4 2172 1 1 31 PRO C C -8.562 1.396 0.736 1.00 . A A . 31 PRO C 1 1 4 2173 1 1 31 PRO CA C -7.462 0.342 0.826 1.00 . A A . 31 PRO CA 1 1 4 2174 1 1 31 PRO CB C -7.597 -0.610 2.027 1.00 . A A . 31 PRO CB 1 1 4 2175 1 1 31 PRO CD C -5.298 0.018 1.772 1.00 . A A . 31 PRO CD 1 1 4 2176 1 1 31 PRO CG C -6.183 -1.158 2.178 1.00 . A A . 31 PRO CG 1 1 4 2177 1 1 31 PRO HA H -7.587 -0.243 -0.052 1.00 . A A . 31 PRO HA 1 1 4 2178 1 1 31 PRO HB2 H -7.859 -0.074 2.940 1.00 . A A . 31 PRO HB2 1 1 4 2179 1 1 31 PRO HB3 H -8.318 -1.405 1.832 1.00 . A A . 31 PRO HB3 1 1 4 2180 1 1 31 PRO HD2 H -5.047 0.586 2.665 1.00 . A A . 31 PRO HD2 1 1 4 2181 1 1 31 PRO HD3 H -4.397 -0.359 1.291 1.00 . A A . 31 PRO HD3 1 1 4 2182 1 1 31 PRO HG2 H -5.979 -1.481 3.200 1.00 . A A . 31 PRO HG2 1 1 4 2183 1 1 31 PRO HG3 H -6.038 -1.985 1.487 1.00 . A A . 31 PRO HG3 1 1 4 2184 1 1 31 PRO N N -6.081 0.845 0.860 1.00 . A A . 31 PRO N 1 1 4 2185 1 1 31 PRO O O -9.215 1.565 -0.298 1.00 . A A . 31 PRO O 1 1 4 2186 1 1 32 SER C C -9.501 3.637 3.599 1.00 . A A . 32 SER C 1 1 4 2187 1 1 32 SER CA C -9.684 3.176 2.144 1.00 . A A . 32 SER CA 1 1 4 2188 1 1 32 SER CB C -11.140 2.742 1.904 1.00 . A A . 32 SER CB 1 1 4 2189 1 1 32 SER H H -8.133 1.730 2.560 1.00 . A A . 32 SER H 1 1 4 2190 1 1 32 SER HA H -9.459 4.023 1.494 1.00 . A A . 32 SER HA 1 1 4 2191 1 1 32 SER HB2 H -11.324 1.781 2.386 1.00 . A A . 32 SER HB2 1 1 4 2192 1 1 32 SER HB3 H -11.829 3.482 2.313 1.00 . A A . 32 SER HB3 1 1 4 2193 1 1 32 SER HG H -10.587 2.188 0.123 1.00 . A A . 32 SER HG 1 1 4 2194 1 1 32 SER N N -8.756 2.073 1.849 1.00 . A A . 32 SER N 1 1 4 2195 1 1 32 SER O O -8.751 3.008 4.349 1.00 . A A . 32 SER O 1 1 4 2196 1 1 32 SER OG O -11.373 2.641 0.516 1.00 . A A . 32 SER OG 1 1 4 2197 1 1 33 GLY C C -8.685 6.001 5.484 1.00 . A A . 33 GLY C 1 1 4 2198 1 1 33 GLY CA C -10.056 5.367 5.298 1.00 . A A . 33 GLY CA 1 1 4 2199 1 1 33 GLY H H -10.759 5.209 3.311 1.00 . A A . 33 GLY H 1 1 4 2200 1 1 33 GLY HA2 H -10.804 6.150 5.408 1.00 . A A . 33 GLY HA2 1 1 4 2201 1 1 33 GLY HA3 H -10.194 4.630 6.089 1.00 . A A . 33 GLY HA3 1 1 4 2202 1 1 33 GLY N N -10.190 4.720 3.986 1.00 . A A . 33 GLY N 1 1 4 2203 1 1 33 GLY O O -8.203 6.651 4.532 1.00 . A A . 33 GLY O 1 1 4 2204 1 1 33 GLY OXT O -8.061 5.760 6.537 1.00 . A A . 33 GLY OXT 1 1 4 2205 2 2 1 NAG C1 C 12.940 1.389 -0.800 1.00 . B A . 101 NAG C1 1 1 4 2206 2 2 1 NAG C2 C 12.456 2.860 -0.789 1.00 . B A . 101 NAG C2 1 1 4 2207 2 2 1 NAG C3 C 11.098 2.918 -1.492 1.00 . B A . 101 NAG C3 1 1 4 2208 2 2 1 NAG C4 C 11.235 2.431 -2.930 1.00 . B A . 101 NAG C4 1 1 4 2209 2 2 1 NAG C5 C 11.690 0.971 -2.921 1.00 . B A . 101 NAG C5 1 1 4 2210 2 2 1 NAG C6 C 11.885 0.332 -4.295 1.00 . B A . 101 NAG C6 1 1 4 2211 2 2 1 NAG C7 C 13.185 4.247 1.106 1.00 . B A . 101 NAG C7 1 1 4 2212 2 2 1 NAG C8 C 12.885 4.708 2.540 1.00 . B A . 101 NAG C8 1 1 4 2213 2 2 1 NAG H1 H 12.270 0.760 -0.208 1.00 . B A . 101 NAG H1 1 1 4 2214 2 2 1 NAG H2 H 13.164 3.472 -1.350 1.00 . B A . 101 NAG H2 1 1 4 2215 2 2 1 NAG H3 H 10.391 2.279 -0.954 1.00 . B A . 101 NAG H3 1 1 4 2216 2 2 1 NAG H4 H 11.931 3.059 -3.487 1.00 . B A . 101 NAG H4 1 1 4 2217 2 2 1 NAG H5 H 10.945 0.398 -2.386 1.00 . B A . 101 NAG H5 1 1 4 2218 2 2 1 NAG H61 H 12.104 -0.729 -4.175 1.00 . B A . 101 NAG H61 1 1 4 2219 2 2 1 NAG H62 H 10.983 0.426 -4.899 1.00 . B A . 101 NAG H62 1 1 4 2220 2 2 1 NAG H81 H 11.973 5.306 2.548 1.00 . B A . 101 NAG H81 1 1 4 2221 2 2 1 NAG H82 H 13.712 5.313 2.915 1.00 . B A . 101 NAG H82 1 1 4 2222 2 2 1 NAG H83 H 12.755 3.843 3.190 1.00 . B A . 101 NAG H83 1 1 4 2223 2 2 1 NAG HN2 H 11.522 3.082 1.144 1.00 . B A . 101 NAG HN2 1 1 4 2224 2 2 1 NAG HO3 H 10.716 4.679 -0.652 1.00 . B A . 101 NAG HO3 1 1 4 2225 2 2 1 NAG HO4 H 9.625 3.422 -3.211 1.00 . B A . 101 NAG HO4 1 1 4 2226 2 2 1 NAG HO6 H 13.748 0.927 -4.336 1.00 . B A . 101 NAG HO6 1 1 4 2227 2 2 1 NAG N2 N 12.310 3.390 0.574 1.00 . B A . 101 NAG N2 1 1 4 2228 2 2 1 NAG O3 O 10.589 4.273 -1.519 1.00 . B A . 101 NAG O3 1 1 4 2229 2 2 1 NAG O4 O 9.924 2.546 -3.494 1.00 . B A . 101 NAG O4 1 1 4 2230 2 2 1 NAG O5 O 12.968 0.877 -2.175 1.00 . B A . 101 NAG O5 1 1 4 2231 2 2 1 NAG O6 O 12.999 0.964 -4.940 1.00 . B A . 101 NAG O6 1 1 4 2232 2 2 1 NAG O7 O 14.168 4.645 0.492 1.00 . B A . 101 NAG O7 1 1 5 2233 1 1 1 LYS C C -7.209 1.820 -4.990 1.00 . A A . 1 LYS C 1 1 5 2234 1 1 1 LYS CA C -7.348 2.945 -3.972 1.00 . A A . 1 LYS CA 1 1 5 2235 1 1 1 LYS CB C -8.465 3.946 -4.321 1.00 . A A . 1 LYS CB 1 1 5 2236 1 1 1 LYS CD C -8.942 5.965 -5.844 1.00 . A A . 1 LYS CD 1 1 5 2237 1 1 1 LYS CE C -8.343 6.714 -7.042 1.00 . A A . 1 LYS CE 1 1 5 2238 1 1 1 LYS CG C -8.301 4.574 -5.720 1.00 . A A . 1 LYS CG 1 1 5 2239 1 1 1 LYS H1 H -5.266 2.982 -3.783 1.00 . A A . 1 LYS H1 1 1 5 2240 1 1 1 LYS H2 H -6.009 4.221 -2.998 1.00 . A A . 1 LYS H2 1 1 5 2241 1 1 1 LYS H3 H -5.876 4.257 -4.616 1.00 . A A . 1 LYS H3 1 1 5 2242 1 1 1 LYS HA H -7.591 2.486 -3.016 1.00 . A A . 1 LYS HA 1 1 5 2243 1 1 1 LYS HB2 H -9.433 3.445 -4.271 1.00 . A A . 1 LYS HB2 1 1 5 2244 1 1 1 LYS HB3 H -8.457 4.732 -3.563 1.00 . A A . 1 LYS HB3 1 1 5 2245 1 1 1 LYS HD2 H -10.017 5.845 -5.989 1.00 . A A . 1 LYS HD2 1 1 5 2246 1 1 1 LYS HD3 H -8.778 6.550 -4.937 1.00 . A A . 1 LYS HD3 1 1 5 2247 1 1 1 LYS HE2 H -8.272 6.020 -7.886 1.00 . A A . 1 LYS HE2 1 1 5 2248 1 1 1 LYS HE3 H -9.020 7.524 -7.329 1.00 . A A . 1 LYS HE3 1 1 5 2249 1 1 1 LYS HG2 H -7.245 4.656 -5.957 1.00 . A A . 1 LYS HG2 1 1 5 2250 1 1 1 LYS HG3 H -8.741 3.911 -6.466 1.00 . A A . 1 LYS HG3 1 1 5 2251 1 1 1 LYS HZ1 H -6.530 7.594 -7.557 1.00 . A A . 1 LYS HZ1 1 1 5 2252 1 1 1 LYS HZ2 H -7.085 8.044 -6.076 1.00 . A A . 1 LYS HZ2 1 1 5 2253 1 1 1 LYS HZ3 H -6.400 6.582 -6.257 1.00 . A A . 1 LYS HZ3 1 1 5 2254 1 1 1 LYS N N -6.046 3.633 -3.830 1.00 . A A . 1 LYS N 1 1 5 2255 1 1 1 LYS NZ N -7.005 7.275 -6.725 1.00 . A A . 1 LYS NZ 1 1 5 2256 1 1 1 LYS O O -6.588 2.025 -6.030 1.00 . A A . 1 LYS O 1 1 5 2257 1 1 2 LEU C C -8.472 -1.708 -5.125 1.00 . A A . 2 LEU C 1 1 5 2258 1 1 2 LEU CA C -7.453 -0.590 -5.436 1.00 . A A . 2 LEU CA 1 1 5 2259 1 1 2 LEU CB C -5.995 -1.030 -5.171 1.00 . A A . 2 LEU CB 1 1 5 2260 1 1 2 LEU CD1 C -6.039 -2.286 -2.929 1.00 . A A . 2 LEU CD1 1 1 5 2261 1 1 2 LEU CD2 C -3.996 -1.021 -3.695 1.00 . A A . 2 LEU CD2 1 1 5 2262 1 1 2 LEU CG C -5.518 -1.070 -3.697 1.00 . A A . 2 LEU CG 1 1 5 2263 1 1 2 LEU H H -8.251 0.471 -3.819 1.00 . A A . 2 LEU H 1 1 5 2264 1 1 2 LEU HA H -7.543 -0.339 -6.494 1.00 . A A . 2 LEU HA 1 1 5 2265 1 1 2 LEU HB2 H -5.821 -2.006 -5.626 1.00 . A A . 2 LEU HB2 1 1 5 2266 1 1 2 LEU HB3 H -5.359 -0.327 -5.710 1.00 . A A . 2 LEU HB3 1 1 5 2267 1 1 2 LEU HD11 H -7.057 -2.099 -2.592 1.00 . A A . 2 LEU HD11 1 1 5 2268 1 1 2 LEU HD12 H -6.058 -3.167 -3.559 1.00 . A A . 2 LEU HD12 1 1 5 2269 1 1 2 LEU HD13 H -5.418 -2.485 -2.056 1.00 . A A . 2 LEU HD13 1 1 5 2270 1 1 2 LEU HD21 H -3.581 -1.851 -4.263 1.00 . A A . 2 LEU HD21 1 1 5 2271 1 1 2 LEU HD22 H -3.659 -0.082 -4.132 1.00 . A A . 2 LEU HD22 1 1 5 2272 1 1 2 LEU HD23 H -3.646 -1.047 -2.670 1.00 . A A . 2 LEU HD23 1 1 5 2273 1 1 2 LEU HG H -5.829 -0.187 -3.139 1.00 . A A . 2 LEU HG 1 1 5 2274 1 1 2 LEU N N -7.707 0.624 -4.657 1.00 . A A . 2 LEU N 1 1 5 2275 1 1 2 LEU O O -9.078 -1.672 -4.051 1.00 . A A . 2 LEU O 1 1 5 2276 1 1 3 PRO C C -8.907 -5.009 -5.115 1.00 . A A . 3 PRO C 1 1 5 2277 1 1 3 PRO CA C -9.577 -3.815 -5.838 1.00 . A A . 3 PRO CA 1 1 5 2278 1 1 3 PRO CB C -9.997 -4.208 -7.259 1.00 . A A . 3 PRO CB 1 1 5 2279 1 1 3 PRO CD C -8.158 -2.691 -7.403 1.00 . A A . 3 PRO CD 1 1 5 2280 1 1 3 PRO CG C -8.733 -3.941 -8.071 1.00 . A A . 3 PRO CG 1 1 5 2281 1 1 3 PRO HA H -10.454 -3.492 -5.277 1.00 . A A . 3 PRO HA 1 1 5 2282 1 1 3 PRO HB2 H -10.307 -5.250 -7.341 1.00 . A A . 3 PRO HB2 1 1 5 2283 1 1 3 PRO HB3 H -10.796 -3.548 -7.601 1.00 . A A . 3 PRO HB3 1 1 5 2284 1 1 3 PRO HD2 H -7.069 -2.723 -7.420 1.00 . A A . 3 PRO HD2 1 1 5 2285 1 1 3 PRO HD3 H -8.515 -1.807 -7.932 1.00 . A A . 3 PRO HD3 1 1 5 2286 1 1 3 PRO HG2 H -8.047 -4.778 -7.954 1.00 . A A . 3 PRO HG2 1 1 5 2287 1 1 3 PRO HG3 H -8.955 -3.771 -9.124 1.00 . A A . 3 PRO HG3 1 1 5 2288 1 1 3 PRO N N -8.674 -2.681 -6.037 1.00 . A A . 3 PRO N 1 1 5 2289 1 1 3 PRO O O -7.676 -5.067 -5.015 1.00 . A A . 3 PRO O 1 1 5 2290 1 1 4 PRO C C -8.163 -7.961 -5.041 1.00 . A A . 4 PRO C 1 1 5 2291 1 1 4 PRO CA C -9.218 -7.288 -4.149 1.00 . A A . 4 PRO CA 1 1 5 2292 1 1 4 PRO CB C -10.460 -8.172 -3.994 1.00 . A A . 4 PRO CB 1 1 5 2293 1 1 4 PRO CD C -11.159 -5.974 -4.604 1.00 . A A . 4 PRO CD 1 1 5 2294 1 1 4 PRO CG C -11.570 -7.159 -3.733 1.00 . A A . 4 PRO CG 1 1 5 2295 1 1 4 PRO HA H -8.790 -7.110 -3.161 1.00 . A A . 4 PRO HA 1 1 5 2296 1 1 4 PRO HB2 H -10.666 -8.699 -4.929 1.00 . A A . 4 PRO HB2 1 1 5 2297 1 1 4 PRO HB3 H -10.355 -8.878 -3.171 1.00 . A A . 4 PRO HB3 1 1 5 2298 1 1 4 PRO HD2 H -11.568 -6.104 -5.606 1.00 . A A . 4 PRO HD2 1 1 5 2299 1 1 4 PRO HD3 H -11.526 -5.048 -4.162 1.00 . A A . 4 PRO HD3 1 1 5 2300 1 1 4 PRO HG2 H -12.550 -7.548 -4.014 1.00 . A A . 4 PRO HG2 1 1 5 2301 1 1 4 PRO HG3 H -11.559 -6.864 -2.682 1.00 . A A . 4 PRO HG3 1 1 5 2302 1 1 4 PRO N N -9.702 -6.004 -4.660 1.00 . A A . 4 PRO N 1 1 5 2303 1 1 4 PRO O O -8.255 -7.932 -6.267 1.00 . A A . 4 PRO O 1 1 5 2304 1 1 5 GLY C C -4.701 -8.388 -4.713 1.00 . A A . 5 GLY C 1 1 5 2305 1 1 5 GLY CA C -5.979 -9.158 -5.049 1.00 . A A . 5 GLY CA 1 1 5 2306 1 1 5 GLY H H -7.150 -8.550 -3.393 1.00 . A A . 5 GLY H 1 1 5 2307 1 1 5 GLY HA2 H -5.864 -10.188 -4.712 1.00 . A A . 5 GLY HA2 1 1 5 2308 1 1 5 GLY HA3 H -6.104 -9.158 -6.133 1.00 . A A . 5 GLY HA3 1 1 5 2309 1 1 5 GLY N N -7.152 -8.560 -4.402 1.00 . A A . 5 GLY N 1 1 5 2310 1 1 5 GLY O O -3.656 -9.004 -4.508 1.00 . A A . 5 GLY O 1 1 5 2311 1 1 6 TRP C C -3.738 -6.192 -2.579 1.00 . A A . 6 TRP C 1 1 5 2312 1 1 6 TRP CA C -3.754 -6.165 -4.113 1.00 . A A . 6 TRP CA 1 1 5 2313 1 1 6 TRP CB C -4.002 -4.738 -4.611 1.00 . A A . 6 TRP CB 1 1 5 2314 1 1 6 TRP CD1 C -2.035 -3.899 -5.965 1.00 . A A . 6 TRP CD1 1 1 5 2315 1 1 6 TRP CD2 C -3.841 -4.317 -7.229 1.00 . A A . 6 TRP CD2 1 1 5 2316 1 1 6 TRP CE2 C -2.820 -3.841 -8.105 1.00 . A A . 6 TRP CE2 1 1 5 2317 1 1 6 TRP CE3 C -5.072 -4.686 -7.809 1.00 . A A . 6 TRP CE3 1 1 5 2318 1 1 6 TRP CG C -3.309 -4.337 -5.872 1.00 . A A . 6 TRP CG 1 1 5 2319 1 1 6 TRP CH2 C -4.247 -4.120 -10.039 1.00 . A A . 6 TRP CH2 1 1 5 2320 1 1 6 TRP CZ2 C -3.009 -3.744 -9.491 1.00 . A A . 6 TRP CZ2 1 1 5 2321 1 1 6 TRP CZ3 C -5.274 -4.589 -9.199 1.00 . A A . 6 TRP CZ3 1 1 5 2322 1 1 6 TRP H H -5.701 -6.622 -4.798 1.00 . A A . 6 TRP H 1 1 5 2323 1 1 6 TRP HA H -2.781 -6.488 -4.468 1.00 . A A . 6 TRP HA 1 1 5 2324 1 1 6 TRP HB2 H -5.069 -4.602 -4.764 1.00 . A A . 6 TRP HB2 1 1 5 2325 1 1 6 TRP HB3 H -3.691 -4.041 -3.835 1.00 . A A . 6 TRP HB3 1 1 5 2326 1 1 6 TRP HD1 H -1.352 -3.799 -5.134 1.00 . A A . 6 TRP HD1 1 1 5 2327 1 1 6 TRP HE1 H -0.810 -3.363 -7.596 1.00 . A A . 6 TRP HE1 1 1 5 2328 1 1 6 TRP HE3 H -5.863 -5.047 -7.164 1.00 . A A . 6 TRP HE3 1 1 5 2329 1 1 6 TRP HH2 H -4.409 -4.051 -11.105 1.00 . A A . 6 TRP HH2 1 1 5 2330 1 1 6 TRP HZ2 H -2.210 -3.392 -10.127 1.00 . A A . 6 TRP HZ2 1 1 5 2331 1 1 6 TRP HZ3 H -6.224 -4.874 -9.632 1.00 . A A . 6 TRP HZ3 1 1 5 2332 1 1 6 TRP N N -4.799 -7.054 -4.627 1.00 . A A . 6 TRP N 1 1 5 2333 1 1 6 TRP NE1 N -1.737 -3.613 -7.282 1.00 . A A . 6 TRP NE1 1 1 5 2334 1 1 6 TRP O O -4.686 -5.741 -1.939 1.00 . A A . 6 TRP O 1 1 5 2335 1 1 7 GLU C C -1.413 -6.150 0.095 1.00 . A A . 7 GLU C 1 1 5 2336 1 1 7 GLU CA C -2.556 -6.958 -0.548 1.00 . A A . 7 GLU CA 1 1 5 2337 1 1 7 GLU CB C -2.372 -8.473 -0.373 1.00 . A A . 7 GLU CB 1 1 5 2338 1 1 7 GLU CD C -2.432 -10.461 1.157 1.00 . A A . 7 GLU CD 1 1 5 2339 1 1 7 GLU CG C -2.717 -8.961 1.035 1.00 . A A . 7 GLU CG 1 1 5 2340 1 1 7 GLU H H -1.914 -7.105 -2.555 1.00 . A A . 7 GLU H 1 1 5 2341 1 1 7 GLU HA H -3.494 -6.676 -0.067 1.00 . A A . 7 GLU HA 1 1 5 2342 1 1 7 GLU HB2 H -3.035 -8.988 -1.068 1.00 . A A . 7 GLU HB2 1 1 5 2343 1 1 7 GLU HB3 H -1.343 -8.740 -0.619 1.00 . A A . 7 GLU HB3 1 1 5 2344 1 1 7 GLU HG2 H -2.124 -8.412 1.769 1.00 . A A . 7 GLU HG2 1 1 5 2345 1 1 7 GLU HG3 H -3.770 -8.757 1.237 1.00 . A A . 7 GLU HG3 1 1 5 2346 1 1 7 GLU N N -2.654 -6.698 -1.985 1.00 . A A . 7 GLU N 1 1 5 2347 1 1 7 GLU O O -0.340 -6.010 -0.496 1.00 . A A . 7 GLU O 1 1 5 2348 1 1 7 GLU OE1 O -1.238 -10.787 1.374 1.00 . A A . 7 GLU OE1 1 1 5 2349 1 1 7 GLU OE2 O -3.390 -11.250 1.029 1.00 . A A . 7 GLU OE2 1 1 5 2350 1 1 8 LYS C C 0.633 -5.331 2.261 1.00 . A A . 8 LYS C 1 1 5 2351 1 1 8 LYS CA C -0.749 -4.697 2.033 1.00 . A A . 8 LYS CA 1 1 5 2352 1 1 8 LYS CB C -1.406 -4.286 3.363 1.00 . A A . 8 LYS CB 1 1 5 2353 1 1 8 LYS CD C -1.071 -2.973 5.538 1.00 . A A . 8 LYS CD 1 1 5 2354 1 1 8 LYS CE C -2.546 -2.599 5.737 1.00 . A A . 8 LYS CE 1 1 5 2355 1 1 8 LYS CG C -0.646 -3.146 4.069 1.00 . A A . 8 LYS CG 1 1 5 2356 1 1 8 LYS H H -2.547 -5.794 1.726 1.00 . A A . 8 LYS H 1 1 5 2357 1 1 8 LYS HA H -0.618 -3.798 1.426 1.00 . A A . 8 LYS HA 1 1 5 2358 1 1 8 LYS HB2 H -2.427 -3.954 3.169 1.00 . A A . 8 LYS HB2 1 1 5 2359 1 1 8 LYS HB3 H -1.447 -5.159 4.019 1.00 . A A . 8 LYS HB3 1 1 5 2360 1 1 8 LYS HD2 H -0.884 -3.913 6.058 1.00 . A A . 8 LYS HD2 1 1 5 2361 1 1 8 LYS HD3 H -0.440 -2.214 6.002 1.00 . A A . 8 LYS HD3 1 1 5 2362 1 1 8 LYS HE2 H -3.175 -3.263 5.139 1.00 . A A . 8 LYS HE2 1 1 5 2363 1 1 8 LYS HE3 H -2.804 -2.756 6.787 1.00 . A A . 8 LYS HE3 1 1 5 2364 1 1 8 LYS HG2 H 0.423 -3.362 4.066 1.00 . A A . 8 LYS HG2 1 1 5 2365 1 1 8 LYS HG3 H -0.803 -2.215 3.525 1.00 . A A . 8 LYS HG3 1 1 5 2366 1 1 8 LYS HZ1 H -2.659 -1.007 4.395 1.00 . A A . 8 LYS HZ1 1 1 5 2367 1 1 8 LYS HZ2 H -3.822 -0.983 5.528 1.00 . A A . 8 LYS HZ2 1 1 5 2368 1 1 8 LYS HZ3 H -2.288 -0.546 5.944 1.00 . A A . 8 LYS HZ3 1 1 5 2369 1 1 8 LYS N N -1.653 -5.606 1.301 1.00 . A A . 8 LYS N 1 1 5 2370 1 1 8 LYS NZ N -2.822 -1.190 5.383 1.00 . A A . 8 LYS NZ 1 1 5 2371 1 1 8 LYS O O 0.749 -6.405 2.855 1.00 . A A . 8 LYS O 1 1 5 2372 1 1 9 ARG C C 4.067 -4.072 2.148 1.00 . A A . 9 ARG C 1 1 5 2373 1 1 9 ARG CA C 3.061 -5.148 1.702 1.00 . A A . 9 ARG CA 1 1 5 2374 1 1 9 ARG CB C 3.226 -5.514 0.217 1.00 . A A . 9 ARG CB 1 1 5 2375 1 1 9 ARG CD C 3.374 -8.110 0.016 1.00 . A A . 9 ARG CD 1 1 5 2376 1 1 9 ARG CG C 4.089 -6.741 -0.045 1.00 . A A . 9 ARG CG 1 1 5 2377 1 1 9 ARG CZ C 1.374 -9.105 1.189 1.00 . A A . 9 ARG CZ 1 1 5 2378 1 1 9 ARG H H 1.568 -3.795 1.289 1.00 . A A . 9 ARG H 1 1 5 2379 1 1 9 ARG HA H 3.205 -6.013 2.346 1.00 . A A . 9 ARG HA 1 1 5 2380 1 1 9 ARG HB2 H 2.261 -5.693 -0.260 1.00 . A A . 9 ARG HB2 1 1 5 2381 1 1 9 ARG HB3 H 3.657 -4.654 -0.292 1.00 . A A . 9 ARG HB3 1 1 5 2382 1 1 9 ARG HD2 H 2.910 -8.296 -0.951 1.00 . A A . 9 ARG HD2 1 1 5 2383 1 1 9 ARG HD3 H 4.121 -8.888 0.177 1.00 . A A . 9 ARG HD3 1 1 5 2384 1 1 9 ARG HE H 2.230 -7.438 1.706 1.00 . A A . 9 ARG HE 1 1 5 2385 1 1 9 ARG HG2 H 4.434 -6.604 -1.062 1.00 . A A . 9 ARG HG2 1 1 5 2386 1 1 9 ARG HG3 H 4.956 -6.721 0.614 1.00 . A A . 9 ARG HG3 1 1 5 2387 1 1 9 ARG HH11 H 1.750 -10.301 -0.410 1.00 . A A . 9 ARG HH11 1 1 5 2388 1 1 9 ARG HH12 H 0.306 -10.647 0.582 1.00 . A A . 9 ARG HH12 1 1 5 2389 1 1 9 ARG HH21 H 0.486 -8.130 2.711 1.00 . A A . 9 ARG HH21 1 1 5 2390 1 1 9 ARG HH22 H -0.246 -9.678 2.147 1.00 . A A . 9 ARG HH22 1 1 5 2391 1 1 9 ARG N N 1.690 -4.665 1.796 1.00 . A A . 9 ARG N 1 1 5 2392 1 1 9 ARG NE N 2.335 -8.202 1.058 1.00 . A A . 9 ARG NE 1 1 5 2393 1 1 9 ARG NH1 N 1.178 -10.124 0.391 1.00 . A A . 9 ARG NH1 1 1 5 2394 1 1 9 ARG NH2 N 0.520 -8.989 2.163 1.00 . A A . 9 ARG NH2 1 1 5 2395 1 1 9 ARG O O 3.714 -2.900 2.287 1.00 . A A . 9 ARG O 1 1 5 2396 1 1 10 MET C C 7.754 -4.001 2.551 1.00 . A A . 10 MET C 1 1 5 2397 1 1 10 MET CA C 6.339 -3.602 2.985 1.00 . A A . 10 MET CA 1 1 5 2398 1 1 10 MET CB C 6.162 -3.697 4.513 1.00 . A A . 10 MET CB 1 1 5 2399 1 1 10 MET CE C 9.452 -2.268 6.711 1.00 . A A . 10 MET CE 1 1 5 2400 1 1 10 MET CG C 7.119 -2.812 5.320 1.00 . A A . 10 MET CG 1 1 5 2401 1 1 10 MET H H 5.606 -5.417 2.193 1.00 . A A . 10 MET H 1 1 5 2402 1 1 10 MET HA H 6.163 -2.571 2.683 1.00 . A A . 10 MET HA 1 1 5 2403 1 1 10 MET HB2 H 5.145 -3.389 4.756 1.00 . A A . 10 MET HB2 1 1 5 2404 1 1 10 MET HB3 H 6.278 -4.733 4.835 1.00 . A A . 10 MET HB3 1 1 5 2405 1 1 10 MET HE1 H 8.845 -2.064 7.593 1.00 . A A . 10 MET HE1 1 1 5 2406 1 1 10 MET HE2 H 10.453 -2.569 7.021 1.00 . A A . 10 MET HE2 1 1 5 2407 1 1 10 MET HE3 H 9.523 -1.368 6.100 1.00 . A A . 10 MET HE3 1 1 5 2408 1 1 10 MET HG2 H 7.308 -1.886 4.774 1.00 . A A . 10 MET HG2 1 1 5 2409 1 1 10 MET HG3 H 6.624 -2.553 6.256 1.00 . A A . 10 MET HG3 1 1 5 2410 1 1 10 MET N N 5.330 -4.461 2.356 1.00 . A A . 10 MET N 1 1 5 2411 1 1 10 MET O O 8.113 -5.177 2.559 1.00 . A A . 10 MET O 1 1 5 2412 1 1 10 MET SD S 8.697 -3.600 5.744 1.00 . A A . 10 MET SD 1 1 5 2413 1 1 11 PHE C C 10.797 -2.880 3.032 1.00 . A A . 11 PHE C 1 1 5 2414 1 1 11 PHE CA C 9.946 -3.109 1.780 1.00 . A A . 11 PHE CA 1 1 5 2415 1 1 11 PHE CB C 10.306 -2.044 0.735 1.00 . A A . 11 PHE CB 1 1 5 2416 1 1 11 PHE CD1 C 10.101 -3.327 -1.430 1.00 . A A . 11 PHE CD1 1 1 5 2417 1 1 11 PHE CD2 C 8.744 -1.322 -1.136 1.00 . A A . 11 PHE CD2 1 1 5 2418 1 1 11 PHE CE1 C 9.580 -3.493 -2.726 1.00 . A A . 11 PHE CE1 1 1 5 2419 1 1 11 PHE CE2 C 8.233 -1.487 -2.436 1.00 . A A . 11 PHE CE2 1 1 5 2420 1 1 11 PHE CG C 9.684 -2.243 -0.631 1.00 . A A . 11 PHE CG 1 1 5 2421 1 1 11 PHE CZ C 8.648 -2.570 -3.228 1.00 . A A . 11 PHE CZ 1 1 5 2422 1 1 11 PHE H H 8.139 -2.069 2.090 1.00 . A A . 11 PHE H 1 1 5 2423 1 1 11 PHE HA H 10.159 -4.085 1.351 1.00 . A A . 11 PHE HA 1 1 5 2424 1 1 11 PHE HB2 H 10.039 -1.060 1.120 1.00 . A A . 11 PHE HB2 1 1 5 2425 1 1 11 PHE HB3 H 11.389 -2.053 0.600 1.00 . A A . 11 PHE HB3 1 1 5 2426 1 1 11 PHE HD1 H 10.840 -4.024 -1.066 1.00 . A A . 11 PHE HD1 1 1 5 2427 1 1 11 PHE HD2 H 8.395 -0.493 -0.535 1.00 . A A . 11 PHE HD2 1 1 5 2428 1 1 11 PHE HE1 H 9.906 -4.318 -3.343 1.00 . A A . 11 PHE HE1 1 1 5 2429 1 1 11 PHE HE2 H 7.508 -0.794 -2.832 1.00 . A A . 11 PHE HE2 1 1 5 2430 1 1 11 PHE HZ H 8.256 -2.684 -4.228 1.00 . A A . 11 PHE HZ 1 1 5 2431 1 1 11 PHE N N 8.531 -3.005 2.119 1.00 . A A . 11 PHE N 1 1 5 2432 1 1 11 PHE O O 10.610 -1.870 3.714 1.00 . A A . 11 PHE O 1 1 5 2433 1 1 12 ALA C C 13.547 -2.225 4.297 1.00 . A A . 12 ALA C 1 1 5 2434 1 1 12 ALA CA C 12.794 -3.574 4.346 1.00 . A A . 12 ALA CA 1 1 5 2435 1 1 12 ALA CB C 13.766 -4.758 4.296 1.00 . A A . 12 ALA CB 1 1 5 2436 1 1 12 ALA H H 11.895 -4.566 2.701 1.00 . A A . 12 ALA H 1 1 5 2437 1 1 12 ALA HA H 12.266 -3.609 5.301 1.00 . A A . 12 ALA HA 1 1 5 2438 1 1 12 ALA HB1 H 14.313 -4.758 3.353 1.00 . A A . 12 ALA HB1 1 1 5 2439 1 1 12 ALA HB2 H 14.477 -4.680 5.119 1.00 . A A . 12 ALA HB2 1 1 5 2440 1 1 12 ALA HB3 H 13.216 -5.696 4.396 1.00 . A A . 12 ALA HB3 1 1 5 2441 1 1 12 ALA N N 11.802 -3.738 3.269 1.00 . A A . 12 ALA N 1 1 5 2442 1 1 12 ALA O O 14.075 -1.769 5.304 1.00 . A A . 12 ALA O 1 1 5 2443 1 1 13 ASN C C 13.146 0.861 3.641 1.00 . A A . 13 ASN C 1 1 5 2444 1 1 13 ASN CA C 13.976 -0.197 2.866 1.00 . A A . 13 ASN CA 1 1 5 2445 1 1 13 ASN CB C 13.820 -0.036 1.341 1.00 . A A . 13 ASN CB 1 1 5 2446 1 1 13 ASN CG C 14.268 1.307 0.757 1.00 . A A . 13 ASN CG 1 1 5 2447 1 1 13 ASN H H 13.106 -2.046 2.354 1.00 . A A . 13 ASN H 1 1 5 2448 1 1 13 ASN HA H 15.024 -0.083 3.147 1.00 . A A . 13 ASN HA 1 1 5 2449 1 1 13 ASN HB2 H 14.394 -0.810 0.832 1.00 . A A . 13 ASN HB2 1 1 5 2450 1 1 13 ASN HB3 H 12.770 -0.196 1.118 1.00 . A A . 13 ASN HB3 1 1 5 2451 1 1 13 ASN HD21 H 14.003 2.725 -0.564 1.00 . A A . 13 ASN HD21 1 1 5 2452 1 1 13 ASN N N 13.533 -1.569 3.131 1.00 . A A . 13 ASN N 1 1 5 2453 1 1 13 ASN ND2 N 13.646 1.822 -0.300 1.00 . A A . 13 ASN ND2 1 1 5 2454 1 1 13 ASN O O 13.494 2.036 3.648 1.00 . A A . 13 ASN O 1 1 5 2455 1 1 13 ASN OD1 O 15.237 1.895 1.208 1.00 . A A . 13 ASN OD1 1 1 5 2456 1 1 14 GLY C C 10.092 1.942 4.014 1.00 . A A . 14 GLY C 1 1 5 2457 1 1 14 GLY CA C 11.106 1.337 4.979 1.00 . A A . 14 GLY CA 1 1 5 2458 1 1 14 GLY H H 11.764 -0.517 4.210 1.00 . A A . 14 GLY H 1 1 5 2459 1 1 14 GLY HA2 H 10.574 0.764 5.738 1.00 . A A . 14 GLY HA2 1 1 5 2460 1 1 14 GLY HA3 H 11.653 2.144 5.468 1.00 . A A . 14 GLY HA3 1 1 5 2461 1 1 14 GLY N N 12.036 0.459 4.276 1.00 . A A . 14 GLY N 1 1 5 2462 1 1 14 GLY O O 10.060 3.156 3.820 1.00 . A A . 14 GLY O 1 1 5 2463 1 1 15 THR C C 7.121 0.655 2.254 1.00 . A A . 15 THR C 1 1 5 2464 1 1 15 THR CA C 8.286 1.633 2.378 1.00 . A A . 15 THR CA 1 1 5 2465 1 1 15 THR CB C 8.941 1.934 1.019 1.00 . A A . 15 THR CB 1 1 5 2466 1 1 15 THR CG2 C 7.956 2.448 -0.032 1.00 . A A . 15 THR CG2 1 1 5 2467 1 1 15 THR H H 9.379 0.106 3.404 1.00 . A A . 15 THR H 1 1 5 2468 1 1 15 THR HA H 7.883 2.570 2.751 1.00 . A A . 15 THR HA 1 1 5 2469 1 1 15 THR HB H 9.427 1.036 0.643 1.00 . A A . 15 THR HB 1 1 5 2470 1 1 15 THR HG1 H 10.005 3.115 2.154 1.00 . A A . 15 THR HG1 1 1 5 2471 1 1 15 THR HG21 H 7.168 1.717 -0.205 1.00 . A A . 15 THR HG21 1 1 5 2472 1 1 15 THR HG22 H 7.509 3.385 0.301 1.00 . A A . 15 THR HG22 1 1 5 2473 1 1 15 THR HG23 H 8.482 2.616 -0.972 1.00 . A A . 15 THR HG23 1 1 5 2474 1 1 15 THR N N 9.293 1.117 3.321 1.00 . A A . 15 THR N 1 1 5 2475 1 1 15 THR O O 7.330 -0.500 1.891 1.00 . A A . 15 THR O 1 1 5 2476 1 1 15 THR OG1 O 9.921 2.935 1.190 1.00 . A A . 15 THR OG1 1 1 5 2477 1 1 16 VAL C C 3.999 0.538 1.100 1.00 . A A . 16 VAL C 1 1 5 2478 1 1 16 VAL CA C 4.672 0.310 2.452 1.00 . A A . 16 VAL CA 1 1 5 2479 1 1 16 VAL CB C 3.725 0.615 3.636 1.00 . A A . 16 VAL CB 1 1 5 2480 1 1 16 VAL CG1 C 2.260 0.196 3.425 1.00 . A A . 16 VAL CG1 1 1 5 2481 1 1 16 VAL CG2 C 4.229 -0.137 4.874 1.00 . A A . 16 VAL CG2 1 1 5 2482 1 1 16 VAL H H 5.775 2.086 2.799 1.00 . A A . 16 VAL H 1 1 5 2483 1 1 16 VAL HA H 4.936 -0.744 2.507 1.00 . A A . 16 VAL HA 1 1 5 2484 1 1 16 VAL HB H 3.741 1.687 3.839 1.00 . A A . 16 VAL HB 1 1 5 2485 1 1 16 VAL HG11 H 2.198 -0.866 3.185 1.00 . A A . 16 VAL HG11 1 1 5 2486 1 1 16 VAL HG12 H 1.687 0.387 4.332 1.00 . A A . 16 VAL HG12 1 1 5 2487 1 1 16 VAL HG13 H 1.812 0.777 2.618 1.00 . A A . 16 VAL HG13 1 1 5 2488 1 1 16 VAL HG21 H 5.270 0.117 5.074 1.00 . A A . 16 VAL HG21 1 1 5 2489 1 1 16 VAL HG22 H 3.629 0.133 5.742 1.00 . A A . 16 VAL HG22 1 1 5 2490 1 1 16 VAL HG23 H 4.143 -1.212 4.702 1.00 . A A . 16 VAL HG23 1 1 5 2491 1 1 16 VAL N N 5.899 1.115 2.549 1.00 . A A . 16 VAL N 1 1 5 2492 1 1 16 VAL O O 4.009 1.638 0.549 1.00 . A A . 16 VAL O 1 1 5 2493 1 1 17 TYR C C 1.701 -1.712 -0.695 1.00 . A A . 17 TYR C 1 1 5 2494 1 1 17 TYR CA C 2.764 -0.612 -0.729 1.00 . A A . 17 TYR CA 1 1 5 2495 1 1 17 TYR CB C 3.814 -0.884 -1.825 1.00 . A A . 17 TYR CB 1 1 5 2496 1 1 17 TYR CD1 C 5.609 -2.309 -0.777 1.00 . A A . 17 TYR CD1 1 1 5 2497 1 1 17 TYR CD2 C 4.318 -3.263 -2.610 1.00 . A A . 17 TYR CD2 1 1 5 2498 1 1 17 TYR CE1 C 6.400 -3.467 -0.721 1.00 . A A . 17 TYR CE1 1 1 5 2499 1 1 17 TYR CE2 C 5.133 -4.412 -2.580 1.00 . A A . 17 TYR CE2 1 1 5 2500 1 1 17 TYR CG C 4.575 -2.195 -1.724 1.00 . A A . 17 TYR CG 1 1 5 2501 1 1 17 TYR CZ C 6.183 -4.511 -1.642 1.00 . A A . 17 TYR CZ 1 1 5 2502 1 1 17 TYR H H 3.399 -1.404 1.112 1.00 . A A . 17 TYR H 1 1 5 2503 1 1 17 TYR HA H 2.272 0.337 -0.942 1.00 . A A . 17 TYR HA 1 1 5 2504 1 1 17 TYR HB2 H 3.335 -0.820 -2.804 1.00 . A A . 17 TYR HB2 1 1 5 2505 1 1 17 TYR HB3 H 4.557 -0.089 -1.781 1.00 . A A . 17 TYR HB3 1 1 5 2506 1 1 17 TYR HD1 H 5.822 -1.480 -0.117 1.00 . A A . 17 TYR HD1 1 1 5 2507 1 1 17 TYR HD2 H 3.510 -3.205 -3.324 1.00 . A A . 17 TYR HD2 1 1 5 2508 1 1 17 TYR HE1 H 7.207 -3.523 -0.011 1.00 . A A . 17 TYR HE1 1 1 5 2509 1 1 17 TYR HE2 H 4.975 -5.233 -3.261 1.00 . A A . 17 TYR HE2 1 1 5 2510 1 1 17 TYR HH H 7.742 -5.494 -1.058 1.00 . A A . 17 TYR HH 1 1 5 2511 1 1 17 TYR N N 3.423 -0.539 0.571 1.00 . A A . 17 TYR N 1 1 5 2512 1 1 17 TYR O O 1.509 -2.369 0.321 1.00 . A A . 17 TYR O 1 1 5 2513 1 1 17 TYR OH O 6.969 -5.620 -1.612 1.00 . A A . 17 TYR OH 1 1 5 2514 1 1 18 TYR C C 0.578 -3.874 -3.204 1.00 . A A . 18 TYR C 1 1 5 2515 1 1 18 TYR CA C 0.103 -3.054 -2.016 1.00 . A A . 18 TYR CA 1 1 5 2516 1 1 18 TYR CB C -1.329 -2.565 -2.231 1.00 . A A . 18 TYR CB 1 1 5 2517 1 1 18 TYR CD1 C -1.376 -0.767 -0.476 1.00 . A A . 18 TYR CD1 1 1 5 2518 1 1 18 TYR CD2 C -2.973 -2.593 -0.297 1.00 . A A . 18 TYR CD2 1 1 5 2519 1 1 18 TYR CE1 C -1.747 -0.304 0.787 1.00 . A A . 18 TYR CE1 1 1 5 2520 1 1 18 TYR CE2 C -3.439 -2.057 0.917 1.00 . A A . 18 TYR CE2 1 1 5 2521 1 1 18 TYR CG C -1.921 -1.956 -0.981 1.00 . A A . 18 TYR CG 1 1 5 2522 1 1 18 TYR CZ C -2.790 -0.940 1.491 1.00 . A A . 18 TYR CZ 1 1 5 2523 1 1 18 TYR H H 1.005 -1.210 -2.520 1.00 . A A . 18 TYR H 1 1 5 2524 1 1 18 TYR HA H 0.105 -3.688 -1.133 1.00 . A A . 18 TYR HA 1 1 5 2525 1 1 18 TYR HB2 H -1.343 -1.831 -3.037 1.00 . A A . 18 TYR HB2 1 1 5 2526 1 1 18 TYR HB3 H -1.940 -3.414 -2.532 1.00 . A A . 18 TYR HB3 1 1 5 2527 1 1 18 TYR HD1 H -0.618 -0.230 -1.023 1.00 . A A . 18 TYR HD1 1 1 5 2528 1 1 18 TYR HD2 H -3.424 -3.487 -0.705 1.00 . A A . 18 TYR HD2 1 1 5 2529 1 1 18 TYR HE1 H -1.215 0.541 1.178 1.00 . A A . 18 TYR HE1 1 1 5 2530 1 1 18 TYR HE2 H -4.284 -2.508 1.411 1.00 . A A . 18 TYR HE2 1 1 5 2531 1 1 18 TYR HH H -4.150 -0.707 2.936 1.00 . A A . 18 TYR HH 1 1 5 2532 1 1 18 TYR N N 1.007 -1.930 -1.806 1.00 . A A . 18 TYR N 1 1 5 2533 1 1 18 TYR O O 0.993 -3.324 -4.225 1.00 . A A . 18 TYR O 1 1 5 2534 1 1 18 TYR OH O -3.182 -0.447 2.695 1.00 . A A . 18 TYR OH 1 1 5 2535 1 1 19 PHE C C -0.090 -7.057 -4.554 1.00 . A A . 19 PHE C 1 1 5 2536 1 1 19 PHE CA C 1.017 -6.139 -4.049 1.00 . A A . 19 PHE CA 1 1 5 2537 1 1 19 PHE CB C 2.135 -6.920 -3.365 1.00 . A A . 19 PHE CB 1 1 5 2538 1 1 19 PHE CD1 C 3.818 -7.401 -5.187 1.00 . A A . 19 PHE CD1 1 1 5 2539 1 1 19 PHE CD2 C 2.576 -9.260 -4.214 1.00 . A A . 19 PHE CD2 1 1 5 2540 1 1 19 PHE CE1 C 4.520 -8.304 -6.004 1.00 . A A . 19 PHE CE1 1 1 5 2541 1 1 19 PHE CE2 C 3.274 -10.162 -5.034 1.00 . A A . 19 PHE CE2 1 1 5 2542 1 1 19 PHE CG C 2.860 -7.883 -4.277 1.00 . A A . 19 PHE CG 1 1 5 2543 1 1 19 PHE CZ C 4.257 -9.683 -5.919 1.00 . A A . 19 PHE CZ 1 1 5 2544 1 1 19 PHE H H 0.140 -5.583 -2.203 1.00 . A A . 19 PHE H 1 1 5 2545 1 1 19 PHE HA H 1.445 -5.609 -4.902 1.00 . A A . 19 PHE HA 1 1 5 2546 1 1 19 PHE HB2 H 2.861 -6.216 -2.961 1.00 . A A . 19 PHE HB2 1 1 5 2547 1 1 19 PHE HB3 H 1.705 -7.470 -2.527 1.00 . A A . 19 PHE HB3 1 1 5 2548 1 1 19 PHE HD1 H 4.024 -6.340 -5.261 1.00 . A A . 19 PHE HD1 1 1 5 2549 1 1 19 PHE HD2 H 1.822 -9.626 -3.531 1.00 . A A . 19 PHE HD2 1 1 5 2550 1 1 19 PHE HE1 H 5.260 -7.932 -6.699 1.00 . A A . 19 PHE HE1 1 1 5 2551 1 1 19 PHE HE2 H 3.062 -11.221 -4.982 1.00 . A A . 19 PHE HE2 1 1 5 2552 1 1 19 PHE HZ H 4.798 -10.379 -6.547 1.00 . A A . 19 PHE HZ 1 1 5 2553 1 1 19 PHE N N 0.483 -5.193 -3.083 1.00 . A A . 19 PHE N 1 1 5 2554 1 1 19 PHE O O -0.699 -7.786 -3.772 1.00 . A A . 19 PHE O 1 1 5 2555 1 1 20 ASN C C -0.695 -9.285 -6.637 1.00 . A A . 20 ASN C 1 1 5 2556 1 1 20 ASN CA C -1.306 -7.885 -6.526 1.00 . A A . 20 ASN CA 1 1 5 2557 1 1 20 ASN CB C -1.687 -7.292 -7.887 1.00 . A A . 20 ASN CB 1 1 5 2558 1 1 20 ASN CG C -2.791 -8.082 -8.561 1.00 . A A . 20 ASN CG 1 1 5 2559 1 1 20 ASN H H 0.121 -6.343 -6.460 1.00 . A A . 20 ASN H 1 1 5 2560 1 1 20 ASN HA H -2.211 -7.950 -5.938 1.00 . A A . 20 ASN HA 1 1 5 2561 1 1 20 ASN HB2 H -2.008 -6.271 -7.754 1.00 . A A . 20 ASN HB2 1 1 5 2562 1 1 20 ASN HB3 H -0.816 -7.282 -8.539 1.00 . A A . 20 ASN HB3 1 1 5 2563 1 1 20 ASN HD21 H -4.177 -6.578 -8.430 1.00 . A A . 20 ASN HD21 1 1 5 2564 1 1 20 ASN HD22 H -4.678 -8.089 -9.161 1.00 . A A . 20 ASN HD22 1 1 5 2565 1 1 20 ASN N N -0.378 -6.991 -5.855 1.00 . A A . 20 ASN N 1 1 5 2566 1 1 20 ASN ND2 N -3.980 -7.533 -8.699 1.00 . A A . 20 ASN ND2 1 1 5 2567 1 1 20 ASN O O -0.014 -9.593 -7.615 1.00 . A A . 20 ASN O 1 1 5 2568 1 1 20 ASN OD1 O -2.575 -9.207 -8.993 1.00 . A A . 20 ASN OD1 1 1 5 2569 1 1 21 HIS C C -0.979 -12.460 -6.701 1.00 . A A . 21 HIS C 1 1 5 2570 1 1 21 HIS CA C -0.356 -11.507 -5.660 1.00 . A A . 21 HIS CA 1 1 5 2571 1 1 21 HIS CB C -0.347 -12.084 -4.238 1.00 . A A . 21 HIS CB 1 1 5 2572 1 1 21 HIS CD2 C -2.699 -13.017 -3.861 1.00 . A A . 21 HIS CD2 1 1 5 2573 1 1 21 HIS CE1 C -3.311 -11.722 -2.180 1.00 . A A . 21 HIS CE1 1 1 5 2574 1 1 21 HIS CG C -1.692 -12.144 -3.571 1.00 . A A . 21 HIS CG 1 1 5 2575 1 1 21 HIS H H -1.523 -9.874 -4.866 1.00 . A A . 21 HIS H 1 1 5 2576 1 1 21 HIS HA H 0.688 -11.413 -5.960 1.00 . A A . 21 HIS HA 1 1 5 2577 1 1 21 HIS HB2 H 0.091 -13.083 -4.253 1.00 . A A . 21 HIS HB2 1 1 5 2578 1 1 21 HIS HB3 H 0.302 -11.463 -3.622 1.00 . A A . 21 HIS HB3 1 1 5 2579 1 1 21 HIS HD2 H -2.678 -13.787 -4.621 1.00 . A A . 21 HIS HD2 1 1 5 2580 1 1 21 HIS HE1 H -3.887 -11.299 -1.366 1.00 . A A . 21 HIS HE1 1 1 5 2581 1 1 21 HIS HE2 H -4.599 -13.213 -2.890 1.00 . A A . 21 HIS HE2 1 1 5 2582 1 1 21 HIS N N -0.937 -10.156 -5.654 1.00 . A A . 21 HIS N 1 1 5 2583 1 1 21 HIS ND1 N -2.077 -11.324 -2.517 1.00 . A A . 21 HIS ND1 1 1 5 2584 1 1 21 HIS NE2 N -3.715 -12.733 -2.973 1.00 . A A . 21 HIS NE2 1 1 5 2585 1 1 21 HIS O O -0.656 -13.644 -6.706 1.00 . A A . 21 HIS O 1 1 5 2586 1 1 22 ILE C C -1.492 -12.394 -10.011 1.00 . A A . 22 ILE C 1 1 5 2587 1 1 22 ILE CA C -2.359 -12.686 -8.763 1.00 . A A . 22 ILE CA 1 1 5 2588 1 1 22 ILE CB C -3.861 -12.339 -8.980 1.00 . A A . 22 ILE CB 1 1 5 2589 1 1 22 ILE CD1 C -6.147 -12.037 -7.770 1.00 . A A . 22 ILE CD1 1 1 5 2590 1 1 22 ILE CG1 C -4.679 -12.471 -7.666 1.00 . A A . 22 ILE CG1 1 1 5 2591 1 1 22 ILE CG2 C -4.478 -13.227 -10.079 1.00 . A A . 22 ILE CG2 1 1 5 2592 1 1 22 ILE H H -2.085 -10.975 -7.549 1.00 . A A . 22 ILE H 1 1 5 2593 1 1 22 ILE HA H -2.291 -13.758 -8.568 1.00 . A A . 22 ILE HA 1 1 5 2594 1 1 22 ILE HB H -3.933 -11.306 -9.314 1.00 . A A . 22 ILE HB 1 1 5 2595 1 1 22 ILE HD11 H -6.715 -12.741 -8.380 1.00 . A A . 22 ILE HD11 1 1 5 2596 1 1 22 ILE HD12 H -6.587 -12.018 -6.773 1.00 . A A . 22 ILE HD12 1 1 5 2597 1 1 22 ILE HD13 H -6.212 -11.038 -8.203 1.00 . A A . 22 ILE HD13 1 1 5 2598 1 1 22 ILE HG12 H -4.639 -13.504 -7.317 1.00 . A A . 22 ILE HG12 1 1 5 2599 1 1 22 ILE HG13 H -4.238 -11.841 -6.894 1.00 . A A . 22 ILE HG13 1 1 5 2600 1 1 22 ILE HG21 H -4.421 -14.277 -9.792 1.00 . A A . 22 ILE HG21 1 1 5 2601 1 1 22 ILE HG22 H -5.518 -12.955 -10.256 1.00 . A A . 22 ILE HG22 1 1 5 2602 1 1 22 ILE HG23 H -3.954 -13.087 -11.025 1.00 . A A . 22 ILE HG23 1 1 5 2603 1 1 22 ILE N N -1.842 -11.956 -7.596 1.00 . A A . 22 ILE N 1 1 5 2604 1 1 22 ILE O O -1.476 -13.189 -10.949 1.00 . A A . 22 ILE O 1 1 5 2605 1 1 23 THR C C 1.389 -10.241 -10.961 1.00 . A A . 23 THR C 1 1 5 2606 1 1 23 THR CA C -0.028 -10.770 -11.220 1.00 . A A . 23 THR CA 1 1 5 2607 1 1 23 THR CB C -0.803 -9.611 -11.865 1.00 . A A . 23 THR CB 1 1 5 2608 1 1 23 THR CG2 C -2.204 -9.992 -12.348 1.00 . A A . 23 THR CG2 1 1 5 2609 1 1 23 THR H H -0.812 -10.665 -9.221 1.00 . A A . 23 THR H 1 1 5 2610 1 1 23 THR HA H 0.061 -11.569 -11.957 1.00 . A A . 23 THR HA 1 1 5 2611 1 1 23 THR HB H -0.239 -9.245 -12.723 1.00 . A A . 23 THR HB 1 1 5 2612 1 1 23 THR HG1 H -1.578 -8.868 -10.262 1.00 . A A . 23 THR HG1 1 1 5 2613 1 1 23 THR HG21 H -2.838 -10.282 -11.510 1.00 . A A . 23 THR HG21 1 1 5 2614 1 1 23 THR HG22 H -2.654 -9.140 -12.857 1.00 . A A . 23 THR HG22 1 1 5 2615 1 1 23 THR HG23 H -2.134 -10.826 -13.047 1.00 . A A . 23 THR HG23 1 1 5 2616 1 1 23 THR N N -0.744 -11.277 -10.028 1.00 . A A . 23 THR N 1 1 5 2617 1 1 23 THR O O 2.168 -10.138 -11.907 1.00 . A A . 23 THR O 1 1 5 2618 1 1 23 THR OG1 O -0.920 -8.566 -10.926 1.00 . A A . 23 THR OG1 1 1 5 2619 1 1 24 ASN C C 2.834 -7.691 -9.323 1.00 . A A . 24 ASN C 1 1 5 2620 1 1 24 ASN CA C 2.913 -9.230 -9.193 1.00 . A A . 24 ASN CA 1 1 5 2621 1 1 24 ASN CB C 4.239 -9.783 -9.765 1.00 . A A . 24 ASN CB 1 1 5 2622 1 1 24 ASN CG C 4.371 -11.296 -9.694 1.00 . A A . 24 ASN CG 1 1 5 2623 1 1 24 ASN H H 1.021 -10.069 -8.986 1.00 . A A . 24 ASN H 1 1 5 2624 1 1 24 ASN HA H 2.927 -9.424 -8.122 1.00 . A A . 24 ASN HA 1 1 5 2625 1 1 24 ASN HB2 H 4.356 -9.460 -10.800 1.00 . A A . 24 ASN HB2 1 1 5 2626 1 1 24 ASN HB3 H 5.067 -9.354 -9.204 1.00 . A A . 24 ASN HB3 1 1 5 2627 1 1 24 ASN HD21 H 3.498 -11.493 -11.495 1.00 . A A . 24 ASN HD21 1 1 5 2628 1 1 24 ASN HD22 H 4.055 -12.988 -10.706 1.00 . A A . 24 ASN HD22 1 1 5 2629 1 1 24 ASN N N 1.727 -9.932 -9.702 1.00 . A A . 24 ASN N 1 1 5 2630 1 1 24 ASN ND2 N 3.966 -11.989 -10.739 1.00 . A A . 24 ASN ND2 1 1 5 2631 1 1 24 ASN O O 3.794 -7.012 -8.959 1.00 . A A . 24 ASN O 1 1 5 2632 1 1 24 ASN OD1 O 4.846 -11.857 -8.720 1.00 . A A . 24 ASN OD1 1 1 5 2633 1 1 25 ALA C C 1.594 -4.941 -8.587 1.00 . A A . 25 ALA C 1 1 5 2634 1 1 25 ALA CA C 1.615 -5.655 -9.957 1.00 . A A . 25 ALA CA 1 1 5 2635 1 1 25 ALA CB C 0.359 -5.330 -10.775 1.00 . A A . 25 ALA CB 1 1 5 2636 1 1 25 ALA H H 0.930 -7.673 -10.106 1.00 . A A . 25 ALA H 1 1 5 2637 1 1 25 ALA HA H 2.482 -5.300 -10.516 1.00 . A A . 25 ALA HA 1 1 5 2638 1 1 25 ALA HB1 H -0.535 -5.655 -10.242 1.00 . A A . 25 ALA HB1 1 1 5 2639 1 1 25 ALA HB2 H 0.300 -4.255 -10.946 1.00 . A A . 25 ALA HB2 1 1 5 2640 1 1 25 ALA HB3 H 0.403 -5.840 -11.738 1.00 . A A . 25 ALA HB3 1 1 5 2641 1 1 25 ALA N N 1.727 -7.113 -9.819 1.00 . A A . 25 ALA N 1 1 5 2642 1 1 25 ALA O O 0.791 -5.278 -7.718 1.00 . A A . 25 ALA O 1 1 5 2643 1 1 26 SER C C 2.064 -1.767 -7.179 1.00 . A A . 26 SER C 1 1 5 2644 1 1 26 SER CA C 2.585 -3.208 -7.115 1.00 . A A . 26 SER CA 1 1 5 2645 1 1 26 SER CB C 4.058 -3.211 -6.702 1.00 . A A . 26 SER CB 1 1 5 2646 1 1 26 SER H H 3.092 -3.661 -9.117 1.00 . A A . 26 SER H 1 1 5 2647 1 1 26 SER HA H 2.036 -3.744 -6.344 1.00 . A A . 26 SER HA 1 1 5 2648 1 1 26 SER HB2 H 4.160 -2.766 -5.712 1.00 . A A . 26 SER HB2 1 1 5 2649 1 1 26 SER HB3 H 4.428 -4.235 -6.648 1.00 . A A . 26 SER HB3 1 1 5 2650 1 1 26 SER HG H 4.278 -1.703 -7.911 1.00 . A A . 26 SER HG 1 1 5 2651 1 1 26 SER N N 2.429 -3.913 -8.396 1.00 . A A . 26 SER N 1 1 5 2652 1 1 26 SER O O 2.503 -1.004 -8.041 1.00 . A A . 26 SER O 1 1 5 2653 1 1 26 SER OG O 4.811 -2.473 -7.646 1.00 . A A . 26 SER OG 1 1 5 2654 1 1 27 GLN C C 0.837 0.568 -4.793 1.00 . A A . 27 GLN C 1 1 5 2655 1 1 27 GLN CA C 0.540 -0.074 -6.155 1.00 . A A . 27 GLN CA 1 1 5 2656 1 1 27 GLN CB C -0.974 -0.255 -6.394 1.00 . A A . 27 GLN CB 1 1 5 2657 1 1 27 GLN CD C -1.421 2.199 -6.995 1.00 . A A . 27 GLN CD 1 1 5 2658 1 1 27 GLN CG C -1.837 0.996 -6.152 1.00 . A A . 27 GLN CG 1 1 5 2659 1 1 27 GLN H H 0.963 -2.047 -5.500 1.00 . A A . 27 GLN H 1 1 5 2660 1 1 27 GLN HA H 0.934 0.578 -6.936 1.00 . A A . 27 GLN HA 1 1 5 2661 1 1 27 GLN HB2 H -1.126 -0.591 -7.420 1.00 . A A . 27 GLN HB2 1 1 5 2662 1 1 27 GLN HB3 H -1.339 -1.037 -5.728 1.00 . A A . 27 GLN HB3 1 1 5 2663 1 1 27 GLN HE21 H -2.916 1.950 -8.369 1.00 . A A . 27 GLN HE21 1 1 5 2664 1 1 27 GLN HE22 H -1.797 3.287 -8.597 1.00 . A A . 27 GLN HE22 1 1 5 2665 1 1 27 GLN HG2 H -2.875 0.748 -6.373 1.00 . A A . 27 GLN HG2 1 1 5 2666 1 1 27 GLN HG3 H -1.785 1.273 -5.101 1.00 . A A . 27 GLN HG3 1 1 5 2667 1 1 27 GLN N N 1.186 -1.388 -6.246 1.00 . A A . 27 GLN N 1 1 5 2668 1 1 27 GLN NE2 N -2.116 2.488 -8.077 1.00 . A A . 27 GLN NE2 1 1 5 2669 1 1 27 GLN O O 0.554 -0.023 -3.754 1.00 . A A . 27 GLN O 1 1 5 2670 1 1 27 GLN OE1 O -0.469 2.901 -6.680 1.00 . A A . 27 GLN OE1 1 1 5 2671 1 1 28 PHE C C 0.372 3.264 -3.044 1.00 . A A . 28 PHE C 1 1 5 2672 1 1 28 PHE CA C 1.631 2.546 -3.559 1.00 . A A . 28 PHE CA 1 1 5 2673 1 1 28 PHE CB C 2.759 3.556 -3.801 1.00 . A A . 28 PHE CB 1 1 5 2674 1 1 28 PHE CD1 C 4.825 2.341 -2.998 1.00 . A A . 28 PHE CD1 1 1 5 2675 1 1 28 PHE CD2 C 4.617 2.833 -5.375 1.00 . A A . 28 PHE CD2 1 1 5 2676 1 1 28 PHE CE1 C 6.054 1.707 -3.237 1.00 . A A . 28 PHE CE1 1 1 5 2677 1 1 28 PHE CE2 C 5.852 2.203 -5.611 1.00 . A A . 28 PHE CE2 1 1 5 2678 1 1 28 PHE CG C 4.101 2.905 -4.067 1.00 . A A . 28 PHE CG 1 1 5 2679 1 1 28 PHE CZ C 6.572 1.641 -4.542 1.00 . A A . 28 PHE CZ 1 1 5 2680 1 1 28 PHE H H 1.532 2.258 -5.668 1.00 . A A . 28 PHE H 1 1 5 2681 1 1 28 PHE HA H 1.966 1.866 -2.774 1.00 . A A . 28 PHE HA 1 1 5 2682 1 1 28 PHE HB2 H 2.495 4.205 -4.637 1.00 . A A . 28 PHE HB2 1 1 5 2683 1 1 28 PHE HB3 H 2.864 4.184 -2.916 1.00 . A A . 28 PHE HB3 1 1 5 2684 1 1 28 PHE HD1 H 4.435 2.377 -1.989 1.00 . A A . 28 PHE HD1 1 1 5 2685 1 1 28 PHE HD2 H 4.068 3.259 -6.202 1.00 . A A . 28 PHE HD2 1 1 5 2686 1 1 28 PHE HE1 H 6.586 1.263 -2.412 1.00 . A A . 28 PHE HE1 1 1 5 2687 1 1 28 PHE HE2 H 6.247 2.149 -6.614 1.00 . A A . 28 PHE HE2 1 1 5 2688 1 1 28 PHE HZ H 7.522 1.159 -4.723 1.00 . A A . 28 PHE HZ 1 1 5 2689 1 1 28 PHE N N 1.391 1.783 -4.787 1.00 . A A . 28 PHE N 1 1 5 2690 1 1 28 PHE O O 0.231 3.448 -1.835 1.00 . A A . 28 PHE O 1 1 5 2691 1 1 29 GLU C C -2.747 3.509 -2.864 1.00 . A A . 29 GLU C 1 1 5 2692 1 1 29 GLU CA C -1.718 4.458 -3.519 1.00 . A A . 29 GLU CA 1 1 5 2693 1 1 29 GLU CB C -2.235 5.206 -4.768 1.00 . A A . 29 GLU CB 1 1 5 2694 1 1 29 GLU CD C -4.528 6.137 -4.210 1.00 . A A . 29 GLU CD 1 1 5 2695 1 1 29 GLU CG C -3.064 6.464 -4.481 1.00 . A A . 29 GLU CG 1 1 5 2696 1 1 29 GLU H H -0.418 3.493 -4.924 1.00 . A A . 29 GLU H 1 1 5 2697 1 1 29 GLU HA H -1.399 5.201 -2.787 1.00 . A A . 29 GLU HA 1 1 5 2698 1 1 29 GLU HB2 H -1.364 5.543 -5.333 1.00 . A A . 29 GLU HB2 1 1 5 2699 1 1 29 GLU HB3 H -2.792 4.527 -5.415 1.00 . A A . 29 GLU HB3 1 1 5 2700 1 1 29 GLU HG2 H -2.632 7.006 -3.637 1.00 . A A . 29 GLU HG2 1 1 5 2701 1 1 29 GLU HG3 H -3.014 7.118 -5.354 1.00 . A A . 29 GLU HG3 1 1 5 2702 1 1 29 GLU N N -0.546 3.679 -3.931 1.00 . A A . 29 GLU N 1 1 5 2703 1 1 29 GLU O O -3.442 2.736 -3.531 1.00 . A A . 29 GLU O 1 1 5 2704 1 1 29 GLU OE1 O -5.299 5.939 -5.178 1.00 . A A . 29 GLU OE1 1 1 5 2705 1 1 29 GLU OE2 O -4.903 6.007 -3.024 1.00 . A A . 29 GLU OE2 1 1 5 2706 1 1 30 ARG C C -5.186 2.834 -0.743 1.00 . A A . 30 ARG C 1 1 5 2707 1 1 30 ARG CA C -3.654 2.699 -0.689 1.00 . A A . 30 ARG CA 1 1 5 2708 1 1 30 ARG CB C -3.127 2.802 0.757 1.00 . A A . 30 ARG CB 1 1 5 2709 1 1 30 ARG CD C -3.165 5.366 1.216 1.00 . A A . 30 ARG CD 1 1 5 2710 1 1 30 ARG CG C -3.614 3.963 1.640 1.00 . A A . 30 ARG CG 1 1 5 2711 1 1 30 ARG CZ C -4.404 7.229 0.076 1.00 . A A . 30 ARG CZ 1 1 5 2712 1 1 30 ARG H H -2.277 4.276 -1.066 1.00 . A A . 30 ARG H 1 1 5 2713 1 1 30 ARG HA H -3.402 1.700 -1.047 1.00 . A A . 30 ARG HA 1 1 5 2714 1 1 30 ARG HB2 H -3.414 1.894 1.281 1.00 . A A . 30 ARG HB2 1 1 5 2715 1 1 30 ARG HB3 H -2.036 2.816 0.735 1.00 . A A . 30 ARG HB3 1 1 5 2716 1 1 30 ARG HD2 H -3.189 5.988 2.111 1.00 . A A . 30 ARG HD2 1 1 5 2717 1 1 30 ARG HD3 H -2.132 5.328 0.864 1.00 . A A . 30 ARG HD3 1 1 5 2718 1 1 30 ARG HE H -4.464 5.330 -0.500 1.00 . A A . 30 ARG HE 1 1 5 2719 1 1 30 ARG HG2 H -4.699 3.942 1.732 1.00 . A A . 30 ARG HG2 1 1 5 2720 1 1 30 ARG HG3 H -3.205 3.778 2.634 1.00 . A A . 30 ARG HG3 1 1 5 2721 1 1 30 ARG HH11 H -3.523 7.851 1.757 1.00 . A A . 30 ARG HH11 1 1 5 2722 1 1 30 ARG HH12 H -4.366 9.088 0.864 1.00 . A A . 30 ARG HH12 1 1 5 2723 1 1 30 ARG HH21 H -5.182 6.957 -1.741 1.00 . A A . 30 ARG HH21 1 1 5 2724 1 1 30 ARG HH22 H -5.405 8.570 -1.066 1.00 . A A . 30 ARG HH22 1 1 5 2725 1 1 30 ARG N N -2.901 3.638 -1.538 1.00 . A A . 30 ARG N 1 1 5 2726 1 1 30 ARG NE N -4.034 5.958 0.179 1.00 . A A . 30 ARG NE 1 1 5 2727 1 1 30 ARG NH1 N -4.077 8.134 0.970 1.00 . A A . 30 ARG NH1 1 1 5 2728 1 1 30 ARG NH2 N -5.109 7.621 -0.951 1.00 . A A . 30 ARG NH2 1 1 5 2729 1 1 30 ARG O O -5.680 3.923 -1.045 1.00 . A A . 30 ARG O 1 1 5 2730 1 1 31 PRO C C -7.738 2.209 1.186 1.00 . A A . 31 PRO C 1 1 5 2731 1 1 31 PRO CA C -7.402 1.810 -0.266 1.00 . A A . 31 PRO CA 1 1 5 2732 1 1 31 PRO CB C -7.848 0.370 -0.552 1.00 . A A . 31 PRO CB 1 1 5 2733 1 1 31 PRO CD C -5.485 0.410 -0.167 1.00 . A A . 31 PRO CD 1 1 5 2734 1 1 31 PRO CG C -6.729 -0.440 0.100 1.00 . A A . 31 PRO CG 1 1 5 2735 1 1 31 PRO HA H -7.885 2.502 -0.954 1.00 . A A . 31 PRO HA 1 1 5 2736 1 1 31 PRO HB2 H -8.823 0.127 -0.129 1.00 . A A . 31 PRO HB2 1 1 5 2737 1 1 31 PRO HB3 H -7.853 0.193 -1.628 1.00 . A A . 31 PRO HB3 1 1 5 2738 1 1 31 PRO HD2 H -4.868 0.411 0.727 1.00 . A A . 31 PRO HD2 1 1 5 2739 1 1 31 PRO HD3 H -4.928 0.006 -1.011 1.00 . A A . 31 PRO HD3 1 1 5 2740 1 1 31 PRO HG2 H -6.899 -0.510 1.175 1.00 . A A . 31 PRO HG2 1 1 5 2741 1 1 31 PRO HG3 H -6.643 -1.438 -0.322 1.00 . A A . 31 PRO HG3 1 1 5 2742 1 1 31 PRO N N -5.953 1.763 -0.458 1.00 . A A . 31 PRO N 1 1 5 2743 1 1 31 PRO O O -6.848 2.489 1.991 1.00 . A A . 31 PRO O 1 1 5 2744 1 1 32 SER C C -9.223 1.015 3.700 1.00 . A A . 32 SER C 1 1 5 2745 1 1 32 SER CA C -9.470 2.337 2.939 1.00 . A A . 32 SER CA 1 1 5 2746 1 1 32 SER CB C -10.949 2.748 2.964 1.00 . A A . 32 SER CB 1 1 5 2747 1 1 32 SER H H -9.754 1.962 0.888 1.00 . A A . 32 SER H 1 1 5 2748 1 1 32 SER HA H -8.891 3.124 3.425 1.00 . A A . 32 SER HA 1 1 5 2749 1 1 32 SER HB2 H -11.262 2.923 3.995 1.00 . A A . 32 SER HB2 1 1 5 2750 1 1 32 SER HB3 H -11.087 3.667 2.392 1.00 . A A . 32 SER HB3 1 1 5 2751 1 1 32 SER HG H -11.545 0.931 2.948 1.00 . A A . 32 SER HG 1 1 5 2752 1 1 32 SER N N -9.026 2.199 1.548 1.00 . A A . 32 SER N 1 1 5 2753 1 1 32 SER O O -10.173 0.318 4.063 1.00 . A A . 32 SER O 1 1 5 2754 1 1 32 SER OG O -11.737 1.718 2.405 1.00 . A A . 32 SER OG 1 1 5 2755 1 1 33 GLY C C -5.990 -0.779 4.459 1.00 . A A . 33 GLY C 1 1 5 2756 1 1 33 GLY CA C -7.505 -0.638 4.427 1.00 . A A . 33 GLY CA 1 1 5 2757 1 1 33 GLY H H -7.227 1.253 3.479 1.00 . A A . 33 GLY H 1 1 5 2758 1 1 33 GLY HA2 H -7.874 -0.734 5.448 1.00 . A A . 33 GLY HA2 1 1 5 2759 1 1 33 GLY HA3 H -7.908 -1.455 3.831 1.00 . A A . 33 GLY HA3 1 1 5 2760 1 1 33 GLY N N -7.945 0.646 3.866 1.00 . A A . 33 GLY N 1 1 5 2761 1 1 33 GLY O O -5.384 -1.037 3.394 1.00 . A A . 33 GLY O 1 1 5 2762 1 1 33 GLY OXT O -5.411 -0.628 5.553 1.00 . A A . 33 GLY OXT 1 1 5 2763 2 2 1 NAG C1 C 12.544 1.215 -1.036 1.00 . B A . 101 NAG C1 1 1 5 2764 2 2 1 NAG C2 C 11.848 2.196 -2.005 1.00 . B A . 101 NAG C2 1 1 5 2765 2 2 1 NAG C3 C 10.806 1.397 -2.807 1.00 . B A . 101 NAG C3 1 1 5 2766 2 2 1 NAG C4 C 11.542 0.343 -3.627 1.00 . B A . 101 NAG C4 1 1 5 2767 2 2 1 NAG C5 C 12.235 -0.648 -2.692 1.00 . B A . 101 NAG C5 1 1 5 2768 2 2 1 NAG C6 C 13.045 -1.724 -3.415 1.00 . B A . 101 NAG C6 1 1 5 2769 2 2 1 NAG C7 C 10.870 4.445 -1.869 1.00 . B A . 101 NAG C7 1 1 5 2770 2 2 1 NAG C8 C 10.331 5.556 -0.955 1.00 . B A . 101 NAG C8 1 1 5 2771 2 2 1 NAG H1 H 11.810 0.812 -0.339 1.00 . B A . 101 NAG H1 1 1 5 2772 2 2 1 NAG H2 H 12.588 2.609 -2.693 1.00 . B A . 101 NAG H2 1 1 5 2773 2 2 1 NAG H3 H 10.107 0.906 -2.121 1.00 . B A . 101 NAG H3 1 1 5 2774 2 2 1 NAG H4 H 12.261 0.821 -4.291 1.00 . B A . 101 NAG H4 1 1 5 2775 2 2 1 NAG H5 H 11.484 -1.132 -2.077 1.00 . B A . 101 NAG H5 1 1 5 2776 2 2 1 NAG H61 H 13.244 -2.549 -2.732 1.00 . B A . 101 NAG H61 1 1 5 2777 2 2 1 NAG H62 H 12.514 -2.116 -4.282 1.00 . B A . 101 NAG H62 1 1 5 2778 2 2 1 NAG H81 H 9.312 5.316 -0.652 1.00 . B A . 101 NAG H81 1 1 5 2779 2 2 1 NAG H82 H 10.332 6.506 -1.490 1.00 . B A . 101 NAG H82 1 1 5 2780 2 2 1 NAG H83 H 10.961 5.646 -0.070 1.00 . B A . 101 NAG H83 1 1 5 2781 2 2 1 NAG HN2 H 10.973 3.164 -0.303 1.00 . B A . 101 NAG HN2 1 1 5 2782 2 2 1 NAG HO3 H 10.342 3.173 -3.614 1.00 . B A . 101 NAG HO3 1 1 5 2783 2 2 1 NAG HO4 H 9.936 0.402 -4.655 1.00 . B A . 101 NAG HO4 1 1 5 2784 2 2 1 NAG HO6 H 14.575 -0.572 -3.083 1.00 . B A . 101 NAG HO6 1 1 5 2785 2 2 1 NAG N2 N 11.235 3.309 -1.278 1.00 . B A . 101 NAG N2 1 1 5 2786 2 2 1 NAG O3 O 10.071 2.230 -3.741 1.00 . B A . 101 NAG O3 1 1 5 2787 2 2 1 NAG O4 O 10.539 -0.314 -4.404 1.00 . B A . 101 NAG O4 1 1 5 2788 2 2 1 NAG O5 O 13.150 0.113 -1.802 1.00 . B A . 101 NAG O5 1 1 5 2789 2 2 1 NAG O6 O 14.292 -1.138 -3.813 1.00 . B A . 101 NAG O6 1 1 5 2790 2 2 1 NAG O7 O 10.939 4.572 -3.090 1.00 . B A . 101 NAG O7 1 1 6 2791 1 1 1 LYS C C -7.945 1.438 -3.023 1.00 . A A . 1 LYS C 1 1 6 2792 1 1 1 LYS CA C -8.793 2.419 -2.219 1.00 . A A . 1 LYS CA 1 1 6 2793 1 1 1 LYS CB C -10.017 2.930 -3.018 1.00 . A A . 1 LYS CB 1 1 6 2794 1 1 1 LYS CD C -8.855 4.241 -5.026 1.00 . A A . 1 LYS CD 1 1 6 2795 1 1 1 LYS CE C -9.267 5.710 -4.834 1.00 . A A . 1 LYS CE 1 1 6 2796 1 1 1 LYS CG C -9.864 3.187 -4.532 1.00 . A A . 1 LYS CG 1 1 6 2797 1 1 1 LYS H1 H -7.442 3.999 -2.380 1.00 . A A . 1 LYS H1 1 1 6 2798 1 1 1 LYS H2 H -7.321 3.154 -0.980 1.00 . A A . 1 LYS H2 1 1 6 2799 1 1 1 LYS H3 H -8.590 4.195 -1.202 1.00 . A A . 1 LYS H3 1 1 6 2800 1 1 1 LYS HA H -9.186 1.876 -1.360 1.00 . A A . 1 LYS HA 1 1 6 2801 1 1 1 LYS HB2 H -10.786 2.164 -2.918 1.00 . A A . 1 LYS HB2 1 1 6 2802 1 1 1 LYS HB3 H -10.425 3.820 -2.546 1.00 . A A . 1 LYS HB3 1 1 6 2803 1 1 1 LYS HD2 H -7.867 4.060 -4.609 1.00 . A A . 1 LYS HD2 1 1 6 2804 1 1 1 LYS HD3 H -8.759 4.089 -6.101 1.00 . A A . 1 LYS HD3 1 1 6 2805 1 1 1 LYS HE2 H -8.912 6.260 -5.710 1.00 . A A . 1 LYS HE2 1 1 6 2806 1 1 1 LYS HE3 H -10.358 5.789 -4.812 1.00 . A A . 1 LYS HE3 1 1 6 2807 1 1 1 LYS HG2 H -9.603 2.239 -5.005 1.00 . A A . 1 LYS HG2 1 1 6 2808 1 1 1 LYS HG3 H -10.845 3.460 -4.922 1.00 . A A . 1 LYS HG3 1 1 6 2809 1 1 1 LYS HZ1 H -8.713 7.336 -3.659 1.00 . A A . 1 LYS HZ1 1 1 6 2810 1 1 1 LYS HZ2 H -9.146 6.034 -2.769 1.00 . A A . 1 LYS HZ2 1 1 6 2811 1 1 1 LYS HZ3 H -7.691 6.040 -3.509 1.00 . A A . 1 LYS HZ3 1 1 6 2812 1 1 1 LYS N N -7.980 3.520 -1.662 1.00 . A A . 1 LYS N 1 1 6 2813 1 1 1 LYS NZ N -8.671 6.330 -3.629 1.00 . A A . 1 LYS NZ 1 1 6 2814 1 1 1 LYS O O -6.999 1.858 -3.680 1.00 . A A . 1 LYS O 1 1 6 2815 1 1 2 LEU C C -8.734 -2.041 -4.055 1.00 . A A . 2 LEU C 1 1 6 2816 1 1 2 LEU CA C -7.733 -0.882 -3.867 1.00 . A A . 2 LEU CA 1 1 6 2817 1 1 2 LEU CB C -6.348 -1.343 -3.371 1.00 . A A . 2 LEU CB 1 1 6 2818 1 1 2 LEU CD1 C -6.842 -3.221 -1.642 1.00 . A A . 2 LEU CD1 1 1 6 2819 1 1 2 LEU CD2 C -4.706 -2.021 -1.662 1.00 . A A . 2 LEU CD2 1 1 6 2820 1 1 2 LEU CG C -6.193 -1.863 -1.924 1.00 . A A . 2 LEU CG 1 1 6 2821 1 1 2 LEU H H -9.080 -0.177 -2.434 1.00 . A A . 2 LEU H 1 1 6 2822 1 1 2 LEU HA H -7.581 -0.418 -4.842 1.00 . A A . 2 LEU HA 1 1 6 2823 1 1 2 LEU HB2 H -5.980 -2.113 -4.049 1.00 . A A . 2 LEU HB2 1 1 6 2824 1 1 2 LEU HB3 H -5.678 -0.489 -3.486 1.00 . A A . 2 LEU HB3 1 1 6 2825 1 1 2 LEU HD11 H -7.914 -3.107 -1.503 1.00 . A A . 2 LEU HD11 1 1 6 2826 1 1 2 LEU HD12 H -6.651 -3.909 -2.463 1.00 . A A . 2 LEU HD12 1 1 6 2827 1 1 2 LEU HD13 H -6.417 -3.659 -0.736 1.00 . A A . 2 LEU HD13 1 1 6 2828 1 1 2 LEU HD21 H -4.575 -2.295 -0.624 1.00 . A A . 2 LEU HD21 1 1 6 2829 1 1 2 LEU HD22 H -4.290 -2.799 -2.295 1.00 . A A . 2 LEU HD22 1 1 6 2830 1 1 2 LEU HD23 H -4.183 -1.084 -1.845 1.00 . A A . 2 LEU HD23 1 1 6 2831 1 1 2 LEU HG H -6.558 -1.140 -1.198 1.00 . A A . 2 LEU HG 1 1 6 2832 1 1 2 LEU N N -8.297 0.147 -2.987 1.00 . A A . 2 LEU N 1 1 6 2833 1 1 2 LEU O O -9.571 -2.250 -3.174 1.00 . A A . 2 LEU O 1 1 6 2834 1 1 3 PRO C C -8.916 -5.229 -4.783 1.00 . A A . 3 PRO C 1 1 6 2835 1 1 3 PRO CA C -9.529 -3.954 -5.409 1.00 . A A . 3 PRO CA 1 1 6 2836 1 1 3 PRO CB C -9.640 -4.052 -6.936 1.00 . A A . 3 PRO CB 1 1 6 2837 1 1 3 PRO CD C -7.913 -2.470 -6.382 1.00 . A A . 3 PRO CD 1 1 6 2838 1 1 3 PRO CG C -8.302 -3.513 -7.430 1.00 . A A . 3 PRO CG 1 1 6 2839 1 1 3 PRO HA H -10.521 -3.791 -4.987 1.00 . A A . 3 PRO HA 1 1 6 2840 1 1 3 PRO HB2 H -9.805 -5.071 -7.286 1.00 . A A . 3 PRO HB2 1 1 6 2841 1 1 3 PRO HB3 H -10.443 -3.399 -7.282 1.00 . A A . 3 PRO HB3 1 1 6 2842 1 1 3 PRO HD2 H -6.842 -2.524 -6.182 1.00 . A A . 3 PRO HD2 1 1 6 2843 1 1 3 PRO HD3 H -8.180 -1.477 -6.746 1.00 . A A . 3 PRO HD3 1 1 6 2844 1 1 3 PRO HG2 H -7.580 -4.324 -7.441 1.00 . A A . 3 PRO HG2 1 1 6 2845 1 1 3 PRO HG3 H -8.388 -3.071 -8.424 1.00 . A A . 3 PRO HG3 1 1 6 2846 1 1 3 PRO N N -8.691 -2.775 -5.186 1.00 . A A . 3 PRO N 1 1 6 2847 1 1 3 PRO O O -7.722 -5.255 -4.461 1.00 . A A . 3 PRO O 1 1 6 2848 1 1 4 PRO C C -8.054 -8.183 -4.867 1.00 . A A . 4 PRO C 1 1 6 2849 1 1 4 PRO CA C -9.220 -7.578 -4.070 1.00 . A A . 4 PRO CA 1 1 6 2850 1 1 4 PRO CB C -10.437 -8.508 -4.004 1.00 . A A . 4 PRO CB 1 1 6 2851 1 1 4 PRO CD C -11.107 -6.437 -4.991 1.00 . A A . 4 PRO CD 1 1 6 2852 1 1 4 PRO CG C -11.390 -7.936 -5.050 1.00 . A A . 4 PRO CG 1 1 6 2853 1 1 4 PRO HA H -8.878 -7.387 -3.052 1.00 . A A . 4 PRO HA 1 1 6 2854 1 1 4 PRO HB2 H -10.179 -9.546 -4.220 1.00 . A A . 4 PRO HB2 1 1 6 2855 1 1 4 PRO HB3 H -10.897 -8.431 -3.019 1.00 . A A . 4 PRO HB3 1 1 6 2856 1 1 4 PRO HD2 H -11.339 -5.982 -5.954 1.00 . A A . 4 PRO HD2 1 1 6 2857 1 1 4 PRO HD3 H -11.710 -5.979 -4.206 1.00 . A A . 4 PRO HD3 1 1 6 2858 1 1 4 PRO HG2 H -11.124 -8.319 -6.037 1.00 . A A . 4 PRO HG2 1 1 6 2859 1 1 4 PRO HG3 H -12.432 -8.161 -4.818 1.00 . A A . 4 PRO HG3 1 1 6 2860 1 1 4 PRO N N -9.697 -6.320 -4.644 1.00 . A A . 4 PRO N 1 1 6 2861 1 1 4 PRO O O -8.019 -8.136 -6.096 1.00 . A A . 4 PRO O 1 1 6 2862 1 1 5 GLY C C -4.604 -8.455 -4.448 1.00 . A A . 5 GLY C 1 1 6 2863 1 1 5 GLY CA C -5.848 -9.321 -4.670 1.00 . A A . 5 GLY CA 1 1 6 2864 1 1 5 GLY H H -7.174 -8.727 -3.129 1.00 . A A . 5 GLY H 1 1 6 2865 1 1 5 GLY HA2 H -5.679 -10.287 -4.194 1.00 . A A . 5 GLY HA2 1 1 6 2866 1 1 5 GLY HA3 H -5.955 -9.489 -5.742 1.00 . A A . 5 GLY HA3 1 1 6 2867 1 1 5 GLY N N -7.078 -8.732 -4.133 1.00 . A A . 5 GLY N 1 1 6 2868 1 1 5 GLY O O -3.498 -8.988 -4.456 1.00 . A A . 5 GLY O 1 1 6 2869 1 1 6 TRP C C -3.525 -6.273 -2.291 1.00 . A A . 6 TRP C 1 1 6 2870 1 1 6 TRP CA C -3.702 -6.232 -3.816 1.00 . A A . 6 TRP CA 1 1 6 2871 1 1 6 TRP CB C -4.038 -4.822 -4.307 1.00 . A A . 6 TRP CB 1 1 6 2872 1 1 6 TRP CD1 C -5.130 -5.005 -6.582 1.00 . A A . 6 TRP CD1 1 1 6 2873 1 1 6 TRP CD2 C -3.129 -3.988 -6.674 1.00 . A A . 6 TRP CD2 1 1 6 2874 1 1 6 TRP CE2 C -3.658 -3.995 -8.000 1.00 . A A . 6 TRP CE2 1 1 6 2875 1 1 6 TRP CE3 C -1.851 -3.414 -6.498 1.00 . A A . 6 TRP CE3 1 1 6 2876 1 1 6 TRP CG C -4.100 -4.631 -5.792 1.00 . A A . 6 TRP CG 1 1 6 2877 1 1 6 TRP CH2 C -1.702 -2.882 -8.881 1.00 . A A . 6 TRP CH2 1 1 6 2878 1 1 6 TRP CZ2 C -2.967 -3.451 -9.093 1.00 . A A . 6 TRP CZ2 1 1 6 2879 1 1 6 TRP CZ3 C -1.147 -2.872 -7.590 1.00 . A A . 6 TRP CZ3 1 1 6 2880 1 1 6 TRP H H -5.694 -6.733 -4.226 1.00 . A A . 6 TRP H 1 1 6 2881 1 1 6 TRP HA H -2.765 -6.532 -4.275 1.00 . A A . 6 TRP HA 1 1 6 2882 1 1 6 TRP HB2 H -4.997 -4.520 -3.890 1.00 . A A . 6 TRP HB2 1 1 6 2883 1 1 6 TRP HB3 H -3.284 -4.146 -3.919 1.00 . A A . 6 TRP HB3 1 1 6 2884 1 1 6 TRP HD1 H -6.030 -5.491 -6.225 1.00 . A A . 6 TRP HD1 1 1 6 2885 1 1 6 TRP HE1 H -5.524 -4.759 -8.652 1.00 . A A . 6 TRP HE1 1 1 6 2886 1 1 6 TRP HE3 H -1.411 -3.389 -5.511 1.00 . A A . 6 TRP HE3 1 1 6 2887 1 1 6 TRP HH2 H -1.156 -2.451 -9.708 1.00 . A A . 6 TRP HH2 1 1 6 2888 1 1 6 TRP HZ2 H -3.402 -3.471 -10.081 1.00 . A A . 6 TRP HZ2 1 1 6 2889 1 1 6 TRP HZ3 H -0.175 -2.435 -7.436 1.00 . A A . 6 TRP HZ3 1 1 6 2890 1 1 6 TRP N N -4.769 -7.145 -4.220 1.00 . A A . 6 TRP N 1 1 6 2891 1 1 6 TRP NE1 N -4.875 -4.629 -7.887 1.00 . A A . 6 TRP NE1 1 1 6 2892 1 1 6 TRP O O -4.371 -5.768 -1.555 1.00 . A A . 6 TRP O 1 1 6 2893 1 1 7 GLU C C -0.965 -6.508 0.159 1.00 . A A . 7 GLU C 1 1 6 2894 1 1 7 GLU CA C -2.232 -7.197 -0.389 1.00 . A A . 7 GLU CA 1 1 6 2895 1 1 7 GLU CB C -2.252 -8.733 -0.245 1.00 . A A . 7 GLU CB 1 1 6 2896 1 1 7 GLU CD C -1.154 -9.161 2.048 1.00 . A A . 7 GLU CD 1 1 6 2897 1 1 7 GLU CG C -2.411 -9.288 1.181 1.00 . A A . 7 GLU CG 1 1 6 2898 1 1 7 GLU H H -1.758 -7.283 -2.454 1.00 . A A . 7 GLU H 1 1 6 2899 1 1 7 GLU HA H -3.081 -6.813 0.180 1.00 . A A . 7 GLU HA 1 1 6 2900 1 1 7 GLU HB2 H -3.115 -9.097 -0.806 1.00 . A A . 7 GLU HB2 1 1 6 2901 1 1 7 GLU HB3 H -1.370 -9.159 -0.716 1.00 . A A . 7 GLU HB3 1 1 6 2902 1 1 7 GLU HG2 H -3.249 -8.777 1.661 1.00 . A A . 7 GLU HG2 1 1 6 2903 1 1 7 GLU HG3 H -2.669 -10.346 1.108 1.00 . A A . 7 GLU HG3 1 1 6 2904 1 1 7 GLU N N -2.439 -6.888 -1.809 1.00 . A A . 7 GLU N 1 1 6 2905 1 1 7 GLU O O -0.005 -6.257 -0.572 1.00 . A A . 7 GLU O 1 1 6 2906 1 1 7 GLU OE1 O -0.068 -9.597 1.594 1.00 . A A . 7 GLU OE1 1 1 6 2907 1 1 7 GLU OE2 O -1.266 -8.569 3.146 1.00 . A A . 7 GLU OE2 1 1 6 2908 1 1 8 LYS C C 1.399 -5.949 2.154 1.00 . A A . 8 LYS C 1 1 6 2909 1 1 8 LYS CA C -0.024 -5.375 2.217 1.00 . A A . 8 LYS CA 1 1 6 2910 1 1 8 LYS CB C -0.591 -5.223 3.647 1.00 . A A . 8 LYS CB 1 1 6 2911 1 1 8 LYS CD C 1.307 -5.644 5.429 1.00 . A A . 8 LYS CD 1 1 6 2912 1 1 8 LYS CE C 0.709 -6.971 5.944 1.00 . A A . 8 LYS CE 1 1 6 2913 1 1 8 LYS CG C 0.332 -4.665 4.743 1.00 . A A . 8 LYS CG 1 1 6 2914 1 1 8 LYS H H -1.755 -6.552 2.009 1.00 . A A . 8 LYS H 1 1 6 2915 1 1 8 LYS HA H 0.010 -4.379 1.771 1.00 . A A . 8 LYS HA 1 1 6 2916 1 1 8 LYS HB2 H -1.438 -4.542 3.577 1.00 . A A . 8 LYS HB2 1 1 6 2917 1 1 8 LYS HB3 H -1.011 -6.167 3.987 1.00 . A A . 8 LYS HB3 1 1 6 2918 1 1 8 LYS HD2 H 2.160 -5.848 4.781 1.00 . A A . 8 LYS HD2 1 1 6 2919 1 1 8 LYS HD3 H 1.714 -5.119 6.294 1.00 . A A . 8 LYS HD3 1 1 6 2920 1 1 8 LYS HE2 H 1.370 -7.334 6.735 1.00 . A A . 8 LYS HE2 1 1 6 2921 1 1 8 LYS HE3 H -0.271 -6.785 6.391 1.00 . A A . 8 LYS HE3 1 1 6 2922 1 1 8 LYS HG2 H 0.898 -3.825 4.337 1.00 . A A . 8 LYS HG2 1 1 6 2923 1 1 8 LYS HG3 H -0.314 -4.267 5.526 1.00 . A A . 8 LYS HG3 1 1 6 2924 1 1 8 LYS HZ1 H 0.717 -8.952 5.271 1.00 . A A . 8 LYS HZ1 1 1 6 2925 1 1 8 LYS HZ2 H -0.275 -8.016 4.378 1.00 . A A . 8 LYS HZ2 1 1 6 2926 1 1 8 LYS HZ3 H 1.295 -7.860 4.154 1.00 . A A . 8 LYS HZ3 1 1 6 2927 1 1 8 LYS N N -0.993 -6.177 1.457 1.00 . A A . 8 LYS N 1 1 6 2928 1 1 8 LYS NZ N 0.616 -8.022 4.898 1.00 . A A . 8 LYS NZ 1 1 6 2929 1 1 8 LYS O O 1.667 -7.054 2.628 1.00 . A A . 8 LYS O 1 1 6 2930 1 1 9 ARG C C 4.694 -4.472 1.766 1.00 . A A . 9 ARG C 1 1 6 2931 1 1 9 ARG CA C 3.709 -5.552 1.283 1.00 . A A . 9 ARG CA 1 1 6 2932 1 1 9 ARG CB C 3.717 -5.707 -0.240 1.00 . A A . 9 ARG CB 1 1 6 2933 1 1 9 ARG CD C 4.724 -8.084 -0.533 1.00 . A A . 9 ARG CD 1 1 6 2934 1 1 9 ARG CG C 4.830 -6.580 -0.815 1.00 . A A . 9 ARG CG 1 1 6 2935 1 1 9 ARG CZ C 2.430 -9.076 -0.236 1.00 . A A . 9 ARG CZ 1 1 6 2936 1 1 9 ARG H H 2.078 -4.274 1.206 1.00 . A A . 9 ARG H 1 1 6 2937 1 1 9 ARG HA H 3.953 -6.497 1.766 1.00 . A A . 9 ARG HA 1 1 6 2938 1 1 9 ARG HB2 H 2.765 -6.123 -0.570 1.00 . A A . 9 ARG HB2 1 1 6 2939 1 1 9 ARG HB3 H 3.785 -4.712 -0.679 1.00 . A A . 9 ARG HB3 1 1 6 2940 1 1 9 ARG HD2 H 5.535 -8.577 -1.074 1.00 . A A . 9 ARG HD2 1 1 6 2941 1 1 9 ARG HD3 H 4.876 -8.246 0.530 1.00 . A A . 9 ARG HD3 1 1 6 2942 1 1 9 ARG HE H 3.255 -8.607 -1.980 1.00 . A A . 9 ARG HE 1 1 6 2943 1 1 9 ARG HG2 H 4.783 -6.434 -1.884 1.00 . A A . 9 ARG HG2 1 1 6 2944 1 1 9 ARG HG3 H 5.795 -6.225 -0.463 1.00 . A A . 9 ARG HG3 1 1 6 2945 1 1 9 ARG HH11 H 3.372 -9.133 1.552 1.00 . A A . 9 ARG HH11 1 1 6 2946 1 1 9 ARG HH12 H 1.624 -9.454 1.522 1.00 . A A . 9 ARG HH12 1 1 6 2947 1 1 9 ARG HH21 H 0.945 -8.989 -1.643 1.00 . A A . 9 ARG HH21 1 1 6 2948 1 1 9 ARG HH22 H 0.543 -9.528 -0.009 1.00 . A A . 9 ARG HH22 1 1 6 2949 1 1 9 ARG N N 2.334 -5.175 1.603 1.00 . A A . 9 ARG N 1 1 6 2950 1 1 9 ARG NE N 3.437 -8.647 -0.989 1.00 . A A . 9 ARG NE 1 1 6 2951 1 1 9 ARG NH1 N 2.529 -9.301 1.046 1.00 . A A . 9 ARG NH1 1 1 6 2952 1 1 9 ARG NH2 N 1.238 -9.281 -0.729 1.00 . A A . 9 ARG NH2 1 1 6 2953 1 1 9 ARG O O 4.281 -3.369 2.124 1.00 . A A . 9 ARG O 1 1 6 2954 1 1 10 MET C C 8.391 -4.123 1.756 1.00 . A A . 10 MET C 1 1 6 2955 1 1 10 MET CA C 7.011 -3.921 2.398 1.00 . A A . 10 MET CA 1 1 6 2956 1 1 10 MET CB C 7.043 -4.255 3.898 1.00 . A A . 10 MET CB 1 1 6 2957 1 1 10 MET CE C 8.603 -2.231 7.225 1.00 . A A . 10 MET CE 1 1 6 2958 1 1 10 MET CG C 7.859 -3.272 4.740 1.00 . A A . 10 MET CG 1 1 6 2959 1 1 10 MET H H 6.320 -5.666 1.428 1.00 . A A . 10 MET H 1 1 6 2960 1 1 10 MET HA H 6.717 -2.881 2.280 1.00 . A A . 10 MET HA 1 1 6 2961 1 1 10 MET HB2 H 6.019 -4.237 4.277 1.00 . A A . 10 MET HB2 1 1 6 2962 1 1 10 MET HB3 H 7.436 -5.262 4.043 1.00 . A A . 10 MET HB3 1 1 6 2963 1 1 10 MET HE1 H 9.648 -2.452 7.012 1.00 . A A . 10 MET HE1 1 1 6 2964 1 1 10 MET HE2 H 8.330 -1.265 6.801 1.00 . A A . 10 MET HE2 1 1 6 2965 1 1 10 MET HE3 H 8.457 -2.204 8.304 1.00 . A A . 10 MET HE3 1 1 6 2966 1 1 10 MET HG2 H 8.921 -3.402 4.528 1.00 . A A . 10 MET HG2 1 1 6 2967 1 1 10 MET HG3 H 7.571 -2.252 4.482 1.00 . A A . 10 MET HG3 1 1 6 2968 1 1 10 MET N N 5.998 -4.773 1.767 1.00 . A A . 10 MET N 1 1 6 2969 1 1 10 MET O O 8.817 -5.252 1.521 1.00 . A A . 10 MET O 1 1 6 2970 1 1 10 MET SD S 7.563 -3.527 6.512 1.00 . A A . 10 MET SD 1 1 6 2971 1 1 11 PHE C C 11.481 -3.072 1.917 1.00 . A A . 11 PHE C 1 1 6 2972 1 1 11 PHE CA C 10.396 -2.976 0.833 1.00 . A A . 11 PHE CA 1 1 6 2973 1 1 11 PHE CB C 10.559 -1.675 0.037 1.00 . A A . 11 PHE CB 1 1 6 2974 1 1 11 PHE CD1 C 10.147 -2.463 -2.335 1.00 . A A . 11 PHE CD1 1 1 6 2975 1 1 11 PHE CD2 C 8.743 -0.682 -1.447 1.00 . A A . 11 PHE CD2 1 1 6 2976 1 1 11 PHE CE1 C 9.489 -2.366 -3.574 1.00 . A A . 11 PHE CE1 1 1 6 2977 1 1 11 PHE CE2 C 8.097 -0.579 -2.692 1.00 . A A . 11 PHE CE2 1 1 6 2978 1 1 11 PHE CG C 9.782 -1.618 -1.266 1.00 . A A . 11 PHE CG 1 1 6 2979 1 1 11 PHE CZ C 8.469 -1.417 -3.753 1.00 . A A . 11 PHE CZ 1 1 6 2980 1 1 11 PHE H H 8.617 -2.116 1.606 1.00 . A A . 11 PHE H 1 1 6 2981 1 1 11 PHE HA H 10.512 -3.799 0.133 1.00 . A A . 11 PHE HA 1 1 6 2982 1 1 11 PHE HB2 H 10.272 -0.844 0.675 1.00 . A A . 11 PHE HB2 1 1 6 2983 1 1 11 PHE HB3 H 11.613 -1.543 -0.210 1.00 . A A . 11 PHE HB3 1 1 6 2984 1 1 11 PHE HD1 H 10.961 -3.165 -2.227 1.00 . A A . 11 PHE HD1 1 1 6 2985 1 1 11 PHE HD2 H 8.409 -0.047 -0.641 1.00 . A A . 11 PHE HD2 1 1 6 2986 1 1 11 PHE HE1 H 9.776 -3.005 -4.398 1.00 . A A . 11 PHE HE1 1 1 6 2987 1 1 11 PHE HE2 H 7.296 0.130 -2.836 1.00 . A A . 11 PHE HE2 1 1 6 2988 1 1 11 PHE HZ H 7.970 -1.321 -4.707 1.00 . A A . 11 PHE HZ 1 1 6 2989 1 1 11 PHE N N 9.058 -3.014 1.423 1.00 . A A . 11 PHE N 1 1 6 2990 1 1 11 PHE O O 11.272 -2.653 3.055 1.00 . A A . 11 PHE O 1 1 6 2991 1 1 12 ALA C C 14.334 -2.408 3.102 1.00 . A A . 12 ALA C 1 1 6 2992 1 1 12 ALA CA C 13.816 -3.712 2.456 1.00 . A A . 12 ALA CA 1 1 6 2993 1 1 12 ALA CB C 14.938 -4.425 1.693 1.00 . A A . 12 ALA CB 1 1 6 2994 1 1 12 ALA H H 12.816 -3.865 0.597 1.00 . A A . 12 ALA H 1 1 6 2995 1 1 12 ALA HA H 13.496 -4.362 3.273 1.00 . A A . 12 ALA HA 1 1 6 2996 1 1 12 ALA HB1 H 15.772 -4.621 2.369 1.00 . A A . 12 ALA HB1 1 1 6 2997 1 1 12 ALA HB2 H 14.577 -5.377 1.302 1.00 . A A . 12 ALA HB2 1 1 6 2998 1 1 12 ALA HB3 H 15.289 -3.802 0.869 1.00 . A A . 12 ALA HB3 1 1 6 2999 1 1 12 ALA N N 12.681 -3.537 1.541 1.00 . A A . 12 ALA N 1 1 6 3000 1 1 12 ALA O O 15.036 -2.464 4.107 1.00 . A A . 12 ALA O 1 1 6 3001 1 1 13 ASN C C 13.149 0.480 4.218 1.00 . A A . 13 ASN C 1 1 6 3002 1 1 13 ASN CA C 14.216 0.074 3.171 1.00 . A A . 13 ASN CA 1 1 6 3003 1 1 13 ASN CB C 14.353 1.125 2.045 1.00 . A A . 13 ASN CB 1 1 6 3004 1 1 13 ASN CG C 13.092 1.298 1.204 1.00 . A A . 13 ASN CG 1 1 6 3005 1 1 13 ASN H H 13.371 -1.257 1.748 1.00 . A A . 13 ASN H 1 1 6 3006 1 1 13 ASN HA H 15.168 0.030 3.705 1.00 . A A . 13 ASN HA 1 1 6 3007 1 1 13 ASN HB2 H 14.604 2.090 2.485 1.00 . A A . 13 ASN HB2 1 1 6 3008 1 1 13 ASN HB3 H 15.175 0.831 1.393 1.00 . A A . 13 ASN HB3 1 1 6 3009 1 1 13 ASN HD21 H 14.117 2.192 -0.307 1.00 . A A . 13 ASN HD21 1 1 6 3010 1 1 13 ASN N N 13.966 -1.238 2.561 1.00 . A A . 13 ASN N 1 1 6 3011 1 1 13 ASN ND2 N 13.225 1.845 -0.002 1.00 . A A . 13 ASN ND2 1 1 6 3012 1 1 13 ASN O O 13.257 1.560 4.794 1.00 . A A . 13 ASN O 1 1 6 3013 1 1 13 ASN OD1 O 12.006 0.893 1.617 1.00 . A A . 13 ASN OD1 1 1 6 3014 1 1 14 GLY C C 9.748 0.509 4.741 1.00 . A A . 14 GLY C 1 1 6 3015 1 1 14 GLY CA C 11.018 -0.080 5.373 1.00 . A A . 14 GLY CA 1 1 6 3016 1 1 14 GLY H H 12.058 -1.225 3.932 1.00 . A A . 14 GLY H 1 1 6 3017 1 1 14 GLY HA2 H 10.749 -1.022 5.843 1.00 . A A . 14 GLY HA2 1 1 6 3018 1 1 14 GLY HA3 H 11.356 0.602 6.154 1.00 . A A . 14 GLY HA3 1 1 6 3019 1 1 14 GLY N N 12.114 -0.345 4.440 1.00 . A A . 14 GLY N 1 1 6 3020 1 1 14 GLY O O 8.872 0.959 5.474 1.00 . A A . 14 GLY O 1 1 6 3021 1 1 15 THR C C 7.380 0.324 2.429 1.00 . A A . 15 THR C 1 1 6 3022 1 1 15 THR CA C 8.546 1.261 2.716 1.00 . A A . 15 THR CA 1 1 6 3023 1 1 15 THR CB C 9.073 1.886 1.417 1.00 . A A . 15 THR CB 1 1 6 3024 1 1 15 THR CG2 C 8.071 2.755 0.658 1.00 . A A . 15 THR CG2 1 1 6 3025 1 1 15 THR H H 10.314 0.070 2.824 1.00 . A A . 15 THR H 1 1 6 3026 1 1 15 THR HA H 8.194 2.078 3.342 1.00 . A A . 15 THR HA 1 1 6 3027 1 1 15 THR HB H 9.408 1.097 0.753 1.00 . A A . 15 THR HB 1 1 6 3028 1 1 15 THR HG1 H 10.926 2.034 1.842 1.00 . A A . 15 THR HG1 1 1 6 3029 1 1 15 THR HG21 H 7.153 2.200 0.474 1.00 . A A . 15 THR HG21 1 1 6 3030 1 1 15 THR HG22 H 7.841 3.651 1.236 1.00 . A A . 15 THR HG22 1 1 6 3031 1 1 15 THR HG23 H 8.502 3.039 -0.305 1.00 . A A . 15 THR HG23 1 1 6 3032 1 1 15 THR N N 9.621 0.528 3.406 1.00 . A A . 15 THR N 1 1 6 3033 1 1 15 THR O O 7.566 -0.683 1.748 1.00 . A A . 15 THR O 1 1 6 3034 1 1 15 THR OG1 O 10.190 2.679 1.719 1.00 . A A . 15 THR OG1 1 1 6 3035 1 1 16 VAL C C 4.171 0.223 1.553 1.00 . A A . 16 VAL C 1 1 6 3036 1 1 16 VAL CA C 4.987 -0.196 2.776 1.00 . A A . 16 VAL CA 1 1 6 3037 1 1 16 VAL CB C 4.145 -0.172 4.072 1.00 . A A . 16 VAL CB 1 1 6 3038 1 1 16 VAL CG1 C 2.701 -0.682 3.919 1.00 . A A . 16 VAL CG1 1 1 6 3039 1 1 16 VAL CG2 C 4.823 -1.064 5.120 1.00 . A A . 16 VAL CG2 1 1 6 3040 1 1 16 VAL H H 6.068 1.512 3.437 1.00 . A A . 16 VAL H 1 1 6 3041 1 1 16 VAL HA H 5.308 -1.222 2.615 1.00 . A A . 16 VAL HA 1 1 6 3042 1 1 16 VAL HB H 4.101 0.851 4.450 1.00 . A A . 16 VAL HB 1 1 6 3043 1 1 16 VAL HG11 H 2.210 -0.695 4.891 1.00 . A A . 16 VAL HG11 1 1 6 3044 1 1 16 VAL HG12 H 2.133 -0.020 3.264 1.00 . A A . 16 VAL HG12 1 1 6 3045 1 1 16 VAL HG13 H 2.697 -1.691 3.506 1.00 . A A . 16 VAL HG13 1 1 6 3046 1 1 16 VAL HG21 H 4.280 -1.009 6.062 1.00 . A A . 16 VAL HG21 1 1 6 3047 1 1 16 VAL HG22 H 4.826 -2.099 4.771 1.00 . A A . 16 VAL HG22 1 1 6 3048 1 1 16 VAL HG23 H 5.847 -0.732 5.291 1.00 . A A . 16 VAL HG23 1 1 6 3049 1 1 16 VAL N N 6.179 0.655 2.916 1.00 . A A . 16 VAL N 1 1 6 3050 1 1 16 VAL O O 4.060 1.402 1.222 1.00 . A A . 16 VAL O 1 1 6 3051 1 1 17 TYR C C 1.842 -1.856 -0.419 1.00 . A A . 17 TYR C 1 1 6 3052 1 1 17 TYR CA C 2.822 -0.679 -0.344 1.00 . A A . 17 TYR CA 1 1 6 3053 1 1 17 TYR CB C 3.772 -0.669 -1.557 1.00 . A A . 17 TYR CB 1 1 6 3054 1 1 17 TYR CD1 C 5.807 -2.036 -0.973 1.00 . A A . 17 TYR CD1 1 1 6 3055 1 1 17 TYR CD2 C 4.319 -2.886 -2.706 1.00 . A A . 17 TYR CD2 1 1 6 3056 1 1 17 TYR CE1 C 6.689 -3.104 -1.197 1.00 . A A . 17 TYR CE1 1 1 6 3057 1 1 17 TYR CE2 C 5.204 -3.960 -2.933 1.00 . A A . 17 TYR CE2 1 1 6 3058 1 1 17 TYR CG C 4.636 -1.906 -1.741 1.00 . A A . 17 TYR CG 1 1 6 3059 1 1 17 TYR CZ C 6.406 -4.052 -2.199 1.00 . A A . 17 TYR CZ 1 1 6 3060 1 1 17 TYR H H 3.718 -1.732 1.242 1.00 . A A . 17 TYR H 1 1 6 3061 1 1 17 TYR HA H 2.250 0.250 -0.333 1.00 . A A . 17 TYR HA 1 1 6 3062 1 1 17 TYR HB2 H 3.198 -0.504 -2.466 1.00 . A A . 17 TYR HB2 1 1 6 3063 1 1 17 TYR HB3 H 4.446 0.181 -1.454 1.00 . A A . 17 TYR HB3 1 1 6 3064 1 1 17 TYR HD1 H 6.053 -1.283 -0.240 1.00 . A A . 17 TYR HD1 1 1 6 3065 1 1 17 TYR HD2 H 3.411 -2.809 -3.285 1.00 . A A . 17 TYR HD2 1 1 6 3066 1 1 17 TYR HE1 H 7.601 -3.157 -0.629 1.00 . A A . 17 TYR HE1 1 1 6 3067 1 1 17 TYR HE2 H 4.989 -4.732 -3.655 1.00 . A A . 17 TYR HE2 1 1 6 3068 1 1 17 TYR HH H 8.113 -4.929 -1.995 1.00 . A A . 17 TYR HH 1 1 6 3069 1 1 17 TYR N N 3.616 -0.784 0.878 1.00 . A A . 17 TYR N 1 1 6 3070 1 1 17 TYR O O 1.841 -2.720 0.453 1.00 . A A . 17 TYR O 1 1 6 3071 1 1 17 TYR OH O 7.275 -5.068 -2.442 1.00 . A A . 17 TYR OH 1 1 6 3072 1 1 18 TYR C C 0.571 -3.731 -3.086 1.00 . A A . 18 TYR C 1 1 6 3073 1 1 18 TYR CA C 0.173 -3.072 -1.770 1.00 . A A . 18 TYR CA 1 1 6 3074 1 1 18 TYR CB C -1.302 -2.672 -1.725 1.00 . A A . 18 TYR CB 1 1 6 3075 1 1 18 TYR CD1 C -1.242 -1.190 0.306 1.00 . A A . 18 TYR CD1 1 1 6 3076 1 1 18 TYR CD2 C -2.512 -3.262 0.428 1.00 . A A . 18 TYR CD2 1 1 6 3077 1 1 18 TYR CE1 C -1.448 -0.964 1.668 1.00 . A A . 18 TYR CE1 1 1 6 3078 1 1 18 TYR CE2 C -2.806 -2.990 1.774 1.00 . A A . 18 TYR CE2 1 1 6 3079 1 1 18 TYR CG C -1.723 -2.359 -0.307 1.00 . A A . 18 TYR CG 1 1 6 3080 1 1 18 TYR CZ C -2.239 -1.865 2.413 1.00 . A A . 18 TYR CZ 1 1 6 3081 1 1 18 TYR H H 0.911 -1.108 -2.062 1.00 . A A . 18 TYR H 1 1 6 3082 1 1 18 TYR HA H 0.309 -3.820 -0.990 1.00 . A A . 18 TYR HA 1 1 6 3083 1 1 18 TYR HB2 H -1.475 -1.808 -2.367 1.00 . A A . 18 TYR HB2 1 1 6 3084 1 1 18 TYR HB3 H -1.902 -3.502 -2.097 1.00 . A A . 18 TYR HB3 1 1 6 3085 1 1 18 TYR HD1 H -0.680 -0.467 -0.267 1.00 . A A . 18 TYR HD1 1 1 6 3086 1 1 18 TYR HD2 H -2.940 -4.133 -0.052 1.00 . A A . 18 TYR HD2 1 1 6 3087 1 1 18 TYR HE1 H -1.004 -0.076 2.079 1.00 . A A . 18 TYR HE1 1 1 6 3088 1 1 18 TYR HE2 H -3.475 -3.635 2.315 1.00 . A A . 18 TYR HE2 1 1 6 3089 1 1 18 TYR HH H -1.964 -0.914 4.075 1.00 . A A . 18 TYR HH 1 1 6 3090 1 1 18 TYR N N 1.029 -1.925 -1.472 1.00 . A A . 18 TYR N 1 1 6 3091 1 1 18 TYR O O 0.875 -3.077 -4.085 1.00 . A A . 18 TYR O 1 1 6 3092 1 1 18 TYR OH O -2.491 -1.637 3.730 1.00 . A A . 18 TYR OH 1 1 6 3093 1 1 19 PHE C C 0.018 -6.905 -4.538 1.00 . A A . 19 PHE C 1 1 6 3094 1 1 19 PHE CA C 1.099 -5.939 -4.081 1.00 . A A . 19 PHE CA 1 1 6 3095 1 1 19 PHE CB C 2.286 -6.674 -3.473 1.00 . A A . 19 PHE CB 1 1 6 3096 1 1 19 PHE CD1 C 2.504 -9.059 -4.324 1.00 . A A . 19 PHE CD1 1 1 6 3097 1 1 19 PHE CD2 C 4.050 -7.365 -5.139 1.00 . A A . 19 PHE CD2 1 1 6 3098 1 1 19 PHE CE1 C 3.191 -10.040 -5.061 1.00 . A A . 19 PHE CE1 1 1 6 3099 1 1 19 PHE CE2 C 4.735 -8.341 -5.875 1.00 . A A . 19 PHE CE2 1 1 6 3100 1 1 19 PHE CG C 2.946 -7.720 -4.347 1.00 . A A . 19 PHE CG 1 1 6 3101 1 1 19 PHE CZ C 4.314 -9.683 -5.827 1.00 . A A . 19 PHE CZ 1 1 6 3102 1 1 19 PHE H H 0.315 -5.519 -2.178 1.00 . A A . 19 PHE H 1 1 6 3103 1 1 19 PHE HA H 1.449 -5.357 -4.932 1.00 . A A . 19 PHE HA 1 1 6 3104 1 1 19 PHE HB2 H 3.029 -5.929 -3.199 1.00 . A A . 19 PHE HB2 1 1 6 3105 1 1 19 PHE HB3 H 1.949 -7.152 -2.557 1.00 . A A . 19 PHE HB3 1 1 6 3106 1 1 19 PHE HD1 H 1.639 -9.350 -3.745 1.00 . A A . 19 PHE HD1 1 1 6 3107 1 1 19 PHE HD2 H 4.391 -6.342 -5.178 1.00 . A A . 19 PHE HD2 1 1 6 3108 1 1 19 PHE HE1 H 2.864 -11.069 -5.032 1.00 . A A . 19 PHE HE1 1 1 6 3109 1 1 19 PHE HE2 H 5.588 -8.042 -6.467 1.00 . A A . 19 PHE HE2 1 1 6 3110 1 1 19 PHE HZ H 4.845 -10.440 -6.385 1.00 . A A . 19 PHE HZ 1 1 6 3111 1 1 19 PHE N N 0.570 -5.060 -3.053 1.00 . A A . 19 PHE N 1 1 6 3112 1 1 19 PHE O O -0.507 -7.686 -3.740 1.00 . A A . 19 PHE O 1 1 6 3113 1 1 20 ASN C C -0.647 -9.136 -6.605 1.00 . A A . 20 ASN C 1 1 6 3114 1 1 20 ASN CA C -1.245 -7.730 -6.476 1.00 . A A . 20 ASN CA 1 1 6 3115 1 1 20 ASN CB C -1.646 -7.140 -7.827 1.00 . A A . 20 ASN CB 1 1 6 3116 1 1 20 ASN CG C -2.767 -7.966 -8.419 1.00 . A A . 20 ASN CG 1 1 6 3117 1 1 20 ASN H H 0.219 -6.214 -6.431 1.00 . A A . 20 ASN H 1 1 6 3118 1 1 20 ASN HA H -2.141 -7.789 -5.872 1.00 . A A . 20 ASN HA 1 1 6 3119 1 1 20 ASN HB2 H -1.967 -6.112 -7.710 1.00 . A A . 20 ASN HB2 1 1 6 3120 1 1 20 ASN HB3 H -0.790 -7.148 -8.498 1.00 . A A . 20 ASN HB3 1 1 6 3121 1 1 20 ASN HD21 H -4.221 -6.758 -7.660 1.00 . A A . 20 ASN HD21 1 1 6 3122 1 1 20 ASN HD22 H -4.736 -8.181 -8.561 1.00 . A A . 20 ASN HD22 1 1 6 3123 1 1 20 ASN N N -0.314 -6.834 -5.825 1.00 . A A . 20 ASN N 1 1 6 3124 1 1 20 ASN ND2 N -4.008 -7.600 -8.179 1.00 . A A . 20 ASN ND2 1 1 6 3125 1 1 20 ASN O O 0.064 -9.435 -7.566 1.00 . A A . 20 ASN O 1 1 6 3126 1 1 20 ASN OD1 O -2.521 -8.974 -9.065 1.00 . A A . 20 ASN OD1 1 1 6 3127 1 1 21 HIS C C -0.984 -12.311 -6.763 1.00 . A A . 21 HIS C 1 1 6 3128 1 1 21 HIS CA C -0.415 -11.394 -5.659 1.00 . A A . 21 HIS CA 1 1 6 3129 1 1 21 HIS CB C -0.524 -11.989 -4.247 1.00 . A A . 21 HIS CB 1 1 6 3130 1 1 21 HIS CD2 C -2.913 -12.910 -4.182 1.00 . A A . 21 HIS CD2 1 1 6 3131 1 1 21 HIS CE1 C -3.668 -11.790 -2.435 1.00 . A A . 21 HIS CE1 1 1 6 3132 1 1 21 HIS CG C -1.925 -12.099 -3.704 1.00 . A A . 21 HIS CG 1 1 6 3133 1 1 21 HIS H H -1.581 -9.755 -4.904 1.00 . A A . 21 HIS H 1 1 6 3134 1 1 21 HIS HA H 0.649 -11.321 -5.885 1.00 . A A . 21 HIS HA 1 1 6 3135 1 1 21 HIS HB2 H -0.058 -12.974 -4.234 1.00 . A A . 21 HIS HB2 1 1 6 3136 1 1 21 HIS HB3 H 0.051 -11.360 -3.567 1.00 . A A . 21 HIS HB3 1 1 6 3137 1 1 21 HIS HD2 H -2.835 -13.590 -5.019 1.00 . A A . 21 HIS HD2 1 1 6 3138 1 1 21 HIS HE1 H -4.317 -11.431 -1.648 1.00 . A A . 21 HIS HE1 1 1 6 3139 1 1 21 HIS HE2 H -4.903 -13.158 -3.443 1.00 . A A . 21 HIS HE2 1 1 6 3140 1 1 21 HIS N N -0.955 -10.029 -5.662 1.00 . A A . 21 HIS N 1 1 6 3141 1 1 21 HIS ND1 N -2.398 -11.397 -2.598 1.00 . A A . 21 HIS ND1 1 1 6 3142 1 1 21 HIS NE2 N -4.008 -12.697 -3.371 1.00 . A A . 21 HIS NE2 1 1 6 3143 1 1 21 HIS O O -0.723 -13.511 -6.743 1.00 . A A . 21 HIS O 1 1 6 3144 1 1 22 ILE C C -1.379 -12.115 -10.160 1.00 . A A . 22 ILE C 1 1 6 3145 1 1 22 ILE CA C -2.235 -12.473 -8.919 1.00 . A A . 22 ILE CA 1 1 6 3146 1 1 22 ILE CB C -3.748 -12.169 -9.116 1.00 . A A . 22 ILE CB 1 1 6 3147 1 1 22 ILE CD1 C -6.035 -12.030 -7.881 1.00 . A A . 22 ILE CD1 1 1 6 3148 1 1 22 ILE CG1 C -4.557 -12.439 -7.818 1.00 . A A . 22 ILE CG1 1 1 6 3149 1 1 22 ILE CG2 C -4.332 -12.985 -10.286 1.00 . A A . 22 ILE CG2 1 1 6 3150 1 1 22 ILE H H -1.943 -10.774 -7.690 1.00 . A A . 22 ILE H 1 1 6 3151 1 1 22 ILE HA H -2.131 -13.548 -8.764 1.00 . A A . 22 ILE HA 1 1 6 3152 1 1 22 ILE HB H -3.858 -11.114 -9.364 1.00 . A A . 22 ILE HB 1 1 6 3153 1 1 22 ILE HD11 H -6.589 -12.688 -8.551 1.00 . A A . 22 ILE HD11 1 1 6 3154 1 1 22 ILE HD12 H -6.472 -12.112 -6.884 1.00 . A A . 22 ILE HD12 1 1 6 3155 1 1 22 ILE HD13 H -6.122 -10.998 -8.219 1.00 . A A . 22 ILE HD13 1 1 6 3156 1 1 22 ILE HG12 H -4.492 -13.498 -7.565 1.00 . A A . 22 ILE HG12 1 1 6 3157 1 1 22 ILE HG13 H -4.128 -11.873 -6.992 1.00 . A A . 22 ILE HG13 1 1 6 3158 1 1 22 ILE HG21 H -3.826 -12.732 -11.218 1.00 . A A . 22 ILE HG21 1 1 6 3159 1 1 22 ILE HG22 H -4.217 -14.052 -10.095 1.00 . A A . 22 ILE HG22 1 1 6 3160 1 1 22 ILE HG23 H -5.386 -12.754 -10.430 1.00 . A A . 22 ILE HG23 1 1 6 3161 1 1 22 ILE N N -1.741 -11.765 -7.728 1.00 . A A . 22 ILE N 1 1 6 3162 1 1 22 ILE O O -1.341 -12.874 -11.125 1.00 . A A . 22 ILE O 1 1 6 3163 1 1 23 THR C C 1.456 -9.848 -10.947 1.00 . A A . 23 THR C 1 1 6 3164 1 1 23 THR CA C 0.069 -10.406 -11.284 1.00 . A A . 23 THR CA 1 1 6 3165 1 1 23 THR CB C -0.716 -9.223 -11.875 1.00 . A A . 23 THR CB 1 1 6 3166 1 1 23 THR CG2 C -2.115 -9.591 -12.375 1.00 . A A . 23 THR CG2 1 1 6 3167 1 1 23 THR H H -0.753 -10.396 -9.309 1.00 . A A . 23 THR H 1 1 6 3168 1 1 23 THR HA H 0.196 -11.165 -12.056 1.00 . A A . 23 THR HA 1 1 6 3169 1 1 23 THR HB H -0.158 -8.816 -12.720 1.00 . A A . 23 THR HB 1 1 6 3170 1 1 23 THR HG1 H -1.506 -8.543 -10.251 1.00 . A A . 23 THR HG1 1 1 6 3171 1 1 23 THR HG21 H -2.573 -8.716 -12.837 1.00 . A A . 23 THR HG21 1 1 6 3172 1 1 23 THR HG22 H -2.037 -10.384 -13.119 1.00 . A A . 23 THR HG22 1 1 6 3173 1 1 23 THR HG23 H -2.745 -9.932 -11.556 1.00 . A A . 23 THR HG23 1 1 6 3174 1 1 23 THR N N -0.659 -10.983 -10.130 1.00 . A A . 23 THR N 1 1 6 3175 1 1 23 THR O O 2.162 -9.398 -11.846 1.00 . A A . 23 THR O 1 1 6 3176 1 1 23 THR OG1 O -0.828 -8.222 -10.885 1.00 . A A . 23 THR OG1 1 1 6 3177 1 1 24 ASN C C 3.050 -7.628 -9.360 1.00 . A A . 24 ASN C 1 1 6 3178 1 1 24 ASN CA C 2.995 -9.151 -9.101 1.00 . A A . 24 ASN CA 1 1 6 3179 1 1 24 ASN CB C 4.299 -9.942 -9.357 1.00 . A A . 24 ASN CB 1 1 6 3180 1 1 24 ASN CG C 4.893 -9.831 -10.754 1.00 . A A . 24 ASN CG 1 1 6 3181 1 1 24 ASN H H 1.160 -10.137 -8.967 1.00 . A A . 24 ASN H 1 1 6 3182 1 1 24 ASN HA H 2.835 -9.208 -8.024 1.00 . A A . 24 ASN HA 1 1 6 3183 1 1 24 ASN HB2 H 5.058 -9.581 -8.665 1.00 . A A . 24 ASN HB2 1 1 6 3184 1 1 24 ASN HB3 H 4.128 -10.996 -9.139 1.00 . A A . 24 ASN HB3 1 1 6 3185 1 1 24 ASN HD21 H 5.172 -7.839 -10.551 1.00 . A A . 24 ASN HD21 1 1 6 3186 1 1 24 ASN HD22 H 5.698 -8.588 -12.077 1.00 . A A . 24 ASN HD22 1 1 6 3187 1 1 24 ASN N N 1.828 -9.824 -9.664 1.00 . A A . 24 ASN N 1 1 6 3188 1 1 24 ASN ND2 N 5.327 -8.650 -11.147 1.00 . A A . 24 ASN ND2 1 1 6 3189 1 1 24 ASN O O 4.124 -7.037 -9.214 1.00 . A A . 24 ASN O 1 1 6 3190 1 1 24 ASN OD1 O 5.028 -10.809 -11.472 1.00 . A A . 24 ASN OD1 1 1 6 3191 1 1 25 ALA C C 1.965 -4.922 -8.361 1.00 . A A . 25 ALA C 1 1 6 3192 1 1 25 ALA CA C 1.888 -5.513 -9.789 1.00 . A A . 25 ALA CA 1 1 6 3193 1 1 25 ALA CB C 0.613 -5.076 -10.515 1.00 . A A . 25 ALA CB 1 1 6 3194 1 1 25 ALA H H 1.074 -7.482 -9.941 1.00 . A A . 25 ALA H 1 1 6 3195 1 1 25 ALA HA H 2.747 -5.152 -10.356 1.00 . A A . 25 ALA HA 1 1 6 3196 1 1 25 ALA HB1 H -0.269 -5.369 -9.944 1.00 . A A . 25 ALA HB1 1 1 6 3197 1 1 25 ALA HB2 H 0.613 -3.993 -10.640 1.00 . A A . 25 ALA HB2 1 1 6 3198 1 1 25 ALA HB3 H 0.571 -5.543 -11.500 1.00 . A A . 25 ALA HB3 1 1 6 3199 1 1 25 ALA N N 1.936 -6.979 -9.747 1.00 . A A . 25 ALA N 1 1 6 3200 1 1 25 ALA O O 1.583 -5.580 -7.394 1.00 . A A . 25 ALA O 1 1 6 3201 1 1 26 SER C C 2.431 -1.548 -6.903 1.00 . A A . 26 SER C 1 1 6 3202 1 1 26 SER CA C 2.669 -3.058 -6.894 1.00 . A A . 26 SER CA 1 1 6 3203 1 1 26 SER CB C 4.117 -3.315 -6.460 1.00 . A A . 26 SER CB 1 1 6 3204 1 1 26 SER H H 2.750 -3.153 -9.013 1.00 . A A . 26 SER H 1 1 6 3205 1 1 26 SER HA H 2.007 -3.510 -6.160 1.00 . A A . 26 SER HA 1 1 6 3206 1 1 26 SER HB2 H 4.282 -2.874 -5.477 1.00 . A A . 26 SER HB2 1 1 6 3207 1 1 26 SER HB3 H 4.300 -4.386 -6.393 1.00 . A A . 26 SER HB3 1 1 6 3208 1 1 26 SER HG H 4.623 -1.876 -7.653 1.00 . A A . 26 SER HG 1 1 6 3209 1 1 26 SER N N 2.430 -3.675 -8.212 1.00 . A A . 26 SER N 1 1 6 3210 1 1 26 SER O O 3.031 -0.860 -7.733 1.00 . A A . 26 SER O 1 1 6 3211 1 1 26 SER OG O 5.009 -2.726 -7.384 1.00 . A A . 26 SER OG 1 1 6 3212 1 1 27 GLN C C 1.182 0.808 -4.336 1.00 . A A . 27 GLN C 1 1 6 3213 1 1 27 GLN CA C 1.396 0.410 -5.802 1.00 . A A . 27 GLN CA 1 1 6 3214 1 1 27 GLN CB C 0.206 0.877 -6.671 1.00 . A A . 27 GLN CB 1 1 6 3215 1 1 27 GLN CD C 1.470 2.901 -7.630 1.00 . A A . 27 GLN CD 1 1 6 3216 1 1 27 GLN CG C 0.662 1.635 -7.930 1.00 . A A . 27 GLN CG 1 1 6 3217 1 1 27 GLN H H 1.208 -1.637 -5.259 1.00 . A A . 27 GLN H 1 1 6 3218 1 1 27 GLN HA H 2.301 0.929 -6.122 1.00 . A A . 27 GLN HA 1 1 6 3219 1 1 27 GLN HB2 H -0.399 0.021 -6.972 1.00 . A A . 27 GLN HB2 1 1 6 3220 1 1 27 GLN HB3 H -0.443 1.538 -6.096 1.00 . A A . 27 GLN HB3 1 1 6 3221 1 1 27 GLN HE21 H 2.249 3.009 -9.516 1.00 . A A . 27 GLN HE21 1 1 6 3222 1 1 27 GLN HE22 H 2.722 4.240 -8.357 1.00 . A A . 27 GLN HE22 1 1 6 3223 1 1 27 GLN HG2 H 1.263 0.968 -8.548 1.00 . A A . 27 GLN HG2 1 1 6 3224 1 1 27 GLN HG3 H -0.217 1.919 -8.508 1.00 . A A . 27 GLN HG3 1 1 6 3225 1 1 27 GLN N N 1.622 -1.030 -5.969 1.00 . A A . 27 GLN N 1 1 6 3226 1 1 27 GLN NE2 N 2.199 3.416 -8.598 1.00 . A A . 27 GLN NE2 1 1 6 3227 1 1 27 GLN O O 0.876 -0.020 -3.484 1.00 . A A . 27 GLN O 1 1 6 3228 1 1 27 GLN OE1 O 1.486 3.430 -6.525 1.00 . A A . 27 GLN OE1 1 1 6 3229 1 1 28 PHE C C -0.061 2.981 -2.146 1.00 . A A . 28 PHE C 1 1 6 3230 1 1 28 PHE CA C 1.339 2.655 -2.695 1.00 . A A . 28 PHE CA 1 1 6 3231 1 1 28 PHE CB C 2.255 3.887 -2.666 1.00 . A A . 28 PHE CB 1 1 6 3232 1 1 28 PHE CD1 C 4.507 2.896 -2.092 1.00 . A A . 28 PHE CD1 1 1 6 3233 1 1 28 PHE CD2 C 4.198 3.868 -4.304 1.00 . A A . 28 PHE CD2 1 1 6 3234 1 1 28 PHE CE1 C 5.819 2.535 -2.436 1.00 . A A . 28 PHE CE1 1 1 6 3235 1 1 28 PHE CE2 C 5.517 3.515 -4.641 1.00 . A A . 28 PHE CE2 1 1 6 3236 1 1 28 PHE CG C 3.691 3.560 -3.027 1.00 . A A . 28 PHE CG 1 1 6 3237 1 1 28 PHE CZ C 6.330 2.849 -3.707 1.00 . A A . 28 PHE CZ 1 1 6 3238 1 1 28 PHE H H 1.549 2.743 -4.819 1.00 . A A . 28 PHE H 1 1 6 3239 1 1 28 PHE HA H 1.774 1.914 -2.023 1.00 . A A . 28 PHE HA 1 1 6 3240 1 1 28 PHE HB2 H 1.868 4.642 -3.351 1.00 . A A . 28 PHE HB2 1 1 6 3241 1 1 28 PHE HB3 H 2.252 4.309 -1.661 1.00 . A A . 28 PHE HB3 1 1 6 3242 1 1 28 PHE HD1 H 4.123 2.647 -1.113 1.00 . A A . 28 PHE HD1 1 1 6 3243 1 1 28 PHE HD2 H 3.574 4.368 -5.031 1.00 . A A . 28 PHE HD2 1 1 6 3244 1 1 28 PHE HE1 H 6.425 2.004 -1.721 1.00 . A A . 28 PHE HE1 1 1 6 3245 1 1 28 PHE HE2 H 5.904 3.752 -5.620 1.00 . A A . 28 PHE HE2 1 1 6 3246 1 1 28 PHE HZ H 7.344 2.580 -3.965 1.00 . A A . 28 PHE HZ 1 1 6 3247 1 1 28 PHE N N 1.342 2.104 -4.052 1.00 . A A . 28 PHE N 1 1 6 3248 1 1 28 PHE O O -0.184 3.251 -0.953 1.00 . A A . 28 PHE O 1 1 6 3249 1 1 29 GLU C C -2.896 1.854 -1.629 1.00 . A A . 29 GLU C 1 1 6 3250 1 1 29 GLU CA C -2.497 3.060 -2.495 1.00 . A A . 29 GLU CA 1 1 6 3251 1 1 29 GLU CB C -3.481 3.281 -3.661 1.00 . A A . 29 GLU CB 1 1 6 3252 1 1 29 GLU CD C -5.222 4.843 -2.584 1.00 . A A . 29 GLU CD 1 1 6 3253 1 1 29 GLU CG C -4.107 4.687 -3.631 1.00 . A A . 29 GLU CG 1 1 6 3254 1 1 29 GLU H H -0.967 2.692 -3.941 1.00 . A A . 29 GLU H 1 1 6 3255 1 1 29 GLU HA H -2.536 3.934 -1.843 1.00 . A A . 29 GLU HA 1 1 6 3256 1 1 29 GLU HB2 H -2.955 3.157 -4.609 1.00 . A A . 29 GLU HB2 1 1 6 3257 1 1 29 GLU HB3 H -4.278 2.537 -3.629 1.00 . A A . 29 GLU HB3 1 1 6 3258 1 1 29 GLU HG2 H -3.327 5.431 -3.453 1.00 . A A . 29 GLU HG2 1 1 6 3259 1 1 29 GLU HG3 H -4.525 4.886 -4.621 1.00 . A A . 29 GLU HG3 1 1 6 3260 1 1 29 GLU N N -1.114 2.945 -2.977 1.00 . A A . 29 GLU N 1 1 6 3261 1 1 29 GLU O O -2.403 0.740 -1.806 1.00 . A A . 29 GLU O 1 1 6 3262 1 1 29 GLU OE1 O -5.004 4.551 -1.383 1.00 . A A . 29 GLU OE1 1 1 6 3263 1 1 29 GLU OE2 O -6.347 5.236 -2.973 1.00 . A A . 29 GLU OE2 1 1 6 3264 1 1 30 ARG C C -5.744 1.112 0.552 1.00 . A A . 30 ARG C 1 1 6 3265 1 1 30 ARG CA C -4.212 1.238 0.428 1.00 . A A . 30 ARG CA 1 1 6 3266 1 1 30 ARG CB C -3.480 1.652 1.722 1.00 . A A . 30 ARG CB 1 1 6 3267 1 1 30 ARG CD C -4.463 4.025 1.891 1.00 . A A . 30 ARG CD 1 1 6 3268 1 1 30 ARG CG C -4.153 2.704 2.608 1.00 . A A . 30 ARG CG 1 1 6 3269 1 1 30 ARG CZ C -6.547 5.397 1.857 1.00 . A A . 30 ARG CZ 1 1 6 3270 1 1 30 ARG H H -4.252 3.030 -0.742 1.00 . A A . 30 ARG H 1 1 6 3271 1 1 30 ARG HA H -3.844 0.242 0.176 1.00 . A A . 30 ARG HA 1 1 6 3272 1 1 30 ARG HB2 H -3.368 0.768 2.343 1.00 . A A . 30 ARG HB2 1 1 6 3273 1 1 30 ARG HB3 H -2.474 1.994 1.470 1.00 . A A . 30 ARG HB3 1 1 6 3274 1 1 30 ARG HD2 H -3.584 4.671 1.910 1.00 . A A . 30 ARG HD2 1 1 6 3275 1 1 30 ARG HD3 H -4.712 3.815 0.861 1.00 . A A . 30 ARG HD3 1 1 6 3276 1 1 30 ARG HE H -5.757 4.587 3.484 1.00 . A A . 30 ARG HE 1 1 6 3277 1 1 30 ARG HG2 H -5.073 2.277 3.004 1.00 . A A . 30 ARG HG2 1 1 6 3278 1 1 30 ARG HG3 H -3.485 2.894 3.448 1.00 . A A . 30 ARG HG3 1 1 6 3279 1 1 30 ARG HH11 H -5.831 5.287 -0.087 1.00 . A A . 30 ARG HH11 1 1 6 3280 1 1 30 ARG HH12 H -7.338 6.213 0.239 1.00 . A A . 30 ARG HH12 1 1 6 3281 1 1 30 ARG HH21 H -7.885 5.408 3.382 1.00 . A A . 30 ARG HH21 1 1 6 3282 1 1 30 ARG HH22 H -8.253 6.367 1.938 1.00 . A A . 30 ARG HH22 1 1 6 3283 1 1 30 ARG N N -3.795 2.114 -0.679 1.00 . A A . 30 ARG N 1 1 6 3284 1 1 30 ARG NE N -5.615 4.701 2.495 1.00 . A A . 30 ARG NE 1 1 6 3285 1 1 30 ARG NH1 N -6.533 5.668 0.571 1.00 . A A . 30 ARG NH1 1 1 6 3286 1 1 30 ARG NH2 N -7.582 5.844 2.517 1.00 . A A . 30 ARG NH2 1 1 6 3287 1 1 30 ARG O O -6.453 1.915 -0.060 1.00 . A A . 30 ARG O 1 1 6 3288 1 1 31 PRO C C -8.322 1.284 2.167 1.00 . A A . 31 PRO C 1 1 6 3289 1 1 31 PRO CA C -7.724 -0.003 1.568 1.00 . A A . 31 PRO CA 1 1 6 3290 1 1 31 PRO CB C -7.867 -1.180 2.539 1.00 . A A . 31 PRO CB 1 1 6 3291 1 1 31 PRO CD C -5.574 -0.964 1.942 1.00 . A A . 31 PRO CD 1 1 6 3292 1 1 31 PRO CG C -6.625 -2.020 2.269 1.00 . A A . 31 PRO CG 1 1 6 3293 1 1 31 PRO HA H -8.253 -0.242 0.646 1.00 . A A . 31 PRO HA 1 1 6 3294 1 1 31 PRO HB2 H -7.838 -0.823 3.570 1.00 . A A . 31 PRO HB2 1 1 6 3295 1 1 31 PRO HB3 H -8.781 -1.745 2.357 1.00 . A A . 31 PRO HB3 1 1 6 3296 1 1 31 PRO HD2 H -5.146 -0.580 2.869 1.00 . A A . 31 PRO HD2 1 1 6 3297 1 1 31 PRO HD3 H -4.797 -1.387 1.314 1.00 . A A . 31 PRO HD3 1 1 6 3298 1 1 31 PRO HG2 H -6.351 -2.611 3.141 1.00 . A A . 31 PRO HG2 1 1 6 3299 1 1 31 PRO HG3 H -6.791 -2.659 1.402 1.00 . A A . 31 PRO HG3 1 1 6 3300 1 1 31 PRO N N -6.290 0.097 1.259 1.00 . A A . 31 PRO N 1 1 6 3301 1 1 31 PRO O O -7.601 2.197 2.573 1.00 . A A . 31 PRO O 1 1 6 3302 1 1 32 SER C C -10.414 3.543 1.475 1.00 . A A . 32 SER C 1 1 6 3303 1 1 32 SER CA C -10.447 2.529 2.642 1.00 . A A . 32 SER CA 1 1 6 3304 1 1 32 SER CB C -10.084 3.129 4.018 1.00 . A A . 32 SER CB 1 1 6 3305 1 1 32 SER H H -10.165 0.497 2.032 1.00 . A A . 32 SER H 1 1 6 3306 1 1 32 SER HA H -11.486 2.208 2.724 1.00 . A A . 32 SER HA 1 1 6 3307 1 1 32 SER HB2 H -10.855 3.837 4.323 1.00 . A A . 32 SER HB2 1 1 6 3308 1 1 32 SER HB3 H -10.042 2.328 4.758 1.00 . A A . 32 SER HB3 1 1 6 3309 1 1 32 SER HG H -8.247 3.175 3.461 1.00 . A A . 32 SER HG 1 1 6 3310 1 1 32 SER N N -9.654 1.323 2.306 1.00 . A A . 32 SER N 1 1 6 3311 1 1 32 SER O O -9.958 3.192 0.385 1.00 . A A . 32 SER O 1 1 6 3312 1 1 32 SER OG O -8.841 3.796 3.977 1.00 . A A . 32 SER OG 1 1 6 3313 1 1 33 GLY C C -9.781 6.161 -0.085 1.00 . A A . 33 GLY C 1 1 6 3314 1 1 33 GLY CA C -11.085 5.792 0.616 1.00 . A A . 33 GLY CA 1 1 6 3315 1 1 33 GLY H H -11.283 5.010 2.580 1.00 . A A . 33 GLY H 1 1 6 3316 1 1 33 GLY HA2 H -11.779 5.436 -0.145 1.00 . A A . 33 GLY HA2 1 1 6 3317 1 1 33 GLY HA3 H -11.489 6.704 1.053 1.00 . A A . 33 GLY HA3 1 1 6 3318 1 1 33 GLY N N -10.941 4.764 1.664 1.00 . A A . 33 GLY N 1 1 6 3319 1 1 33 GLY O O -9.565 5.698 -1.223 1.00 . A A . 33 GLY O 1 1 6 3320 1 1 33 GLY OXT O -8.961 6.873 0.528 1.00 . A A . 33 GLY OXT 1 1 6 3321 2 2 1 NAG C1 C 12.228 1.625 -1.040 1.00 . B A . 101 NAG C1 1 1 6 3322 2 2 1 NAG C2 C 11.665 2.913 -1.682 1.00 . B A . 101 NAG C2 1 1 6 3323 2 2 1 NAG C3 C 10.607 2.436 -2.694 1.00 . B A . 101 NAG C3 1 1 6 3324 2 2 1 NAG C4 C 11.322 1.641 -3.780 1.00 . B A . 101 NAG C4 1 1 6 3325 2 2 1 NAG C5 C 12.016 0.410 -3.189 1.00 . B A . 101 NAG C5 1 1 6 3326 2 2 1 NAG C6 C 12.839 -0.397 -4.193 1.00 . B A . 101 NAG C6 1 1 6 3327 2 2 1 NAG C7 C 10.821 5.105 -0.948 1.00 . B A . 101 NAG C7 1 1 6 3328 2 2 1 NAG C8 C 10.353 5.960 0.239 1.00 . B A . 101 NAG C8 1 1 6 3329 2 2 1 NAG H1 H 11.406 1.036 -0.633 1.00 . B A . 101 NAG H1 1 1 6 3330 2 2 1 NAG H2 H 12.463 3.439 -2.209 1.00 . B A . 101 NAG H2 1 1 6 3331 2 2 1 NAG H3 H 9.876 1.794 -2.190 1.00 . B A . 101 NAG H3 1 1 6 3332 2 2 1 NAG H4 H 12.036 2.293 -4.277 1.00 . B A . 101 NAG H4 1 1 6 3333 2 2 1 NAG H5 H 11.250 -0.234 -2.783 1.00 . B A . 101 NAG H5 1 1 6 3334 2 2 1 NAG H61 H 13.092 -1.364 -3.758 1.00 . B A . 101 NAG H61 1 1 6 3335 2 2 1 NAG H62 H 12.283 -0.571 -5.112 1.00 . B A . 101 NAG H62 1 1 6 3336 2 2 1 NAG H81 H 11.004 5.790 1.098 1.00 . B A . 101 NAG H81 1 1 6 3337 2 2 1 NAG H82 H 9.331 5.688 0.503 1.00 . B A . 101 NAG H82 1 1 6 3338 2 2 1 NAG H83 H 10.385 7.016 -0.030 1.00 . B A . 101 NAG H83 1 1 6 3339 2 2 1 NAG HN2 H 10.876 3.456 0.231 1.00 . B A . 101 NAG HN2 1 1 6 3340 2 2 1 NAG HO3 H 10.248 4.393 -2.966 1.00 . B A . 101 NAG HO3 1 1 6 3341 2 2 1 NAG HO4 H 9.748 2.023 -4.804 1.00 . B A . 101 NAG HO4 1 1 6 3342 2 2 1 NAG HO6 H 14.415 0.595 -3.613 1.00 . B A . 101 NAG HO6 1 1 6 3343 2 2 1 NAG N2 N 11.103 3.830 -0.687 1.00 . B A . 101 NAG N2 1 1 6 3344 2 2 1 NAG O3 O 9.930 3.537 -3.351 1.00 . B A . 101 NAG O3 1 1 6 3345 2 2 1 NAG O4 O 10.310 1.240 -4.707 1.00 . B A . 101 NAG O4 1 1 6 3346 2 2 1 NAG O5 O 12.905 0.834 -2.074 1.00 . B A . 101 NAG O5 1 1 6 3347 2 2 1 NAG O6 O 14.050 0.324 -4.461 1.00 . B A . 101 NAG O6 1 1 6 3348 2 2 1 NAG O7 O 10.907 5.552 -2.089 1.00 . B A . 101 NAG O7 1 1 7 3349 1 1 1 LYS C C -10.132 0.327 -2.303 1.00 . A A . 1 LYS C 1 1 7 3350 1 1 1 LYS CA C -11.138 1.376 -1.839 1.00 . A A . 1 LYS CA 1 1 7 3351 1 1 1 LYS CB C -10.506 2.511 -1.007 1.00 . A A . 1 LYS CB 1 1 7 3352 1 1 1 LYS CD C -8.838 4.443 -1.017 1.00 . A A . 1 LYS CD 1 1 7 3353 1 1 1 LYS CE C -7.399 4.857 -1.359 1.00 . A A . 1 LYS CE 1 1 7 3354 1 1 1 LYS CG C -9.261 3.119 -1.679 1.00 . A A . 1 LYS CG 1 1 7 3355 1 1 1 LYS H1 H -12.694 0.008 -1.723 1.00 . A A . 1 LYS H1 1 1 7 3356 1 1 1 LYS H2 H -13.015 1.438 -0.966 1.00 . A A . 1 LYS H2 1 1 7 3357 1 1 1 LYS H3 H -12.027 0.370 -0.259 1.00 . A A . 1 LYS H3 1 1 7 3358 1 1 1 LYS HA H -11.500 1.833 -2.761 1.00 . A A . 1 LYS HA 1 1 7 3359 1 1 1 LYS HB2 H -11.256 3.294 -0.876 1.00 . A A . 1 LYS HB2 1 1 7 3360 1 1 1 LYS HB3 H -10.221 2.146 -0.021 1.00 . A A . 1 LYS HB3 1 1 7 3361 1 1 1 LYS HD2 H -9.526 5.232 -1.323 1.00 . A A . 1 LYS HD2 1 1 7 3362 1 1 1 LYS HD3 H -8.903 4.340 0.068 1.00 . A A . 1 LYS HD3 1 1 7 3363 1 1 1 LYS HE2 H -7.183 5.828 -0.909 1.00 . A A . 1 LYS HE2 1 1 7 3364 1 1 1 LYS HE3 H -6.716 4.130 -0.917 1.00 . A A . 1 LYS HE3 1 1 7 3365 1 1 1 LYS HG2 H -8.440 2.403 -1.611 1.00 . A A . 1 LYS HG2 1 1 7 3366 1 1 1 LYS HG3 H -9.472 3.305 -2.733 1.00 . A A . 1 LYS HG3 1 1 7 3367 1 1 1 LYS HZ1 H -7.275 3.973 -3.232 1.00 . A A . 1 LYS HZ1 1 1 7 3368 1 1 1 LYS HZ2 H -7.658 5.607 -3.309 1.00 . A A . 1 LYS HZ2 1 1 7 3369 1 1 1 LYS HZ3 H -6.128 4.972 -3.003 1.00 . A A . 1 LYS HZ3 1 1 7 3370 1 1 1 LYS N N -12.300 0.754 -1.168 1.00 . A A . 1 LYS N 1 1 7 3371 1 1 1 LYS NZ N -7.137 4.903 -2.813 1.00 . A A . 1 LYS NZ 1 1 7 3372 1 1 1 LYS O O -9.808 0.369 -3.482 1.00 . A A . 1 LYS O 1 1 7 3373 1 1 2 LEU C C -9.143 -2.409 -3.071 1.00 . A A . 2 LEU C 1 1 7 3374 1 1 2 LEU CA C -8.674 -1.613 -1.827 1.00 . A A . 2 LEU CA 1 1 7 3375 1 1 2 LEU CB C -8.441 -2.541 -0.611 1.00 . A A . 2 LEU CB 1 1 7 3376 1 1 2 LEU CD1 C -6.110 -3.285 -1.468 1.00 . A A . 2 LEU CD1 1 1 7 3377 1 1 2 LEU CD2 C -7.084 -4.275 0.602 1.00 . A A . 2 LEU CD2 1 1 7 3378 1 1 2 LEU CG C -7.413 -3.686 -0.773 1.00 . A A . 2 LEU CG 1 1 7 3379 1 1 2 LEU H H -9.965 -0.566 -0.462 1.00 . A A . 2 LEU H 1 1 7 3380 1 1 2 LEU HA H -7.737 -1.105 -2.043 1.00 . A A . 2 LEU HA 1 1 7 3381 1 1 2 LEU HB2 H -8.131 -1.926 0.230 1.00 . A A . 2 LEU HB2 1 1 7 3382 1 1 2 LEU HB3 H -9.396 -2.991 -0.332 1.00 . A A . 2 LEU HB3 1 1 7 3383 1 1 2 LEU HD11 H -5.698 -2.372 -1.051 1.00 . A A . 2 LEU HD11 1 1 7 3384 1 1 2 LEU HD12 H -5.387 -4.091 -1.370 1.00 . A A . 2 LEU HD12 1 1 7 3385 1 1 2 LEU HD13 H -6.297 -3.151 -2.528 1.00 . A A . 2 LEU HD13 1 1 7 3386 1 1 2 LEU HD21 H -8.003 -4.597 1.092 1.00 . A A . 2 LEU HD21 1 1 7 3387 1 1 2 LEU HD22 H -6.435 -5.143 0.480 1.00 . A A . 2 LEU HD22 1 1 7 3388 1 1 2 LEU HD23 H -6.583 -3.535 1.224 1.00 . A A . 2 LEU HD23 1 1 7 3389 1 1 2 LEU HG H -7.857 -4.482 -1.362 1.00 . A A . 2 LEU HG 1 1 7 3390 1 1 2 LEU N N -9.662 -0.589 -1.441 1.00 . A A . 2 LEU N 1 1 7 3391 1 1 2 LEU O O -10.184 -3.065 -2.996 1.00 . A A . 2 LEU O 1 1 7 3392 1 1 3 PRO C C -8.586 -4.690 -5.193 1.00 . A A . 3 PRO C 1 1 7 3393 1 1 3 PRO CA C -8.762 -3.166 -5.386 1.00 . A A . 3 PRO CA 1 1 7 3394 1 1 3 PRO CB C -7.901 -2.604 -6.526 1.00 . A A . 3 PRO CB 1 1 7 3395 1 1 3 PRO CD C -7.326 -1.448 -4.515 1.00 . A A . 3 PRO CD 1 1 7 3396 1 1 3 PRO CG C -6.725 -1.922 -5.828 1.00 . A A . 3 PRO CG 1 1 7 3397 1 1 3 PRO HA H -9.809 -2.965 -5.612 1.00 . A A . 3 PRO HA 1 1 7 3398 1 1 3 PRO HB2 H -7.563 -3.378 -7.215 1.00 . A A . 3 PRO HB2 1 1 7 3399 1 1 3 PRO HB3 H -8.477 -1.852 -7.068 1.00 . A A . 3 PRO HB3 1 1 7 3400 1 1 3 PRO HD2 H -6.551 -1.413 -3.751 1.00 . A A . 3 PRO HD2 1 1 7 3401 1 1 3 PRO HD3 H -7.749 -0.453 -4.654 1.00 . A A . 3 PRO HD3 1 1 7 3402 1 1 3 PRO HG2 H -5.943 -2.643 -5.614 1.00 . A A . 3 PRO HG2 1 1 7 3403 1 1 3 PRO HG3 H -6.329 -1.091 -6.415 1.00 . A A . 3 PRO HG3 1 1 7 3404 1 1 3 PRO N N -8.395 -2.393 -4.197 1.00 . A A . 3 PRO N 1 1 7 3405 1 1 3 PRO O O -7.785 -5.130 -4.363 1.00 . A A . 3 PRO O 1 1 7 3406 1 1 4 PRO C C -7.992 -7.654 -6.092 1.00 . A A . 4 PRO C 1 1 7 3407 1 1 4 PRO CA C -9.336 -6.974 -5.791 1.00 . A A . 4 PRO CA 1 1 7 3408 1 1 4 PRO CB C -10.452 -7.479 -6.713 1.00 . A A . 4 PRO CB 1 1 7 3409 1 1 4 PRO CD C -10.182 -5.135 -7.070 1.00 . A A . 4 PRO CD 1 1 7 3410 1 1 4 PRO CG C -10.518 -6.425 -7.814 1.00 . A A . 4 PRO CG 1 1 7 3411 1 1 4 PRO HA H -9.614 -7.185 -4.758 1.00 . A A . 4 PRO HA 1 1 7 3412 1 1 4 PRO HB2 H -10.242 -8.472 -7.115 1.00 . A A . 4 PRO HB2 1 1 7 3413 1 1 4 PRO HB3 H -11.396 -7.488 -6.165 1.00 . A A . 4 PRO HB3 1 1 7 3414 1 1 4 PRO HD2 H -9.706 -4.428 -7.749 1.00 . A A . 4 PRO HD2 1 1 7 3415 1 1 4 PRO HD3 H -11.094 -4.704 -6.654 1.00 . A A . 4 PRO HD3 1 1 7 3416 1 1 4 PRO HG2 H -9.751 -6.627 -8.563 1.00 . A A . 4 PRO HG2 1 1 7 3417 1 1 4 PRO HG3 H -11.505 -6.381 -8.277 1.00 . A A . 4 PRO HG3 1 1 7 3418 1 1 4 PRO N N -9.292 -5.524 -5.985 1.00 . A A . 4 PRO N 1 1 7 3419 1 1 4 PRO O O -7.361 -7.404 -7.120 1.00 . A A . 4 PRO O 1 1 7 3420 1 1 5 GLY C C -5.051 -8.536 -4.871 1.00 . A A . 5 GLY C 1 1 7 3421 1 1 5 GLY CA C -6.313 -9.295 -5.298 1.00 . A A . 5 GLY CA 1 1 7 3422 1 1 5 GLY H H -8.114 -8.684 -4.349 1.00 . A A . 5 GLY H 1 1 7 3423 1 1 5 GLY HA2 H -6.390 -10.190 -4.682 1.00 . A A . 5 GLY HA2 1 1 7 3424 1 1 5 GLY HA3 H -6.182 -9.605 -6.333 1.00 . A A . 5 GLY HA3 1 1 7 3425 1 1 5 GLY N N -7.560 -8.531 -5.178 1.00 . A A . 5 GLY N 1 1 7 3426 1 1 5 GLY O O -3.960 -9.089 -4.985 1.00 . A A . 5 GLY O 1 1 7 3427 1 1 6 TRP C C -3.930 -6.712 -2.363 1.00 . A A . 6 TRP C 1 1 7 3428 1 1 6 TRP CA C -4.072 -6.491 -3.875 1.00 . A A . 6 TRP CA 1 1 7 3429 1 1 6 TRP CB C -4.294 -5.028 -4.258 1.00 . A A . 6 TRP CB 1 1 7 3430 1 1 6 TRP CD1 C -5.233 -5.002 -6.614 1.00 . A A . 6 TRP CD1 1 1 7 3431 1 1 6 TRP CD2 C -3.155 -4.175 -6.527 1.00 . A A . 6 TRP CD2 1 1 7 3432 1 1 6 TRP CE2 C -3.576 -4.110 -7.890 1.00 . A A . 6 TRP CE2 1 1 7 3433 1 1 6 TRP CE3 C -1.844 -3.738 -6.242 1.00 . A A . 6 TRP CE3 1 1 7 3434 1 1 6 TRP CG C -4.239 -4.748 -5.733 1.00 . A A . 6 TRP CG 1 1 7 3435 1 1 6 TRP CH2 C -1.423 -3.273 -8.604 1.00 . A A . 6 TRP CH2 1 1 7 3436 1 1 6 TRP CZ2 C -2.735 -3.661 -8.919 1.00 . A A . 6 TRP CZ2 1 1 7 3437 1 1 6 TRP CZ3 C -0.987 -3.299 -7.267 1.00 . A A . 6 TRP CZ3 1 1 7 3438 1 1 6 TRP H H -6.081 -6.844 -4.326 1.00 . A A . 6 TRP H 1 1 7 3439 1 1 6 TRP HA H -3.142 -6.809 -4.339 1.00 . A A . 6 TRP HA 1 1 7 3440 1 1 6 TRP HB2 H -5.261 -4.705 -3.879 1.00 . A A . 6 TRP HB2 1 1 7 3441 1 1 6 TRP HB3 H -3.538 -4.429 -3.766 1.00 . A A . 6 TRP HB3 1 1 7 3442 1 1 6 TRP HD1 H -6.190 -5.427 -6.345 1.00 . A A . 6 TRP HD1 1 1 7 3443 1 1 6 TRP HE1 H -5.462 -4.683 -8.690 1.00 . A A . 6 TRP HE1 1 1 7 3444 1 1 6 TRP HE3 H -1.489 -3.770 -5.224 1.00 . A A . 6 TRP HE3 1 1 7 3445 1 1 6 TRP HH2 H -0.751 -2.958 -9.390 1.00 . A A . 6 TRP HH2 1 1 7 3446 1 1 6 TRP HZ2 H -3.082 -3.647 -9.941 1.00 . A A . 6 TRP HZ2 1 1 7 3447 1 1 6 TRP HZ3 H 0.024 -3.010 -7.025 1.00 . A A . 6 TRP HZ3 1 1 7 3448 1 1 6 TRP N N -5.175 -7.286 -4.407 1.00 . A A . 6 TRP N 1 1 7 3449 1 1 6 TRP NE1 N -4.860 -4.610 -7.882 1.00 . A A . 6 TRP NE1 1 1 7 3450 1 1 6 TRP O O -4.902 -6.646 -1.615 1.00 . A A . 6 TRP O 1 1 7 3451 1 1 7 GLU C C -1.244 -6.507 0.014 1.00 . A A . 7 GLU C 1 1 7 3452 1 1 7 GLU CA C -2.344 -7.420 -0.575 1.00 . A A . 7 GLU CA 1 1 7 3453 1 1 7 GLU CB C -1.894 -8.889 -0.754 1.00 . A A . 7 GLU CB 1 1 7 3454 1 1 7 GLU CD C -1.375 -9.322 1.665 1.00 . A A . 7 GLU CD 1 1 7 3455 1 1 7 GLU CG C -2.146 -9.801 0.447 1.00 . A A . 7 GLU CG 1 1 7 3456 1 1 7 GLU H H -1.941 -7.065 -2.591 1.00 . A A . 7 GLU H 1 1 7 3457 1 1 7 GLU HA H -3.225 -7.388 0.069 1.00 . A A . 7 GLU HA 1 1 7 3458 1 1 7 GLU HB2 H -2.444 -9.333 -1.585 1.00 . A A . 7 GLU HB2 1 1 7 3459 1 1 7 GLU HB3 H -0.839 -8.913 -1.022 1.00 . A A . 7 GLU HB3 1 1 7 3460 1 1 7 GLU HG2 H -3.216 -9.821 0.664 1.00 . A A . 7 GLU HG2 1 1 7 3461 1 1 7 GLU HG3 H -1.830 -10.814 0.193 1.00 . A A . 7 GLU HG3 1 1 7 3462 1 1 7 GLU N N -2.699 -6.968 -1.920 1.00 . A A . 7 GLU N 1 1 7 3463 1 1 7 GLU O O -0.357 -6.072 -0.721 1.00 . A A . 7 GLU O 1 1 7 3464 1 1 7 GLU OE1 O -0.146 -9.550 1.741 1.00 . A A . 7 GLU OE1 1 1 7 3465 1 1 7 GLU OE2 O -1.976 -8.629 2.512 1.00 . A A . 7 GLU OE2 1 1 7 3466 1 1 8 LYS C C 1.069 -5.660 2.016 1.00 . A A . 8 LYS C 1 1 7 3467 1 1 8 LYS CA C -0.376 -5.159 1.889 1.00 . A A . 8 LYS CA 1 1 7 3468 1 1 8 LYS CB C -0.907 -4.533 3.201 1.00 . A A . 8 LYS CB 1 1 7 3469 1 1 8 LYS CD C -1.441 -6.414 4.897 1.00 . A A . 8 LYS CD 1 1 7 3470 1 1 8 LYS CE C -0.630 -7.624 5.379 1.00 . A A . 8 LYS CE 1 1 7 3471 1 1 8 LYS CG C -0.550 -5.216 4.537 1.00 . A A . 8 LYS CG 1 1 7 3472 1 1 8 LYS H H -1.920 -6.697 1.915 1.00 . A A . 8 LYS H 1 1 7 3473 1 1 8 LYS HA H -0.348 -4.341 1.166 1.00 . A A . 8 LYS HA 1 1 7 3474 1 1 8 LYS HB2 H -0.483 -3.529 3.251 1.00 . A A . 8 LYS HB2 1 1 7 3475 1 1 8 LYS HB3 H -1.988 -4.415 3.138 1.00 . A A . 8 LYS HB3 1 1 7 3476 1 1 8 LYS HD2 H -2.112 -6.110 5.702 1.00 . A A . 8 LYS HD2 1 1 7 3477 1 1 8 LYS HD3 H -2.067 -6.697 4.053 1.00 . A A . 8 LYS HD3 1 1 7 3478 1 1 8 LYS HE2 H 0.106 -7.293 6.117 1.00 . A A . 8 LYS HE2 1 1 7 3479 1 1 8 LYS HE3 H -1.315 -8.323 5.865 1.00 . A A . 8 LYS HE3 1 1 7 3480 1 1 8 LYS HG2 H 0.502 -5.498 4.549 1.00 . A A . 8 LYS HG2 1 1 7 3481 1 1 8 LYS HG3 H -0.673 -4.473 5.327 1.00 . A A . 8 LYS HG3 1 1 7 3482 1 1 8 LYS HZ1 H -0.665 -8.605 3.559 1.00 . A A . 8 LYS HZ1 1 1 7 3483 1 1 8 LYS HZ2 H 0.642 -7.695 3.710 1.00 . A A . 8 LYS HZ2 1 1 7 3484 1 1 8 LYS HZ3 H 0.546 -9.134 4.533 1.00 . A A . 8 LYS HZ3 1 1 7 3485 1 1 8 LYS N N -1.288 -6.171 1.316 1.00 . A A . 8 LYS N 1 1 7 3486 1 1 8 LYS NZ N 0.037 -8.311 4.253 1.00 . A A . 8 LYS NZ 1 1 7 3487 1 1 8 LYS O O 1.321 -6.828 2.340 1.00 . A A . 8 LYS O 1 1 7 3488 1 1 9 ARG C C 4.331 -3.926 2.155 1.00 . A A . 9 ARG C 1 1 7 3489 1 1 9 ARG CA C 3.451 -5.093 1.688 1.00 . A A . 9 ARG CA 1 1 7 3490 1 1 9 ARG CB C 3.636 -5.386 0.196 1.00 . A A . 9 ARG CB 1 1 7 3491 1 1 9 ARG CD C 4.577 -7.759 0.595 1.00 . A A . 9 ARG CD 1 1 7 3492 1 1 9 ARG CG C 4.713 -6.405 -0.111 1.00 . A A . 9 ARG CG 1 1 7 3493 1 1 9 ARG CZ C 2.794 -9.252 -0.359 1.00 . A A . 9 ARG CZ 1 1 7 3494 1 1 9 ARG H H 1.854 -3.863 1.369 1.00 . A A . 9 ARG H 1 1 7 3495 1 1 9 ARG HA H 3.670 -5.963 2.305 1.00 . A A . 9 ARG HA 1 1 7 3496 1 1 9 ARG HB2 H 2.711 -5.770 -0.242 1.00 . A A . 9 ARG HB2 1 1 7 3497 1 1 9 ARG HB3 H 3.858 -4.454 -0.319 1.00 . A A . 9 ARG HB3 1 1 7 3498 1 1 9 ARG HD2 H 5.312 -8.421 0.140 1.00 . A A . 9 ARG HD2 1 1 7 3499 1 1 9 ARG HD3 H 4.848 -7.649 1.646 1.00 . A A . 9 ARG HD3 1 1 7 3500 1 1 9 ARG HE H 2.526 -8.025 1.185 1.00 . A A . 9 ARG HE 1 1 7 3501 1 1 9 ARG HG2 H 4.649 -6.559 -1.181 1.00 . A A . 9 ARG HG2 1 1 7 3502 1 1 9 ARG HG3 H 5.682 -5.979 0.139 1.00 . A A . 9 ARG HG3 1 1 7 3503 1 1 9 ARG HH11 H 4.449 -9.228 -1.473 1.00 . A A . 9 ARG HH11 1 1 7 3504 1 1 9 ARG HH12 H 3.200 -10.290 -2.052 1.00 . A A . 9 ARG HH12 1 1 7 3505 1 1 9 ARG HH21 H 1.004 -9.595 0.578 1.00 . A A . 9 ARG HH21 1 1 7 3506 1 1 9 ARG HH22 H 1.298 -10.493 -0.884 1.00 . A A . 9 ARG HH22 1 1 7 3507 1 1 9 ARG N N 2.039 -4.771 1.791 1.00 . A A . 9 ARG N 1 1 7 3508 1 1 9 ARG NE N 3.218 -8.342 0.510 1.00 . A A . 9 ARG NE 1 1 7 3509 1 1 9 ARG NH1 N 3.546 -9.648 -1.362 1.00 . A A . 9 ARG NH1 1 1 7 3510 1 1 9 ARG NH2 N 1.608 -9.793 -0.241 1.00 . A A . 9 ARG NH2 1 1 7 3511 1 1 9 ARG O O 3.830 -2.827 2.380 1.00 . A A . 9 ARG O 1 1 7 3512 1 1 10 MET C C 8.002 -3.468 2.104 1.00 . A A . 10 MET C 1 1 7 3513 1 1 10 MET CA C 6.615 -3.128 2.663 1.00 . A A . 10 MET CA 1 1 7 3514 1 1 10 MET CB C 6.664 -3.058 4.198 1.00 . A A . 10 MET CB 1 1 7 3515 1 1 10 MET CE C 9.101 -3.095 6.578 1.00 . A A . 10 MET CE 1 1 7 3516 1 1 10 MET CG C 7.473 -1.859 4.704 1.00 . A A . 10 MET CG 1 1 7 3517 1 1 10 MET H H 6.030 -5.056 2.049 1.00 . A A . 10 MET H 1 1 7 3518 1 1 10 MET HA H 6.303 -2.164 2.268 1.00 . A A . 10 MET HA 1 1 7 3519 1 1 10 MET HB2 H 5.651 -2.970 4.593 1.00 . A A . 10 MET HB2 1 1 7 3520 1 1 10 MET HB3 H 7.099 -3.981 4.583 1.00 . A A . 10 MET HB3 1 1 7 3521 1 1 10 MET HE1 H 8.727 -4.064 6.250 1.00 . A A . 10 MET HE1 1 1 7 3522 1 1 10 MET HE2 H 9.931 -2.793 5.939 1.00 . A A . 10 MET HE2 1 1 7 3523 1 1 10 MET HE3 H 9.451 -3.175 7.608 1.00 . A A . 10 MET HE3 1 1 7 3524 1 1 10 MET HG2 H 8.436 -1.825 4.199 1.00 . A A . 10 MET HG2 1 1 7 3525 1 1 10 MET HG3 H 6.928 -0.950 4.454 1.00 . A A . 10 MET HG3 1 1 7 3526 1 1 10 MET N N 5.644 -4.148 2.259 1.00 . A A . 10 MET N 1 1 7 3527 1 1 10 MET O O 8.437 -4.616 2.187 1.00 . A A . 10 MET O 1 1 7 3528 1 1 10 MET SD S 7.778 -1.857 6.489 1.00 . A A . 10 MET SD 1 1 7 3529 1 1 11 PHE C C 11.069 -2.737 2.168 1.00 . A A . 11 PHE C 1 1 7 3530 1 1 11 PHE CA C 10.054 -2.641 1.018 1.00 . A A . 11 PHE CA 1 1 7 3531 1 1 11 PHE CB C 10.394 -1.487 0.070 1.00 . A A . 11 PHE CB 1 1 7 3532 1 1 11 PHE CD1 C 10.111 -2.605 -2.181 1.00 . A A . 11 PHE CD1 1 1 7 3533 1 1 11 PHE CD2 C 8.709 -0.681 -1.661 1.00 . A A . 11 PHE CD2 1 1 7 3534 1 1 11 PHE CE1 C 9.510 -2.708 -3.447 1.00 . A A . 11 PHE CE1 1 1 7 3535 1 1 11 PHE CE2 C 8.112 -0.788 -2.930 1.00 . A A . 11 PHE CE2 1 1 7 3536 1 1 11 PHE CG C 9.713 -1.595 -1.281 1.00 . A A . 11 PHE CG 1 1 7 3537 1 1 11 PHE CZ C 8.508 -1.798 -3.822 1.00 . A A . 11 PHE CZ 1 1 7 3538 1 1 11 PHE H H 8.249 -1.566 1.417 1.00 . A A . 11 PHE H 1 1 7 3539 1 1 11 PHE HA H 10.110 -3.554 0.432 1.00 . A A . 11 PHE HA 1 1 7 3540 1 1 11 PHE HB2 H 10.133 -0.549 0.550 1.00 . A A . 11 PHE HB2 1 1 7 3541 1 1 11 PHE HB3 H 11.470 -1.474 -0.107 1.00 . A A . 11 PHE HB3 1 1 7 3542 1 1 11 PHE HD1 H 10.889 -3.303 -1.910 1.00 . A A . 11 PHE HD1 1 1 7 3543 1 1 11 PHE HD2 H 8.380 0.093 -0.982 1.00 . A A . 11 PHE HD2 1 1 7 3544 1 1 11 PHE HE1 H 9.813 -3.488 -4.131 1.00 . A A . 11 PHE HE1 1 1 7 3545 1 1 11 PHE HE2 H 7.327 -0.111 -3.227 1.00 . A A . 11 PHE HE2 1 1 7 3546 1 1 11 PHE HZ H 8.033 -1.874 -4.790 1.00 . A A . 11 PHE HZ 1 1 7 3547 1 1 11 PHE N N 8.687 -2.478 1.519 1.00 . A A . 11 PHE N 1 1 7 3548 1 1 11 PHE O O 10.819 -2.252 3.270 1.00 . A A . 11 PHE O 1 1 7 3549 1 1 12 ALA C C 13.862 -2.142 3.485 1.00 . A A . 12 ALA C 1 1 7 3550 1 1 12 ALA CA C 13.327 -3.462 2.887 1.00 . A A . 12 ALA CA 1 1 7 3551 1 1 12 ALA CB C 14.460 -4.267 2.240 1.00 . A A . 12 ALA CB 1 1 7 3552 1 1 12 ALA H H 12.430 -3.681 0.980 1.00 . A A . 12 ALA H 1 1 7 3553 1 1 12 ALA HA H 12.928 -4.047 3.717 1.00 . A A . 12 ALA HA 1 1 7 3554 1 1 12 ALA HB1 H 14.081 -5.225 1.885 1.00 . A A . 12 ALA HB1 1 1 7 3555 1 1 12 ALA HB2 H 14.887 -3.712 1.404 1.00 . A A . 12 ALA HB2 1 1 7 3556 1 1 12 ALA HB3 H 15.242 -4.453 2.978 1.00 . A A . 12 ALA HB3 1 1 7 3557 1 1 12 ALA N N 12.259 -3.290 1.893 1.00 . A A . 12 ALA N 1 1 7 3558 1 1 12 ALA O O 14.467 -2.155 4.552 1.00 . A A . 12 ALA O 1 1 7 3559 1 1 13 ASN C C 12.734 0.897 4.238 1.00 . A A . 13 ASN C 1 1 7 3560 1 1 13 ASN CA C 13.871 0.342 3.345 1.00 . A A . 13 ASN CA 1 1 7 3561 1 1 13 ASN CB C 14.176 1.269 2.149 1.00 . A A . 13 ASN CB 1 1 7 3562 1 1 13 ASN CG C 13.037 1.358 1.139 1.00 . A A . 13 ASN CG 1 1 7 3563 1 1 13 ASN H H 13.094 -1.069 1.962 1.00 . A A . 13 ASN H 1 1 7 3564 1 1 13 ASN HA H 14.762 0.302 3.974 1.00 . A A . 13 ASN HA 1 1 7 3565 1 1 13 ASN HB2 H 14.392 2.275 2.511 1.00 . A A . 13 ASN HB2 1 1 7 3566 1 1 13 ASN HB3 H 15.069 0.900 1.645 1.00 . A A . 13 ASN HB3 1 1 7 3567 1 1 13 ASN HD21 H 14.311 1.760 -0.412 1.00 . A A . 13 ASN HD21 1 1 7 3568 1 1 13 ASN N N 13.607 -1.005 2.827 1.00 . A A . 13 ASN N 1 1 7 3569 1 1 13 ASN ND2 N 13.364 1.566 -0.134 1.00 . A A . 13 ASN ND2 1 1 7 3570 1 1 13 ASN O O 12.840 2.025 4.713 1.00 . A A . 13 ASN O 1 1 7 3571 1 1 13 ASN OD1 O 11.868 1.206 1.500 1.00 . A A . 13 ASN OD1 1 1 7 3572 1 1 14 GLY C C 9.302 1.085 4.442 1.00 . A A . 14 GLY C 1 1 7 3573 1 1 14 GLY CA C 10.485 0.529 5.246 1.00 . A A . 14 GLY CA 1 1 7 3574 1 1 14 GLY H H 11.602 -0.793 4.036 1.00 . A A . 14 GLY H 1 1 7 3575 1 1 14 GLY HA2 H 10.136 -0.345 5.793 1.00 . A A . 14 GLY HA2 1 1 7 3576 1 1 14 GLY HA3 H 10.781 1.283 5.977 1.00 . A A . 14 GLY HA3 1 1 7 3577 1 1 14 GLY N N 11.648 0.135 4.448 1.00 . A A . 14 GLY N 1 1 7 3578 1 1 14 GLY O O 8.385 1.638 5.045 1.00 . A A . 14 GLY O 1 1 7 3579 1 1 15 THR C C 7.084 0.785 2.012 1.00 . A A . 15 THR C 1 1 7 3580 1 1 15 THR CA C 8.280 1.682 2.295 1.00 . A A . 15 THR CA 1 1 7 3581 1 1 15 THR CB C 8.902 2.208 0.994 1.00 . A A . 15 THR CB 1 1 7 3582 1 1 15 THR CG2 C 7.972 3.086 0.160 1.00 . A A . 15 THR CG2 1 1 7 3583 1 1 15 THR H H 9.995 0.434 2.616 1.00 . A A . 15 THR H 1 1 7 3584 1 1 15 THR HA H 7.924 2.558 2.824 1.00 . A A . 15 THR HA 1 1 7 3585 1 1 15 THR HB H 9.236 1.377 0.385 1.00 . A A . 15 THR HB 1 1 7 3586 1 1 15 THR HG1 H 10.755 2.338 1.496 1.00 . A A . 15 THR HG1 1 1 7 3587 1 1 15 THR HG21 H 8.469 3.351 -0.776 1.00 . A A . 15 THR HG21 1 1 7 3588 1 1 15 THR HG22 H 7.053 2.549 -0.073 1.00 . A A . 15 THR HG22 1 1 7 3589 1 1 15 THR HG23 H 7.725 3.995 0.709 1.00 . A A . 15 THR HG23 1 1 7 3590 1 1 15 THR N N 9.283 0.967 3.103 1.00 . A A . 15 THR N 1 1 7 3591 1 1 15 THR O O 7.171 -0.100 1.168 1.00 . A A . 15 THR O 1 1 7 3592 1 1 15 THR OG1 O 10.028 2.980 1.312 1.00 . A A . 15 THR OG1 1 1 7 3593 1 1 16 VAL C C 4.178 0.469 1.097 1.00 . A A . 16 VAL C 1 1 7 3594 1 1 16 VAL CA C 4.675 0.357 2.547 1.00 . A A . 16 VAL CA 1 1 7 3595 1 1 16 VAL CB C 3.639 0.872 3.571 1.00 . A A . 16 VAL CB 1 1 7 3596 1 1 16 VAL CG1 C 2.179 0.545 3.214 1.00 . A A . 16 VAL CG1 1 1 7 3597 1 1 16 VAL CG2 C 3.922 0.216 4.931 1.00 . A A . 16 VAL CG2 1 1 7 3598 1 1 16 VAL H H 6.068 1.630 3.528 1.00 . A A . 16 VAL H 1 1 7 3599 1 1 16 VAL HA H 4.788 -0.703 2.741 1.00 . A A . 16 VAL HA 1 1 7 3600 1 1 16 VAL HB H 3.735 1.955 3.667 1.00 . A A . 16 VAL HB 1 1 7 3601 1 1 16 VAL HG11 H 2.058 -0.529 3.061 1.00 . A A . 16 VAL HG11 1 1 7 3602 1 1 16 VAL HG12 H 1.521 0.864 4.022 1.00 . A A . 16 VAL HG12 1 1 7 3603 1 1 16 VAL HG13 H 1.882 1.077 2.310 1.00 . A A . 16 VAL HG13 1 1 7 3604 1 1 16 VAL HG21 H 3.794 -0.866 4.849 1.00 . A A . 16 VAL HG21 1 1 7 3605 1 1 16 VAL HG22 H 4.940 0.436 5.255 1.00 . A A . 16 VAL HG22 1 1 7 3606 1 1 16 VAL HG23 H 3.229 0.600 5.679 1.00 . A A . 16 VAL HG23 1 1 7 3607 1 1 16 VAL N N 6.003 0.953 2.780 1.00 . A A . 16 VAL N 1 1 7 3608 1 1 16 VAL O O 4.262 1.539 0.495 1.00 . A A . 16 VAL O 1 1 7 3609 1 1 17 TYR C C 1.804 -1.733 -0.707 1.00 . A A . 17 TYR C 1 1 7 3610 1 1 17 TYR CA C 2.872 -0.627 -0.712 1.00 . A A . 17 TYR CA 1 1 7 3611 1 1 17 TYR CB C 3.852 -0.822 -1.887 1.00 . A A . 17 TYR CB 1 1 7 3612 1 1 17 TYR CD1 C 5.810 -2.171 -1.095 1.00 . A A . 17 TYR CD1 1 1 7 3613 1 1 17 TYR CD2 C 4.321 -3.215 -2.704 1.00 . A A . 17 TYR CD2 1 1 7 3614 1 1 17 TYR CE1 C 6.666 -3.278 -1.150 1.00 . A A . 17 TYR CE1 1 1 7 3615 1 1 17 TYR CE2 C 5.178 -4.337 -2.763 1.00 . A A . 17 TYR CE2 1 1 7 3616 1 1 17 TYR CG C 4.658 -2.112 -1.890 1.00 . A A . 17 TYR CG 1 1 7 3617 1 1 17 TYR CZ C 6.376 -4.350 -2.015 1.00 . A A . 17 TYR CZ 1 1 7 3618 1 1 17 TYR H H 3.592 -1.486 1.090 1.00 . A A . 17 TYR H 1 1 7 3619 1 1 17 TYR HA H 2.365 0.329 -0.844 1.00 . A A . 17 TYR HA 1 1 7 3620 1 1 17 TYR HB2 H 3.315 -0.744 -2.828 1.00 . A A . 17 TYR HB2 1 1 7 3621 1 1 17 TYR HB3 H 4.556 0.010 -1.880 1.00 . A A . 17 TYR HB3 1 1 7 3622 1 1 17 TYR HD1 H 6.049 -1.328 -0.473 1.00 . A A . 17 TYR HD1 1 1 7 3623 1 1 17 TYR HD2 H 3.413 -3.208 -3.285 1.00 . A A . 17 TYR HD2 1 1 7 3624 1 1 17 TYR HE1 H 7.567 -3.283 -0.564 1.00 . A A . 17 TYR HE1 1 1 7 3625 1 1 17 TYR HE2 H 4.920 -5.203 -3.353 1.00 . A A . 17 TYR HE2 1 1 7 3626 1 1 17 TYR HH H 7.067 -5.952 -2.859 1.00 . A A . 17 TYR HH 1 1 7 3627 1 1 17 TYR N N 3.604 -0.614 0.561 1.00 . A A . 17 TYR N 1 1 7 3628 1 1 17 TYR O O 1.717 -2.518 0.234 1.00 . A A . 17 TYR O 1 1 7 3629 1 1 17 TYR OH O 7.228 -5.408 -2.088 1.00 . A A . 17 TYR OH 1 1 7 3630 1 1 18 TYR C C 0.584 -3.751 -3.297 1.00 . A A . 18 TYR C 1 1 7 3631 1 1 18 TYR CA C 0.135 -2.966 -2.067 1.00 . A A . 18 TYR CA 1 1 7 3632 1 1 18 TYR CB C -1.313 -2.469 -2.179 1.00 . A A . 18 TYR CB 1 1 7 3633 1 1 18 TYR CD1 C -1.327 -1.038 -0.123 1.00 . A A . 18 TYR CD1 1 1 7 3634 1 1 18 TYR CD2 C -2.774 -2.991 -0.164 1.00 . A A . 18 TYR CD2 1 1 7 3635 1 1 18 TYR CE1 C -1.585 -0.863 1.235 1.00 . A A . 18 TYR CE1 1 1 7 3636 1 1 18 TYR CE2 C -3.141 -2.752 1.172 1.00 . A A . 18 TYR CE2 1 1 7 3637 1 1 18 TYR CG C -1.862 -2.135 -0.811 1.00 . A A . 18 TYR CG 1 1 7 3638 1 1 18 TYR CZ C -2.504 -1.711 1.894 1.00 . A A . 18 TYR CZ 1 1 7 3639 1 1 18 TYR H H 0.986 -1.060 -2.420 1.00 . A A . 18 TYR H 1 1 7 3640 1 1 18 TYR HA H 0.166 -3.656 -1.224 1.00 . A A . 18 TYR HA 1 1 7 3641 1 1 18 TYR HB2 H -1.362 -1.592 -2.827 1.00 . A A . 18 TYR HB2 1 1 7 3642 1 1 18 TYR HB3 H -1.926 -3.254 -2.620 1.00 . A A . 18 TYR HB3 1 1 7 3643 1 1 18 TYR HD1 H -0.667 -0.343 -0.619 1.00 . A A . 18 TYR HD1 1 1 7 3644 1 1 18 TYR HD2 H -3.188 -3.847 -0.675 1.00 . A A . 18 TYR HD2 1 1 7 3645 1 1 18 TYR HE1 H -1.054 -0.064 1.718 1.00 . A A . 18 TYR HE1 1 1 7 3646 1 1 18 TYR HE2 H -3.884 -3.394 1.623 1.00 . A A . 18 TYR HE2 1 1 7 3647 1 1 18 TYR HH H -3.422 -2.147 3.539 1.00 . A A . 18 TYR HH 1 1 7 3648 1 1 18 TYR N N 1.049 -1.858 -1.798 1.00 . A A . 18 TYR N 1 1 7 3649 1 1 18 TYR O O 1.025 -3.195 -4.303 1.00 . A A . 18 TYR O 1 1 7 3650 1 1 18 TYR OH O -2.796 -1.504 3.205 1.00 . A A . 18 TYR OH 1 1 7 3651 1 1 19 PHE C C -0.143 -6.956 -4.595 1.00 . A A . 19 PHE C 1 1 7 3652 1 1 19 PHE CA C 0.993 -6.071 -4.093 1.00 . A A . 19 PHE CA 1 1 7 3653 1 1 19 PHE CB C 2.044 -6.884 -3.334 1.00 . A A . 19 PHE CB 1 1 7 3654 1 1 19 PHE CD1 C 3.845 -7.737 -4.878 1.00 . A A . 19 PHE CD1 1 1 7 3655 1 1 19 PHE CD2 C 2.127 -9.298 -4.130 1.00 . A A . 19 PHE CD2 1 1 7 3656 1 1 19 PHE CE1 C 4.491 -8.775 -5.562 1.00 . A A . 19 PHE CE1 1 1 7 3657 1 1 19 PHE CE2 C 2.779 -10.340 -4.813 1.00 . A A . 19 PHE CE2 1 1 7 3658 1 1 19 PHE CG C 2.679 -7.998 -4.138 1.00 . A A . 19 PHE CG 1 1 7 3659 1 1 19 PHE CZ C 3.969 -10.081 -5.516 1.00 . A A . 19 PHE CZ 1 1 7 3660 1 1 19 PHE H H 0.097 -5.445 -2.311 1.00 . A A . 19 PHE H 1 1 7 3661 1 1 19 PHE HA H 1.475 -5.589 -4.944 1.00 . A A . 19 PHE HA 1 1 7 3662 1 1 19 PHE HB2 H 2.828 -6.207 -2.996 1.00 . A A . 19 PHE HB2 1 1 7 3663 1 1 19 PHE HB3 H 1.594 -7.313 -2.438 1.00 . A A . 19 PHE HB3 1 1 7 3664 1 1 19 PHE HD1 H 4.249 -6.737 -4.930 1.00 . A A . 19 PHE HD1 1 1 7 3665 1 1 19 PHE HD2 H 1.207 -9.502 -3.599 1.00 . A A . 19 PHE HD2 1 1 7 3666 1 1 19 PHE HE1 H 5.383 -8.550 -6.132 1.00 . A A . 19 PHE HE1 1 1 7 3667 1 1 19 PHE HE2 H 2.367 -11.340 -4.809 1.00 . A A . 19 PHE HE2 1 1 7 3668 1 1 19 PHE HZ H 4.460 -10.880 -6.053 1.00 . A A . 19 PHE HZ 1 1 7 3669 1 1 19 PHE N N 0.465 -5.071 -3.183 1.00 . A A . 19 PHE N 1 1 7 3670 1 1 19 PHE O O -0.774 -7.670 -3.818 1.00 . A A . 19 PHE O 1 1 7 3671 1 1 20 ASN C C -0.873 -9.205 -6.604 1.00 . A A . 20 ASN C 1 1 7 3672 1 1 20 ASN CA C -1.380 -7.757 -6.554 1.00 . A A . 20 ASN CA 1 1 7 3673 1 1 20 ASN CB C -1.663 -7.214 -7.951 1.00 . A A . 20 ASN CB 1 1 7 3674 1 1 20 ASN CG C -2.802 -7.998 -8.562 1.00 . A A . 20 ASN CG 1 1 7 3675 1 1 20 ASN H H 0.130 -6.286 -6.492 1.00 . A A . 20 ASN H 1 1 7 3676 1 1 20 ASN HA H -2.309 -7.733 -5.993 1.00 . A A . 20 ASN HA 1 1 7 3677 1 1 20 ASN HB2 H -1.913 -6.162 -7.910 1.00 . A A . 20 ASN HB2 1 1 7 3678 1 1 20 ASN HB3 H -0.773 -7.311 -8.568 1.00 . A A . 20 ASN HB3 1 1 7 3679 1 1 20 ASN HD21 H -4.241 -6.799 -7.743 1.00 . A A . 20 ASN HD21 1 1 7 3680 1 1 20 ASN HD22 H -4.785 -8.168 -8.687 1.00 . A A . 20 ASN HD22 1 1 7 3681 1 1 20 ASN N N -0.422 -6.895 -5.894 1.00 . A A . 20 ASN N 1 1 7 3682 1 1 20 ASN ND2 N -4.036 -7.615 -8.305 1.00 . A A . 20 ASN ND2 1 1 7 3683 1 1 20 ASN O O -0.063 -9.555 -7.463 1.00 . A A . 20 ASN O 1 1 7 3684 1 1 20 ASN OD1 O -2.572 -8.996 -9.230 1.00 . A A . 20 ASN OD1 1 1 7 3685 1 1 21 HIS C C -1.372 -12.337 -6.826 1.00 . A A . 21 HIS C 1 1 7 3686 1 1 21 HIS CA C -0.907 -11.460 -5.647 1.00 . A A . 21 HIS CA 1 1 7 3687 1 1 21 HIS CB C -1.262 -12.055 -4.277 1.00 . A A . 21 HIS CB 1 1 7 3688 1 1 21 HIS CD2 C -3.529 -13.193 -4.660 1.00 . A A . 21 HIS CD2 1 1 7 3689 1 1 21 HIS CE1 C -4.724 -12.112 -3.153 1.00 . A A . 21 HIS CE1 1 1 7 3690 1 1 21 HIS CG C -2.734 -12.278 -4.029 1.00 . A A . 21 HIS CG 1 1 7 3691 1 1 21 HIS H H -2.097 -9.768 -5.070 1.00 . A A . 21 HIS H 1 1 7 3692 1 1 21 HIS HA H 0.181 -11.448 -5.715 1.00 . A A . 21 HIS HA 1 1 7 3693 1 1 21 HIS HB2 H -0.736 -13.003 -4.162 1.00 . A A . 21 HIS HB2 1 1 7 3694 1 1 21 HIS HB3 H -0.883 -11.388 -3.501 1.00 . A A . 21 HIS HB3 1 1 7 3695 1 1 21 HIS HD2 H -3.221 -13.886 -5.431 1.00 . A A . 21 HIS HD2 1 1 7 3696 1 1 21 HIS HE1 H -5.550 -11.800 -2.530 1.00 . A A . 21 HIS HE1 1 1 7 3697 1 1 21 HIS HE2 H -5.600 -13.610 -4.339 1.00 . A A . 21 HIS HE2 1 1 7 3698 1 1 21 HIS N N -1.364 -10.069 -5.714 1.00 . A A . 21 HIS N 1 1 7 3699 1 1 21 HIS ND1 N -3.488 -11.604 -3.071 1.00 . A A . 21 HIS ND1 1 1 7 3700 1 1 21 HIS NE2 N -4.782 -13.066 -4.102 1.00 . A A . 21 HIS NE2 1 1 7 3701 1 1 21 HIS O O -1.039 -13.518 -6.858 1.00 . A A . 21 HIS O 1 1 7 3702 1 1 22 ILE C C -1.577 -12.235 -10.171 1.00 . A A . 22 ILE C 1 1 7 3703 1 1 22 ILE CA C -2.564 -12.487 -9.007 1.00 . A A . 22 ILE CA 1 1 7 3704 1 1 22 ILE CB C -4.026 -12.079 -9.353 1.00 . A A . 22 ILE CB 1 1 7 3705 1 1 22 ILE CD1 C -6.408 -11.764 -8.342 1.00 . A A . 22 ILE CD1 1 1 7 3706 1 1 22 ILE CG1 C -4.958 -12.218 -8.119 1.00 . A A . 22 ILE CG1 1 1 7 3707 1 1 22 ILE CG2 C -4.573 -12.916 -10.526 1.00 . A A . 22 ILE CG2 1 1 7 3708 1 1 22 ILE H H -2.365 -10.801 -7.735 1.00 . A A . 22 ILE H 1 1 7 3709 1 1 22 ILE HA H -2.557 -13.560 -8.814 1.00 . A A . 22 ILE HA 1 1 7 3710 1 1 22 ILE HB H -4.032 -11.035 -9.662 1.00 . A A . 22 ILE HB 1 1 7 3711 1 1 22 ILE HD11 H -6.421 -10.755 -8.758 1.00 . A A . 22 ILE HD11 1 1 7 3712 1 1 22 ILE HD12 H -6.927 -12.447 -9.012 1.00 . A A . 22 ILE HD12 1 1 7 3713 1 1 22 ILE HD13 H -6.933 -11.759 -7.386 1.00 . A A . 22 ILE HD13 1 1 7 3714 1 1 22 ILE HG12 H -4.964 -13.257 -7.786 1.00 . A A . 22 ILE HG12 1 1 7 3715 1 1 22 ILE HG13 H -4.576 -11.608 -7.300 1.00 . A A . 22 ILE HG13 1 1 7 3716 1 1 22 ILE HG21 H -4.575 -13.975 -10.266 1.00 . A A . 22 ILE HG21 1 1 7 3717 1 1 22 ILE HG22 H -5.584 -12.606 -10.785 1.00 . A A . 22 ILE HG22 1 1 7 3718 1 1 22 ILE HG23 H -3.966 -12.769 -11.419 1.00 . A A . 22 ILE HG23 1 1 7 3719 1 1 22 ILE N N -2.122 -11.783 -7.793 1.00 . A A . 22 ILE N 1 1 7 3720 1 1 22 ILE O O -1.519 -13.019 -11.115 1.00 . A A . 22 ILE O 1 1 7 3721 1 1 23 THR C C 1.531 -10.329 -10.767 1.00 . A A . 23 THR C 1 1 7 3722 1 1 23 THR CA C 0.106 -10.697 -11.190 1.00 . A A . 23 THR CA 1 1 7 3723 1 1 23 THR CB C -0.490 -9.449 -11.860 1.00 . A A . 23 THR CB 1 1 7 3724 1 1 23 THR CG2 C -1.849 -9.694 -12.518 1.00 . A A . 23 THR CG2 1 1 7 3725 1 1 23 THR H H -0.884 -10.561 -9.291 1.00 . A A . 23 THR H 1 1 7 3726 1 1 23 THR HA H 0.193 -11.476 -11.948 1.00 . A A . 23 THR HA 1 1 7 3727 1 1 23 THR HB H 0.201 -9.101 -12.629 1.00 . A A . 23 THR HB 1 1 7 3728 1 1 23 THR HG1 H -1.411 -8.681 -10.344 1.00 . A A . 23 THR HG1 1 1 7 3729 1 1 23 THR HG21 H -1.756 -10.489 -13.259 1.00 . A A . 23 THR HG21 1 1 7 3730 1 1 23 THR HG22 H -2.593 -9.983 -11.777 1.00 . A A . 23 THR HG22 1 1 7 3731 1 1 23 THR HG23 H -2.177 -8.782 -13.018 1.00 . A A . 23 THR HG23 1 1 7 3732 1 1 23 THR N N -0.766 -11.167 -10.094 1.00 . A A . 23 THR N 1 1 7 3733 1 1 23 THR O O 2.417 -10.316 -11.621 1.00 . A A . 23 THR O 1 1 7 3734 1 1 23 THR OG1 O -0.635 -8.432 -10.894 1.00 . A A . 23 THR OG1 1 1 7 3735 1 1 24 ASN C C 3.063 -7.951 -8.994 1.00 . A A . 24 ASN C 1 1 7 3736 1 1 24 ASN CA C 2.961 -9.485 -8.851 1.00 . A A . 24 ASN CA 1 1 7 3737 1 1 24 ASN CB C 4.267 -10.193 -9.278 1.00 . A A . 24 ASN CB 1 1 7 3738 1 1 24 ASN CG C 4.217 -11.711 -9.196 1.00 . A A . 24 ASN CG 1 1 7 3739 1 1 24 ASN H H 0.978 -10.110 -8.827 1.00 . A A . 24 ASN H 1 1 7 3740 1 1 24 ASN HA H 2.838 -9.662 -7.784 1.00 . A A . 24 ASN HA 1 1 7 3741 1 1 24 ASN HB2 H 4.531 -9.895 -10.292 1.00 . A A . 24 ASN HB2 1 1 7 3742 1 1 24 ASN HB3 H 5.074 -9.855 -8.628 1.00 . A A . 24 ASN HB3 1 1 7 3743 1 1 24 ASN HD21 H 3.530 -11.822 -11.081 1.00 . A A . 24 ASN HD21 1 1 7 3744 1 1 24 ASN HD22 H 3.821 -13.364 -10.243 1.00 . A A . 24 ASN HD22 1 1 7 3745 1 1 24 ASN N N 1.759 -10.053 -9.475 1.00 . A A . 24 ASN N 1 1 7 3746 1 1 24 ASN ND2 N 3.853 -12.362 -10.281 1.00 . A A . 24 ASN ND2 1 1 7 3747 1 1 24 ASN O O 4.065 -7.378 -8.566 1.00 . A A . 24 ASN O 1 1 7 3748 1 1 24 ASN OD1 O 4.517 -12.312 -8.177 1.00 . A A . 24 ASN OD1 1 1 7 3749 1 1 25 ALA C C 2.122 -5.108 -8.346 1.00 . A A . 25 ALA C 1 1 7 3750 1 1 25 ALA CA C 2.106 -5.807 -9.719 1.00 . A A . 25 ALA CA 1 1 7 3751 1 1 25 ALA CB C 0.912 -5.355 -10.568 1.00 . A A . 25 ALA CB 1 1 7 3752 1 1 25 ALA H H 1.223 -7.737 -9.902 1.00 . A A . 25 ALA H 1 1 7 3753 1 1 25 ALA HA H 3.022 -5.544 -10.251 1.00 . A A . 25 ALA HA 1 1 7 3754 1 1 25 ALA HB1 H 0.971 -4.281 -10.742 1.00 . A A . 25 ALA HB1 1 1 7 3755 1 1 25 ALA HB2 H 0.926 -5.869 -11.530 1.00 . A A . 25 ALA HB2 1 1 7 3756 1 1 25 ALA HB3 H -0.022 -5.582 -10.055 1.00 . A A . 25 ALA HB3 1 1 7 3757 1 1 25 ALA N N 2.063 -7.266 -9.578 1.00 . A A . 25 ALA N 1 1 7 3758 1 1 25 ALA O O 1.365 -5.483 -7.454 1.00 . A A . 25 ALA O 1 1 7 3759 1 1 26 SER C C 2.952 -1.892 -6.993 1.00 . A A . 26 SER C 1 1 7 3760 1 1 26 SER CA C 3.172 -3.401 -6.879 1.00 . A A . 26 SER CA 1 1 7 3761 1 1 26 SER CB C 4.593 -3.679 -6.376 1.00 . A A . 26 SER CB 1 1 7 3762 1 1 26 SER H H 3.590 -3.812 -8.909 1.00 . A A . 26 SER H 1 1 7 3763 1 1 26 SER HA H 2.481 -3.799 -6.139 1.00 . A A . 26 SER HA 1 1 7 3764 1 1 26 SER HB2 H 4.729 -3.219 -5.401 1.00 . A A . 26 SER HB2 1 1 7 3765 1 1 26 SER HB3 H 4.744 -4.752 -6.266 1.00 . A A . 26 SER HB3 1 1 7 3766 1 1 26 SER HG H 5.183 -2.281 -7.584 1.00 . A A . 26 SER HG 1 1 7 3767 1 1 26 SER N N 2.959 -4.079 -8.167 1.00 . A A . 26 SER N 1 1 7 3768 1 1 26 SER O O 3.643 -1.248 -7.785 1.00 . A A . 26 SER O 1 1 7 3769 1 1 26 SER OG O 5.535 -3.138 -7.282 1.00 . A A . 26 SER OG 1 1 7 3770 1 1 27 GLN C C 1.604 0.688 -4.806 1.00 . A A . 27 GLN C 1 1 7 3771 1 1 27 GLN CA C 1.697 0.097 -6.214 1.00 . A A . 27 GLN CA 1 1 7 3772 1 1 27 GLN CB C 0.350 0.316 -6.925 1.00 . A A . 27 GLN CB 1 1 7 3773 1 1 27 GLN CD C -0.914 0.462 -9.098 1.00 . A A . 27 GLN CD 1 1 7 3774 1 1 27 GLN CG C 0.386 0.021 -8.430 1.00 . A A . 27 GLN CG 1 1 7 3775 1 1 27 GLN H H 1.551 -1.903 -5.504 1.00 . A A . 27 GLN H 1 1 7 3776 1 1 27 GLN HA H 2.467 0.647 -6.758 1.00 . A A . 27 GLN HA 1 1 7 3777 1 1 27 GLN HB2 H -0.414 -0.304 -6.451 1.00 . A A . 27 GLN HB2 1 1 7 3778 1 1 27 GLN HB3 H 0.061 1.361 -6.800 1.00 . A A . 27 GLN HB3 1 1 7 3779 1 1 27 GLN HE21 H -2.037 -1.091 -8.342 1.00 . A A . 27 GLN HE21 1 1 7 3780 1 1 27 GLN HE22 H -2.829 0.119 -9.351 1.00 . A A . 27 GLN HE22 1 1 7 3781 1 1 27 GLN HG2 H 1.213 0.566 -8.884 1.00 . A A . 27 GLN HG2 1 1 7 3782 1 1 27 GLN HG3 H 0.541 -1.044 -8.596 1.00 . A A . 27 GLN HG3 1 1 7 3783 1 1 27 GLN N N 2.038 -1.330 -6.194 1.00 . A A . 27 GLN N 1 1 7 3784 1 1 27 GLN NE2 N -2.009 -0.247 -8.897 1.00 . A A . 27 GLN NE2 1 1 7 3785 1 1 27 GLN O O 1.143 0.041 -3.866 1.00 . A A . 27 GLN O 1 1 7 3786 1 1 27 GLN OE1 O -0.969 1.464 -9.791 1.00 . A A . 27 GLN OE1 1 1 7 3787 1 1 28 PHE C C 0.370 3.205 -3.153 1.00 . A A . 28 PHE C 1 1 7 3788 1 1 28 PHE CA C 1.815 2.766 -3.460 1.00 . A A . 28 PHE CA 1 1 7 3789 1 1 28 PHE CB C 2.786 3.953 -3.534 1.00 . A A . 28 PHE CB 1 1 7 3790 1 1 28 PHE CD1 C 4.886 2.789 -2.768 1.00 . A A . 28 PHE CD1 1 1 7 3791 1 1 28 PHE CD2 C 4.861 3.786 -4.991 1.00 . A A . 28 PHE CD2 1 1 7 3792 1 1 28 PHE CE1 C 6.195 2.334 -2.987 1.00 . A A . 28 PHE CE1 1 1 7 3793 1 1 28 PHE CE2 C 6.169 3.321 -5.212 1.00 . A A . 28 PHE CE2 1 1 7 3794 1 1 28 PHE CG C 4.218 3.520 -3.767 1.00 . A A . 28 PHE CG 1 1 7 3795 1 1 28 PHE CZ C 6.835 2.592 -4.211 1.00 . A A . 28 PHE CZ 1 1 7 3796 1 1 28 PHE H H 2.336 2.457 -5.486 1.00 . A A . 28 PHE H 1 1 7 3797 1 1 28 PHE HA H 2.123 2.140 -2.623 1.00 . A A . 28 PHE HA 1 1 7 3798 1 1 28 PHE HB2 H 2.469 4.632 -4.329 1.00 . A A . 28 PHE HB2 1 1 7 3799 1 1 28 PHE HB3 H 2.756 4.499 -2.590 1.00 . A A . 28 PHE HB3 1 1 7 3800 1 1 28 PHE HD1 H 4.391 2.557 -1.835 1.00 . A A . 28 PHE HD1 1 1 7 3801 1 1 28 PHE HD2 H 4.348 4.337 -5.766 1.00 . A A . 28 PHE HD2 1 1 7 3802 1 1 28 PHE HE1 H 6.692 1.773 -2.213 1.00 . A A . 28 PHE HE1 1 1 7 3803 1 1 28 PHE HE2 H 6.660 3.518 -6.153 1.00 . A A . 28 PHE HE2 1 1 7 3804 1 1 28 PHE HZ H 7.835 2.222 -4.383 1.00 . A A . 28 PHE HZ 1 1 7 3805 1 1 28 PHE N N 1.950 1.974 -4.688 1.00 . A A . 28 PHE N 1 1 7 3806 1 1 28 PHE O O 0.148 3.954 -2.204 1.00 . A A . 28 PHE O 1 1 7 3807 1 1 29 GLU C C -2.352 2.304 -2.292 1.00 . A A . 29 GLU C 1 1 7 3808 1 1 29 GLU CA C -2.040 2.885 -3.677 1.00 . A A . 29 GLU CA 1 1 7 3809 1 1 29 GLU CB C -2.847 2.206 -4.807 1.00 . A A . 29 GLU CB 1 1 7 3810 1 1 29 GLU CD C -5.230 2.861 -3.938 1.00 . A A . 29 GLU CD 1 1 7 3811 1 1 29 GLU CG C -4.296 1.774 -4.491 1.00 . A A . 29 GLU CG 1 1 7 3812 1 1 29 GLU H H -0.348 2.118 -4.687 1.00 . A A . 29 GLU H 1 1 7 3813 1 1 29 GLU HA H -2.298 3.945 -3.670 1.00 . A A . 29 GLU HA 1 1 7 3814 1 1 29 GLU HB2 H -2.865 2.881 -5.664 1.00 . A A . 29 GLU HB2 1 1 7 3815 1 1 29 GLU HB3 H -2.313 1.306 -5.118 1.00 . A A . 29 GLU HB3 1 1 7 3816 1 1 29 GLU HG2 H -4.730 1.383 -5.413 1.00 . A A . 29 GLU HG2 1 1 7 3817 1 1 29 GLU HG3 H -4.274 0.944 -3.782 1.00 . A A . 29 GLU HG3 1 1 7 3818 1 1 29 GLU N N -0.606 2.747 -3.947 1.00 . A A . 29 GLU N 1 1 7 3819 1 1 29 GLU O O -2.268 1.093 -2.089 1.00 . A A . 29 GLU O 1 1 7 3820 1 1 29 GLU OE1 O -4.776 3.970 -3.564 1.00 . A A . 29 GLU OE1 1 1 7 3821 1 1 29 GLU OE2 O -6.451 2.595 -3.840 1.00 . A A . 29 GLU OE2 1 1 7 3822 1 1 30 ARG C C -4.408 2.980 0.394 1.00 . A A . 30 ARG C 1 1 7 3823 1 1 30 ARG CA C -2.917 2.820 0.062 1.00 . A A . 30 ARG CA 1 1 7 3824 1 1 30 ARG CB C -2.015 3.642 0.992 1.00 . A A . 30 ARG CB 1 1 7 3825 1 1 30 ARG CD C -2.407 4.221 3.474 1.00 . A A . 30 ARG CD 1 1 7 3826 1 1 30 ARG CG C -2.090 3.128 2.447 1.00 . A A . 30 ARG CG 1 1 7 3827 1 1 30 ARG CZ C -4.111 6.024 3.022 1.00 . A A . 30 ARG CZ 1 1 7 3828 1 1 30 ARG H H -2.751 4.154 -1.589 1.00 . A A . 30 ARG H 1 1 7 3829 1 1 30 ARG HA H -2.614 1.783 0.186 1.00 . A A . 30 ARG HA 1 1 7 3830 1 1 30 ARG HB2 H -0.983 3.548 0.646 1.00 . A A . 30 ARG HB2 1 1 7 3831 1 1 30 ARG HB3 H -2.294 4.694 0.934 1.00 . A A . 30 ARG HB3 1 1 7 3832 1 1 30 ARG HD2 H -2.332 3.781 4.469 1.00 . A A . 30 ARG HD2 1 1 7 3833 1 1 30 ARG HD3 H -1.650 5.003 3.407 1.00 . A A . 30 ARG HD3 1 1 7 3834 1 1 30 ARG HE H -4.538 4.112 3.420 1.00 . A A . 30 ARG HE 1 1 7 3835 1 1 30 ARG HG2 H -2.837 2.340 2.544 1.00 . A A . 30 ARG HG2 1 1 7 3836 1 1 30 ARG HG3 H -1.126 2.688 2.703 1.00 . A A . 30 ARG HG3 1 1 7 3837 1 1 30 ARG HH11 H -2.271 6.614 2.538 1.00 . A A . 30 ARG HH11 1 1 7 3838 1 1 30 ARG HH12 H -3.488 7.856 2.431 1.00 . A A . 30 ARG HH12 1 1 7 3839 1 1 30 ARG HH21 H -6.068 5.819 3.518 1.00 . A A . 30 ARG HH21 1 1 7 3840 1 1 30 ARG HH22 H -5.600 7.373 2.889 1.00 . A A . 30 ARG HH22 1 1 7 3841 1 1 30 ARG N N -2.683 3.179 -1.335 1.00 . A A . 30 ARG N 1 1 7 3842 1 1 30 ARG NE N -3.772 4.772 3.315 1.00 . A A . 30 ARG NE 1 1 7 3843 1 1 30 ARG NH1 N -3.221 6.914 2.646 1.00 . A A . 30 ARG NH1 1 1 7 3844 1 1 30 ARG NH2 N -5.356 6.428 3.115 1.00 . A A . 30 ARG NH2 1 1 7 3845 1 1 30 ARG O O -4.907 4.107 0.415 1.00 . A A . 30 ARG O 1 1 7 3846 1 1 31 PRO C C -6.813 2.443 2.407 1.00 . A A . 31 PRO C 1 1 7 3847 1 1 31 PRO CA C -6.548 1.906 0.995 1.00 . A A . 31 PRO CA 1 1 7 3848 1 1 31 PRO CB C -7.002 0.452 0.843 1.00 . A A . 31 PRO CB 1 1 7 3849 1 1 31 PRO CD C -4.640 0.514 0.686 1.00 . A A . 31 PRO CD 1 1 7 3850 1 1 31 PRO CG C -5.765 -0.339 1.253 1.00 . A A . 31 PRO CG 1 1 7 3851 1 1 31 PRO HA H -7.094 2.519 0.283 1.00 . A A . 31 PRO HA 1 1 7 3852 1 1 31 PRO HB2 H -7.869 0.200 1.455 1.00 . A A . 31 PRO HB2 1 1 7 3853 1 1 31 PRO HB3 H -7.215 0.266 -0.209 1.00 . A A . 31 PRO HB3 1 1 7 3854 1 1 31 PRO HD2 H -3.781 0.451 1.347 1.00 . A A . 31 PRO HD2 1 1 7 3855 1 1 31 PRO HD3 H -4.384 0.183 -0.322 1.00 . A A . 31 PRO HD3 1 1 7 3856 1 1 31 PRO HG2 H -5.672 -0.385 2.337 1.00 . A A . 31 PRO HG2 1 1 7 3857 1 1 31 PRO HG3 H -5.761 -1.343 0.842 1.00 . A A . 31 PRO HG3 1 1 7 3858 1 1 31 PRO N N -5.135 1.880 0.654 1.00 . A A . 31 PRO N 1 1 7 3859 1 1 31 PRO O O -5.917 2.829 3.168 1.00 . A A . 31 PRO O 1 1 7 3860 1 1 32 SER C C -10.033 2.182 4.234 1.00 . A A . 32 SER C 1 1 7 3861 1 1 32 SER CA C -8.620 2.778 4.101 1.00 . A A . 32 SER CA 1 1 7 3862 1 1 32 SER CB C -8.579 4.286 4.394 1.00 . A A . 32 SER CB 1 1 7 3863 1 1 32 SER H H -8.785 2.248 2.057 1.00 . A A . 32 SER H 1 1 7 3864 1 1 32 SER HA H -7.993 2.267 4.834 1.00 . A A . 32 SER HA 1 1 7 3865 1 1 32 SER HB2 H -9.188 4.823 3.666 1.00 . A A . 32 SER HB2 1 1 7 3866 1 1 32 SER HB3 H -8.957 4.480 5.399 1.00 . A A . 32 SER HB3 1 1 7 3867 1 1 32 SER HG H -6.726 3.923 3.994 1.00 . A A . 32 SER HG 1 1 7 3868 1 1 32 SER N N -8.098 2.505 2.753 1.00 . A A . 32 SER N 1 1 7 3869 1 1 32 SER O O -10.899 2.758 4.887 1.00 . A A . 32 SER O 1 1 7 3870 1 1 32 SER OG O -7.230 4.714 4.308 1.00 . A A . 32 SER OG 1 1 7 3871 1 1 33 GLY C C -11.742 0.161 1.814 1.00 . A A . 33 GLY C 1 1 7 3872 1 1 33 GLY CA C -11.532 0.385 3.307 1.00 . A A . 33 GLY CA 1 1 7 3873 1 1 33 GLY H H -9.495 0.632 3.029 1.00 . A A . 33 GLY H 1 1 7 3874 1 1 33 GLY HA2 H -11.546 -0.583 3.805 1.00 . A A . 33 GLY HA2 1 1 7 3875 1 1 33 GLY HA3 H -12.358 0.992 3.680 1.00 . A A . 33 GLY HA3 1 1 7 3876 1 1 33 GLY N N -10.255 1.055 3.540 1.00 . A A . 33 GLY N 1 1 7 3877 1 1 33 GLY O O -10.749 -0.041 1.074 1.00 . A A . 33 GLY O 1 1 7 3878 1 1 33 GLY OXT O -12.896 0.275 1.360 1.00 . A A . 33 GLY OXT 1 1 7 3879 2 2 1 NAG C1 C 12.374 1.456 -1.192 1.00 . B A . 101 NAG C1 1 1 7 3880 2 2 1 NAG C2 C 11.998 2.799 -1.841 1.00 . B A . 101 NAG C2 1 1 7 3881 2 2 1 NAG C3 C 10.840 2.458 -2.779 1.00 . B A . 101 NAG C3 1 1 7 3882 2 2 1 NAG C4 C 11.370 1.552 -3.892 1.00 . B A . 101 NAG C4 1 1 7 3883 2 2 1 NAG C5 C 11.958 0.255 -3.301 1.00 . B A . 101 NAG C5 1 1 7 3884 2 2 1 NAG C6 C 12.641 -0.658 -4.317 1.00 . B A . 101 NAG C6 1 1 7 3885 2 2 1 NAG C7 C 12.447 4.741 -0.423 1.00 . B A . 101 NAG C7 1 1 7 3886 2 2 1 NAG C8 C 11.863 5.716 0.605 1.00 . B A . 101 NAG C8 1 1 7 3887 2 2 1 NAG H1 H 11.478 0.986 -0.788 1.00 . B A . 101 NAG H1 1 1 7 3888 2 2 1 NAG H2 H 12.839 3.177 -2.424 1.00 . B A . 101 NAG H2 1 1 7 3889 2 2 1 NAG H3 H 10.060 1.939 -2.209 1.00 . B A . 101 NAG H3 1 1 7 3890 2 2 1 NAG H4 H 12.123 2.092 -4.462 1.00 . B A . 101 NAG H4 1 1 7 3891 2 2 1 NAG H5 H 11.142 -0.297 -2.857 1.00 . B A . 101 NAG H5 1 1 7 3892 2 2 1 NAG H61 H 12.978 -1.573 -3.828 1.00 . B A . 101 NAG H61 1 1 7 3893 2 2 1 NAG H62 H 11.951 -0.930 -5.115 1.00 . B A . 101 NAG H62 1 1 7 3894 2 2 1 NAG H81 H 10.831 5.958 0.349 1.00 . B A . 101 NAG H81 1 1 7 3895 2 2 1 NAG H82 H 12.452 6.634 0.616 1.00 . B A . 101 NAG H82 1 1 7 3896 2 2 1 NAG H83 H 11.894 5.260 1.595 1.00 . B A . 101 NAG H83 1 1 7 3897 2 2 1 NAG HN2 H 10.726 3.676 -0.365 1.00 . B A . 101 NAG HN2 1 1 7 3898 2 2 1 NAG HO3 H 9.785 3.342 -4.161 1.00 . B A . 101 NAG HO3 1 1 7 3899 2 2 1 NAG HO4 H 10.573 0.806 -5.550 1.00 . B A . 101 NAG HO4 1 1 7 3900 2 2 1 NAG HO6 H 14.362 0.261 -4.135 1.00 . B A . 101 NAG HO6 1 1 7 3901 2 2 1 NAG N2 N 11.614 3.792 -0.842 1.00 . B A . 101 NAG N2 1 1 7 3902 2 2 1 NAG O3 O 10.290 3.639 -3.394 1.00 . B A . 101 NAG O3 1 1 7 3903 2 2 1 NAG O4 O 10.255 1.240 -4.752 1.00 . B A . 101 NAG O4 1 1 7 3904 2 2 1 NAG O5 O 12.932 0.577 -2.225 1.00 . B A . 101 NAG O5 1 1 7 3905 2 2 1 NAG O6 O 13.773 0.031 -4.860 1.00 . B A . 101 NAG O6 1 1 7 3906 2 2 1 NAG O7 O 13.606 4.828 -0.819 1.00 . B A . 101 NAG O7 1 1 8 3907 1 1 1 LYS C C -7.798 0.529 -3.556 1.00 . A A . 1 LYS C 1 1 8 3908 1 1 1 LYS CA C -8.695 1.611 -2.965 1.00 . A A . 1 LYS CA 1 1 8 3909 1 1 1 LYS CB C -9.799 2.023 -3.969 1.00 . A A . 1 LYS CB 1 1 8 3910 1 1 1 LYS CD C -8.782 4.158 -5.156 1.00 . A A . 1 LYS CD 1 1 8 3911 1 1 1 LYS CE C -9.643 5.114 -4.313 1.00 . A A . 1 LYS CE 1 1 8 3912 1 1 1 LYS CG C -9.392 2.749 -5.275 1.00 . A A . 1 LYS CG 1 1 8 3913 1 1 1 LYS H1 H -7.399 3.236 -3.145 1.00 . A A . 1 LYS H1 1 1 8 3914 1 1 1 LYS H2 H -7.290 2.468 -1.698 1.00 . A A . 1 LYS H2 1 1 8 3915 1 1 1 LYS H3 H -8.578 3.419 -2.007 1.00 . A A . 1 LYS H3 1 1 8 3916 1 1 1 LYS HA H -9.207 1.159 -2.116 1.00 . A A . 1 LYS HA 1 1 8 3917 1 1 1 LYS HB2 H -10.316 1.110 -4.266 1.00 . A A . 1 LYS HB2 1 1 8 3918 1 1 1 LYS HB3 H -10.546 2.617 -3.446 1.00 . A A . 1 LYS HB3 1 1 8 3919 1 1 1 LYS HD2 H -7.783 4.070 -4.739 1.00 . A A . 1 LYS HD2 1 1 8 3920 1 1 1 LYS HD3 H -8.668 4.580 -6.156 1.00 . A A . 1 LYS HD3 1 1 8 3921 1 1 1 LYS HE2 H -10.429 5.552 -4.933 1.00 . A A . 1 LYS HE2 1 1 8 3922 1 1 1 LYS HE3 H -10.137 4.538 -3.530 1.00 . A A . 1 LYS HE3 1 1 8 3923 1 1 1 LYS HG2 H -8.691 2.118 -5.823 1.00 . A A . 1 LYS HG2 1 1 8 3924 1 1 1 LYS HG3 H -10.290 2.834 -5.890 1.00 . A A . 1 LYS HG3 1 1 8 3925 1 1 1 LYS HZ1 H -8.723 6.985 -4.234 1.00 . A A . 1 LYS HZ1 1 1 8 3926 1 1 1 LYS HZ2 H -9.283 6.422 -2.758 1.00 . A A . 1 LYS HZ2 1 1 8 3927 1 1 1 LYS HZ3 H -7.916 5.810 -3.392 1.00 . A A . 1 LYS HZ3 1 1 8 3928 1 1 1 LYS N N -7.930 2.756 -2.430 1.00 . A A . 1 LYS N 1 1 8 3929 1 1 1 LYS NZ N -8.842 6.171 -3.654 1.00 . A A . 1 LYS NZ 1 1 8 3930 1 1 1 LYS O O -6.772 0.838 -4.163 1.00 . A A . 1 LYS O 1 1 8 3931 1 1 2 LEU C C -8.648 -3.083 -3.951 1.00 . A A . 2 LEU C 1 1 8 3932 1 1 2 LEU CA C -7.632 -1.919 -3.997 1.00 . A A . 2 LEU CA 1 1 8 3933 1 1 2 LEU CB C -6.259 -2.292 -3.405 1.00 . A A . 2 LEU CB 1 1 8 3934 1 1 2 LEU CD1 C -6.618 -3.590 -1.194 1.00 . A A . 2 LEU CD1 1 1 8 3935 1 1 2 LEU CD2 C -4.569 -2.309 -1.595 1.00 . A A . 2 LEU CD2 1 1 8 3936 1 1 2 LEU CG C -6.061 -2.334 -1.870 1.00 . A A . 2 LEU CG 1 1 8 3937 1 1 2 LEU H H -9.024 -0.942 -2.809 1.00 . A A . 2 LEU H 1 1 8 3938 1 1 2 LEU HA H -7.458 -1.655 -5.040 1.00 . A A . 2 LEU HA 1 1 8 3939 1 1 2 LEU HB2 H -5.955 -3.251 -3.824 1.00 . A A . 2 LEU HB2 1 1 8 3940 1 1 2 LEU HB3 H -5.559 -1.562 -3.805 1.00 . A A . 2 LEU HB3 1 1 8 3941 1 1 2 LEU HD11 H -7.695 -3.501 -1.068 1.00 . A A . 2 LEU HD11 1 1 8 3942 1 1 2 LEU HD12 H -6.399 -4.473 -1.793 1.00 . A A . 2 LEU HD12 1 1 8 3943 1 1 2 LEU HD13 H -6.156 -3.726 -0.214 1.00 . A A . 2 LEU HD13 1 1 8 3944 1 1 2 LEU HD21 H -4.435 -2.240 -0.522 1.00 . A A . 2 LEU HD21 1 1 8 3945 1 1 2 LEU HD22 H -4.102 -3.216 -1.976 1.00 . A A . 2 LEU HD22 1 1 8 3946 1 1 2 LEU HD23 H -4.107 -1.434 -2.051 1.00 . A A . 2 LEU HD23 1 1 8 3947 1 1 2 LEU HG H -6.462 -1.450 -1.373 1.00 . A A . 2 LEU HG 1 1 8 3948 1 1 2 LEU N N -8.197 -0.733 -3.354 1.00 . A A . 2 LEU N 1 1 8 3949 1 1 2 LEU O O -9.343 -3.219 -2.942 1.00 . A A . 2 LEU O 1 1 8 3950 1 1 3 PRO C C -8.993 -6.311 -4.409 1.00 . A A . 3 PRO C 1 1 8 3951 1 1 3 PRO CA C -9.656 -5.070 -5.052 1.00 . A A . 3 PRO CA 1 1 8 3952 1 1 3 PRO CB C -9.936 -5.292 -6.548 1.00 . A A . 3 PRO CB 1 1 8 3953 1 1 3 PRO CD C -8.237 -3.629 -6.349 1.00 . A A . 3 PRO CD 1 1 8 3954 1 1 3 PRO CG C -8.671 -4.794 -7.236 1.00 . A A . 3 PRO CG 1 1 8 3955 1 1 3 PRO HA H -10.594 -4.861 -4.536 1.00 . A A . 3 PRO HA 1 1 8 3956 1 1 3 PRO HB2 H -10.127 -6.335 -6.800 1.00 . A A . 3 PRO HB2 1 1 8 3957 1 1 3 PRO HB3 H -10.782 -4.672 -6.853 1.00 . A A . 3 PRO HB3 1 1 8 3958 1 1 3 PRO HD2 H -7.152 -3.552 -6.317 1.00 . A A . 3 PRO HD2 1 1 8 3959 1 1 3 PRO HD3 H -8.663 -2.704 -6.741 1.00 . A A . 3 PRO HD3 1 1 8 3960 1 1 3 PRO HG2 H -7.920 -5.582 -7.225 1.00 . A A . 3 PRO HG2 1 1 8 3961 1 1 3 PRO HG3 H -8.869 -4.470 -8.258 1.00 . A A . 3 PRO HG3 1 1 8 3962 1 1 3 PRO N N -8.791 -3.886 -5.025 1.00 . A A . 3 PRO N 1 1 8 3963 1 1 3 PRO O O -7.792 -6.296 -4.121 1.00 . A A . 3 PRO O 1 1 8 3964 1 1 4 PRO C C -8.121 -9.201 -4.862 1.00 . A A . 4 PRO C 1 1 8 3965 1 1 4 PRO CA C -9.155 -8.711 -3.831 1.00 . A A . 4 PRO CA 1 1 8 3966 1 1 4 PRO CB C -10.333 -9.677 -3.665 1.00 . A A . 4 PRO CB 1 1 8 3967 1 1 4 PRO CD C -11.176 -7.561 -4.393 1.00 . A A . 4 PRO CD 1 1 8 3968 1 1 4 PRO CG C -11.433 -9.060 -4.525 1.00 . A A . 4 PRO CG 1 1 8 3969 1 1 4 PRO HA H -8.658 -8.595 -2.867 1.00 . A A . 4 PRO HA 1 1 8 3970 1 1 4 PRO HB2 H -10.089 -10.690 -3.988 1.00 . A A . 4 PRO HB2 1 1 8 3971 1 1 4 PRO HB3 H -10.651 -9.679 -2.621 1.00 . A A . 4 PRO HB3 1 1 8 3972 1 1 4 PRO HD2 H -11.551 -7.044 -5.273 1.00 . A A . 4 PRO HD2 1 1 8 3973 1 1 4 PRO HD3 H -11.674 -7.181 -3.500 1.00 . A A . 4 PRO HD3 1 1 8 3974 1 1 4 PRO HG2 H -11.299 -9.363 -5.565 1.00 . A A . 4 PRO HG2 1 1 8 3975 1 1 4 PRO HG3 H -12.428 -9.333 -4.171 1.00 . A A . 4 PRO HG3 1 1 8 3976 1 1 4 PRO N N -9.733 -7.425 -4.226 1.00 . A A . 4 PRO N 1 1 8 3977 1 1 4 PRO O O -8.289 -9.017 -6.067 1.00 . A A . 4 PRO O 1 1 8 3978 1 1 5 GLY C C -4.610 -9.274 -4.784 1.00 . A A . 5 GLY C 1 1 8 3979 1 1 5 GLY CA C -5.826 -10.134 -5.146 1.00 . A A . 5 GLY CA 1 1 8 3980 1 1 5 GLY H H -6.955 -9.911 -3.367 1.00 . A A . 5 GLY H 1 1 8 3981 1 1 5 GLY HA2 H -5.577 -11.177 -4.956 1.00 . A A . 5 GLY HA2 1 1 8 3982 1 1 5 GLY HA3 H -6.025 -10.012 -6.210 1.00 . A A . 5 GLY HA3 1 1 8 3983 1 1 5 GLY N N -7.020 -9.777 -4.366 1.00 . A A . 5 GLY N 1 1 8 3984 1 1 5 GLY O O -3.477 -9.667 -5.049 1.00 . A A . 5 GLY O 1 1 8 3985 1 1 6 TRP C C -3.667 -7.571 -2.099 1.00 . A A . 6 TRP C 1 1 8 3986 1 1 6 TRP CA C -3.843 -7.238 -3.588 1.00 . A A . 6 TRP CA 1 1 8 3987 1 1 6 TRP CB C -4.269 -5.784 -3.780 1.00 . A A . 6 TRP CB 1 1 8 3988 1 1 6 TRP CD1 C -5.307 -5.518 -6.081 1.00 . A A . 6 TRP CD1 1 1 8 3989 1 1 6 TRP CD2 C -3.308 -4.524 -5.921 1.00 . A A . 6 TRP CD2 1 1 8 3990 1 1 6 TRP CE2 C -3.790 -4.276 -7.242 1.00 . A A . 6 TRP CE2 1 1 8 3991 1 1 6 TRP CE3 C -2.029 -4.032 -5.603 1.00 . A A . 6 TRP CE3 1 1 8 3992 1 1 6 TRP CG C -4.307 -5.301 -5.199 1.00 . A A . 6 TRP CG 1 1 8 3993 1 1 6 TRP CH2 C -1.776 -3.088 -7.847 1.00 . A A . 6 TRP CH2 1 1 8 3994 1 1 6 TRP CZ2 C -3.050 -3.563 -8.195 1.00 . A A . 6 TRP CZ2 1 1 8 3995 1 1 6 TRP CZ3 C -1.270 -3.338 -6.559 1.00 . A A . 6 TRP CZ3 1 1 8 3996 1 1 6 TRP H H -5.800 -7.791 -4.040 1.00 . A A . 6 TRP H 1 1 8 3997 1 1 6 TRP HA H -2.885 -7.381 -4.072 1.00 . A A . 6 TRP HA 1 1 8 3998 1 1 6 TRP HB2 H -5.257 -5.648 -3.343 1.00 . A A . 6 TRP HB2 1 1 8 3999 1 1 6 TRP HB3 H -3.577 -5.154 -3.228 1.00 . A A . 6 TRP HB3 1 1 8 4000 1 1 6 TRP HD1 H -6.206 -6.075 -5.856 1.00 . A A . 6 TRP HD1 1 1 8 4001 1 1 6 TRP HE1 H -5.635 -4.891 -8.083 1.00 . A A . 6 TRP HE1 1 1 8 4002 1 1 6 TRP HE3 H -1.627 -4.206 -4.617 1.00 . A A . 6 TRP HE3 1 1 8 4003 1 1 6 TRP HH2 H -1.187 -2.531 -8.561 1.00 . A A . 6 TRP HH2 1 1 8 4004 1 1 6 TRP HZ2 H -3.450 -3.386 -9.182 1.00 . A A . 6 TRP HZ2 1 1 8 4005 1 1 6 TRP HZ3 H -0.294 -2.983 -6.289 1.00 . A A . 6 TRP HZ3 1 1 8 4006 1 1 6 TRP N N -4.850 -8.095 -4.200 1.00 . A A . 6 TRP N 1 1 8 4007 1 1 6 TRP NE1 N -5.015 -4.904 -7.284 1.00 . A A . 6 TRP NE1 1 1 8 4008 1 1 6 TRP O O -4.631 -7.949 -1.433 1.00 . A A . 6 TRP O 1 1 8 4009 1 1 7 GLU C C -1.111 -6.398 0.288 1.00 . A A . 7 GLU C 1 1 8 4010 1 1 7 GLU CA C -2.171 -7.439 -0.127 1.00 . A A . 7 GLU CA 1 1 8 4011 1 1 7 GLU CB C -1.745 -8.885 0.202 1.00 . A A . 7 GLU CB 1 1 8 4012 1 1 7 GLU CD C -2.331 -8.864 2.744 1.00 . A A . 7 GLU CD 1 1 8 4013 1 1 7 GLU CG C -1.310 -9.201 1.646 1.00 . A A . 7 GLU CG 1 1 8 4014 1 1 7 GLU H H -1.667 -7.173 -2.173 1.00 . A A . 7 GLU H 1 1 8 4015 1 1 7 GLU HA H -3.086 -7.218 0.422 1.00 . A A . 7 GLU HA 1 1 8 4016 1 1 7 GLU HB2 H -2.574 -9.541 -0.053 1.00 . A A . 7 GLU HB2 1 1 8 4017 1 1 7 GLU HB3 H -0.910 -9.149 -0.452 1.00 . A A . 7 GLU HB3 1 1 8 4018 1 1 7 GLU HG2 H -1.076 -10.266 1.695 1.00 . A A . 7 GLU HG2 1 1 8 4019 1 1 7 GLU HG3 H -0.384 -8.667 1.856 1.00 . A A . 7 GLU HG3 1 1 8 4020 1 1 7 GLU N N -2.462 -7.357 -1.562 1.00 . A A . 7 GLU N 1 1 8 4021 1 1 7 GLU O O -0.270 -5.996 -0.518 1.00 . A A . 7 GLU O 1 1 8 4022 1 1 7 GLU OE1 O -2.842 -7.716 2.777 1.00 . A A . 7 GLU OE1 1 1 8 4023 1 1 7 GLU OE2 O -2.518 -9.673 3.681 1.00 . A A . 7 GLU OE2 1 1 8 4024 1 1 8 LYS C C 1.220 -5.644 2.219 1.00 . A A . 8 LYS C 1 1 8 4025 1 1 8 LYS CA C -0.196 -5.049 2.193 1.00 . A A . 8 LYS CA 1 1 8 4026 1 1 8 LYS CB C -0.700 -4.691 3.605 1.00 . A A . 8 LYS CB 1 1 8 4027 1 1 8 LYS CD C -1.633 -5.754 5.763 1.00 . A A . 8 LYS CD 1 1 8 4028 1 1 8 LYS CE C -2.019 -7.148 6.283 1.00 . A A . 8 LYS CE 1 1 8 4029 1 1 8 LYS CG C -0.656 -5.882 4.581 1.00 . A A . 8 LYS CG 1 1 8 4030 1 1 8 LYS H H -1.851 -6.419 2.151 1.00 . A A . 8 LYS H 1 1 8 4031 1 1 8 LYS HA H -0.159 -4.131 1.604 1.00 . A A . 8 LYS HA 1 1 8 4032 1 1 8 LYS HB2 H -0.098 -3.878 4.012 1.00 . A A . 8 LYS HB2 1 1 8 4033 1 1 8 LYS HB3 H -1.727 -4.337 3.514 1.00 . A A . 8 LYS HB3 1 1 8 4034 1 1 8 LYS HD2 H -1.147 -5.188 6.559 1.00 . A A . 8 LYS HD2 1 1 8 4035 1 1 8 LYS HD3 H -2.537 -5.221 5.464 1.00 . A A . 8 LYS HD3 1 1 8 4036 1 1 8 LYS HE2 H -1.120 -7.771 6.288 1.00 . A A . 8 LYS HE2 1 1 8 4037 1 1 8 LYS HE3 H -2.382 -7.065 7.310 1.00 . A A . 8 LYS HE3 1 1 8 4038 1 1 8 LYS HG2 H -0.883 -6.794 4.037 1.00 . A A . 8 LYS HG2 1 1 8 4039 1 1 8 LYS HG3 H 0.359 -5.986 4.965 1.00 . A A . 8 LYS HG3 1 1 8 4040 1 1 8 LYS HZ1 H -3.014 -7.436 4.462 1.00 . A A . 8 LYS HZ1 1 1 8 4041 1 1 8 LYS HZ2 H -2.866 -8.762 5.225 1.00 . A A . 8 LYS HZ2 1 1 8 4042 1 1 8 LYS HZ3 H -3.998 -7.654 5.780 1.00 . A A . 8 LYS HZ3 1 1 8 4043 1 1 8 LYS N N -1.156 -5.962 1.553 1.00 . A A . 8 LYS N 1 1 8 4044 1 1 8 LYS NZ N -3.061 -7.775 5.433 1.00 . A A . 8 LYS NZ 1 1 8 4045 1 1 8 LYS O O 1.412 -6.820 2.528 1.00 . A A . 8 LYS O 1 1 8 4046 1 1 9 ARG C C 4.581 -4.164 2.142 1.00 . A A . 9 ARG C 1 1 8 4047 1 1 9 ARG CA C 3.600 -5.240 1.658 1.00 . A A . 9 ARG CA 1 1 8 4048 1 1 9 ARG CB C 3.656 -5.470 0.141 1.00 . A A . 9 ARG CB 1 1 8 4049 1 1 9 ARG CD C 5.384 -7.396 0.100 1.00 . A A . 9 ARG CD 1 1 8 4050 1 1 9 ARG CG C 4.944 -6.037 -0.443 1.00 . A A . 9 ARG CG 1 1 8 4051 1 1 9 ARG CZ C 7.535 -8.009 -1.094 1.00 . A A . 9 ARG CZ 1 1 8 4052 1 1 9 ARG H H 2.039 -3.879 1.565 1.00 . A A . 9 ARG H 1 1 8 4053 1 1 9 ARG HA H 3.804 -6.171 2.190 1.00 . A A . 9 ARG HA 1 1 8 4054 1 1 9 ARG HB2 H 2.852 -6.155 -0.134 1.00 . A A . 9 ARG HB2 1 1 8 4055 1 1 9 ARG HB3 H 3.455 -4.522 -0.361 1.00 . A A . 9 ARG HB3 1 1 8 4056 1 1 9 ARG HD2 H 5.926 -7.252 1.034 1.00 . A A . 9 ARG HD2 1 1 8 4057 1 1 9 ARG HD3 H 4.497 -8.000 0.300 1.00 . A A . 9 ARG HD3 1 1 8 4058 1 1 9 ARG HE H 5.738 -8.766 -1.462 1.00 . A A . 9 ARG HE 1 1 8 4059 1 1 9 ARG HG2 H 4.739 -6.107 -1.502 1.00 . A A . 9 ARG HG2 1 1 8 4060 1 1 9 ARG HG3 H 5.761 -5.342 -0.298 1.00 . A A . 9 ARG HG3 1 1 8 4061 1 1 9 ARG HH11 H 8.031 -6.571 0.297 1.00 . A A . 9 ARG HH11 1 1 8 4062 1 1 9 ARG HH12 H 9.319 -7.197 -0.653 1.00 . A A . 9 ARG HH12 1 1 8 4063 1 1 9 ARG HH21 H 7.507 -9.359 -2.594 1.00 . A A . 9 ARG HH21 1 1 8 4064 1 1 9 ARG HH22 H 9.063 -8.694 -2.212 1.00 . A A . 9 ARG HH22 1 1 8 4065 1 1 9 ARG N N 2.223 -4.826 1.895 1.00 . A A . 9 ARG N 1 1 8 4066 1 1 9 ARG NE N 6.226 -8.110 -0.876 1.00 . A A . 9 ARG NE 1 1 8 4067 1 1 9 ARG NH1 N 8.345 -7.217 -0.426 1.00 . A A . 9 ARG NH1 1 1 8 4068 1 1 9 ARG NH2 N 8.076 -8.745 -2.038 1.00 . A A . 9 ARG NH2 1 1 8 4069 1 1 9 ARG O O 4.194 -3.047 2.479 1.00 . A A . 9 ARG O 1 1 8 4070 1 1 10 MET C C 8.240 -4.021 1.775 1.00 . A A . 10 MET C 1 1 8 4071 1 1 10 MET CA C 6.968 -3.637 2.543 1.00 . A A . 10 MET CA 1 1 8 4072 1 1 10 MET CB C 7.163 -3.824 4.059 1.00 . A A . 10 MET CB 1 1 8 4073 1 1 10 MET CE C 7.143 -2.457 7.218 1.00 . A A . 10 MET CE 1 1 8 4074 1 1 10 MET CG C 8.190 -2.851 4.652 1.00 . A A . 10 MET CG 1 1 8 4075 1 1 10 MET H H 6.139 -5.404 1.785 1.00 . A A . 10 MET H 1 1 8 4076 1 1 10 MET HA H 6.712 -2.603 2.343 1.00 . A A . 10 MET HA 1 1 8 4077 1 1 10 MET HB2 H 6.210 -3.668 4.565 1.00 . A A . 10 MET HB2 1 1 8 4078 1 1 10 MET HB3 H 7.491 -4.846 4.254 1.00 . A A . 10 MET HB3 1 1 8 4079 1 1 10 MET HE1 H 7.221 -2.628 8.292 1.00 . A A . 10 MET HE1 1 1 8 4080 1 1 10 MET HE2 H 7.104 -1.384 7.032 1.00 . A A . 10 MET HE2 1 1 8 4081 1 1 10 MET HE3 H 6.235 -2.930 6.844 1.00 . A A . 10 MET HE3 1 1 8 4082 1 1 10 MET HG2 H 9.118 -2.939 4.093 1.00 . A A . 10 MET HG2 1 1 8 4083 1 1 10 MET HG3 H 7.824 -1.829 4.545 1.00 . A A . 10 MET HG3 1 1 8 4084 1 1 10 MET N N 5.873 -4.483 2.092 1.00 . A A . 10 MET N 1 1 8 4085 1 1 10 MET O O 8.456 -5.197 1.465 1.00 . A A . 10 MET O 1 1 8 4086 1 1 10 MET SD S 8.593 -3.159 6.394 1.00 . A A . 10 MET SD 1 1 8 4087 1 1 11 PHE C C 11.455 -3.363 1.716 1.00 . A A . 11 PHE C 1 1 8 4088 1 1 11 PHE CA C 10.312 -3.112 0.716 1.00 . A A . 11 PHE CA 1 1 8 4089 1 1 11 PHE CB C 10.574 -1.817 -0.064 1.00 . A A . 11 PHE CB 1 1 8 4090 1 1 11 PHE CD1 C 10.064 -2.506 -2.445 1.00 . A A . 11 PHE CD1 1 1 8 4091 1 1 11 PHE CD2 C 8.795 -0.665 -1.477 1.00 . A A . 11 PHE CD2 1 1 8 4092 1 1 11 PHE CE1 C 9.395 -2.325 -3.669 1.00 . A A . 11 PHE CE1 1 1 8 4093 1 1 11 PHE CE2 C 8.131 -0.485 -2.702 1.00 . A A . 11 PHE CE2 1 1 8 4094 1 1 11 PHE CG C 9.775 -1.671 -1.346 1.00 . A A . 11 PHE CG 1 1 8 4095 1 1 11 PHE CZ C 8.433 -1.310 -3.797 1.00 . A A . 11 PHE CZ 1 1 8 4096 1 1 11 PHE H H 8.695 -2.061 1.606 1.00 . A A . 11 PHE H 1 1 8 4097 1 1 11 PHE HA H 10.281 -3.925 -0.006 1.00 . A A . 11 PHE HA 1 1 8 4098 1 1 11 PHE HB2 H 10.378 -0.971 0.591 1.00 . A A . 11 PHE HB2 1 1 8 4099 1 1 11 PHE HB3 H 11.629 -1.772 -0.339 1.00 . A A . 11 PHE HB3 1 1 8 4100 1 1 11 PHE HD1 H 10.828 -3.265 -2.372 1.00 . A A . 11 PHE HD1 1 1 8 4101 1 1 11 PHE HD2 H 8.533 -0.029 -0.645 1.00 . A A . 11 PHE HD2 1 1 8 4102 1 1 11 PHE HE1 H 9.629 -2.954 -4.516 1.00 . A A . 11 PHE HE1 1 1 8 4103 1 1 11 PHE HE2 H 7.377 0.278 -2.809 1.00 . A A . 11 PHE HE2 1 1 8 4104 1 1 11 PHE HZ H 7.925 -1.154 -4.739 1.00 . A A . 11 PHE HZ 1 1 8 4105 1 1 11 PHE N N 9.020 -3.003 1.396 1.00 . A A . 11 PHE N 1 1 8 4106 1 1 11 PHE O O 11.342 -3.039 2.897 1.00 . A A . 11 PHE O 1 1 8 4107 1 1 12 ALA C C 14.430 -2.910 2.735 1.00 . A A . 12 ALA C 1 1 8 4108 1 1 12 ALA CA C 13.797 -4.135 2.034 1.00 . A A . 12 ALA CA 1 1 8 4109 1 1 12 ALA CB C 14.819 -4.838 1.132 1.00 . A A . 12 ALA CB 1 1 8 4110 1 1 12 ALA H H 12.671 -4.075 0.245 1.00 . A A . 12 ALA H 1 1 8 4111 1 1 12 ALA HA H 13.508 -4.832 2.822 1.00 . A A . 12 ALA HA 1 1 8 4112 1 1 12 ALA HB1 H 14.379 -5.736 0.696 1.00 . A A . 12 ALA HB1 1 1 8 4113 1 1 12 ALA HB2 H 15.142 -4.167 0.334 1.00 . A A . 12 ALA HB2 1 1 8 4114 1 1 12 ALA HB3 H 15.690 -5.129 1.723 1.00 . A A . 12 ALA HB3 1 1 8 4115 1 1 12 ALA N N 12.604 -3.845 1.225 1.00 . A A . 12 ALA N 1 1 8 4116 1 1 12 ALA O O 15.327 -3.073 3.557 1.00 . A A . 12 ALA O 1 1 8 4117 1 1 13 ASN C C 13.278 0.004 4.167 1.00 . A A . 13 ASN C 1 1 8 4118 1 1 13 ASN CA C 14.321 -0.446 3.113 1.00 . A A . 13 ASN CA 1 1 8 4119 1 1 13 ASN CB C 14.561 0.631 2.031 1.00 . A A . 13 ASN CB 1 1 8 4120 1 1 13 ASN CG C 13.332 0.910 1.170 1.00 . A A . 13 ASN CG 1 1 8 4121 1 1 13 ASN H H 13.207 -1.632 1.764 1.00 . A A . 13 ASN H 1 1 8 4122 1 1 13 ASN HA H 15.258 -0.595 3.652 1.00 . A A . 13 ASN HA 1 1 8 4123 1 1 13 ASN HB2 H 14.868 1.562 2.507 1.00 . A A . 13 ASN HB2 1 1 8 4124 1 1 13 ASN HB3 H 15.376 0.300 1.387 1.00 . A A . 13 ASN HB3 1 1 8 4125 1 1 13 ASN HD21 H 14.447 1.692 -0.341 1.00 . A A . 13 ASN HD21 1 1 8 4126 1 1 13 ASN N N 13.956 -1.694 2.438 1.00 . A A . 13 ASN N 1 1 8 4127 1 1 13 ASN ND2 N 13.523 1.436 -0.037 1.00 . A A . 13 ASN ND2 1 1 8 4128 1 1 13 ASN O O 13.448 1.064 4.763 1.00 . A A . 13 ASN O 1 1 8 4129 1 1 13 ASN OD1 O 12.211 0.606 1.576 1.00 . A A . 13 ASN OD1 1 1 8 4130 1 1 14 GLY C C 9.911 0.301 4.699 1.00 . A A . 14 GLY C 1 1 8 4131 1 1 14 GLY CA C 11.111 -0.439 5.311 1.00 . A A . 14 GLY CA 1 1 8 4132 1 1 14 GLY H H 12.092 -1.638 3.864 1.00 . A A . 14 GLY H 1 1 8 4133 1 1 14 GLY HA2 H 10.746 -1.369 5.741 1.00 . A A . 14 GLY HA2 1 1 8 4134 1 1 14 GLY HA3 H 11.505 0.172 6.125 1.00 . A A . 14 GLY HA3 1 1 8 4135 1 1 14 GLY N N 12.192 -0.763 4.374 1.00 . A A . 14 GLY N 1 1 8 4136 1 1 14 GLY O O 9.080 0.808 5.448 1.00 . A A . 14 GLY O 1 1 8 4137 1 1 15 THR C C 7.550 0.439 2.389 1.00 . A A . 15 THR C 1 1 8 4138 1 1 15 THR CA C 8.798 1.249 2.705 1.00 . A A . 15 THR CA 1 1 8 4139 1 1 15 THR CB C 9.379 1.857 1.421 1.00 . A A . 15 THR CB 1 1 8 4140 1 1 15 THR CG2 C 8.461 2.838 0.692 1.00 . A A . 15 THR CG2 1 1 8 4141 1 1 15 THR H H 10.445 -0.112 2.768 1.00 . A A . 15 THR H 1 1 8 4142 1 1 15 THR HA H 8.529 2.073 3.359 1.00 . A A . 15 THR HA 1 1 8 4143 1 1 15 THR HB H 9.640 1.058 0.733 1.00 . A A . 15 THR HB 1 1 8 4144 1 1 15 THR HG1 H 11.239 1.821 1.844 1.00 . A A . 15 THR HG1 1 1 8 4145 1 1 15 THR HG21 H 8.921 3.122 -0.257 1.00 . A A . 15 THR HG21 1 1 8 4146 1 1 15 THR HG22 H 7.501 2.371 0.479 1.00 . A A . 15 THR HG22 1 1 8 4147 1 1 15 THR HG23 H 8.304 3.726 1.303 1.00 . A A . 15 THR HG23 1 1 8 4148 1 1 15 THR N N 9.792 0.383 3.366 1.00 . A A . 15 THR N 1 1 8 4149 1 1 15 THR O O 7.653 -0.580 1.710 1.00 . A A . 15 THR O 1 1 8 4150 1 1 15 THR OG1 O 10.564 2.535 1.746 1.00 . A A . 15 THR OG1 1 1 8 4151 1 1 16 VAL C C 4.311 0.481 1.577 1.00 . A A . 16 VAL C 1 1 8 4152 1 1 16 VAL CA C 5.129 0.111 2.811 1.00 . A A . 16 VAL CA 1 1 8 4153 1 1 16 VAL CB C 4.311 0.315 4.108 1.00 . A A . 16 VAL CB 1 1 8 4154 1 1 16 VAL CG1 C 2.834 -0.105 4.017 1.00 . A A . 16 VAL CG1 1 1 8 4155 1 1 16 VAL CG2 C 4.949 -0.517 5.225 1.00 . A A . 16 VAL CG2 1 1 8 4156 1 1 16 VAL H H 6.349 1.754 3.374 1.00 . A A . 16 VAL H 1 1 8 4157 1 1 16 VAL HA H 5.374 -0.945 2.741 1.00 . A A . 16 VAL HA 1 1 8 4158 1 1 16 VAL HB H 4.344 1.369 4.388 1.00 . A A . 16 VAL HB 1 1 8 4159 1 1 16 VAL HG11 H 2.754 -1.144 3.696 1.00 . A A . 16 VAL HG11 1 1 8 4160 1 1 16 VAL HG12 H 2.359 0.002 4.992 1.00 . A A . 16 VAL HG12 1 1 8 4161 1 1 16 VAL HG13 H 2.299 0.534 3.314 1.00 . A A . 16 VAL HG13 1 1 8 4162 1 1 16 VAL HG21 H 4.430 -0.335 6.166 1.00 . A A . 16 VAL HG21 1 1 8 4163 1 1 16 VAL HG22 H 4.875 -1.577 4.974 1.00 . A A . 16 VAL HG22 1 1 8 4164 1 1 16 VAL HG23 H 5.996 -0.239 5.343 1.00 . A A . 16 VAL HG23 1 1 8 4165 1 1 16 VAL N N 6.381 0.884 2.864 1.00 . A A . 16 VAL N 1 1 8 4166 1 1 16 VAL O O 4.220 1.644 1.188 1.00 . A A . 16 VAL O 1 1 8 4167 1 1 17 TYR C C 1.921 -1.648 -0.288 1.00 . A A . 17 TYR C 1 1 8 4168 1 1 17 TYR CA C 2.920 -0.485 -0.253 1.00 . A A . 17 TYR CA 1 1 8 4169 1 1 17 TYR CB C 3.854 -0.503 -1.475 1.00 . A A . 17 TYR CB 1 1 8 4170 1 1 17 TYR CD1 C 5.804 -1.995 -0.936 1.00 . A A . 17 TYR CD1 1 1 8 4171 1 1 17 TYR CD2 C 4.310 -2.673 -2.732 1.00 . A A . 17 TYR CD2 1 1 8 4172 1 1 17 TYR CE1 C 6.664 -3.059 -1.249 1.00 . A A . 17 TYR CE1 1 1 8 4173 1 1 17 TYR CE2 C 5.166 -3.744 -3.049 1.00 . A A . 17 TYR CE2 1 1 8 4174 1 1 17 TYR CG C 4.652 -1.771 -1.705 1.00 . A A . 17 TYR CG 1 1 8 4175 1 1 17 TYR CZ C 6.375 -3.908 -2.339 1.00 . A A . 17 TYR CZ 1 1 8 4176 1 1 17 TYR H H 3.811 -1.478 1.377 1.00 . A A . 17 TYR H 1 1 8 4177 1 1 17 TYR HA H 2.355 0.448 -0.261 1.00 . A A . 17 TYR HA 1 1 8 4178 1 1 17 TYR HB2 H 3.284 -0.281 -2.374 1.00 . A A . 17 TYR HB2 1 1 8 4179 1 1 17 TYR HB3 H 4.572 0.308 -1.363 1.00 . A A . 17 TYR HB3 1 1 8 4180 1 1 17 TYR HD1 H 6.040 -1.313 -0.136 1.00 . A A . 17 TYR HD1 1 1 8 4181 1 1 17 TYR HD2 H 3.401 -2.536 -3.294 1.00 . A A . 17 TYR HD2 1 1 8 4182 1 1 17 TYR HE1 H 7.566 -3.200 -0.680 1.00 . A A . 17 TYR HE1 1 1 8 4183 1 1 17 TYR HE2 H 4.892 -4.438 -3.827 1.00 . A A . 17 TYR HE2 1 1 8 4184 1 1 17 TYR HH H 7.029 -5.278 -3.525 1.00 . A A . 17 TYR HH 1 1 8 4185 1 1 17 TYR N N 3.725 -0.549 0.965 1.00 . A A . 17 TYR N 1 1 8 4186 1 1 17 TYR O O 1.800 -2.397 0.677 1.00 . A A . 17 TYR O 1 1 8 4187 1 1 17 TYR OH O 7.221 -4.927 -2.655 1.00 . A A . 17 TYR OH 1 1 8 4188 1 1 18 TYR C C 0.705 -3.631 -2.960 1.00 . A A . 18 TYR C 1 1 8 4189 1 1 18 TYR CA C 0.314 -2.933 -1.664 1.00 . A A . 18 TYR CA 1 1 8 4190 1 1 18 TYR CB C -1.136 -2.449 -1.689 1.00 . A A . 18 TYR CB 1 1 8 4191 1 1 18 TYR CD1 C -1.095 -0.547 -0.047 1.00 . A A . 18 TYR CD1 1 1 8 4192 1 1 18 TYR CD2 C -2.231 -2.607 0.591 1.00 . A A . 18 TYR CD2 1 1 8 4193 1 1 18 TYR CE1 C -1.280 -0.035 1.240 1.00 . A A . 18 TYR CE1 1 1 8 4194 1 1 18 TYR CE2 C -2.502 -2.058 1.854 1.00 . A A . 18 TYR CE2 1 1 8 4195 1 1 18 TYR CG C -1.527 -1.846 -0.361 1.00 . A A . 18 TYR CG 1 1 8 4196 1 1 18 TYR CZ C -1.996 -0.783 2.198 1.00 . A A . 18 TYR CZ 1 1 8 4197 1 1 18 TYR H H 1.236 -1.087 -2.109 1.00 . A A . 18 TYR H 1 1 8 4198 1 1 18 TYR HA H 0.405 -3.655 -0.854 1.00 . A A . 18 TYR HA 1 1 8 4199 1 1 18 TYR HB2 H -1.264 -1.706 -2.477 1.00 . A A . 18 TYR HB2 1 1 8 4200 1 1 18 TYR HB3 H -1.782 -3.300 -1.910 1.00 . A A . 18 TYR HB3 1 1 8 4201 1 1 18 TYR HD1 H -0.580 0.050 -0.786 1.00 . A A . 18 TYR HD1 1 1 8 4202 1 1 18 TYR HD2 H -2.611 -3.589 0.337 1.00 . A A . 18 TYR HD2 1 1 8 4203 1 1 18 TYR HE1 H -0.871 0.936 1.463 1.00 . A A . 18 TYR HE1 1 1 8 4204 1 1 18 TYR HE2 H -3.107 -2.628 2.535 1.00 . A A . 18 TYR HE2 1 1 8 4205 1 1 18 TYR HH H -2.595 -0.905 4.039 1.00 . A A . 18 TYR HH 1 1 8 4206 1 1 18 TYR N N 1.214 -1.814 -1.403 1.00 . A A . 18 TYR N 1 1 8 4207 1 1 18 TYR O O 1.028 -2.988 -3.961 1.00 . A A . 18 TYR O 1 1 8 4208 1 1 18 TYR OH O -2.229 -0.260 3.431 1.00 . A A . 18 TYR OH 1 1 8 4209 1 1 19 PHE C C 0.121 -6.812 -4.417 1.00 . A A . 19 PHE C 1 1 8 4210 1 1 19 PHE CA C 1.197 -5.838 -3.957 1.00 . A A . 19 PHE CA 1 1 8 4211 1 1 19 PHE CB C 2.407 -6.561 -3.365 1.00 . A A . 19 PHE CB 1 1 8 4212 1 1 19 PHE CD1 C 3.962 -7.069 -5.275 1.00 . A A . 19 PHE CD1 1 1 8 4213 1 1 19 PHE CD2 C 2.843 -8.932 -4.170 1.00 . A A . 19 PHE CD2 1 1 8 4214 1 1 19 PHE CE1 C 4.650 -7.971 -6.099 1.00 . A A . 19 PHE CE1 1 1 8 4215 1 1 19 PHE CE2 C 3.532 -9.835 -4.999 1.00 . A A . 19 PHE CE2 1 1 8 4216 1 1 19 PHE CG C 3.076 -7.548 -4.295 1.00 . A A . 19 PHE CG 1 1 8 4217 1 1 19 PHE CZ C 4.447 -9.355 -5.954 1.00 . A A . 19 PHE CZ 1 1 8 4218 1 1 19 PHE H H 0.349 -5.427 -2.078 1.00 . A A . 19 PHE H 1 1 8 4219 1 1 19 PHE HA H 1.531 -5.253 -4.814 1.00 . A A . 19 PHE HA 1 1 8 4220 1 1 19 PHE HB2 H 3.139 -5.808 -3.083 1.00 . A A . 19 PHE HB2 1 1 8 4221 1 1 19 PHE HB3 H 2.114 -7.076 -2.451 1.00 . A A . 19 PHE HB3 1 1 8 4222 1 1 19 PHE HD1 H 4.117 -6.009 -5.402 1.00 . A A . 19 PHE HD1 1 1 8 4223 1 1 19 PHE HD2 H 2.138 -9.313 -3.441 1.00 . A A . 19 PHE HD2 1 1 8 4224 1 1 19 PHE HE1 H 5.331 -7.578 -6.839 1.00 . A A . 19 PHE HE1 1 1 8 4225 1 1 19 PHE HE2 H 3.364 -10.898 -4.900 1.00 . A A . 19 PHE HE2 1 1 8 4226 1 1 19 PHE HZ H 4.982 -10.052 -6.583 1.00 . A A . 19 PHE HZ 1 1 8 4227 1 1 19 PHE N N 0.672 -4.960 -2.927 1.00 . A A . 19 PHE N 1 1 8 4228 1 1 19 PHE O O -0.492 -7.502 -3.602 1.00 . A A . 19 PHE O 1 1 8 4229 1 1 20 ASN C C -0.343 -9.145 -6.538 1.00 . A A . 20 ASN C 1 1 8 4230 1 1 20 ASN CA C -1.030 -7.792 -6.345 1.00 . A A . 20 ASN CA 1 1 8 4231 1 1 20 ASN CB C -1.557 -7.210 -7.653 1.00 . A A . 20 ASN CB 1 1 8 4232 1 1 20 ASN CG C -2.676 -8.085 -8.177 1.00 . A A . 20 ASN CG 1 1 8 4233 1 1 20 ASN H H 0.443 -6.282 -6.352 1.00 . A A . 20 ASN H 1 1 8 4234 1 1 20 ASN HA H -1.882 -7.943 -5.691 1.00 . A A . 20 ASN HA 1 1 8 4235 1 1 20 ASN HB2 H -1.920 -6.200 -7.499 1.00 . A A . 20 ASN HB2 1 1 8 4236 1 1 20 ASN HB3 H -0.751 -7.171 -8.381 1.00 . A A . 20 ASN HB3 1 1 8 4237 1 1 20 ASN HD21 H -4.142 -6.926 -7.367 1.00 . A A . 20 ASN HD21 1 1 8 4238 1 1 20 ASN HD22 H -4.636 -8.359 -8.262 1.00 . A A . 20 ASN HD22 1 1 8 4239 1 1 20 ASN N N -0.120 -6.852 -5.725 1.00 . A A . 20 ASN N 1 1 8 4240 1 1 20 ASN ND2 N -3.919 -7.751 -7.908 1.00 . A A . 20 ASN ND2 1 1 8 4241 1 1 20 ASN O O 0.329 -9.385 -7.543 1.00 . A A . 20 ASN O 1 1 8 4242 1 1 20 ASN OD1 O -2.423 -9.095 -8.818 1.00 . A A . 20 ASN OD1 1 1 8 4243 1 1 21 HIS C C -0.551 -12.326 -6.673 1.00 . A A . 21 HIS C 1 1 8 4244 1 1 21 HIS CA C 0.068 -11.387 -5.617 1.00 . A A . 21 HIS CA 1 1 8 4245 1 1 21 HIS CB C 0.061 -11.964 -4.196 1.00 . A A . 21 HIS CB 1 1 8 4246 1 1 21 HIS CD2 C -2.238 -13.010 -3.780 1.00 . A A . 21 HIS CD2 1 1 8 4247 1 1 21 HIS CE1 C -3.068 -11.487 -2.412 1.00 . A A . 21 HIS CE1 1 1 8 4248 1 1 21 HIS CG C -1.307 -12.035 -3.571 1.00 . A A . 21 HIS CG 1 1 8 4249 1 1 21 HIS H H -1.169 -9.851 -4.812 1.00 . A A . 21 HIS H 1 1 8 4250 1 1 21 HIS HA H 1.111 -11.273 -5.914 1.00 . A A . 21 HIS HA 1 1 8 4251 1 1 21 HIS HB2 H 0.521 -12.950 -4.197 1.00 . A A . 21 HIS HB2 1 1 8 4252 1 1 21 HIS HB3 H 0.681 -11.327 -3.564 1.00 . A A . 21 HIS HB3 1 1 8 4253 1 1 21 HIS HD2 H -2.117 -13.880 -4.411 1.00 . A A . 21 HIS HD2 1 1 8 4254 1 1 21 HIS HE1 H -3.744 -10.950 -1.760 1.00 . A A . 21 HIS HE1 1 1 8 4255 1 1 21 HIS HE2 H -4.208 -13.162 -2.966 1.00 . A A . 21 HIS HE2 1 1 8 4256 1 1 21 HIS N N -0.535 -10.054 -5.583 1.00 . A A . 21 HIS N 1 1 8 4257 1 1 21 HIS ND1 N -1.830 -11.074 -2.709 1.00 . A A . 21 HIS ND1 1 1 8 4258 1 1 21 HIS NE2 N -3.343 -12.648 -3.039 1.00 . A A . 21 HIS NE2 1 1 8 4259 1 1 21 HIS O O -0.173 -13.494 -6.726 1.00 . A A . 21 HIS O 1 1 8 4260 1 1 22 ILE C C -1.199 -12.160 -9.984 1.00 . A A . 22 ILE C 1 1 8 4261 1 1 22 ILE CA C -1.973 -12.554 -8.706 1.00 . A A . 22 ILE CA 1 1 8 4262 1 1 22 ILE CB C -3.496 -12.296 -8.878 1.00 . A A . 22 ILE CB 1 1 8 4263 1 1 22 ILE CD1 C -4.259 -13.700 -6.812 1.00 . A A . 22 ILE CD1 1 1 8 4264 1 1 22 ILE CG1 C -4.311 -12.363 -7.564 1.00 . A A . 22 ILE CG1 1 1 8 4265 1 1 22 ILE CG2 C -4.114 -13.246 -9.918 1.00 . A A . 22 ILE CG2 1 1 8 4266 1 1 22 ILE H H -1.768 -10.871 -7.431 1.00 . A A . 22 ILE H 1 1 8 4267 1 1 22 ILE HA H -1.827 -13.625 -8.556 1.00 . A A . 22 ILE HA 1 1 8 4268 1 1 22 ILE HB H -3.624 -11.285 -9.262 1.00 . A A . 22 ILE HB 1 1 8 4269 1 1 22 ILE HD11 H -4.821 -13.606 -5.882 1.00 . A A . 22 ILE HD11 1 1 8 4270 1 1 22 ILE HD12 H -4.706 -14.490 -7.414 1.00 . A A . 22 ILE HD12 1 1 8 4271 1 1 22 ILE HD13 H -3.228 -13.963 -6.575 1.00 . A A . 22 ILE HD13 1 1 8 4272 1 1 22 ILE HG12 H -3.963 -11.581 -6.891 1.00 . A A . 22 ILE HG12 1 1 8 4273 1 1 22 ILE HG13 H -5.355 -12.139 -7.788 1.00 . A A . 22 ILE HG13 1 1 8 4274 1 1 22 ILE HG21 H -3.707 -13.036 -10.907 1.00 . A A . 22 ILE HG21 1 1 8 4275 1 1 22 ILE HG22 H -3.899 -14.284 -9.662 1.00 . A A . 22 ILE HG22 1 1 8 4276 1 1 22 ILE HG23 H -5.193 -13.103 -9.964 1.00 . A A . 22 ILE HG23 1 1 8 4277 1 1 22 ILE N N -1.463 -11.834 -7.529 1.00 . A A . 22 ILE N 1 1 8 4278 1 1 22 ILE O O -1.188 -12.919 -10.950 1.00 . A A . 22 ILE O 1 1 8 4279 1 1 23 THR C C 1.456 -9.795 -11.029 1.00 . A A . 23 THR C 1 1 8 4280 1 1 23 THR CA C 0.057 -10.390 -11.214 1.00 . A A . 23 THR CA 1 1 8 4281 1 1 23 THR CB C -0.822 -9.248 -11.748 1.00 . A A . 23 THR CB 1 1 8 4282 1 1 23 THR CG2 C -2.231 -9.684 -12.154 1.00 . A A . 23 THR CG2 1 1 8 4283 1 1 23 THR H H -0.601 -10.408 -9.171 1.00 . A A . 23 THR H 1 1 8 4284 1 1 23 THR HA H 0.133 -11.150 -11.991 1.00 . A A . 23 THR HA 1 1 8 4285 1 1 23 THR HB H -0.343 -8.816 -12.628 1.00 . A A . 23 THR HB 1 1 8 4286 1 1 23 THR HG1 H -1.524 -8.611 -10.070 1.00 . A A . 23 THR HG1 1 1 8 4287 1 1 23 THR HG21 H -2.165 -10.471 -12.906 1.00 . A A . 23 THR HG21 1 1 8 4288 1 1 23 THR HG22 H -2.785 -10.059 -11.296 1.00 . A A . 23 THR HG22 1 1 8 4289 1 1 23 THR HG23 H -2.763 -8.833 -12.578 1.00 . A A . 23 THR HG23 1 1 8 4290 1 1 23 THR N N -0.541 -10.990 -10.000 1.00 . A A . 23 THR N 1 1 8 4291 1 1 23 THR O O 2.086 -9.446 -12.025 1.00 . A A . 23 THR O 1 1 8 4292 1 1 23 THR OG1 O -0.917 -8.251 -10.756 1.00 . A A . 23 THR OG1 1 1 8 4293 1 1 24 ASN C C 3.020 -7.370 -9.598 1.00 . A A . 24 ASN C 1 1 8 4294 1 1 24 ASN CA C 3.143 -8.907 -9.414 1.00 . A A . 24 ASN CA 1 1 8 4295 1 1 24 ASN CB C 4.373 -9.558 -10.098 1.00 . A A . 24 ASN CB 1 1 8 4296 1 1 24 ASN CG C 5.692 -9.408 -9.352 1.00 . A A . 24 ASN CG 1 1 8 4297 1 1 24 ASN H H 1.332 -9.889 -9.003 1.00 . A A . 24 ASN H 1 1 8 4298 1 1 24 ASN HA H 3.254 -9.059 -8.341 1.00 . A A . 24 ASN HA 1 1 8 4299 1 1 24 ASN HB2 H 4.195 -10.628 -10.206 1.00 . A A . 24 ASN HB2 1 1 8 4300 1 1 24 ASN HB3 H 4.493 -9.141 -11.098 1.00 . A A . 24 ASN HB3 1 1 8 4301 1 1 24 ASN HD21 H 5.664 -7.404 -9.538 1.00 . A A . 24 ASN HD21 1 1 8 4302 1 1 24 ASN HD22 H 7.124 -8.125 -8.818 1.00 . A A . 24 ASN HD22 1 1 8 4303 1 1 24 ASN N N 1.930 -9.640 -9.786 1.00 . A A . 24 ASN N 1 1 8 4304 1 1 24 ASN ND2 N 6.225 -8.210 -9.256 1.00 . A A . 24 ASN ND2 1 1 8 4305 1 1 24 ASN O O 4.031 -6.669 -9.506 1.00 . A A . 24 ASN O 1 1 8 4306 1 1 24 ASN OD1 O 6.257 -10.365 -8.852 1.00 . A A . 24 ASN OD1 1 1 8 4307 1 1 25 ALA C C 1.827 -4.790 -8.375 1.00 . A A . 25 ALA C 1 1 8 4308 1 1 25 ALA CA C 1.639 -5.356 -9.803 1.00 . A A . 25 ALA CA 1 1 8 4309 1 1 25 ALA CB C 0.264 -4.997 -10.380 1.00 . A A . 25 ALA CB 1 1 8 4310 1 1 25 ALA H H 0.993 -7.389 -9.981 1.00 . A A . 25 ALA H 1 1 8 4311 1 1 25 ALA HA H 2.398 -4.903 -10.445 1.00 . A A . 25 ALA HA 1 1 8 4312 1 1 25 ALA HB1 H 0.173 -3.914 -10.468 1.00 . A A . 25 ALA HB1 1 1 8 4313 1 1 25 ALA HB2 H 0.151 -5.440 -11.370 1.00 . A A . 25 ALA HB2 1 1 8 4314 1 1 25 ALA HB3 H -0.530 -5.365 -9.731 1.00 . A A . 25 ALA HB3 1 1 8 4315 1 1 25 ALA N N 1.820 -6.814 -9.843 1.00 . A A . 25 ALA N 1 1 8 4316 1 1 25 ALA O O 1.662 -5.507 -7.387 1.00 . A A . 25 ALA O 1 1 8 4317 1 1 26 SER C C 1.967 -1.365 -6.962 1.00 . A A . 26 SER C 1 1 8 4318 1 1 26 SER CA C 2.398 -2.836 -6.956 1.00 . A A . 26 SER CA 1 1 8 4319 1 1 26 SER CB C 3.888 -2.912 -6.609 1.00 . A A . 26 SER CB 1 1 8 4320 1 1 26 SER H H 2.277 -2.923 -9.071 1.00 . A A . 26 SER H 1 1 8 4321 1 1 26 SER HA H 1.853 -3.362 -6.177 1.00 . A A . 26 SER HA 1 1 8 4322 1 1 26 SER HB2 H 4.061 -2.439 -5.644 1.00 . A A . 26 SER HB2 1 1 8 4323 1 1 26 SER HB3 H 4.194 -3.954 -6.522 1.00 . A A . 26 SER HB3 1 1 8 4324 1 1 26 SER HG H 4.173 -1.467 -7.880 1.00 . A A . 26 SER HG 1 1 8 4325 1 1 26 SER N N 2.142 -3.494 -8.249 1.00 . A A . 26 SER N 1 1 8 4326 1 1 26 SER O O 2.324 -0.645 -7.895 1.00 . A A . 26 SER O 1 1 8 4327 1 1 26 SER OG O 4.658 -2.258 -7.598 1.00 . A A . 26 SER OG 1 1 8 4328 1 1 27 GLN C C 1.105 0.940 -4.284 1.00 . A A . 27 GLN C 1 1 8 4329 1 1 27 GLN CA C 0.825 0.469 -5.718 1.00 . A A . 27 GLN CA 1 1 8 4330 1 1 27 GLN CB C -0.682 0.589 -6.056 1.00 . A A . 27 GLN CB 1 1 8 4331 1 1 27 GLN CD C -3.111 0.084 -5.351 1.00 . A A . 27 GLN CD 1 1 8 4332 1 1 27 GLN CG C -1.623 -0.091 -5.038 1.00 . A A . 27 GLN CG 1 1 8 4333 1 1 27 GLN H H 1.088 -1.552 -5.131 1.00 . A A . 27 GLN H 1 1 8 4334 1 1 27 GLN HA H 1.376 1.115 -6.402 1.00 . A A . 27 GLN HA 1 1 8 4335 1 1 27 GLN HB2 H -0.938 1.648 -6.100 1.00 . A A . 27 GLN HB2 1 1 8 4336 1 1 27 GLN HB3 H -0.857 0.162 -7.045 1.00 . A A . 27 GLN HB3 1 1 8 4337 1 1 27 GLN HE21 H -3.524 0.556 -3.415 1.00 . A A . 27 GLN HE21 1 1 8 4338 1 1 27 GLN HE22 H -4.908 0.535 -4.524 1.00 . A A . 27 GLN HE22 1 1 8 4339 1 1 27 GLN HG2 H -1.405 -1.155 -4.979 1.00 . A A . 27 GLN HG2 1 1 8 4340 1 1 27 GLN HG3 H -1.443 0.334 -4.053 1.00 . A A . 27 GLN HG3 1 1 8 4341 1 1 27 GLN N N 1.278 -0.915 -5.906 1.00 . A A . 27 GLN N 1 1 8 4342 1 1 27 GLN NE2 N -3.913 0.399 -4.348 1.00 . A A . 27 GLN NE2 1 1 8 4343 1 1 27 GLN O O 1.017 0.148 -3.350 1.00 . A A . 27 GLN O 1 1 8 4344 1 1 27 GLN OE1 O -3.561 -0.046 -6.477 1.00 . A A . 27 GLN OE1 1 1 8 4345 1 1 28 PHE C C 0.048 3.166 -2.151 1.00 . A A . 28 PHE C 1 1 8 4346 1 1 28 PHE CA C 1.433 2.812 -2.728 1.00 . A A . 28 PHE CA 1 1 8 4347 1 1 28 PHE CB C 2.371 4.028 -2.733 1.00 . A A . 28 PHE CB 1 1 8 4348 1 1 28 PHE CD1 C 4.554 2.952 -2.050 1.00 . A A . 28 PHE CD1 1 1 8 4349 1 1 28 PHE CD2 C 4.444 4.066 -4.210 1.00 . A A . 28 PHE CD2 1 1 8 4350 1 1 28 PHE CE1 C 5.892 2.603 -2.293 1.00 . A A . 28 PHE CE1 1 1 8 4351 1 1 28 PHE CE2 C 5.789 3.729 -4.447 1.00 . A A . 28 PHE CE2 1 1 8 4352 1 1 28 PHE CG C 3.821 3.679 -3.008 1.00 . A A . 28 PHE CG 1 1 8 4353 1 1 28 PHE CZ C 6.516 2.998 -3.489 1.00 . A A . 28 PHE CZ 1 1 8 4354 1 1 28 PHE H H 1.494 2.862 -4.860 1.00 . A A . 28 PHE H 1 1 8 4355 1 1 28 PHE HA H 1.863 2.074 -2.050 1.00 . A A . 28 PHE HA 1 1 8 4356 1 1 28 PHE HB2 H 2.020 4.756 -3.466 1.00 . A A . 28 PHE HB2 1 1 8 4357 1 1 28 PHE HB3 H 2.334 4.503 -1.751 1.00 . A A . 28 PHE HB3 1 1 8 4358 1 1 28 PHE HD1 H 4.088 2.649 -1.123 1.00 . A A . 28 PHE HD1 1 1 8 4359 1 1 28 PHE HD2 H 3.897 4.629 -4.952 1.00 . A A . 28 PHE HD2 1 1 8 4360 1 1 28 PHE HE1 H 6.430 2.025 -1.557 1.00 . A A . 28 PHE HE1 1 1 8 4361 1 1 28 PHE HE2 H 6.267 4.032 -5.366 1.00 . A A . 28 PHE HE2 1 1 8 4362 1 1 28 PHE HZ H 7.551 2.744 -3.671 1.00 . A A . 28 PHE HZ 1 1 8 4363 1 1 28 PHE N N 1.367 2.237 -4.080 1.00 . A A . 28 PHE N 1 1 8 4364 1 1 28 PHE O O -0.074 3.385 -0.948 1.00 . A A . 28 PHE O 1 1 8 4365 1 1 29 GLU C C -2.939 2.336 -1.676 1.00 . A A . 29 GLU C 1 1 8 4366 1 1 29 GLU CA C -2.379 3.465 -2.568 1.00 . A A . 29 GLU CA 1 1 8 4367 1 1 29 GLU CB C -3.231 3.738 -3.821 1.00 . A A . 29 GLU CB 1 1 8 4368 1 1 29 GLU CD C -5.320 4.769 -2.669 1.00 . A A . 29 GLU CD 1 1 8 4369 1 1 29 GLU CG C -4.756 3.717 -3.630 1.00 . A A . 29 GLU CG 1 1 8 4370 1 1 29 GLU H H -0.848 2.998 -3.961 1.00 . A A . 29 GLU H 1 1 8 4371 1 1 29 GLU HA H -2.367 4.377 -1.968 1.00 . A A . 29 GLU HA 1 1 8 4372 1 1 29 GLU HB2 H -2.945 4.709 -4.227 1.00 . A A . 29 GLU HB2 1 1 8 4373 1 1 29 GLU HB3 H -2.986 2.989 -4.575 1.00 . A A . 29 GLU HB3 1 1 8 4374 1 1 29 GLU HG2 H -5.215 3.857 -4.610 1.00 . A A . 29 GLU HG2 1 1 8 4375 1 1 29 GLU HG3 H -5.060 2.733 -3.274 1.00 . A A . 29 GLU HG3 1 1 8 4376 1 1 29 GLU N N -0.999 3.203 -2.987 1.00 . A A . 29 GLU N 1 1 8 4377 1 1 29 GLU O O -2.757 1.148 -1.949 1.00 . A A . 29 GLU O 1 1 8 4378 1 1 29 GLU OE1 O -4.684 5.111 -1.649 1.00 . A A . 29 GLU OE1 1 1 8 4379 1 1 29 GLU OE2 O -6.500 5.146 -2.858 1.00 . A A . 29 GLU OE2 1 1 8 4380 1 1 30 ARG C C -5.731 1.776 0.516 1.00 . A A . 30 ARG C 1 1 8 4381 1 1 30 ARG CA C -4.199 1.946 0.482 1.00 . A A . 30 ARG CA 1 1 8 4382 1 1 30 ARG CB C -3.627 2.510 1.805 1.00 . A A . 30 ARG CB 1 1 8 4383 1 1 30 ARG CD C -4.835 4.775 2.177 1.00 . A A . 30 ARG CD 1 1 8 4384 1 1 30 ARG CG C -3.507 4.032 1.982 1.00 . A A . 30 ARG CG 1 1 8 4385 1 1 30 ARG CZ C -6.769 5.521 0.781 1.00 . A A . 30 ARG CZ 1 1 8 4386 1 1 30 ARG H H -3.951 3.724 -0.677 1.00 . A A . 30 ARG H 1 1 8 4387 1 1 30 ARG HA H -3.783 0.945 0.363 1.00 . A A . 30 ARG HA 1 1 8 4388 1 1 30 ARG HB2 H -4.183 2.104 2.650 1.00 . A A . 30 ARG HB2 1 1 8 4389 1 1 30 ARG HB3 H -2.613 2.138 1.900 1.00 . A A . 30 ARG HB3 1 1 8 4390 1 1 30 ARG HD2 H -5.491 4.159 2.794 1.00 . A A . 30 ARG HD2 1 1 8 4391 1 1 30 ARG HD3 H -4.628 5.694 2.727 1.00 . A A . 30 ARG HD3 1 1 8 4392 1 1 30 ARG HE H -4.977 5.226 0.044 1.00 . A A . 30 ARG HE 1 1 8 4393 1 1 30 ARG HG2 H -2.924 4.192 2.890 1.00 . A A . 30 ARG HG2 1 1 8 4394 1 1 30 ARG HG3 H -2.926 4.456 1.165 1.00 . A A . 30 ARG HG3 1 1 8 4395 1 1 30 ARG HH11 H -7.415 4.645 2.402 1.00 . A A . 30 ARG HH11 1 1 8 4396 1 1 30 ARG HH12 H -8.600 5.662 1.698 1.00 . A A . 30 ARG HH12 1 1 8 4397 1 1 30 ARG HH21 H -6.595 5.823 -1.191 1.00 . A A . 30 ARG HH21 1 1 8 4398 1 1 30 ARG HH22 H -8.190 6.173 -0.515 1.00 . A A . 30 ARG HH22 1 1 8 4399 1 1 30 ARG N N -3.698 2.738 -0.652 1.00 . A A . 30 ARG N 1 1 8 4400 1 1 30 ARG NE N -5.506 5.149 0.918 1.00 . A A . 30 ARG NE 1 1 8 4401 1 1 30 ARG NH1 N -7.617 5.415 1.769 1.00 . A A . 30 ARG NH1 1 1 8 4402 1 1 30 ARG NH2 N -7.193 5.975 -0.367 1.00 . A A . 30 ARG NH2 1 1 8 4403 1 1 30 ARG O O -6.439 2.507 -0.177 1.00 . A A . 30 ARG O 1 1 8 4404 1 1 31 PRO C C -8.389 1.858 2.172 1.00 . A A . 31 PRO C 1 1 8 4405 1 1 31 PRO CA C -7.707 0.630 1.530 1.00 . A A . 31 PRO CA 1 1 8 4406 1 1 31 PRO CB C -7.820 -0.580 2.469 1.00 . A A . 31 PRO CB 1 1 8 4407 1 1 31 PRO CD C -5.534 -0.321 1.861 1.00 . A A . 31 PRO CD 1 1 8 4408 1 1 31 PRO CG C -6.568 -1.396 2.171 1.00 . A A . 31 PRO CG 1 1 8 4409 1 1 31 PRO HA H -8.216 0.394 0.595 1.00 . A A . 31 PRO HA 1 1 8 4410 1 1 31 PRO HB2 H -7.788 -0.251 3.509 1.00 . A A . 31 PRO HB2 1 1 8 4411 1 1 31 PRO HB3 H -8.726 -1.155 2.281 1.00 . A A . 31 PRO HB3 1 1 8 4412 1 1 31 PRO HD2 H -5.074 0.021 2.789 1.00 . A A . 31 PRO HD2 1 1 8 4413 1 1 31 PRO HD3 H -4.780 -0.724 1.188 1.00 . A A . 31 PRO HD3 1 1 8 4414 1 1 31 PRO HG2 H -6.271 -2.013 3.020 1.00 . A A . 31 PRO HG2 1 1 8 4415 1 1 31 PRO HG3 H -6.735 -2.009 1.286 1.00 . A A . 31 PRO HG3 1 1 8 4416 1 1 31 PRO N N -6.271 0.774 1.246 1.00 . A A . 31 PRO N 1 1 8 4417 1 1 31 PRO O O -7.733 2.819 2.577 1.00 . A A . 31 PRO O 1 1 8 4418 1 1 32 SER C C -10.728 4.067 2.157 1.00 . A A . 32 SER C 1 1 8 4419 1 1 32 SER CA C -10.632 2.746 2.934 1.00 . A A . 32 SER CA 1 1 8 4420 1 1 32 SER CB C -10.307 2.963 4.420 1.00 . A A . 32 SER CB 1 1 8 4421 1 1 32 SER H H -10.157 0.902 2.030 1.00 . A A . 32 SER H 1 1 8 4422 1 1 32 SER HA H -11.630 2.310 2.913 1.00 . A A . 32 SER HA 1 1 8 4423 1 1 32 SER HB2 H -9.298 3.359 4.532 1.00 . A A . 32 SER HB2 1 1 8 4424 1 1 32 SER HB3 H -11.014 3.680 4.840 1.00 . A A . 32 SER HB3 1 1 8 4425 1 1 32 SER HG H -10.229 1.893 6.048 1.00 . A A . 32 SER HG 1 1 8 4426 1 1 32 SER N N -9.722 1.765 2.315 1.00 . A A . 32 SER N 1 1 8 4427 1 1 32 SER O O -10.174 5.090 2.560 1.00 . A A . 32 SER O 1 1 8 4428 1 1 32 SER OG O -10.422 1.738 5.119 1.00 . A A . 32 SER OG 1 1 8 4429 1 1 33 GLY C C -10.343 5.158 -0.889 1.00 . A A . 33 GLY C 1 1 8 4430 1 1 33 GLY CA C -11.520 5.157 0.073 1.00 . A A . 33 GLY CA 1 1 8 4431 1 1 33 GLY H H -11.842 3.167 0.719 1.00 . A A . 33 GLY H 1 1 8 4432 1 1 33 GLY HA2 H -12.434 5.079 -0.511 1.00 . A A . 33 GLY HA2 1 1 8 4433 1 1 33 GLY HA3 H -11.526 6.107 0.608 1.00 . A A . 33 GLY HA3 1 1 8 4434 1 1 33 GLY N N -11.435 4.039 1.021 1.00 . A A . 33 GLY N 1 1 8 4435 1 1 33 GLY O O -9.745 6.233 -1.117 1.00 . A A . 33 GLY O 1 1 8 4436 1 1 33 GLY OXT O -10.012 4.075 -1.410 1.00 . A A . 33 GLY OXT 1 1 8 4437 2 2 1 NAG C1 C 12.502 1.341 -1.071 1.00 . B A . 101 NAG C1 1 1 8 4438 2 2 1 NAG C2 C 12.055 2.695 -1.664 1.00 . B A . 101 NAG C2 1 1 8 4439 2 2 1 NAG C3 C 10.938 2.351 -2.665 1.00 . B A . 101 NAG C3 1 1 8 4440 2 2 1 NAG C4 C 11.553 1.528 -3.790 1.00 . B A . 101 NAG C4 1 1 8 4441 2 2 1 NAG C5 C 12.148 0.222 -3.251 1.00 . B A . 101 NAG C5 1 1 8 4442 2 2 1 NAG C6 C 12.876 -0.620 -4.298 1.00 . B A . 101 NAG C6 1 1 8 4443 2 2 1 NAG C7 C 11.451 4.936 -0.853 1.00 . B A . 101 NAG C7 1 1 8 4444 2 2 1 NAG C8 C 11.092 5.801 0.364 1.00 . B A . 101 NAG C8 1 1 8 4445 2 2 1 NAG H1 H 11.634 0.817 -0.672 1.00 . B A . 101 NAG H1 1 1 8 4446 2 2 1 NAG H2 H 12.890 3.158 -2.193 1.00 . B A . 101 NAG H2 1 1 8 4447 2 2 1 NAG H3 H 10.160 1.764 -2.163 1.00 . B A . 101 NAG H3 1 1 8 4448 2 2 1 NAG H4 H 12.311 2.125 -4.290 1.00 . B A . 101 NAG H4 1 1 8 4449 2 2 1 NAG H5 H 11.334 -0.365 -2.850 1.00 . B A . 101 NAG H5 1 1 8 4450 2 2 1 NAG H61 H 13.045 -1.622 -3.903 1.00 . B A . 101 NAG H61 1 1 8 4451 2 2 1 NAG H62 H 12.292 -0.707 -5.214 1.00 . B A . 101 NAG H62 1 1 8 4452 2 2 1 NAG H81 H 10.057 5.612 0.653 1.00 . B A . 101 NAG H81 1 1 8 4453 2 2 1 NAG H82 H 11.209 6.856 0.116 1.00 . B A . 101 NAG H82 1 1 8 4454 2 2 1 NAG H83 H 11.750 5.556 1.199 1.00 . B A . 101 NAG H83 1 1 8 4455 2 2 1 NAG HN2 H 11.343 3.256 0.274 1.00 . B A . 101 NAG HN2 1 1 8 4456 2 2 1 NAG HO3 H 10.765 4.338 -2.874 1.00 . B A . 101 NAG HO3 1 1 8 4457 2 2 1 NAG HO4 H 9.991 2.074 -4.759 1.00 . B A . 101 NAG HO4 1 1 8 4458 2 2 1 NAG HO6 H 14.544 0.207 -3.716 1.00 . B A . 101 NAG HO6 1 1 8 4459 2 2 1 NAG N2 N 11.604 3.633 -0.633 1.00 . B A . 101 NAG N2 1 1 8 4460 2 2 1 NAG O3 O 10.351 3.531 -3.271 1.00 . B A . 101 NAG O3 1 1 8 4461 2 2 1 NAG O4 O 10.486 1.243 -4.699 1.00 . B A . 101 NAG O4 1 1 8 4462 2 2 1 NAG O5 O 13.091 0.526 -2.140 1.00 . B A . 101 NAG O5 1 1 8 4463 2 2 1 NAG O6 O 14.142 -0.004 -4.566 1.00 . B A . 101 NAG O6 1 1 8 4464 2 2 1 NAG O7 O 11.565 5.404 -1.984 1.00 . B A . 101 NAG O7 1 1 9 4465 1 1 1 LYS C C -7.945 -0.443 -2.206 1.00 . A A . 1 LYS C 1 1 9 4466 1 1 1 LYS CA C -8.733 0.828 -1.874 1.00 . A A . 1 LYS CA 1 1 9 4467 1 1 1 LYS CB C -9.655 1.241 -3.039 1.00 . A A . 1 LYS CB 1 1 9 4468 1 1 1 LYS CD C -10.942 3.323 -3.896 1.00 . A A . 1 LYS CD 1 1 9 4469 1 1 1 LYS CE C -9.759 3.948 -4.657 1.00 . A A . 1 LYS CE 1 1 9 4470 1 1 1 LYS CG C -10.557 2.444 -2.692 1.00 . A A . 1 LYS CG 1 1 9 4471 1 1 1 LYS H1 H -8.211 2.783 -1.337 1.00 . A A . 1 LYS H1 1 1 9 4472 1 1 1 LYS H2 H -7.220 2.101 -2.440 1.00 . A A . 1 LYS H2 1 1 9 4473 1 1 1 LYS H3 H -7.107 1.666 -0.865 1.00 . A A . 1 LYS H3 1 1 9 4474 1 1 1 LYS HA H -9.332 0.641 -0.982 1.00 . A A . 1 LYS HA 1 1 9 4475 1 1 1 LYS HB2 H -9.029 1.467 -3.902 1.00 . A A . 1 LYS HB2 1 1 9 4476 1 1 1 LYS HB3 H -10.301 0.405 -3.315 1.00 . A A . 1 LYS HB3 1 1 9 4477 1 1 1 LYS HD2 H -11.517 2.716 -4.596 1.00 . A A . 1 LYS HD2 1 1 9 4478 1 1 1 LYS HD3 H -11.592 4.126 -3.542 1.00 . A A . 1 LYS HD3 1 1 9 4479 1 1 1 LYS HE2 H -9.114 3.153 -5.042 1.00 . A A . 1 LYS HE2 1 1 9 4480 1 1 1 LYS HE3 H -10.146 4.502 -5.514 1.00 . A A . 1 LYS HE3 1 1 9 4481 1 1 1 LYS HG2 H -11.470 2.065 -2.232 1.00 . A A . 1 LYS HG2 1 1 9 4482 1 1 1 LYS HG3 H -10.082 3.077 -1.949 1.00 . A A . 1 LYS HG3 1 1 9 4483 1 1 1 LYS HZ1 H -8.068 5.120 -4.308 1.00 . A A . 1 LYS HZ1 1 1 9 4484 1 1 1 LYS HZ2 H -9.436 5.649 -3.420 1.00 . A A . 1 LYS HZ2 1 1 9 4485 1 1 1 LYS HZ3 H -8.603 4.404 -2.970 1.00 . A A . 1 LYS HZ3 1 1 9 4486 1 1 1 LYS N N -7.761 1.910 -1.597 1.00 . A A . 1 LYS N 1 1 9 4487 1 1 1 LYS NZ N -8.937 4.854 -3.825 1.00 . A A . 1 LYS NZ 1 1 9 4488 1 1 1 LYS O O -6.718 -0.382 -2.201 1.00 . A A . 1 LYS O 1 1 9 4489 1 1 2 LEU C C -8.813 -3.483 -4.068 1.00 . A A . 2 LEU C 1 1 9 4490 1 1 2 LEU CA C -7.937 -2.770 -3.021 1.00 . A A . 2 LEU CA 1 1 9 4491 1 1 2 LEU CB C -7.619 -3.772 -1.889 1.00 . A A . 2 LEU CB 1 1 9 4492 1 1 2 LEU CD1 C -6.429 -4.420 0.214 1.00 . A A . 2 LEU CD1 1 1 9 4493 1 1 2 LEU CD2 C -5.181 -3.098 -1.459 1.00 . A A . 2 LEU CD2 1 1 9 4494 1 1 2 LEU CG C -6.567 -3.331 -0.856 1.00 . A A . 2 LEU CG 1 1 9 4495 1 1 2 LEU H H -9.614 -1.622 -2.445 1.00 . A A . 2 LEU H 1 1 9 4496 1 1 2 LEU HA H -6.998 -2.483 -3.488 1.00 . A A . 2 LEU HA 1 1 9 4497 1 1 2 LEU HB2 H -8.546 -4.001 -1.361 1.00 . A A . 2 LEU HB2 1 1 9 4498 1 1 2 LEU HB3 H -7.268 -4.699 -2.346 1.00 . A A . 2 LEU HB3 1 1 9 4499 1 1 2 LEU HD11 H -5.605 -4.190 0.887 1.00 . A A . 2 LEU HD11 1 1 9 4500 1 1 2 LEU HD12 H -7.354 -4.499 0.784 1.00 . A A . 2 LEU HD12 1 1 9 4501 1 1 2 LEU HD13 H -6.225 -5.379 -0.261 1.00 . A A . 2 LEU HD13 1 1 9 4502 1 1 2 LEU HD21 H -4.564 -2.600 -0.717 1.00 . A A . 2 LEU HD21 1 1 9 4503 1 1 2 LEU HD22 H -4.731 -4.048 -1.744 1.00 . A A . 2 LEU HD22 1 1 9 4504 1 1 2 LEU HD23 H -5.226 -2.445 -2.327 1.00 . A A . 2 LEU HD23 1 1 9 4505 1 1 2 LEU HG H -6.901 -2.414 -0.371 1.00 . A A . 2 LEU HG 1 1 9 4506 1 1 2 LEU N N -8.607 -1.576 -2.486 1.00 . A A . 2 LEU N 1 1 9 4507 1 1 2 LEU O O -9.916 -3.914 -3.728 1.00 . A A . 2 LEU O 1 1 9 4508 1 1 3 PRO C C -8.749 -5.975 -6.032 1.00 . A A . 3 PRO C 1 1 9 4509 1 1 3 PRO CA C -8.997 -4.472 -6.326 1.00 . A A . 3 PRO CA 1 1 9 4510 1 1 3 PRO CB C -8.399 -4.056 -7.682 1.00 . A A . 3 PRO CB 1 1 9 4511 1 1 3 PRO CD C -7.323 -2.793 -5.941 1.00 . A A . 3 PRO CD 1 1 9 4512 1 1 3 PRO CG C -7.682 -2.733 -7.421 1.00 . A A . 3 PRO CG 1 1 9 4513 1 1 3 PRO HA H -10.067 -4.270 -6.326 1.00 . A A . 3 PRO HA 1 1 9 4514 1 1 3 PRO HB2 H -7.680 -4.798 -8.027 1.00 . A A . 3 PRO HB2 1 1 9 4515 1 1 3 PRO HB3 H -9.180 -3.928 -8.433 1.00 . A A . 3 PRO HB3 1 1 9 4516 1 1 3 PRO HD2 H -6.346 -3.255 -5.806 1.00 . A A . 3 PRO HD2 1 1 9 4517 1 1 3 PRO HD3 H -7.317 -1.784 -5.529 1.00 . A A . 3 PRO HD3 1 1 9 4518 1 1 3 PRO HG2 H -6.796 -2.620 -8.046 1.00 . A A . 3 PRO HG2 1 1 9 4519 1 1 3 PRO HG3 H -8.375 -1.907 -7.589 1.00 . A A . 3 PRO HG3 1 1 9 4520 1 1 3 PRO N N -8.349 -3.621 -5.326 1.00 . A A . 3 PRO N 1 1 9 4521 1 1 3 PRO O O -7.966 -6.312 -5.135 1.00 . A A . 3 PRO O 1 1 9 4522 1 1 4 PRO C C -7.583 -8.721 -6.703 1.00 . A A . 4 PRO C 1 1 9 4523 1 1 4 PRO CA C -9.078 -8.344 -6.719 1.00 . A A . 4 PRO CA 1 1 9 4524 1 1 4 PRO CB C -9.812 -8.973 -7.909 1.00 . A A . 4 PRO CB 1 1 9 4525 1 1 4 PRO CD C -10.349 -6.650 -7.830 1.00 . A A . 4 PRO CD 1 1 9 4526 1 1 4 PRO CG C -10.970 -8.009 -8.149 1.00 . A A . 4 PRO CG 1 1 9 4527 1 1 4 PRO HA H -9.545 -8.705 -5.802 1.00 . A A . 4 PRO HA 1 1 9 4528 1 1 4 PRO HB2 H -9.169 -8.986 -8.791 1.00 . A A . 4 PRO HB2 1 1 9 4529 1 1 4 PRO HB3 H -10.165 -9.979 -7.680 1.00 . A A . 4 PRO HB3 1 1 9 4530 1 1 4 PRO HD2 H -9.868 -6.254 -8.725 1.00 . A A . 4 PRO HD2 1 1 9 4531 1 1 4 PRO HD3 H -11.117 -5.962 -7.475 1.00 . A A . 4 PRO HD3 1 1 9 4532 1 1 4 PRO HG2 H -11.333 -8.056 -9.177 1.00 . A A . 4 PRO HG2 1 1 9 4533 1 1 4 PRO HG3 H -11.776 -8.218 -7.444 1.00 . A A . 4 PRO HG3 1 1 9 4534 1 1 4 PRO N N -9.342 -6.905 -6.810 1.00 . A A . 4 PRO N 1 1 9 4535 1 1 4 PRO O O -6.838 -8.421 -7.638 1.00 . A A . 4 PRO O 1 1 9 4536 1 1 5 GLY C C -4.726 -9.037 -4.940 1.00 . A A . 5 GLY C 1 1 9 4537 1 1 5 GLY CA C -5.809 -9.970 -5.495 1.00 . A A . 5 GLY CA 1 1 9 4538 1 1 5 GLY H H -7.798 -9.563 -4.873 1.00 . A A . 5 GLY H 1 1 9 4539 1 1 5 GLY HA2 H -5.867 -10.834 -4.834 1.00 . A A . 5 GLY HA2 1 1 9 4540 1 1 5 GLY HA3 H -5.472 -10.317 -6.472 1.00 . A A . 5 GLY HA3 1 1 9 4541 1 1 5 GLY N N -7.150 -9.390 -5.627 1.00 . A A . 5 GLY N 1 1 9 4542 1 1 5 GLY O O -3.577 -9.459 -4.849 1.00 . A A . 5 GLY O 1 1 9 4543 1 1 6 TRP C C -4.049 -6.973 -2.479 1.00 . A A . 6 TRP C 1 1 9 4544 1 1 6 TRP CA C -4.115 -6.828 -4.004 1.00 . A A . 6 TRP CA 1 1 9 4545 1 1 6 TRP CB C -4.530 -5.414 -4.419 1.00 . A A . 6 TRP CB 1 1 9 4546 1 1 6 TRP CD1 C -5.264 -5.464 -6.848 1.00 . A A . 6 TRP CD1 1 1 9 4547 1 1 6 TRP CD2 C -3.334 -4.367 -6.565 1.00 . A A . 6 TRP CD2 1 1 9 4548 1 1 6 TRP CE2 C -3.657 -4.292 -7.954 1.00 . A A . 6 TRP CE2 1 1 9 4549 1 1 6 TRP CE3 C -2.116 -3.783 -6.161 1.00 . A A . 6 TRP CE3 1 1 9 4550 1 1 6 TRP CG C -4.393 -5.102 -5.881 1.00 . A A . 6 TRP CG 1 1 9 4551 1 1 6 TRP CH2 C -1.619 -3.098 -8.456 1.00 . A A . 6 TRP CH2 1 1 9 4552 1 1 6 TRP CZ2 C -2.826 -3.666 -8.893 1.00 . A A . 6 TRP CZ2 1 1 9 4553 1 1 6 TRP CZ3 C -1.269 -3.166 -7.097 1.00 . A A . 6 TRP CZ3 1 1 9 4554 1 1 6 TRP H H -6.006 -7.457 -4.682 1.00 . A A . 6 TRP H 1 1 9 4555 1 1 6 TRP HA H -3.118 -7.000 -4.387 1.00 . A A . 6 TRP HA 1 1 9 4556 1 1 6 TRP HB2 H -5.563 -5.238 -4.118 1.00 . A A . 6 TRP HB2 1 1 9 4557 1 1 6 TRP HB3 H -3.910 -4.710 -3.872 1.00 . A A . 6 TRP HB3 1 1 9 4558 1 1 6 TRP HD1 H -6.159 -6.042 -6.680 1.00 . A A . 6 TRP HD1 1 1 9 4559 1 1 6 TRP HE1 H -5.353 -5.105 -8.935 1.00 . A A . 6 TRP HE1 1 1 9 4560 1 1 6 TRP HE3 H -1.829 -3.821 -5.121 1.00 . A A . 6 TRP HE3 1 1 9 4561 1 1 6 TRP HH2 H -0.961 -2.615 -9.164 1.00 . A A . 6 TRP HH2 1 1 9 4562 1 1 6 TRP HZ2 H -3.103 -3.633 -9.936 1.00 . A A . 6 TRP HZ2 1 1 9 4563 1 1 6 TRP HZ3 H -0.342 -2.738 -6.761 1.00 . A A . 6 TRP HZ3 1 1 9 4564 1 1 6 TRP N N -5.052 -7.786 -4.595 1.00 . A A . 6 TRP N 1 1 9 4565 1 1 6 TRP NE1 N -4.848 -4.971 -8.068 1.00 . A A . 6 TRP NE1 1 1 9 4566 1 1 6 TRP O O -5.074 -6.857 -1.813 1.00 . A A . 6 TRP O 1 1 9 4567 1 1 7 GLU C C -1.307 -6.770 0.036 1.00 . A A . 7 GLU C 1 1 9 4568 1 1 7 GLU CA C -2.655 -7.344 -0.466 1.00 . A A . 7 GLU CA 1 1 9 4569 1 1 7 GLU CB C -2.972 -8.788 -0.014 1.00 . A A . 7 GLU CB 1 1 9 4570 1 1 7 GLU CD C -0.965 -10.336 -0.462 1.00 . A A . 7 GLU CD 1 1 9 4571 1 1 7 GLU CG C -2.401 -9.968 -0.831 1.00 . A A . 7 GLU CG 1 1 9 4572 1 1 7 GLU H H -2.036 -7.360 -2.507 1.00 . A A . 7 GLU H 1 1 9 4573 1 1 7 GLU HA H -3.412 -6.722 0.015 1.00 . A A . 7 GLU HA 1 1 9 4574 1 1 7 GLU HB2 H -2.711 -8.900 1.037 1.00 . A A . 7 GLU HB2 1 1 9 4575 1 1 7 GLU HB3 H -4.058 -8.889 -0.062 1.00 . A A . 7 GLU HB3 1 1 9 4576 1 1 7 GLU HG2 H -3.023 -10.842 -0.625 1.00 . A A . 7 GLU HG2 1 1 9 4577 1 1 7 GLU HG3 H -2.478 -9.769 -1.901 1.00 . A A . 7 GLU HG3 1 1 9 4578 1 1 7 GLU N N -2.855 -7.208 -1.916 1.00 . A A . 7 GLU N 1 1 9 4579 1 1 7 GLU O O -0.385 -6.525 -0.741 1.00 . A A . 7 GLU O 1 1 9 4580 1 1 7 GLU OE1 O -0.669 -10.470 0.750 1.00 . A A . 7 GLU OE1 1 1 9 4581 1 1 7 GLU OE2 O -0.106 -10.484 -1.355 1.00 . A A . 7 GLU OE2 1 1 9 4582 1 1 8 LYS C C 1.302 -6.295 1.822 1.00 . A A . 8 LYS C 1 1 9 4583 1 1 8 LYS CA C -0.125 -5.748 2.010 1.00 . A A . 8 LYS CA 1 1 9 4584 1 1 8 LYS CB C -0.455 -5.505 3.500 1.00 . A A . 8 LYS CB 1 1 9 4585 1 1 8 LYS CD C -1.062 -7.886 4.442 1.00 . A A . 8 LYS CD 1 1 9 4586 1 1 8 LYS CE C -0.522 -8.892 3.422 1.00 . A A . 8 LYS CE 1 1 9 4587 1 1 8 LYS CG C -0.179 -6.624 4.527 1.00 . A A . 8 LYS CG 1 1 9 4588 1 1 8 LYS H H -2.019 -6.704 1.927 1.00 . A A . 8 LYS H 1 1 9 4589 1 1 8 LYS HA H -0.126 -4.761 1.539 1.00 . A A . 8 LYS HA 1 1 9 4590 1 1 8 LYS HB2 H 0.133 -4.643 3.816 1.00 . A A . 8 LYS HB2 1 1 9 4591 1 1 8 LYS HB3 H -1.501 -5.213 3.593 1.00 . A A . 8 LYS HB3 1 1 9 4592 1 1 8 LYS HD2 H -1.069 -8.365 5.422 1.00 . A A . 8 LYS HD2 1 1 9 4593 1 1 8 LYS HD3 H -2.085 -7.601 4.191 1.00 . A A . 8 LYS HD3 1 1 9 4594 1 1 8 LYS HE2 H -0.454 -8.402 2.451 1.00 . A A . 8 LYS HE2 1 1 9 4595 1 1 8 LYS HE3 H 0.495 -9.177 3.702 1.00 . A A . 8 LYS HE3 1 1 9 4596 1 1 8 LYS HG2 H 0.875 -6.900 4.484 1.00 . A A . 8 LYS HG2 1 1 9 4597 1 1 8 LYS HG3 H -0.347 -6.185 5.510 1.00 . A A . 8 LYS HG3 1 1 9 4598 1 1 8 LYS HZ1 H -1.107 -10.520 2.362 1.00 . A A . 8 LYS HZ1 1 1 9 4599 1 1 8 LYS HZ2 H -1.206 -10.762 4.010 1.00 . A A . 8 LYS HZ2 1 1 9 4600 1 1 8 LYS HZ3 H -2.340 -9.855 3.208 1.00 . A A . 8 LYS HZ3 1 1 9 4601 1 1 8 LYS N N -1.219 -6.495 1.351 1.00 . A A . 8 LYS N 1 1 9 4602 1 1 8 LYS NZ N -1.364 -10.096 3.268 1.00 . A A . 8 LYS NZ 1 1 9 4603 1 1 8 LYS O O 1.569 -7.478 2.036 1.00 . A A . 8 LYS O 1 1 9 4604 1 1 9 ARG C C 4.554 -4.584 1.667 1.00 . A A . 9 ARG C 1 1 9 4605 1 1 9 ARG CA C 3.646 -5.733 1.188 1.00 . A A . 9 ARG CA 1 1 9 4606 1 1 9 ARG CB C 3.684 -5.927 -0.332 1.00 . A A . 9 ARG CB 1 1 9 4607 1 1 9 ARG CD C 4.680 -8.221 -1.101 1.00 . A A . 9 ARG CD 1 1 9 4608 1 1 9 ARG CG C 4.882 -6.715 -0.863 1.00 . A A . 9 ARG CG 1 1 9 4609 1 1 9 ARG CZ C 2.772 -9.610 -0.278 1.00 . A A . 9 ARG CZ 1 1 9 4610 1 1 9 ARG H H 2.031 -4.455 1.230 1.00 . A A . 9 ARG H 1 1 9 4611 1 1 9 ARG HA H 3.937 -6.645 1.706 1.00 . A A . 9 ARG HA 1 1 9 4612 1 1 9 ARG HB2 H 2.776 -6.428 -0.668 1.00 . A A . 9 ARG HB2 1 1 9 4613 1 1 9 ARG HB3 H 3.680 -4.938 -0.790 1.00 . A A . 9 ARG HB3 1 1 9 4614 1 1 9 ARG HD2 H 4.212 -8.339 -2.079 1.00 . A A . 9 ARG HD2 1 1 9 4615 1 1 9 ARG HD3 H 5.655 -8.710 -1.139 1.00 . A A . 9 ARG HD3 1 1 9 4616 1 1 9 ARG HE H 3.976 -8.575 0.884 1.00 . A A . 9 ARG HE 1 1 9 4617 1 1 9 ARG HG2 H 5.062 -6.274 -1.828 1.00 . A A . 9 ARG HG2 1 1 9 4618 1 1 9 ARG HG3 H 5.757 -6.551 -0.239 1.00 . A A . 9 ARG HG3 1 1 9 4619 1 1 9 ARG HH11 H 3.094 -10.049 -2.225 1.00 . A A . 9 ARG HH11 1 1 9 4620 1 1 9 ARG HH12 H 1.512 -10.470 -1.530 1.00 . A A . 9 ARG HH12 1 1 9 4621 1 1 9 ARG HH21 H 1.904 -9.051 1.414 1.00 . A A . 9 ARG HH21 1 1 9 4622 1 1 9 ARG HH22 H 1.017 -10.229 0.493 1.00 . A A . 9 ARG HH22 1 1 9 4623 1 1 9 ARG N N 2.250 -5.418 1.476 1.00 . A A . 9 ARG N 1 1 9 4624 1 1 9 ARG NE N 3.843 -8.857 -0.071 1.00 . A A . 9 ARG NE 1 1 9 4625 1 1 9 ARG NH1 N 2.496 -10.161 -1.430 1.00 . A A . 9 ARG NH1 1 1 9 4626 1 1 9 ARG NH2 N 1.919 -9.770 0.695 1.00 . A A . 9 ARG NH2 1 1 9 4627 1 1 9 ARG O O 4.065 -3.503 1.999 1.00 . A A . 9 ARG O 1 1 9 4628 1 1 10 MET C C 8.208 -3.951 1.624 1.00 . A A . 10 MET C 1 1 9 4629 1 1 10 MET CA C 6.812 -3.803 2.239 1.00 . A A . 10 MET CA 1 1 9 4630 1 1 10 MET CB C 6.887 -3.977 3.767 1.00 . A A . 10 MET CB 1 1 9 4631 1 1 10 MET CE C 9.067 -4.118 6.371 1.00 . A A . 10 MET CE 1 1 9 4632 1 1 10 MET CG C 7.576 -2.789 4.446 1.00 . A A . 10 MET CG 1 1 9 4633 1 1 10 MET H H 6.277 -5.663 1.391 1.00 . A A . 10 MET H 1 1 9 4634 1 1 10 MET HA H 6.434 -2.810 2.013 1.00 . A A . 10 MET HA 1 1 9 4635 1 1 10 MET HB2 H 5.879 -4.058 4.174 1.00 . A A . 10 MET HB2 1 1 9 4636 1 1 10 MET HB3 H 7.424 -4.897 4.001 1.00 . A A . 10 MET HB3 1 1 9 4637 1 1 10 MET HE1 H 9.939 -3.747 5.832 1.00 . A A . 10 MET HE1 1 1 9 4638 1 1 10 MET HE2 H 9.324 -4.263 7.420 1.00 . A A . 10 MET HE2 1 1 9 4639 1 1 10 MET HE3 H 8.754 -5.071 5.944 1.00 . A A . 10 MET HE3 1 1 9 4640 1 1 10 MET HG2 H 8.576 -2.667 4.040 1.00 . A A . 10 MET HG2 1 1 9 4641 1 1 10 MET HG3 H 7.012 -1.888 4.214 1.00 . A A . 10 MET HG3 1 1 9 4642 1 1 10 MET N N 5.875 -4.788 1.693 1.00 . A A . 10 MET N 1 1 9 4643 1 1 10 MET O O 8.681 -5.064 1.402 1.00 . A A . 10 MET O 1 1 9 4644 1 1 10 MET SD S 7.717 -2.914 6.247 1.00 . A A . 10 MET SD 1 1 9 4645 1 1 11 PHE C C 11.219 -2.796 2.094 1.00 . A A . 11 PHE C 1 1 9 4646 1 1 11 PHE CA C 10.252 -2.751 0.902 1.00 . A A . 11 PHE CA 1 1 9 4647 1 1 11 PHE CB C 10.474 -1.454 0.114 1.00 . A A . 11 PHE CB 1 1 9 4648 1 1 11 PHE CD1 C 10.143 -2.161 -2.282 1.00 . A A . 11 PHE CD1 1 1 9 4649 1 1 11 PHE CD2 C 8.611 -0.503 -1.350 1.00 . A A . 11 PHE CD2 1 1 9 4650 1 1 11 PHE CE1 C 9.486 -2.082 -3.522 1.00 . A A . 11 PHE CE1 1 1 9 4651 1 1 11 PHE CE2 C 7.964 -0.426 -2.598 1.00 . A A . 11 PHE CE2 1 1 9 4652 1 1 11 PHE CG C 9.713 -1.373 -1.195 1.00 . A A . 11 PHE CG 1 1 9 4653 1 1 11 PHE CZ C 8.397 -1.211 -3.680 1.00 . A A . 11 PHE CZ 1 1 9 4654 1 1 11 PHE H H 8.375 -1.935 1.506 1.00 . A A . 11 PHE H 1 1 9 4655 1 1 11 PHE HA H 10.466 -3.588 0.238 1.00 . A A . 11 PHE HA 1 1 9 4656 1 1 11 PHE HB2 H 10.215 -0.612 0.750 1.00 . A A . 11 PHE HB2 1 1 9 4657 1 1 11 PHE HB3 H 11.535 -1.361 -0.121 1.00 . A A . 11 PHE HB3 1 1 9 4658 1 1 11 PHE HD1 H 11.000 -2.809 -2.183 1.00 . A A . 11 PHE HD1 1 1 9 4659 1 1 11 PHE HD2 H 8.231 0.091 -0.527 1.00 . A A . 11 PHE HD2 1 1 9 4660 1 1 11 PHE HE1 H 9.820 -2.682 -4.357 1.00 . A A . 11 PHE HE1 1 1 9 4661 1 1 11 PHE HE2 H 7.106 0.213 -2.733 1.00 . A A . 11 PHE HE2 1 1 9 4662 1 1 11 PHE HZ H 7.890 -1.145 -4.633 1.00 . A A . 11 PHE HZ 1 1 9 4663 1 1 11 PHE N N 8.858 -2.816 1.341 1.00 . A A . 11 PHE N 1 1 9 4664 1 1 11 PHE O O 10.853 -2.425 3.209 1.00 . A A . 11 PHE O 1 1 9 4665 1 1 12 ALA C C 13.717 -1.675 3.492 1.00 . A A . 12 ALA C 1 1 9 4666 1 1 12 ALA CA C 13.565 -3.067 2.843 1.00 . A A . 12 ALA CA 1 1 9 4667 1 1 12 ALA CB C 14.875 -3.517 2.187 1.00 . A A . 12 ALA CB 1 1 9 4668 1 1 12 ALA H H 12.760 -3.436 0.916 1.00 . A A . 12 ALA H 1 1 9 4669 1 1 12 ALA HA H 13.325 -3.771 3.642 1.00 . A A . 12 ALA HA 1 1 9 4670 1 1 12 ALA HB1 H 15.148 -2.834 1.381 1.00 . A A . 12 ALA HB1 1 1 9 4671 1 1 12 ALA HB2 H 15.672 -3.521 2.932 1.00 . A A . 12 ALA HB2 1 1 9 4672 1 1 12 ALA HB3 H 14.765 -4.526 1.787 1.00 . A A . 12 ALA HB3 1 1 9 4673 1 1 12 ALA N N 12.495 -3.125 1.838 1.00 . A A . 12 ALA N 1 1 9 4674 1 1 12 ALA O O 14.098 -1.574 4.653 1.00 . A A . 12 ALA O 1 1 9 4675 1 1 13 ASN C C 12.016 0.952 4.291 1.00 . A A . 13 ASN C 1 1 9 4676 1 1 13 ASN CA C 13.174 0.762 3.273 1.00 . A A . 13 ASN CA 1 1 9 4677 1 1 13 ASN CB C 12.937 1.670 2.049 1.00 . A A . 13 ASN CB 1 1 9 4678 1 1 13 ASN CG C 14.051 1.667 1.005 1.00 . A A . 13 ASN CG 1 1 9 4679 1 1 13 ASN H H 13.030 -0.787 1.833 1.00 . A A . 13 ASN H 1 1 9 4680 1 1 13 ASN HA H 14.103 1.056 3.766 1.00 . A A . 13 ASN HA 1 1 9 4681 1 1 13 ASN HB2 H 11.999 1.365 1.598 1.00 . A A . 13 ASN HB2 1 1 9 4682 1 1 13 ASN HB3 H 12.831 2.703 2.379 1.00 . A A . 13 ASN HB3 1 1 9 4683 1 1 13 ASN HD21 H 14.600 2.063 -0.826 1.00 . A A . 13 ASN HD21 1 1 9 4684 1 1 13 ASN N N 13.313 -0.613 2.783 1.00 . A A . 13 ASN N 1 1 9 4685 1 1 13 ASN ND2 N 13.778 1.991 -0.252 1.00 . A A . 13 ASN ND2 1 1 9 4686 1 1 13 ASN O O 11.482 2.058 4.397 1.00 . A A . 13 ASN O 1 1 9 4687 1 1 13 ASN OD1 O 15.213 1.461 1.321 1.00 . A A . 13 ASN OD1 1 1 9 4688 1 1 14 GLY C C 9.101 0.543 5.081 1.00 . A A . 14 GLY C 1 1 9 4689 1 1 14 GLY CA C 10.303 -0.129 5.757 1.00 . A A . 14 GLY CA 1 1 9 4690 1 1 14 GLY H H 11.984 -1.010 4.797 1.00 . A A . 14 GLY H 1 1 9 4691 1 1 14 GLY HA2 H 10.040 -1.163 5.977 1.00 . A A . 14 GLY HA2 1 1 9 4692 1 1 14 GLY HA3 H 10.504 0.387 6.697 1.00 . A A . 14 GLY HA3 1 1 9 4693 1 1 14 GLY N N 11.520 -0.120 4.931 1.00 . A A . 14 GLY N 1 1 9 4694 1 1 14 GLY O O 8.268 1.146 5.751 1.00 . A A . 14 GLY O 1 1 9 4695 1 1 15 THR C C 6.937 0.348 2.524 1.00 . A A . 15 THR C 1 1 9 4696 1 1 15 THR CA C 8.081 1.258 2.947 1.00 . A A . 15 THR CA 1 1 9 4697 1 1 15 THR CB C 8.803 1.918 1.763 1.00 . A A . 15 THR CB 1 1 9 4698 1 1 15 THR CG2 C 7.888 2.808 0.922 1.00 . A A . 15 THR CG2 1 1 9 4699 1 1 15 THR H H 9.651 -0.152 3.253 1.00 . A A . 15 THR H 1 1 9 4700 1 1 15 THR HA H 7.666 2.067 3.537 1.00 . A A . 15 THR HA 1 1 9 4701 1 1 15 THR HB H 9.215 1.148 1.121 1.00 . A A . 15 THR HB 1 1 9 4702 1 1 15 THR HG1 H 10.198 2.410 3.079 1.00 . A A . 15 THR HG1 1 1 9 4703 1 1 15 THR HG21 H 7.525 3.643 1.523 1.00 . A A . 15 THR HG21 1 1 9 4704 1 1 15 THR HG22 H 8.444 3.196 0.067 1.00 . A A . 15 THR HG22 1 1 9 4705 1 1 15 THR HG23 H 7.039 2.234 0.554 1.00 . A A . 15 THR HG23 1 1 9 4706 1 1 15 THR N N 9.033 0.485 3.744 1.00 . A A . 15 THR N 1 1 9 4707 1 1 15 THR O O 7.159 -0.570 1.736 1.00 . A A . 15 THR O 1 1 9 4708 1 1 15 THR OG1 O 9.866 2.730 2.219 1.00 . A A . 15 THR OG1 1 1 9 4709 1 1 16 VAL C C 3.715 0.108 1.734 1.00 . A A . 16 VAL C 1 1 9 4710 1 1 16 VAL CA C 4.579 -0.312 2.917 1.00 . A A . 16 VAL CA 1 1 9 4711 1 1 16 VAL CB C 3.733 -0.346 4.212 1.00 . A A . 16 VAL CB 1 1 9 4712 1 1 16 VAL CG1 C 2.341 -0.979 4.034 1.00 . A A . 16 VAL CG1 1 1 9 4713 1 1 16 VAL CG2 C 4.457 -1.170 5.280 1.00 . A A . 16 VAL CG2 1 1 9 4714 1 1 16 VAL H H 5.626 1.364 3.696 1.00 . A A . 16 VAL H 1 1 9 4715 1 1 16 VAL HA H 4.942 -1.323 2.735 1.00 . A A . 16 VAL HA 1 1 9 4716 1 1 16 VAL HB H 3.598 0.673 4.580 1.00 . A A . 16 VAL HB 1 1 9 4717 1 1 16 VAL HG11 H 1.843 -1.052 5.001 1.00 . A A . 16 VAL HG11 1 1 9 4718 1 1 16 VAL HG12 H 1.719 -0.367 3.384 1.00 . A A . 16 VAL HG12 1 1 9 4719 1 1 16 VAL HG13 H 2.434 -1.980 3.609 1.00 . A A . 16 VAL HG13 1 1 9 4720 1 1 16 VAL HG21 H 5.442 -0.752 5.478 1.00 . A A . 16 VAL HG21 1 1 9 4721 1 1 16 VAL HG22 H 3.886 -1.160 6.209 1.00 . A A . 16 VAL HG22 1 1 9 4722 1 1 16 VAL HG23 H 4.552 -2.203 4.936 1.00 . A A . 16 VAL HG23 1 1 9 4723 1 1 16 VAL N N 5.731 0.592 3.053 1.00 . A A . 16 VAL N 1 1 9 4724 1 1 16 VAL O O 3.350 1.278 1.576 1.00 . A A . 16 VAL O 1 1 9 4725 1 1 17 TYR C C 1.649 -1.998 -0.416 1.00 . A A . 17 TYR C 1 1 9 4726 1 1 17 TYR CA C 2.580 -0.783 -0.294 1.00 . A A . 17 TYR CA 1 1 9 4727 1 1 17 TYR CB C 3.552 -0.675 -1.486 1.00 . A A . 17 TYR CB 1 1 9 4728 1 1 17 TYR CD1 C 5.645 -1.989 -1.039 1.00 . A A . 17 TYR CD1 1 1 9 4729 1 1 17 TYR CD2 C 4.088 -2.864 -2.696 1.00 . A A . 17 TYR CD2 1 1 9 4730 1 1 17 TYR CE1 C 6.552 -3.020 -1.333 1.00 . A A . 17 TYR CE1 1 1 9 4731 1 1 17 TYR CE2 C 4.990 -3.904 -2.988 1.00 . A A . 17 TYR CE2 1 1 9 4732 1 1 17 TYR CG C 4.430 -1.887 -1.738 1.00 . A A . 17 TYR CG 1 1 9 4733 1 1 17 TYR CZ C 6.239 -3.962 -2.333 1.00 . A A . 17 TYR CZ 1 1 9 4734 1 1 17 TYR H H 3.626 -1.844 1.186 1.00 . A A . 17 TYR H 1 1 9 4735 1 1 17 TYR HA H 1.965 0.117 -0.261 1.00 . A A . 17 TYR HA 1 1 9 4736 1 1 17 TYR HB2 H 2.997 -0.458 -2.394 1.00 . A A . 17 TYR HB2 1 1 9 4737 1 1 17 TYR HB3 H 4.222 0.173 -1.313 1.00 . A A . 17 TYR HB3 1 1 9 4738 1 1 17 TYR HD1 H 5.899 -1.235 -0.310 1.00 . A A . 17 TYR HD1 1 1 9 4739 1 1 17 TYR HD2 H 3.150 -2.827 -3.230 1.00 . A A . 17 TYR HD2 1 1 9 4740 1 1 17 TYR HE1 H 7.501 -3.048 -0.825 1.00 . A A . 17 TYR HE1 1 1 9 4741 1 1 17 TYR HE2 H 4.737 -4.669 -3.706 1.00 . A A . 17 TYR HE2 1 1 9 4742 1 1 17 TYR HH H 7.979 -4.801 -2.234 1.00 . A A . 17 TYR HH 1 1 9 4743 1 1 17 TYR N N 3.374 -0.890 0.923 1.00 . A A . 17 TYR N 1 1 9 4744 1 1 17 TYR O O 1.673 -2.898 0.424 1.00 . A A . 17 TYR O 1 1 9 4745 1 1 17 TYR OH O 7.126 -4.945 -2.648 1.00 . A A . 17 TYR OH 1 1 9 4746 1 1 18 TYR C C 0.336 -3.818 -3.096 1.00 . A A . 18 TYR C 1 1 9 4747 1 1 18 TYR CA C -0.046 -3.170 -1.767 1.00 . A A . 18 TYR CA 1 1 9 4748 1 1 18 TYR CB C -1.510 -2.731 -1.642 1.00 . A A . 18 TYR CB 1 1 9 4749 1 1 18 TYR CD1 C -1.329 -1.261 0.400 1.00 . A A . 18 TYR CD1 1 1 9 4750 1 1 18 TYR CD2 C -2.476 -3.393 0.617 1.00 . A A . 18 TYR CD2 1 1 9 4751 1 1 18 TYR CE1 C -1.355 -1.095 1.790 1.00 . A A . 18 TYR CE1 1 1 9 4752 1 1 18 TYR CE2 C -2.604 -3.181 2.001 1.00 . A A . 18 TYR CE2 1 1 9 4753 1 1 18 TYR CG C -1.832 -2.434 -0.188 1.00 . A A . 18 TYR CG 1 1 9 4754 1 1 18 TYR CZ C -2.004 -2.052 2.600 1.00 . A A . 18 TYR CZ 1 1 9 4755 1 1 18 TYR H H 0.758 -1.227 -2.072 1.00 . A A . 18 TYR H 1 1 9 4756 1 1 18 TYR HA H 0.101 -3.938 -1.006 1.00 . A A . 18 TYR HA 1 1 9 4757 1 1 18 TYR HB2 H -1.691 -1.846 -2.255 1.00 . A A . 18 TYR HB2 1 1 9 4758 1 1 18 TYR HB3 H -2.155 -3.535 -1.999 1.00 . A A . 18 TYR HB3 1 1 9 4759 1 1 18 TYR HD1 H -0.842 -0.520 -0.215 1.00 . A A . 18 TYR HD1 1 1 9 4760 1 1 18 TYR HD2 H -2.864 -4.294 0.171 1.00 . A A . 18 TYR HD2 1 1 9 4761 1 1 18 TYR HE1 H -0.847 -0.239 2.191 1.00 . A A . 18 TYR HE1 1 1 9 4762 1 1 18 TYR HE2 H -3.118 -3.895 2.623 1.00 . A A . 18 TYR HE2 1 1 9 4763 1 1 18 TYR HH H -1.500 -1.187 4.264 1.00 . A A . 18 TYR HH 1 1 9 4764 1 1 18 TYR N N 0.847 -2.047 -1.479 1.00 . A A . 18 TYR N 1 1 9 4765 1 1 18 TYR O O 0.622 -3.147 -4.091 1.00 . A A . 18 TYR O 1 1 9 4766 1 1 18 TYR OH O -2.064 -1.895 3.949 1.00 . A A . 18 TYR OH 1 1 9 4767 1 1 19 PHE C C -0.154 -6.978 -4.610 1.00 . A A . 19 PHE C 1 1 9 4768 1 1 19 PHE CA C 0.911 -6.009 -4.114 1.00 . A A . 19 PHE CA 1 1 9 4769 1 1 19 PHE CB C 2.101 -6.746 -3.499 1.00 . A A . 19 PHE CB 1 1 9 4770 1 1 19 PHE CD1 C 2.300 -9.114 -4.401 1.00 . A A . 19 PHE CD1 1 1 9 4771 1 1 19 PHE CD2 C 3.939 -7.439 -5.066 1.00 . A A . 19 PHE CD2 1 1 9 4772 1 1 19 PHE CE1 C 3.032 -10.098 -5.090 1.00 . A A . 19 PHE CE1 1 1 9 4773 1 1 19 PHE CE2 C 4.662 -8.416 -5.760 1.00 . A A . 19 PHE CE2 1 1 9 4774 1 1 19 PHE CG C 2.772 -7.785 -4.368 1.00 . A A . 19 PHE CG 1 1 9 4775 1 1 19 PHE CZ C 4.220 -9.752 -5.760 1.00 . A A . 19 PHE CZ 1 1 9 4776 1 1 19 PHE H H 0.111 -5.638 -2.217 1.00 . A A . 19 PHE H 1 1 9 4777 1 1 19 PHE HA H 1.265 -5.409 -4.950 1.00 . A A . 19 PHE HA 1 1 9 4778 1 1 19 PHE HB2 H 2.843 -6.003 -3.212 1.00 . A A . 19 PHE HB2 1 1 9 4779 1 1 19 PHE HB3 H 1.781 -7.236 -2.582 1.00 . A A . 19 PHE HB3 1 1 9 4780 1 1 19 PHE HD1 H 1.390 -9.397 -3.884 1.00 . A A . 19 PHE HD1 1 1 9 4781 1 1 19 PHE HD2 H 4.304 -6.425 -5.059 1.00 . A A . 19 PHE HD2 1 1 9 4782 1 1 19 PHE HE1 H 2.690 -11.122 -5.094 1.00 . A A . 19 PHE HE1 1 1 9 4783 1 1 19 PHE HE2 H 5.563 -8.115 -6.271 1.00 . A A . 19 PHE HE2 1 1 9 4784 1 1 19 PHE HZ H 4.787 -10.512 -6.278 1.00 . A A . 19 PHE HZ 1 1 9 4785 1 1 19 PHE N N 0.377 -5.148 -3.071 1.00 . A A . 19 PHE N 1 1 9 4786 1 1 19 PHE O O -0.820 -7.642 -3.817 1.00 . A A . 19 PHE O 1 1 9 4787 1 1 20 ASN C C -0.627 -9.367 -6.709 1.00 . A A . 20 ASN C 1 1 9 4788 1 1 20 ASN CA C -1.240 -7.969 -6.567 1.00 . A A . 20 ASN CA 1 1 9 4789 1 1 20 ASN CB C -1.672 -7.395 -7.912 1.00 . A A . 20 ASN CB 1 1 9 4790 1 1 20 ASN CG C -2.782 -8.253 -8.481 1.00 . A A . 20 ASN CG 1 1 9 4791 1 1 20 ASN H H 0.308 -6.526 -6.534 1.00 . A A . 20 ASN H 1 1 9 4792 1 1 20 ASN HA H -2.126 -8.040 -5.948 1.00 . A A . 20 ASN HA 1 1 9 4793 1 1 20 ASN HB2 H -2.016 -6.374 -7.788 1.00 . A A . 20 ASN HB2 1 1 9 4794 1 1 20 ASN HB3 H -0.821 -7.383 -8.588 1.00 . A A . 20 ASN HB3 1 1 9 4795 1 1 20 ASN HD21 H -4.205 -7.115 -7.606 1.00 . A A . 20 ASN HD21 1 1 9 4796 1 1 20 ASN HD22 H -4.806 -8.505 -8.457 1.00 . A A . 20 ASN HD22 1 1 9 4797 1 1 20 ASN N N -0.313 -7.058 -5.929 1.00 . A A . 20 ASN N 1 1 9 4798 1 1 20 ASN ND2 N -4.019 -7.937 -8.163 1.00 . A A . 20 ASN ND2 1 1 9 4799 1 1 20 ASN O O 0.158 -9.621 -7.626 1.00 . A A . 20 ASN O 1 1 9 4800 1 1 20 ASN OD1 O -2.520 -9.231 -9.166 1.00 . A A . 20 ASN OD1 1 1 9 4801 1 1 21 HIS C C -0.831 -12.505 -7.045 1.00 . A A . 21 HIS C 1 1 9 4802 1 1 21 HIS CA C -0.439 -11.648 -5.827 1.00 . A A . 21 HIS CA 1 1 9 4803 1 1 21 HIS CB C -0.748 -12.342 -4.492 1.00 . A A . 21 HIS CB 1 1 9 4804 1 1 21 HIS CD2 C -2.597 -14.059 -4.920 1.00 . A A . 21 HIS CD2 1 1 9 4805 1 1 21 HIS CE1 C -4.233 -13.137 -3.766 1.00 . A A . 21 HIS CE1 1 1 9 4806 1 1 21 HIS CG C -2.149 -12.895 -4.364 1.00 . A A . 21 HIS CG 1 1 9 4807 1 1 21 HIS H H -1.720 -10.073 -5.132 1.00 . A A . 21 HIS H 1 1 9 4808 1 1 21 HIS HA H 0.643 -11.541 -5.888 1.00 . A A . 21 HIS HA 1 1 9 4809 1 1 21 HIS HB2 H -0.040 -13.159 -4.361 1.00 . A A . 21 HIS HB2 1 1 9 4810 1 1 21 HIS HB3 H -0.565 -11.639 -3.680 1.00 . A A . 21 HIS HB3 1 1 9 4811 1 1 21 HIS HD2 H -2.017 -14.734 -5.535 1.00 . A A . 21 HIS HD2 1 1 9 4812 1 1 21 HIS HE1 H -5.196 -12.970 -3.305 1.00 . A A . 21 HIS HE1 1 1 9 4813 1 1 21 HIS HE2 H -4.534 -14.951 -4.780 1.00 . A A . 21 HIS HE2 1 1 9 4814 1 1 21 HIS N N -1.007 -10.296 -5.828 1.00 . A A . 21 HIS N 1 1 9 4815 1 1 21 HIS ND1 N -3.182 -12.318 -3.630 1.00 . A A . 21 HIS ND1 1 1 9 4816 1 1 21 HIS NE2 N -3.915 -14.190 -4.539 1.00 . A A . 21 HIS NE2 1 1 9 4817 1 1 21 HIS O O -0.318 -13.612 -7.186 1.00 . A A . 21 HIS O 1 1 9 4818 1 1 22 ILE C C -1.245 -12.268 -10.352 1.00 . A A . 22 ILE C 1 1 9 4819 1 1 22 ILE CA C -2.131 -12.694 -9.158 1.00 . A A . 22 ILE CA 1 1 9 4820 1 1 22 ILE CB C -3.648 -12.445 -9.403 1.00 . A A . 22 ILE CB 1 1 9 4821 1 1 22 ILE CD1 C -5.986 -12.516 -8.259 1.00 . A A . 22 ILE CD1 1 1 9 4822 1 1 22 ILE CG1 C -4.485 -12.821 -8.150 1.00 . A A . 22 ILE CG1 1 1 9 4823 1 1 22 ILE CG2 C -4.156 -13.225 -10.631 1.00 . A A . 22 ILE CG2 1 1 9 4824 1 1 22 ILE H H -2.084 -11.077 -7.783 1.00 . A A . 22 ILE H 1 1 9 4825 1 1 22 ILE HA H -1.989 -13.768 -9.028 1.00 . A A . 22 ILE HA 1 1 9 4826 1 1 22 ILE HB H -3.798 -11.384 -9.601 1.00 . A A . 22 ILE HB 1 1 9 4827 1 1 22 ILE HD11 H -6.466 -13.195 -8.962 1.00 . A A . 22 ILE HD11 1 1 9 4828 1 1 22 ILE HD12 H -6.451 -12.653 -7.282 1.00 . A A . 22 ILE HD12 1 1 9 4829 1 1 22 ILE HD13 H -6.136 -11.485 -8.581 1.00 . A A . 22 ILE HD13 1 1 9 4830 1 1 22 ILE HG12 H -4.356 -13.883 -7.935 1.00 . A A . 22 ILE HG12 1 1 9 4831 1 1 22 ILE HG13 H -4.126 -12.261 -7.288 1.00 . A A . 22 ILE HG13 1 1 9 4832 1 1 22 ILE HG21 H -3.635 -12.904 -11.533 1.00 . A A . 22 ILE HG21 1 1 9 4833 1 1 22 ILE HG22 H -4.001 -14.294 -10.489 1.00 . A A . 22 ILE HG22 1 1 9 4834 1 1 22 ILE HG23 H -5.214 -13.031 -10.803 1.00 . A A . 22 ILE HG23 1 1 9 4835 1 1 22 ILE N N -1.710 -12.008 -7.928 1.00 . A A . 22 ILE N 1 1 9 4836 1 1 22 ILE O O -1.163 -12.989 -11.344 1.00 . A A . 22 ILE O 1 1 9 4837 1 1 23 THR C C 1.563 -9.957 -11.047 1.00 . A A . 23 THR C 1 1 9 4838 1 1 23 THR CA C 0.170 -10.492 -11.385 1.00 . A A . 23 THR CA 1 1 9 4839 1 1 23 THR CB C -0.626 -9.303 -11.947 1.00 . A A . 23 THR CB 1 1 9 4840 1 1 23 THR CG2 C -2.001 -9.682 -12.497 1.00 . A A . 23 THR CG2 1 1 9 4841 1 1 23 THR H H -0.672 -10.576 -9.412 1.00 . A A . 23 THR H 1 1 9 4842 1 1 23 THR HA H 0.301 -11.220 -12.186 1.00 . A A . 23 THR HA 1 1 9 4843 1 1 23 THR HB H -0.055 -8.848 -12.758 1.00 . A A . 23 THR HB 1 1 9 4844 1 1 23 THR HG1 H -1.479 -8.715 -10.324 1.00 . A A . 23 THR HG1 1 1 9 4845 1 1 23 THR HG21 H -1.885 -10.437 -13.276 1.00 . A A . 23 THR HG21 1 1 9 4846 1 1 23 THR HG22 H -2.639 -10.080 -11.709 1.00 . A A . 23 THR HG22 1 1 9 4847 1 1 23 THR HG23 H -2.473 -8.799 -12.928 1.00 . A A . 23 THR HG23 1 1 9 4848 1 1 23 THR N N -0.552 -11.121 -10.258 1.00 . A A . 23 THR N 1 1 9 4849 1 1 23 THR O O 2.287 -9.580 -11.965 1.00 . A A . 23 THR O 1 1 9 4850 1 1 23 THR OG1 O -0.790 -8.350 -10.923 1.00 . A A . 23 THR OG1 1 1 9 4851 1 1 24 ASN C C 3.103 -7.668 -9.467 1.00 . A A . 24 ASN C 1 1 9 4852 1 1 24 ASN CA C 3.143 -9.207 -9.271 1.00 . A A . 24 ASN CA 1 1 9 4853 1 1 24 ASN CB C 4.396 -9.914 -9.846 1.00 . A A . 24 ASN CB 1 1 9 4854 1 1 24 ASN CG C 5.660 -9.814 -9.000 1.00 . A A . 24 ASN CG 1 1 9 4855 1 1 24 ASN H H 1.272 -10.145 -9.039 1.00 . A A . 24 ASN H 1 1 9 4856 1 1 24 ASN HA H 3.148 -9.362 -8.192 1.00 . A A . 24 ASN HA 1 1 9 4857 1 1 24 ASN HB2 H 4.182 -10.978 -9.963 1.00 . A A . 24 ASN HB2 1 1 9 4858 1 1 24 ASN HB3 H 4.616 -9.511 -10.835 1.00 . A A . 24 ASN HB3 1 1 9 4859 1 1 24 ASN HD21 H 5.711 -7.807 -9.153 1.00 . A A . 24 ASN HD21 1 1 9 4860 1 1 24 ASN HD22 H 7.087 -8.588 -8.336 1.00 . A A . 24 ASN HD22 1 1 9 4861 1 1 24 ASN N N 1.937 -9.882 -9.762 1.00 . A A . 24 ASN N 1 1 9 4862 1 1 24 ASN ND2 N 6.221 -8.636 -8.842 1.00 . A A . 24 ASN ND2 1 1 9 4863 1 1 24 ASN O O 4.134 -7.009 -9.311 1.00 . A A . 24 ASN O 1 1 9 4864 1 1 24 ASN OD1 O 6.161 -10.799 -8.483 1.00 . A A . 24 ASN OD1 1 1 9 4865 1 1 25 ALA C C 1.949 -5.044 -8.336 1.00 . A A . 25 ALA C 1 1 9 4866 1 1 25 ALA CA C 1.834 -5.597 -9.776 1.00 . A A . 25 ALA CA 1 1 9 4867 1 1 25 ALA CB C 0.518 -5.184 -10.445 1.00 . A A . 25 ALA CB 1 1 9 4868 1 1 25 ALA H H 1.106 -7.598 -9.988 1.00 . A A . 25 ALA H 1 1 9 4869 1 1 25 ALA HA H 2.654 -5.181 -10.363 1.00 . A A . 25 ALA HA 1 1 9 4870 1 1 25 ALA HB1 H 0.481 -4.099 -10.546 1.00 . A A . 25 ALA HB1 1 1 9 4871 1 1 25 ALA HB2 H 0.453 -5.631 -11.438 1.00 . A A . 25 ALA HB2 1 1 9 4872 1 1 25 ALA HB3 H -0.332 -5.515 -9.848 1.00 . A A . 25 ALA HB3 1 1 9 4873 1 1 25 ALA N N 1.949 -7.061 -9.800 1.00 . A A . 25 ALA N 1 1 9 4874 1 1 25 ALA O O 1.670 -5.755 -7.370 1.00 . A A . 25 ALA O 1 1 9 4875 1 1 26 SER C C 2.300 -1.648 -6.873 1.00 . A A . 26 SER C 1 1 9 4876 1 1 26 SER CA C 2.571 -3.153 -6.855 1.00 . A A . 26 SER CA 1 1 9 4877 1 1 26 SER CB C 4.025 -3.380 -6.426 1.00 . A A . 26 SER CB 1 1 9 4878 1 1 26 SER H H 2.573 -3.214 -8.978 1.00 . A A . 26 SER H 1 1 9 4879 1 1 26 SER HA H 1.920 -3.616 -6.116 1.00 . A A . 26 SER HA 1 1 9 4880 1 1 26 SER HB2 H 4.201 -2.902 -5.465 1.00 . A A . 26 SER HB2 1 1 9 4881 1 1 26 SER HB3 H 4.209 -4.444 -6.300 1.00 . A A . 26 SER HB3 1 1 9 4882 1 1 26 SER HG H 4.558 -1.970 -7.655 1.00 . A A . 26 SER HG 1 1 9 4883 1 1 26 SER N N 2.332 -3.771 -8.172 1.00 . A A . 26 SER N 1 1 9 4884 1 1 26 SER O O 2.838 -0.958 -7.744 1.00 . A A . 26 SER O 1 1 9 4885 1 1 26 SER OG O 4.911 -2.831 -7.385 1.00 . A A . 26 SER OG 1 1 9 4886 1 1 27 GLN C C 1.062 0.773 -4.379 1.00 . A A . 27 GLN C 1 1 9 4887 1 1 27 GLN CA C 1.113 0.274 -5.829 1.00 . A A . 27 GLN CA 1 1 9 4888 1 1 27 GLN CB C -0.268 0.484 -6.488 1.00 . A A . 27 GLN CB 1 1 9 4889 1 1 27 GLN CD C 0.534 1.494 -8.685 1.00 . A A . 27 GLN CD 1 1 9 4890 1 1 27 GLN CG C -0.265 0.374 -8.021 1.00 . A A . 27 GLN CG 1 1 9 4891 1 1 27 GLN H H 1.130 -1.754 -5.198 1.00 . A A . 27 GLN H 1 1 9 4892 1 1 27 GLN HA H 1.852 0.887 -6.345 1.00 . A A . 27 GLN HA 1 1 9 4893 1 1 27 GLN HB2 H -0.968 -0.248 -6.082 1.00 . A A . 27 GLN HB2 1 1 9 4894 1 1 27 GLN HB3 H -0.641 1.475 -6.228 1.00 . A A . 27 GLN HB3 1 1 9 4895 1 1 27 GLN HE21 H 2.284 0.426 -8.661 1.00 . A A . 27 GLN HE21 1 1 9 4896 1 1 27 GLN HE22 H 2.298 2.041 -9.397 1.00 . A A . 27 GLN HE22 1 1 9 4897 1 1 27 GLN HG2 H 0.131 -0.591 -8.328 1.00 . A A . 27 GLN HG2 1 1 9 4898 1 1 27 GLN HG3 H -1.295 0.437 -8.375 1.00 . A A . 27 GLN HG3 1 1 9 4899 1 1 27 GLN N N 1.508 -1.137 -5.919 1.00 . A A . 27 GLN N 1 1 9 4900 1 1 27 GLN NE2 N 1.810 1.288 -8.944 1.00 . A A . 27 GLN NE2 1 1 9 4901 1 1 27 GLN O O 0.800 0.017 -3.444 1.00 . A A . 27 GLN O 1 1 9 4902 1 1 27 GLN OE1 O 0.031 2.570 -8.955 1.00 . A A . 27 GLN OE1 1 1 9 4903 1 1 28 PHE C C -0.041 3.181 -2.359 1.00 . A A . 28 PHE C 1 1 9 4904 1 1 28 PHE CA C 1.326 2.745 -2.903 1.00 . A A . 28 PHE CA 1 1 9 4905 1 1 28 PHE CB C 2.275 3.947 -2.984 1.00 . A A . 28 PHE CB 1 1 9 4906 1 1 28 PHE CD1 C 4.452 2.927 -2.219 1.00 . A A . 28 PHE CD1 1 1 9 4907 1 1 28 PHE CD2 C 4.309 3.796 -4.491 1.00 . A A . 28 PHE CD2 1 1 9 4908 1 1 28 PHE CE1 C 5.790 2.568 -2.439 1.00 . A A . 28 PHE CE1 1 1 9 4909 1 1 28 PHE CE2 C 5.648 3.426 -4.714 1.00 . A A . 28 PHE CE2 1 1 9 4910 1 1 28 PHE CG C 3.713 3.553 -3.239 1.00 . A A . 28 PHE CG 1 1 9 4911 1 1 28 PHE CZ C 6.390 2.818 -3.685 1.00 . A A . 28 PHE CZ 1 1 9 4912 1 1 28 PHE H H 1.493 2.655 -5.012 1.00 . A A . 28 PHE H 1 1 9 4913 1 1 28 PHE HA H 1.738 2.046 -2.176 1.00 . A A . 28 PHE HA 1 1 9 4914 1 1 28 PHE HB2 H 1.931 4.628 -3.764 1.00 . A A . 28 PHE HB2 1 1 9 4915 1 1 28 PHE HB3 H 2.248 4.489 -2.039 1.00 . A A . 28 PHE HB3 1 1 9 4916 1 1 28 PHE HD1 H 3.996 2.710 -1.264 1.00 . A A . 28 PHE HD1 1 1 9 4917 1 1 28 PHE HD2 H 3.740 4.265 -5.281 1.00 . A A . 28 PHE HD2 1 1 9 4918 1 1 28 PHE HE1 H 6.352 2.095 -1.651 1.00 . A A . 28 PHE HE1 1 1 9 4919 1 1 28 PHE HE2 H 6.109 3.614 -5.673 1.00 . A A . 28 PHE HE2 1 1 9 4920 1 1 28 PHE HZ H 7.419 2.538 -3.854 1.00 . A A . 28 PHE HZ 1 1 9 4921 1 1 28 PHE N N 1.280 2.083 -4.210 1.00 . A A . 28 PHE N 1 1 9 4922 1 1 28 PHE O O -0.098 3.646 -1.221 1.00 . A A . 28 PHE O 1 1 9 4923 1 1 29 GLU C C -2.755 2.167 -1.498 1.00 . A A . 29 GLU C 1 1 9 4924 1 1 29 GLU CA C -2.478 3.244 -2.565 1.00 . A A . 29 GLU CA 1 1 9 4925 1 1 29 GLU CB C -3.566 3.244 -3.658 1.00 . A A . 29 GLU CB 1 1 9 4926 1 1 29 GLU CD C -6.038 3.850 -4.043 1.00 . A A . 29 GLU CD 1 1 9 4927 1 1 29 GLU CG C -4.794 4.033 -3.169 1.00 . A A . 29 GLU CG 1 1 9 4928 1 1 29 GLU H H -1.046 2.647 -4.045 1.00 . A A . 29 GLU H 1 1 9 4929 1 1 29 GLU HA H -2.486 4.220 -2.078 1.00 . A A . 29 GLU HA 1 1 9 4930 1 1 29 GLU HB2 H -3.184 3.723 -4.560 1.00 . A A . 29 GLU HB2 1 1 9 4931 1 1 29 GLU HB3 H -3.845 2.217 -3.896 1.00 . A A . 29 GLU HB3 1 1 9 4932 1 1 29 GLU HG2 H -5.057 3.718 -2.160 1.00 . A A . 29 GLU HG2 1 1 9 4933 1 1 29 GLU HG3 H -4.530 5.092 -3.116 1.00 . A A . 29 GLU HG3 1 1 9 4934 1 1 29 GLU N N -1.134 3.047 -3.125 1.00 . A A . 29 GLU N 1 1 9 4935 1 1 29 GLU O O -2.255 1.046 -1.586 1.00 . A A . 29 GLU O 1 1 9 4936 1 1 29 GLU OE1 O -6.697 2.793 -3.900 1.00 . A A . 29 GLU OE1 1 1 9 4937 1 1 29 GLU OE2 O -6.438 4.812 -4.735 1.00 . A A . 29 GLU OE2 1 1 9 4938 1 1 30 ARG C C -5.282 1.587 0.993 1.00 . A A . 30 ARG C 1 1 9 4939 1 1 30 ARG CA C -3.771 1.692 0.725 1.00 . A A . 30 ARG CA 1 1 9 4940 1 1 30 ARG CB C -2.961 2.251 1.919 1.00 . A A . 30 ARG CB 1 1 9 4941 1 1 30 ARG CD C -0.538 2.745 2.703 1.00 . A A . 30 ARG CD 1 1 9 4942 1 1 30 ARG CG C -1.496 2.529 1.526 1.00 . A A . 30 ARG CG 1 1 9 4943 1 1 30 ARG CZ C 1.391 3.950 1.622 1.00 . A A . 30 ARG CZ 1 1 9 4944 1 1 30 ARG H H -4.010 3.410 -0.491 1.00 . A A . 30 ARG H 1 1 9 4945 1 1 30 ARG HA H -3.409 0.686 0.512 1.00 . A A . 30 ARG HA 1 1 9 4946 1 1 30 ARG HB2 H -3.416 3.178 2.272 1.00 . A A . 30 ARG HB2 1 1 9 4947 1 1 30 ARG HB3 H -2.979 1.526 2.732 1.00 . A A . 30 ARG HB3 1 1 9 4948 1 1 30 ARG HD2 H -0.840 3.630 3.267 1.00 . A A . 30 ARG HD2 1 1 9 4949 1 1 30 ARG HD3 H -0.590 1.884 3.370 1.00 . A A . 30 ARG HD3 1 1 9 4950 1 1 30 ARG HE H 1.463 2.090 2.259 1.00 . A A . 30 ARG HE 1 1 9 4951 1 1 30 ARG HG2 H -1.121 1.697 0.932 1.00 . A A . 30 ARG HG2 1 1 9 4952 1 1 30 ARG HG3 H -1.477 3.425 0.910 1.00 . A A . 30 ARG HG3 1 1 9 4953 1 1 30 ARG HH11 H -0.207 5.125 1.775 1.00 . A A . 30 ARG HH11 1 1 9 4954 1 1 30 ARG HH12 H 1.146 5.829 0.935 1.00 . A A . 30 ARG HH12 1 1 9 4955 1 1 30 ARG HH21 H 3.086 2.962 1.260 1.00 . A A . 30 ARG HH21 1 1 9 4956 1 1 30 ARG HH22 H 3.066 4.643 0.724 1.00 . A A . 30 ARG HH22 1 1 9 4957 1 1 30 ARG N N -3.536 2.518 -0.468 1.00 . A A . 30 ARG N 1 1 9 4958 1 1 30 ARG NE N 0.850 2.894 2.218 1.00 . A A . 30 ARG NE 1 1 9 4959 1 1 30 ARG NH1 N 0.749 5.086 1.476 1.00 . A A . 30 ARG NH1 1 1 9 4960 1 1 30 ARG NH2 N 2.615 3.864 1.163 1.00 . A A . 30 ARG NH2 1 1 9 4961 1 1 30 ARG O O -6.036 2.410 0.470 1.00 . A A . 30 ARG O 1 1 9 4962 1 1 31 PRO C C -8.124 1.483 2.296 1.00 . A A . 31 PRO C 1 1 9 4963 1 1 31 PRO CA C -7.214 0.318 1.906 1.00 . A A . 31 PRO CA 1 1 9 4964 1 1 31 PRO CB C -7.308 -0.813 2.933 1.00 . A A . 31 PRO CB 1 1 9 4965 1 1 31 PRO CD C -5.000 -0.462 2.392 1.00 . A A . 31 PRO CD 1 1 9 4966 1 1 31 PRO CG C -5.994 -1.563 2.748 1.00 . A A . 31 PRO CG 1 1 9 4967 1 1 31 PRO HA H -7.556 -0.017 0.950 1.00 . A A . 31 PRO HA 1 1 9 4968 1 1 31 PRO HB2 H -7.349 -0.401 3.944 1.00 . A A . 31 PRO HB2 1 1 9 4969 1 1 31 PRO HB3 H -8.172 -1.450 2.747 1.00 . A A . 31 PRO HB3 1 1 9 4970 1 1 31 PRO HD2 H -4.533 -0.083 3.302 1.00 . A A . 31 PRO HD2 1 1 9 4971 1 1 31 PRO HD3 H -4.249 -0.862 1.713 1.00 . A A . 31 PRO HD3 1 1 9 4972 1 1 31 PRO HG2 H -5.694 -2.104 3.647 1.00 . A A . 31 PRO HG2 1 1 9 4973 1 1 31 PRO HG3 H -6.088 -2.243 1.907 1.00 . A A . 31 PRO HG3 1 1 9 4974 1 1 31 PRO N N -5.776 0.595 1.761 1.00 . A A . 31 PRO N 1 1 9 4975 1 1 31 PRO O O -9.297 1.522 1.941 1.00 . A A . 31 PRO O 1 1 9 4976 1 1 32 SER C C -8.518 4.774 2.832 1.00 . A A . 32 SER C 1 1 9 4977 1 1 32 SER CA C -8.102 3.574 3.702 1.00 . A A . 32 SER CA 1 1 9 4978 1 1 32 SER CB C -7.091 4.034 4.762 1.00 . A A . 32 SER CB 1 1 9 4979 1 1 32 SER H H -6.545 2.217 3.086 1.00 . A A . 32 SER H 1 1 9 4980 1 1 32 SER HA H -9.000 3.237 4.219 1.00 . A A . 32 SER HA 1 1 9 4981 1 1 32 SER HB2 H -7.488 4.885 5.317 1.00 . A A . 32 SER HB2 1 1 9 4982 1 1 32 SER HB3 H -6.919 3.217 5.463 1.00 . A A . 32 SER HB3 1 1 9 4983 1 1 32 SER HG H -5.936 5.278 3.810 1.00 . A A . 32 SER HG 1 1 9 4984 1 1 32 SER N N -7.525 2.422 3.004 1.00 . A A . 32 SER N 1 1 9 4985 1 1 32 SER O O -9.005 5.752 3.397 1.00 . A A . 32 SER O 1 1 9 4986 1 1 32 SER OG O -5.858 4.384 4.157 1.00 . A A . 32 SER OG 1 1 9 4987 1 1 33 GLY C C -8.840 5.454 -0.844 1.00 . A A . 33 GLY C 1 1 9 4988 1 1 33 GLY CA C -8.686 5.863 0.612 1.00 . A A . 33 GLY CA 1 1 9 4989 1 1 33 GLY H H -7.892 3.945 1.065 1.00 . A A . 33 GLY H 1 1 9 4990 1 1 33 GLY HA2 H -9.632 6.299 0.932 1.00 . A A . 33 GLY HA2 1 1 9 4991 1 1 33 GLY HA3 H -7.919 6.633 0.662 1.00 . A A . 33 GLY HA3 1 1 9 4992 1 1 33 GLY N N -8.323 4.748 1.505 1.00 . A A . 33 GLY N 1 1 9 4993 1 1 33 GLY O O -8.164 4.488 -1.264 1.00 . A A . 33 GLY O 1 1 9 4994 1 1 33 GLY OXT O -9.638 6.085 -1.569 1.00 . A A . 33 GLY OXT 1 1 9 4995 2 2 1 NAG C1 C 12.529 1.772 -0.960 1.00 . B A . 101 NAG C1 1 1 9 4996 2 2 1 NAG C2 C 11.793 3.091 -1.303 1.00 . B A . 101 NAG C2 1 1 9 4997 2 2 1 NAG C3 C 10.623 2.779 -2.249 1.00 . B A . 101 NAG C3 1 1 9 4998 2 2 1 NAG C4 C 11.169 2.119 -3.511 1.00 . B A . 101 NAG C4 1 1 9 4999 2 2 1 NAG C5 C 11.849 0.797 -3.155 1.00 . B A . 101 NAG C5 1 1 9 5000 2 2 1 NAG C6 C 12.442 0.038 -4.341 1.00 . B A . 101 NAG C6 1 1 9 5001 2 2 1 NAG C7 C 11.055 5.084 -0.086 1.00 . B A . 101 NAG C7 1 1 9 5002 2 2 1 NAG C8 C 10.711 5.717 1.270 1.00 . B A . 101 NAG C8 1 1 9 5003 2 2 1 NAG H1 H 11.877 1.109 -0.393 1.00 . B A . 101 NAG H1 1 1 9 5004 2 2 1 NAG H2 H 12.492 3.753 -1.817 1.00 . B A . 101 NAG H2 1 1 9 5005 2 2 1 NAG H3 H 9.919 2.104 -1.753 1.00 . B A . 101 NAG H3 1 1 9 5006 2 2 1 NAG H4 H 11.867 2.794 -4.003 1.00 . B A . 101 NAG H4 1 1 9 5007 2 2 1 NAG H5 H 11.116 0.163 -2.672 1.00 . B A . 101 NAG H5 1 1 9 5008 2 2 1 NAG H61 H 12.733 -0.964 -4.024 1.00 . B A . 101 NAG H61 1 1 9 5009 2 2 1 NAG H62 H 11.721 -0.058 -5.153 1.00 . B A . 101 NAG H62 1 1 9 5010 2 2 1 NAG H81 H 10.887 6.792 1.229 1.00 . B A . 101 NAG H81 1 1 9 5011 2 2 1 NAG H82 H 11.335 5.285 2.053 1.00 . B A . 101 NAG H82 1 1 9 5012 2 2 1 NAG H83 H 9.661 5.535 1.500 1.00 . B A . 101 NAG H83 1 1 9 5013 2 2 1 NAG HN2 H 11.054 3.236 0.724 1.00 . B A . 101 NAG HN2 1 1 9 5014 2 2 1 NAG HO3 H 10.302 4.758 -2.166 1.00 . B A . 101 NAG HO3 1 1 9 5015 2 2 1 NAG HO4 H 9.548 2.723 -4.318 1.00 . B A . 101 NAG HO4 1 1 9 5016 2 2 1 NAG HO6 H 14.145 0.928 -4.007 1.00 . B A . 101 NAG HO6 1 1 9 5017 2 2 1 NAG N2 N 11.313 3.777 -0.096 1.00 . B A . 101 NAG N2 1 1 9 5018 2 2 1 NAG O3 O 9.935 3.988 -2.664 1.00 . B A . 101 NAG O3 1 1 9 5019 2 2 1 NAG O4 O 10.041 1.892 -4.358 1.00 . B A . 101 NAG O4 1 1 9 5020 2 2 1 NAG O5 O 12.937 1.078 -2.187 1.00 . B A . 101 NAG O5 1 1 9 5021 2 2 1 NAG O6 O 13.612 0.739 -4.786 1.00 . B A . 101 NAG O6 1 1 9 5022 2 2 1 NAG O7 O 11.069 5.737 -1.129 1.00 . B A . 101 NAG O7 1 1 10 5023 1 1 1 LYS C C -10.473 -1.062 -5.178 1.00 . A A . 1 LYS C 1 1 10 5024 1 1 1 LYS CA C -11.383 0.164 -5.131 1.00 . A A . 1 LYS CA 1 1 10 5025 1 1 1 LYS CB C -10.585 1.471 -4.955 1.00 . A A . 1 LYS CB 1 1 10 5026 1 1 1 LYS CD C -8.790 2.990 -5.933 1.00 . A A . 1 LYS CD 1 1 10 5027 1 1 1 LYS CE C -7.575 3.013 -6.868 1.00 . A A . 1 LYS CE 1 1 10 5028 1 1 1 LYS CG C -9.490 1.629 -6.026 1.00 . A A . 1 LYS CG 1 1 10 5029 1 1 1 LYS H1 H -12.973 -0.818 -4.227 1.00 . A A . 1 LYS H1 1 1 10 5030 1 1 1 LYS H2 H -13.068 0.822 -4.123 1.00 . A A . 1 LYS H2 1 1 10 5031 1 1 1 LYS H3 H -12.041 -0.017 -3.163 1.00 . A A . 1 LYS H3 1 1 10 5032 1 1 1 LYS HA H -11.864 0.207 -6.109 1.00 . A A . 1 LYS HA 1 1 10 5033 1 1 1 LYS HB2 H -11.274 2.314 -5.026 1.00 . A A . 1 LYS HB2 1 1 10 5034 1 1 1 LYS HB3 H -10.120 1.489 -3.967 1.00 . A A . 1 LYS HB3 1 1 10 5035 1 1 1 LYS HD2 H -9.488 3.781 -6.208 1.00 . A A . 1 LYS HD2 1 1 10 5036 1 1 1 LYS HD3 H -8.450 3.152 -4.908 1.00 . A A . 1 LYS HD3 1 1 10 5037 1 1 1 LYS HE2 H -6.901 2.207 -6.567 1.00 . A A . 1 LYS HE2 1 1 10 5038 1 1 1 LYS HE3 H -7.891 2.831 -7.898 1.00 . A A . 1 LYS HE3 1 1 10 5039 1 1 1 LYS HG2 H -8.743 0.846 -5.893 1.00 . A A . 1 LYS HG2 1 1 10 5040 1 1 1 LYS HG3 H -9.935 1.525 -7.018 1.00 . A A . 1 LYS HG3 1 1 10 5041 1 1 1 LYS HZ1 H -7.276 5.048 -7.296 1.00 . A A . 1 LYS HZ1 1 1 10 5042 1 1 1 LYS HZ2 H -6.780 4.574 -5.777 1.00 . A A . 1 LYS HZ2 1 1 10 5043 1 1 1 LYS HZ3 H -5.857 4.198 -6.962 1.00 . A A . 1 LYS HZ3 1 1 10 5044 1 1 1 LYS N N -12.441 0.032 -4.105 1.00 . A A . 1 LYS N 1 1 10 5045 1 1 1 LYS NZ N -6.856 4.300 -6.767 1.00 . A A . 1 LYS NZ 1 1 10 5046 1 1 1 LYS O O -10.337 -1.643 -6.248 1.00 . A A . 1 LYS O 1 1 10 5047 1 1 2 LEU C C -9.339 -3.830 -4.436 1.00 . A A . 2 LEU C 1 1 10 5048 1 1 2 LEU CA C -8.794 -2.449 -3.987 1.00 . A A . 2 LEU CA 1 1 10 5049 1 1 2 LEU CB C -8.308 -2.457 -2.524 1.00 . A A . 2 LEU CB 1 1 10 5050 1 1 2 LEU CD1 C -5.826 -2.839 -2.933 1.00 . A A . 2 LEU CD1 1 1 10 5051 1 1 2 LEU CD2 C -6.854 -3.395 -0.728 1.00 . A A . 2 LEU CD2 1 1 10 5052 1 1 2 LEU CG C -7.094 -3.356 -2.242 1.00 . A A . 2 LEU CG 1 1 10 5053 1 1 2 LEU H H -10.013 -0.917 -3.190 1.00 . A A . 2 LEU H 1 1 10 5054 1 1 2 LEU HA H -7.970 -2.139 -4.624 1.00 . A A . 2 LEU HA 1 1 10 5055 1 1 2 LEU HB2 H -8.053 -1.438 -2.230 1.00 . A A . 2 LEU HB2 1 1 10 5056 1 1 2 LEU HB3 H -9.137 -2.783 -1.891 1.00 . A A . 2 LEU HB3 1 1 10 5057 1 1 2 LEU HD11 H -5.005 -3.522 -2.730 1.00 . A A . 2 LEU HD11 1 1 10 5058 1 1 2 LEU HD12 H -5.963 -2.798 -4.010 1.00 . A A . 2 LEU HD12 1 1 10 5059 1 1 2 LEU HD13 H -5.567 -1.848 -2.568 1.00 . A A . 2 LEU HD13 1 1 10 5060 1 1 2 LEU HD21 H -6.667 -2.393 -0.345 1.00 . A A . 2 LEU HD21 1 1 10 5061 1 1 2 LEU HD22 H -7.728 -3.814 -0.229 1.00 . A A . 2 LEU HD22 1 1 10 5062 1 1 2 LEU HD23 H -6.000 -4.033 -0.505 1.00 . A A . 2 LEU HD23 1 1 10 5063 1 1 2 LEU HG H -7.310 -4.365 -2.592 1.00 . A A . 2 LEU HG 1 1 10 5064 1 1 2 LEU N N -9.825 -1.415 -4.064 1.00 . A A . 2 LEU N 1 1 10 5065 1 1 2 LEU O O -10.282 -4.326 -3.818 1.00 . A A . 2 LEU O 1 1 10 5066 1 1 3 PRO C C -8.699 -6.972 -5.379 1.00 . A A . 3 PRO C 1 1 10 5067 1 1 3 PRO CA C -9.297 -5.714 -6.050 1.00 . A A . 3 PRO CA 1 1 10 5068 1 1 3 PRO CB C -8.921 -5.641 -7.536 1.00 . A A . 3 PRO CB 1 1 10 5069 1 1 3 PRO CD C -7.763 -3.906 -6.381 1.00 . A A . 3 PRO CD 1 1 10 5070 1 1 3 PRO CG C -7.578 -4.929 -7.497 1.00 . A A . 3 PRO CG 1 1 10 5071 1 1 3 PRO HA H -10.383 -5.740 -5.956 1.00 . A A . 3 PRO HA 1 1 10 5072 1 1 3 PRO HB2 H -8.832 -6.622 -8.004 1.00 . A A . 3 PRO HB2 1 1 10 5073 1 1 3 PRO HB3 H -9.648 -5.027 -8.069 1.00 . A A . 3 PRO HB3 1 1 10 5074 1 1 3 PRO HD2 H -6.820 -3.750 -5.861 1.00 . A A . 3 PRO HD2 1 1 10 5075 1 1 3 PRO HD3 H -8.122 -2.968 -6.806 1.00 . A A . 3 PRO HD3 1 1 10 5076 1 1 3 PRO HG2 H -6.812 -5.649 -7.214 1.00 . A A . 3 PRO HG2 1 1 10 5077 1 1 3 PRO HG3 H -7.340 -4.454 -8.450 1.00 . A A . 3 PRO HG3 1 1 10 5078 1 1 3 PRO N N -8.778 -4.461 -5.492 1.00 . A A . 3 PRO N 1 1 10 5079 1 1 3 PRO O O -7.665 -6.893 -4.709 1.00 . A A . 3 PRO O 1 1 10 5080 1 1 4 PRO C C -7.385 -9.754 -5.306 1.00 . A A . 4 PRO C 1 1 10 5081 1 1 4 PRO CA C -8.846 -9.409 -4.979 1.00 . A A . 4 PRO CA 1 1 10 5082 1 1 4 PRO CB C -9.830 -10.497 -5.427 1.00 . A A . 4 PRO CB 1 1 10 5083 1 1 4 PRO CD C -10.502 -8.411 -6.379 1.00 . A A . 4 PRO CD 1 1 10 5084 1 1 4 PRO CG C -10.495 -9.909 -6.669 1.00 . A A . 4 PRO CG 1 1 10 5085 1 1 4 PRO HA H -8.933 -9.298 -3.897 1.00 . A A . 4 PRO HA 1 1 10 5086 1 1 4 PRO HB2 H -9.331 -11.441 -5.650 1.00 . A A . 4 PRO HB2 1 1 10 5087 1 1 4 PRO HB3 H -10.582 -10.644 -4.650 1.00 . A A . 4 PRO HB3 1 1 10 5088 1 1 4 PRO HD2 H -10.517 -7.856 -7.315 1.00 . A A . 4 PRO HD2 1 1 10 5089 1 1 4 PRO HD3 H -11.377 -8.155 -5.780 1.00 . A A . 4 PRO HD3 1 1 10 5090 1 1 4 PRO HG2 H -9.875 -10.108 -7.545 1.00 . A A . 4 PRO HG2 1 1 10 5091 1 1 4 PRO HG3 H -11.503 -10.298 -6.814 1.00 . A A . 4 PRO HG3 1 1 10 5092 1 1 4 PRO N N -9.297 -8.163 -5.597 1.00 . A A . 4 PRO N 1 1 10 5093 1 1 4 PRO O O -6.889 -9.554 -6.419 1.00 . A A . 4 PRO O 1 1 10 5094 1 1 5 GLY C C -4.376 -9.294 -4.032 1.00 . A A . 5 GLY C 1 1 10 5095 1 1 5 GLY CA C -5.248 -10.524 -4.309 1.00 . A A . 5 GLY CA 1 1 10 5096 1 1 5 GLY H H -7.157 -10.396 -3.402 1.00 . A A . 5 GLY H 1 1 10 5097 1 1 5 GLY HA2 H -5.013 -11.285 -3.565 1.00 . A A . 5 GLY HA2 1 1 10 5098 1 1 5 GLY HA3 H -4.975 -10.909 -5.291 1.00 . A A . 5 GLY HA3 1 1 10 5099 1 1 5 GLY N N -6.686 -10.257 -4.283 1.00 . A A . 5 GLY N 1 1 10 5100 1 1 5 GLY O O -3.211 -9.473 -3.684 1.00 . A A . 5 GLY O 1 1 10 5101 1 1 6 TRP C C -4.288 -6.388 -2.477 1.00 . A A . 6 TRP C 1 1 10 5102 1 1 6 TRP CA C -4.180 -6.821 -3.941 1.00 . A A . 6 TRP CA 1 1 10 5103 1 1 6 TRP CB C -4.661 -5.750 -4.938 1.00 . A A . 6 TRP CB 1 1 10 5104 1 1 6 TRP CD1 C -2.640 -4.230 -4.668 1.00 . A A . 6 TRP CD1 1 1 10 5105 1 1 6 TRP CD2 C -3.469 -4.176 -6.749 1.00 . A A . 6 TRP CD2 1 1 10 5106 1 1 6 TRP CE2 C -2.385 -3.249 -6.711 1.00 . A A . 6 TRP CE2 1 1 10 5107 1 1 6 TRP CE3 C -4.113 -4.341 -7.996 1.00 . A A . 6 TRP CE3 1 1 10 5108 1 1 6 TRP CG C -3.633 -4.761 -5.416 1.00 . A A . 6 TRP CG 1 1 10 5109 1 1 6 TRP CH2 C -2.709 -2.635 -9.031 1.00 . A A . 6 TRP CH2 1 1 10 5110 1 1 6 TRP CZ2 C -2.014 -2.478 -7.823 1.00 . A A . 6 TRP CZ2 1 1 10 5111 1 1 6 TRP CZ3 C -3.745 -3.580 -9.121 1.00 . A A . 6 TRP CZ3 1 1 10 5112 1 1 6 TRP H H -5.895 -7.956 -4.391 1.00 . A A . 6 TRP H 1 1 10 5113 1 1 6 TRP HA H -3.135 -6.989 -4.145 1.00 . A A . 6 TRP HA 1 1 10 5114 1 1 6 TRP HB2 H -5.039 -6.254 -5.825 1.00 . A A . 6 TRP HB2 1 1 10 5115 1 1 6 TRP HB3 H -5.504 -5.210 -4.510 1.00 . A A . 6 TRP HB3 1 1 10 5116 1 1 6 TRP HD1 H -2.466 -4.467 -3.628 1.00 . A A . 6 TRP HD1 1 1 10 5117 1 1 6 TRP HE1 H -1.053 -2.878 -5.094 1.00 . A A . 6 TRP HE1 1 1 10 5118 1 1 6 TRP HE3 H -4.901 -5.064 -8.094 1.00 . A A . 6 TRP HE3 1 1 10 5119 1 1 6 TRP HH2 H -2.436 -2.045 -9.896 1.00 . A A . 6 TRP HH2 1 1 10 5120 1 1 6 TRP HZ2 H -1.210 -1.766 -7.757 1.00 . A A . 6 TRP HZ2 1 1 10 5121 1 1 6 TRP HZ3 H -4.265 -3.716 -10.060 1.00 . A A . 6 TRP HZ3 1 1 10 5122 1 1 6 TRP N N -4.913 -8.069 -4.159 1.00 . A A . 6 TRP N 1 1 10 5123 1 1 6 TRP NE1 N -1.886 -3.355 -5.431 1.00 . A A . 6 TRP NE1 1 1 10 5124 1 1 6 TRP O O -5.375 -6.068 -2.010 1.00 . A A . 6 TRP O 1 1 10 5125 1 1 7 GLU C C -1.816 -5.394 0.130 1.00 . A A . 7 GLU C 1 1 10 5126 1 1 7 GLU CA C -3.154 -6.008 -0.319 1.00 . A A . 7 GLU CA 1 1 10 5127 1 1 7 GLU CB C -3.517 -7.226 0.566 1.00 . A A . 7 GLU CB 1 1 10 5128 1 1 7 GLU CD C -4.934 -6.017 2.319 1.00 . A A . 7 GLU CD 1 1 10 5129 1 1 7 GLU CG C -4.895 -7.105 1.240 1.00 . A A . 7 GLU CG 1 1 10 5130 1 1 7 GLU H H -2.293 -6.692 -2.166 1.00 . A A . 7 GLU H 1 1 10 5131 1 1 7 GLU HA H -3.910 -5.236 -0.185 1.00 . A A . 7 GLU HA 1 1 10 5132 1 1 7 GLU HB2 H -3.509 -8.135 -0.040 1.00 . A A . 7 GLU HB2 1 1 10 5133 1 1 7 GLU HB3 H -2.765 -7.362 1.345 1.00 . A A . 7 GLU HB3 1 1 10 5134 1 1 7 GLU HG2 H -5.656 -6.896 0.487 1.00 . A A . 7 GLU HG2 1 1 10 5135 1 1 7 GLU HG3 H -5.135 -8.069 1.692 1.00 . A A . 7 GLU HG3 1 1 10 5136 1 1 7 GLU N N -3.171 -6.399 -1.738 1.00 . A A . 7 GLU N 1 1 10 5137 1 1 7 GLU O O -0.798 -5.553 -0.557 1.00 . A A . 7 GLU O 1 1 10 5138 1 1 7 GLU OE1 O -4.503 -4.867 2.051 1.00 . A A . 7 GLU OE1 1 1 10 5139 1 1 7 GLU OE2 O -5.336 -6.301 3.470 1.00 . A A . 7 GLU OE2 1 1 10 5140 1 1 8 LYS C C 0.630 -4.915 1.949 1.00 . A A . 8 LYS C 1 1 10 5141 1 1 8 LYS CA C -0.638 -4.051 1.882 1.00 . A A . 8 LYS CA 1 1 10 5142 1 1 8 LYS CB C -0.926 -3.353 3.229 1.00 . A A . 8 LYS CB 1 1 10 5143 1 1 8 LYS CD C -2.431 -4.808 4.734 1.00 . A A . 8 LYS CD 1 1 10 5144 1 1 8 LYS CE C -3.440 -3.711 5.119 1.00 . A A . 8 LYS CE 1 1 10 5145 1 1 8 LYS CG C -1.032 -4.230 4.494 1.00 . A A . 8 LYS CG 1 1 10 5146 1 1 8 LYS H H -2.719 -4.642 1.767 1.00 . A A . 8 LYS H 1 1 10 5147 1 1 8 LYS HA H -0.410 -3.242 1.186 1.00 . A A . 8 LYS HA 1 1 10 5148 1 1 8 LYS HB2 H -0.103 -2.656 3.400 1.00 . A A . 8 LYS HB2 1 1 10 5149 1 1 8 LYS HB3 H -1.822 -2.748 3.129 1.00 . A A . 8 LYS HB3 1 1 10 5150 1 1 8 LYS HD2 H -2.742 -5.337 3.836 1.00 . A A . 8 LYS HD2 1 1 10 5151 1 1 8 LYS HD3 H -2.383 -5.537 5.544 1.00 . A A . 8 LYS HD3 1 1 10 5152 1 1 8 LYS HE2 H -3.520 -3.676 6.209 1.00 . A A . 8 LYS HE2 1 1 10 5153 1 1 8 LYS HE3 H -3.069 -2.741 4.778 1.00 . A A . 8 LYS HE3 1 1 10 5154 1 1 8 LYS HG2 H -0.312 -5.046 4.444 1.00 . A A . 8 LYS HG2 1 1 10 5155 1 1 8 LYS HG3 H -0.769 -3.620 5.359 1.00 . A A . 8 LYS HG3 1 1 10 5156 1 1 8 LYS HZ1 H -4.683 -3.944 3.489 1.00 . A A . 8 LYS HZ1 1 1 10 5157 1 1 8 LYS HZ2 H -5.067 -4.930 4.609 1.00 . A A . 8 LYS HZ2 1 1 10 5158 1 1 8 LYS HZ3 H -5.477 -3.307 4.815 1.00 . A A . 8 LYS HZ3 1 1 10 5159 1 1 8 LYS N N -1.811 -4.734 1.301 1.00 . A A . 8 LYS N 1 1 10 5160 1 1 8 LYS NZ N -4.765 -3.953 4.513 1.00 . A A . 8 LYS NZ 1 1 10 5161 1 1 8 LYS O O 0.585 -6.137 2.099 1.00 . A A . 8 LYS O 1 1 10 5162 1 1 9 ARG C C 4.172 -3.878 2.109 1.00 . A A . 9 ARG C 1 1 10 5163 1 1 9 ARG CA C 3.099 -4.834 1.568 1.00 . A A . 9 ARG CA 1 1 10 5164 1 1 9 ARG CB C 3.221 -4.968 0.049 1.00 . A A . 9 ARG CB 1 1 10 5165 1 1 9 ARG CD C 3.467 -7.552 0.016 1.00 . A A . 9 ARG CD 1 1 10 5166 1 1 9 ARG CG C 4.020 -6.180 -0.393 1.00 . A A . 9 ARG CG 1 1 10 5167 1 1 9 ARG CZ C 1.167 -8.517 -0.416 1.00 . A A . 9 ARG CZ 1 1 10 5168 1 1 9 ARG H H 1.766 -3.296 1.456 1.00 . A A . 9 ARG H 1 1 10 5169 1 1 9 ARG HA H 3.170 -5.796 2.076 1.00 . A A . 9 ARG HA 1 1 10 5170 1 1 9 ARG HB2 H 2.239 -5.033 -0.424 1.00 . A A . 9 ARG HB2 1 1 10 5171 1 1 9 ARG HB3 H 3.679 -4.065 -0.349 1.00 . A A . 9 ARG HB3 1 1 10 5172 1 1 9 ARG HD2 H 3.850 -8.264 -0.717 1.00 . A A . 9 ARG HD2 1 1 10 5173 1 1 9 ARG HD3 H 3.869 -7.799 0.997 1.00 . A A . 9 ARG HD3 1 1 10 5174 1 1 9 ARG HE H 1.511 -6.849 0.561 1.00 . A A . 9 ARG HE 1 1 10 5175 1 1 9 ARG HG2 H 4.026 -6.118 -1.471 1.00 . A A . 9 ARG HG2 1 1 10 5176 1 1 9 ARG HG3 H 5.041 -6.081 -0.029 1.00 . A A . 9 ARG HG3 1 1 10 5177 1 1 9 ARG HH11 H 2.499 -10.008 -0.573 1.00 . A A . 9 ARG HH11 1 1 10 5178 1 1 9 ARG HH12 H 0.835 -10.369 -1.058 1.00 . A A . 9 ARG HH12 1 1 10 5179 1 1 9 ARG HH21 H -0.396 -7.266 -0.518 1.00 . A A . 9 ARG HH21 1 1 10 5180 1 1 9 ARG HH22 H -0.682 -8.926 -1.055 1.00 . A A . 9 ARG HH22 1 1 10 5181 1 1 9 ARG N N 1.778 -4.265 1.759 1.00 . A A . 9 ARG N 1 1 10 5182 1 1 9 ARG NE N 1.989 -7.597 0.064 1.00 . A A . 9 ARG NE 1 1 10 5183 1 1 9 ARG NH1 N 1.556 -9.721 -0.751 1.00 . A A . 9 ARG NH1 1 1 10 5184 1 1 9 ARG NH2 N -0.096 -8.238 -0.595 1.00 . A A . 9 ARG NH2 1 1 10 5185 1 1 9 ARG O O 3.886 -2.699 2.325 1.00 . A A . 9 ARG O 1 1 10 5186 1 1 10 MET C C 7.883 -3.978 2.271 1.00 . A A . 10 MET C 1 1 10 5187 1 1 10 MET CA C 6.509 -3.510 2.761 1.00 . A A . 10 MET CA 1 1 10 5188 1 1 10 MET CB C 6.475 -3.501 4.298 1.00 . A A . 10 MET CB 1 1 10 5189 1 1 10 MET CE C 8.039 -3.822 7.241 1.00 . A A . 10 MET CE 1 1 10 5190 1 1 10 MET CG C 7.463 -2.475 4.872 1.00 . A A . 10 MET CG 1 1 10 5191 1 1 10 MET H H 5.642 -5.302 2.028 1.00 . A A . 10 MET H 1 1 10 5192 1 1 10 MET HA H 6.351 -2.491 2.412 1.00 . A A . 10 MET HA 1 1 10 5193 1 1 10 MET HB2 H 5.473 -3.240 4.636 1.00 . A A . 10 MET HB2 1 1 10 5194 1 1 10 MET HB3 H 6.716 -4.495 4.676 1.00 . A A . 10 MET HB3 1 1 10 5195 1 1 10 MET HE1 H 7.387 -4.637 6.928 1.00 . A A . 10 MET HE1 1 1 10 5196 1 1 10 MET HE2 H 9.036 -3.971 6.825 1.00 . A A . 10 MET HE2 1 1 10 5197 1 1 10 MET HE3 H 8.102 -3.813 8.330 1.00 . A A . 10 MET HE3 1 1 10 5198 1 1 10 MET HG2 H 8.481 -2.774 4.621 1.00 . A A . 10 MET HG2 1 1 10 5199 1 1 10 MET HG3 H 7.271 -1.512 4.399 1.00 . A A . 10 MET HG3 1 1 10 5200 1 1 10 MET N N 5.420 -4.342 2.244 1.00 . A A . 10 MET N 1 1 10 5201 1 1 10 MET O O 8.256 -5.137 2.430 1.00 . A A . 10 MET O 1 1 10 5202 1 1 10 MET SD S 7.368 -2.239 6.665 1.00 . A A . 10 MET SD 1 1 10 5203 1 1 11 PHE C C 10.904 -3.070 2.596 1.00 . A A . 11 PHE C 1 1 10 5204 1 1 11 PHE CA C 10.040 -3.177 1.333 1.00 . A A . 11 PHE CA 1 1 10 5205 1 1 11 PHE CB C 10.410 -2.067 0.342 1.00 . A A . 11 PHE CB 1 1 10 5206 1 1 11 PHE CD1 C 10.186 -3.191 -1.908 1.00 . A A . 11 PHE CD1 1 1 10 5207 1 1 11 PHE CD2 C 8.796 -1.241 -1.444 1.00 . A A . 11 PHE CD2 1 1 10 5208 1 1 11 PHE CE1 C 9.637 -3.286 -3.198 1.00 . A A . 11 PHE CE1 1 1 10 5209 1 1 11 PHE CE2 C 8.252 -1.343 -2.739 1.00 . A A . 11 PHE CE2 1 1 10 5210 1 1 11 PHE CG C 9.763 -2.178 -1.023 1.00 . A A . 11 PHE CG 1 1 10 5211 1 1 11 PHE CZ C 8.668 -2.360 -3.613 1.00 . A A . 11 PHE CZ 1 1 10 5212 1 1 11 PHE H H 8.245 -2.107 1.589 1.00 . A A . 11 PHE H 1 1 10 5213 1 1 11 PHE HA H 10.206 -4.140 0.853 1.00 . A A . 11 PHE HA 1 1 10 5214 1 1 11 PHE HB2 H 10.181 -1.097 0.784 1.00 . A A . 11 PHE HB2 1 1 10 5215 1 1 11 PHE HB3 H 11.483 -2.107 0.186 1.00 . A A . 11 PHE HB3 1 1 10 5216 1 1 11 PHE HD1 H 10.960 -3.884 -1.618 1.00 . A A . 11 PHE HD1 1 1 10 5217 1 1 11 PHE HD2 H 8.452 -0.457 -0.778 1.00 . A A . 11 PHE HD2 1 1 10 5218 1 1 11 PHE HE1 H 9.964 -4.065 -3.872 1.00 . A A . 11 PHE HE1 1 1 10 5219 1 1 11 PHE HE2 H 7.485 -0.663 -3.067 1.00 . A A . 11 PHE HE2 1 1 10 5220 1 1 11 PHE HZ H 8.240 -2.430 -4.603 1.00 . A A . 11 PHE HZ 1 1 10 5221 1 1 11 PHE N N 8.634 -3.041 1.690 1.00 . A A . 11 PHE N 1 1 10 5222 1 1 11 PHE O O 10.755 -2.116 3.365 1.00 . A A . 11 PHE O 1 1 10 5223 1 1 12 ALA C C 13.563 -2.905 4.242 1.00 . A A . 12 ALA C 1 1 10 5224 1 1 12 ALA CA C 12.653 -4.127 4.007 1.00 . A A . 12 ALA CA 1 1 10 5225 1 1 12 ALA CB C 13.478 -5.416 3.917 1.00 . A A . 12 ALA CB 1 1 10 5226 1 1 12 ALA H H 11.892 -4.791 2.146 1.00 . A A . 12 ALA H 1 1 10 5227 1 1 12 ALA HA H 11.995 -4.207 4.874 1.00 . A A . 12 ALA HA 1 1 10 5228 1 1 12 ALA HB1 H 12.815 -6.277 3.822 1.00 . A A . 12 ALA HB1 1 1 10 5229 1 1 12 ALA HB2 H 14.147 -5.375 3.057 1.00 . A A . 12 ALA HB2 1 1 10 5230 1 1 12 ALA HB3 H 14.072 -5.532 4.825 1.00 . A A . 12 ALA HB3 1 1 10 5231 1 1 12 ALA N N 11.814 -4.032 2.805 1.00 . A A . 12 ALA N 1 1 10 5232 1 1 12 ALA O O 13.860 -2.575 5.386 1.00 . A A . 12 ALA O 1 1 10 5233 1 1 13 ASN C C 13.721 0.276 3.651 1.00 . A A . 13 ASN C 1 1 10 5234 1 1 13 ASN CA C 14.636 -0.896 3.218 1.00 . A A . 13 ASN CA 1 1 10 5235 1 1 13 ASN CB C 15.351 -0.651 1.867 1.00 . A A . 13 ASN CB 1 1 10 5236 1 1 13 ASN CG C 14.453 -0.826 0.647 1.00 . A A . 13 ASN CG 1 1 10 5237 1 1 13 ASN H H 13.705 -2.516 2.246 1.00 . A A . 13 ASN H 1 1 10 5238 1 1 13 ASN HA H 15.409 -0.956 3.987 1.00 . A A . 13 ASN HA 1 1 10 5239 1 1 13 ASN HB2 H 15.791 0.346 1.865 1.00 . A A . 13 ASN HB2 1 1 10 5240 1 1 13 ASN HB3 H 16.169 -1.366 1.771 1.00 . A A . 13 ASN HB3 1 1 10 5241 1 1 13 ASN HD21 H 14.713 1.123 0.075 1.00 . A A . 13 ASN HD21 1 1 10 5242 1 1 13 ASN N N 13.953 -2.193 3.178 1.00 . A A . 13 ASN N 1 1 10 5243 1 1 13 ASN ND2 N 14.263 0.230 -0.136 1.00 . A A . 13 ASN ND2 1 1 10 5244 1 1 13 ASN O O 14.154 1.425 3.616 1.00 . A A . 13 ASN O 1 1 10 5245 1 1 13 ASN OD1 O 13.901 -1.908 0.458 1.00 . A A . 13 ASN OD1 1 1 10 5246 1 1 14 GLY C C 10.594 1.639 3.725 1.00 . A A . 14 GLY C 1 1 10 5247 1 1 14 GLY CA C 11.561 0.959 4.688 1.00 . A A . 14 GLY CA 1 1 10 5248 1 1 14 GLY H H 12.126 -0.948 3.983 1.00 . A A . 14 GLY H 1 1 10 5249 1 1 14 GLY HA2 H 10.977 0.428 5.439 1.00 . A A . 14 GLY HA2 1 1 10 5250 1 1 14 GLY HA3 H 12.140 1.730 5.197 1.00 . A A . 14 GLY HA3 1 1 10 5251 1 1 14 GLY N N 12.469 0.005 4.052 1.00 . A A . 14 GLY N 1 1 10 5252 1 1 14 GLY O O 10.643 2.857 3.562 1.00 . A A . 14 GLY O 1 1 10 5253 1 1 15 THR C C 7.402 0.621 2.147 1.00 . A A . 15 THR C 1 1 10 5254 1 1 15 THR CA C 8.631 1.518 2.249 1.00 . A A . 15 THR CA 1 1 10 5255 1 1 15 THR CB C 9.166 1.934 0.869 1.00 . A A . 15 THR CB 1 1 10 5256 1 1 15 THR CG2 C 8.119 2.531 -0.065 1.00 . A A . 15 THR CG2 1 1 10 5257 1 1 15 THR H H 9.725 -0.120 3.134 1.00 . A A . 15 THR H 1 1 10 5258 1 1 15 THR HA H 8.307 2.431 2.735 1.00 . A A . 15 THR HA 1 1 10 5259 1 1 15 THR HB H 9.651 1.088 0.385 1.00 . A A . 15 THR HB 1 1 10 5260 1 1 15 THR HG1 H 10.317 3.016 2.011 1.00 . A A . 15 THR HG1 1 1 10 5261 1 1 15 THR HG21 H 8.616 2.857 -0.980 1.00 . A A . 15 THR HG21 1 1 10 5262 1 1 15 THR HG22 H 7.360 1.790 -0.312 1.00 . A A . 15 THR HG22 1 1 10 5263 1 1 15 THR HG23 H 7.657 3.396 0.409 1.00 . A A . 15 THR HG23 1 1 10 5264 1 1 15 THR N N 9.702 0.895 3.056 1.00 . A A . 15 THR N 1 1 10 5265 1 1 15 THR O O 7.498 -0.496 1.650 1.00 . A A . 15 THR O 1 1 10 5266 1 1 15 THR OG1 O 10.100 2.972 1.048 1.00 . A A . 15 THR OG1 1 1 10 5267 1 1 16 VAL C C 4.189 0.781 1.292 1.00 . A A . 16 VAL C 1 1 10 5268 1 1 16 VAL CA C 4.955 0.409 2.560 1.00 . A A . 16 VAL CA 1 1 10 5269 1 1 16 VAL CB C 4.118 0.739 3.816 1.00 . A A . 16 VAL CB 1 1 10 5270 1 1 16 VAL CG1 C 2.640 0.319 3.722 1.00 . A A . 16 VAL CG1 1 1 10 5271 1 1 16 VAL CG2 C 4.711 0.024 5.035 1.00 . A A . 16 VAL CG2 1 1 10 5272 1 1 16 VAL H H 6.224 2.061 2.967 1.00 . A A . 16 VAL H 1 1 10 5273 1 1 16 VAL HA H 5.143 -0.662 2.548 1.00 . A A . 16 VAL HA 1 1 10 5274 1 1 16 VAL HB H 4.148 1.816 3.988 1.00 . A A . 16 VAL HB 1 1 10 5275 1 1 16 VAL HG11 H 2.125 0.879 2.943 1.00 . A A . 16 VAL HG11 1 1 10 5276 1 1 16 VAL HG12 H 2.563 -0.748 3.510 1.00 . A A . 16 VAL HG12 1 1 10 5277 1 1 16 VAL HG13 H 2.137 0.525 4.668 1.00 . A A . 16 VAL HG13 1 1 10 5278 1 1 16 VAL HG21 H 4.628 -1.054 4.898 1.00 . A A . 16 VAL HG21 1 1 10 5279 1 1 16 VAL HG22 H 5.757 0.296 5.164 1.00 . A A . 16 VAL HG22 1 1 10 5280 1 1 16 VAL HG23 H 4.165 0.308 5.935 1.00 . A A . 16 VAL HG23 1 1 10 5281 1 1 16 VAL N N 6.241 1.126 2.588 1.00 . A A . 16 VAL N 1 1 10 5282 1 1 16 VAL O O 4.146 1.950 0.907 1.00 . A A . 16 VAL O 1 1 10 5283 1 1 17 TYR C C 1.714 -1.190 -0.618 1.00 . A A . 17 TYR C 1 1 10 5284 1 1 17 TYR CA C 2.822 -0.125 -0.592 1.00 . A A . 17 TYR CA 1 1 10 5285 1 1 17 TYR CB C 3.818 -0.333 -1.756 1.00 . A A . 17 TYR CB 1 1 10 5286 1 1 17 TYR CD1 C 5.602 -1.921 -0.952 1.00 . A A . 17 TYR CD1 1 1 10 5287 1 1 17 TYR CD2 C 4.140 -2.672 -2.751 1.00 . A A . 17 TYR CD2 1 1 10 5288 1 1 17 TYR CE1 C 6.310 -3.133 -1.013 1.00 . A A . 17 TYR CE1 1 1 10 5289 1 1 17 TYR CE2 C 4.896 -3.861 -2.858 1.00 . A A . 17 TYR CE2 1 1 10 5290 1 1 17 TYR CG C 4.517 -1.684 -1.814 1.00 . A A . 17 TYR CG 1 1 10 5291 1 1 17 TYR CZ C 5.990 -4.086 -1.995 1.00 . A A . 17 TYR CZ 1 1 10 5292 1 1 17 TYR H H 3.588 -1.147 1.090 1.00 . A A . 17 TYR H 1 1 10 5293 1 1 17 TYR HA H 2.363 0.860 -0.686 1.00 . A A . 17 TYR HA 1 1 10 5294 1 1 17 TYR HB2 H 3.312 -0.170 -2.704 1.00 . A A . 17 TYR HB2 1 1 10 5295 1 1 17 TYR HB3 H 4.596 0.427 -1.681 1.00 . A A . 17 TYR HB3 1 1 10 5296 1 1 17 TYR HD1 H 5.906 -1.144 -0.266 1.00 . A A . 17 TYR HD1 1 1 10 5297 1 1 17 TYR HD2 H 3.280 -2.518 -3.392 1.00 . A A . 17 TYR HD2 1 1 10 5298 1 1 17 TYR HE1 H 7.144 -3.331 -0.364 1.00 . A A . 17 TYR HE1 1 1 10 5299 1 1 17 TYR HE2 H 4.645 -4.631 -3.569 1.00 . A A . 17 TYR HE2 1 1 10 5300 1 1 17 TYR HH H 6.541 -5.715 -2.893 1.00 . A A . 17 TYR HH 1 1 10 5301 1 1 17 TYR N N 3.573 -0.221 0.664 1.00 . A A . 17 TYR N 1 1 10 5302 1 1 17 TYR O O 1.609 -1.983 0.310 1.00 . A A . 17 TYR O 1 1 10 5303 1 1 17 TYR OH O 6.715 -5.234 -2.083 1.00 . A A . 17 TYR OH 1 1 10 5304 1 1 18 TYR C C 0.374 -3.202 -3.132 1.00 . A A . 18 TYR C 1 1 10 5305 1 1 18 TYR CA C -0.040 -2.350 -1.939 1.00 . A A . 18 TYR CA 1 1 10 5306 1 1 18 TYR CB C -1.447 -1.776 -2.148 1.00 . A A . 18 TYR CB 1 1 10 5307 1 1 18 TYR CD1 C -1.542 -0.472 -0.019 1.00 . A A . 18 TYR CD1 1 1 10 5308 1 1 18 TYR CD2 C -3.220 -2.194 -0.387 1.00 . A A . 18 TYR CD2 1 1 10 5309 1 1 18 TYR CE1 C -2.026 -0.271 1.270 1.00 . A A . 18 TYR CE1 1 1 10 5310 1 1 18 TYR CE2 C -3.772 -1.924 0.878 1.00 . A A . 18 TYR CE2 1 1 10 5311 1 1 18 TYR CG C -2.108 -1.458 -0.835 1.00 . A A . 18 TYR CG 1 1 10 5312 1 1 18 TYR CZ C -3.169 -0.965 1.720 1.00 . A A . 18 TYR CZ 1 1 10 5313 1 1 18 TYR H H 0.808 -0.415 -2.232 1.00 . A A . 18 TYR H 1 1 10 5314 1 1 18 TYR HA H -0.066 -3.014 -1.078 1.00 . A A . 18 TYR HA 1 1 10 5315 1 1 18 TYR HB2 H -1.401 -0.878 -2.768 1.00 . A A . 18 TYR HB2 1 1 10 5316 1 1 18 TYR HB3 H -2.064 -2.505 -2.666 1.00 . A A . 18 TYR HB3 1 1 10 5317 1 1 18 TYR HD1 H -0.731 0.150 -0.363 1.00 . A A . 18 TYR HD1 1 1 10 5318 1 1 18 TYR HD2 H -3.658 -2.958 -1.007 1.00 . A A . 18 TYR HD2 1 1 10 5319 1 1 18 TYR HE1 H -1.504 0.464 1.840 1.00 . A A . 18 TYR HE1 1 1 10 5320 1 1 18 TYR HE2 H -4.647 -2.456 1.211 1.00 . A A . 18 TYR HE2 1 1 10 5321 1 1 18 TYR HH H -4.603 -0.223 2.713 1.00 . A A . 18 TYR HH 1 1 10 5322 1 1 18 TYR N N 0.911 -1.260 -1.680 1.00 . A A . 18 TYR N 1 1 10 5323 1 1 18 TYR O O 0.691 -2.667 -4.194 1.00 . A A . 18 TYR O 1 1 10 5324 1 1 18 TYR OH O -3.738 -0.660 2.914 1.00 . A A . 18 TYR OH 1 1 10 5325 1 1 19 PHE C C -0.309 -6.565 -4.262 1.00 . A A . 19 PHE C 1 1 10 5326 1 1 19 PHE CA C 0.748 -5.503 -3.981 1.00 . A A . 19 PHE CA 1 1 10 5327 1 1 19 PHE CB C 2.006 -6.173 -3.434 1.00 . A A . 19 PHE CB 1 1 10 5328 1 1 19 PHE CD1 C 3.422 -6.677 -5.471 1.00 . A A . 19 PHE CD1 1 1 10 5329 1 1 19 PHE CD2 C 2.650 -8.536 -4.107 1.00 . A A . 19 PHE CD2 1 1 10 5330 1 1 19 PHE CE1 C 4.113 -7.573 -6.304 1.00 . A A . 19 PHE CE1 1 1 10 5331 1 1 19 PHE CE2 C 3.349 -9.434 -4.936 1.00 . A A . 19 PHE CE2 1 1 10 5332 1 1 19 PHE CG C 2.696 -7.152 -4.364 1.00 . A A . 19 PHE CG 1 1 10 5333 1 1 19 PHE CZ C 4.083 -8.952 -6.033 1.00 . A A . 19 PHE CZ 1 1 10 5334 1 1 19 PHE H H -0.039 -4.918 -2.105 1.00 . A A . 19 PHE H 1 1 10 5335 1 1 19 PHE HA H 0.999 -4.997 -4.912 1.00 . A A . 19 PHE HA 1 1 10 5336 1 1 19 PHE HB2 H 2.705 -5.387 -3.178 1.00 . A A . 19 PHE HB2 1 1 10 5337 1 1 19 PHE HB3 H 1.748 -6.686 -2.510 1.00 . A A . 19 PHE HB3 1 1 10 5338 1 1 19 PHE HD1 H 3.450 -5.622 -5.685 1.00 . A A . 19 PHE HD1 1 1 10 5339 1 1 19 PHE HD2 H 2.083 -8.916 -3.273 1.00 . A A . 19 PHE HD2 1 1 10 5340 1 1 19 PHE HE1 H 4.667 -7.199 -7.154 1.00 . A A . 19 PHE HE1 1 1 10 5341 1 1 19 PHE HE2 H 3.331 -10.494 -4.732 1.00 . A A . 19 PHE HE2 1 1 10 5342 1 1 19 PHE HZ H 4.612 -9.644 -6.674 1.00 . A A . 19 PHE HZ 1 1 10 5343 1 1 19 PHE N N 0.294 -4.529 -2.986 1.00 . A A . 19 PHE N 1 1 10 5344 1 1 19 PHE O O -0.905 -7.104 -3.328 1.00 . A A . 19 PHE O 1 1 10 5345 1 1 20 ASN C C -0.462 -9.286 -6.065 1.00 . A A . 20 ASN C 1 1 10 5346 1 1 20 ASN CA C -1.313 -8.020 -5.971 1.00 . A A . 20 ASN CA 1 1 10 5347 1 1 20 ASN CB C -2.073 -7.694 -7.262 1.00 . A A . 20 ASN CB 1 1 10 5348 1 1 20 ASN CG C -3.134 -8.756 -7.518 1.00 . A A . 20 ASN CG 1 1 10 5349 1 1 20 ASN H H 0.030 -6.409 -6.263 1.00 . A A . 20 ASN H 1 1 10 5350 1 1 20 ASN HA H -2.058 -8.214 -5.217 1.00 . A A . 20 ASN HA 1 1 10 5351 1 1 20 ASN HB2 H -2.547 -6.720 -7.171 1.00 . A A . 20 ASN HB2 1 1 10 5352 1 1 20 ASN HB3 H -1.379 -7.659 -8.098 1.00 . A A . 20 ASN HB3 1 1 10 5353 1 1 20 ASN HD21 H -4.660 -7.467 -7.171 1.00 . A A . 20 ASN HD21 1 1 10 5354 1 1 20 ASN HD22 H -5.128 -9.120 -7.416 1.00 . A A . 20 ASN HD22 1 1 10 5355 1 1 20 ASN N N -0.505 -6.891 -5.542 1.00 . A A . 20 ASN N 1 1 10 5356 1 1 20 ASN ND2 N -4.401 -8.408 -7.398 1.00 . A A . 20 ASN ND2 1 1 10 5357 1 1 20 ASN O O 0.211 -9.517 -7.067 1.00 . A A . 20 ASN O 1 1 10 5358 1 1 20 ASN OD1 O -2.818 -9.912 -7.753 1.00 . A A . 20 ASN OD1 1 1 10 5359 1 1 21 HIS C C -0.387 -12.524 -5.857 1.00 . A A . 21 HIS C 1 1 10 5360 1 1 21 HIS CA C 0.221 -11.402 -4.988 1.00 . A A . 21 HIS CA 1 1 10 5361 1 1 21 HIS CB C 0.475 -11.800 -3.525 1.00 . A A . 21 HIS CB 1 1 10 5362 1 1 21 HIS CD2 C -1.783 -12.672 -2.711 1.00 . A A . 21 HIS CD2 1 1 10 5363 1 1 21 HIS CE1 C -2.178 -11.199 -1.115 1.00 . A A . 21 HIS CE1 1 1 10 5364 1 1 21 HIS CG C -0.744 -11.790 -2.643 1.00 . A A . 21 HIS CG 1 1 10 5365 1 1 21 HIS H H -1.143 -9.921 -4.257 1.00 . A A . 21 HIS H 1 1 10 5366 1 1 21 HIS HA H 1.198 -11.222 -5.437 1.00 . A A . 21 HIS HA 1 1 10 5367 1 1 21 HIS HB2 H 0.945 -12.781 -3.480 1.00 . A A . 21 HIS HB2 1 1 10 5368 1 1 21 HIS HB3 H 1.193 -11.094 -3.112 1.00 . A A . 21 HIS HB3 1 1 10 5369 1 1 21 HIS HD2 H -1.869 -13.502 -3.401 1.00 . A A . 21 HIS HD2 1 1 10 5370 1 1 21 HIS HE1 H -2.670 -10.675 -0.306 1.00 . A A . 21 HIS HE1 1 1 10 5371 1 1 21 HIS HE2 H -3.555 -12.732 -1.519 1.00 . A A . 21 HIS HE2 1 1 10 5372 1 1 21 HIS N N -0.519 -10.133 -5.033 1.00 . A A . 21 HIS N 1 1 10 5373 1 1 21 HIS ND1 N -0.985 -10.859 -1.631 1.00 . A A . 21 HIS ND1 1 1 10 5374 1 1 21 HIS NE2 N -2.676 -12.284 -1.738 1.00 . A A . 21 HIS NE2 1 1 10 5375 1 1 21 HIS O O -0.173 -13.701 -5.580 1.00 . A A . 21 HIS O 1 1 10 5376 1 1 22 ILE C C -1.118 -12.583 -9.338 1.00 . A A . 22 ILE C 1 1 10 5377 1 1 22 ILE CA C -1.612 -13.071 -7.960 1.00 . A A . 22 ILE CA 1 1 10 5378 1 1 22 ILE CB C -3.156 -13.229 -7.918 1.00 . A A . 22 ILE CB 1 1 10 5379 1 1 22 ILE CD1 C -5.197 -13.646 -6.370 1.00 . A A . 22 ILE CD1 1 1 10 5380 1 1 22 ILE CG1 C -3.672 -13.527 -6.487 1.00 . A A . 22 ILE CG1 1 1 10 5381 1 1 22 ILE CG2 C -3.588 -14.339 -8.895 1.00 . A A . 22 ILE CG2 1 1 10 5382 1 1 22 ILE H H -1.339 -11.179 -7.041 1.00 . A A . 22 ILE H 1 1 10 5383 1 1 22 ILE HA H -1.174 -14.057 -7.799 1.00 . A A . 22 ILE HA 1 1 10 5384 1 1 22 ILE HB H -3.611 -12.297 -8.251 1.00 . A A . 22 ILE HB 1 1 10 5385 1 1 22 ILE HD11 H -5.549 -14.552 -6.862 1.00 . A A . 22 ILE HD11 1 1 10 5386 1 1 22 ILE HD12 H -5.474 -13.698 -5.316 1.00 . A A . 22 ILE HD12 1 1 10 5387 1 1 22 ILE HD13 H -5.674 -12.775 -6.819 1.00 . A A . 22 ILE HD13 1 1 10 5388 1 1 22 ILE HG12 H -3.216 -14.449 -6.121 1.00 . A A . 22 ILE HG12 1 1 10 5389 1 1 22 ILE HG13 H -3.372 -12.719 -5.820 1.00 . A A . 22 ILE HG13 1 1 10 5390 1 1 22 ILE HG21 H -3.225 -14.130 -9.901 1.00 . A A . 22 ILE HG21 1 1 10 5391 1 1 22 ILE HG22 H -3.190 -15.301 -8.568 1.00 . A A . 22 ILE HG22 1 1 10 5392 1 1 22 ILE HG23 H -4.674 -14.397 -8.951 1.00 . A A . 22 ILE HG23 1 1 10 5393 1 1 22 ILE N N -1.135 -12.162 -6.910 1.00 . A A . 22 ILE N 1 1 10 5394 1 1 22 ILE O O -0.680 -13.401 -10.144 1.00 . A A . 22 ILE O 1 1 10 5395 1 1 23 THR C C 0.751 -10.076 -10.814 1.00 . A A . 23 THR C 1 1 10 5396 1 1 23 THR CA C -0.656 -10.680 -10.872 1.00 . A A . 23 THR CA 1 1 10 5397 1 1 23 THR CB C -1.613 -9.588 -11.376 1.00 . A A . 23 THR CB 1 1 10 5398 1 1 23 THR CG2 C -3.064 -10.063 -11.487 1.00 . A A . 23 THR CG2 1 1 10 5399 1 1 23 THR H H -1.581 -10.638 -8.941 1.00 . A A . 23 THR H 1 1 10 5400 1 1 23 THR HA H -0.630 -11.461 -11.632 1.00 . A A . 23 THR HA 1 1 10 5401 1 1 23 THR HB H -1.284 -9.274 -12.368 1.00 . A A . 23 THR HB 1 1 10 5402 1 1 23 THR HG1 H -2.287 -7.879 -10.812 1.00 . A A . 23 THR HG1 1 1 10 5403 1 1 23 THR HG21 H -3.667 -9.293 -11.969 1.00 . A A . 23 THR HG21 1 1 10 5404 1 1 23 THR HG22 H -3.106 -10.970 -12.090 1.00 . A A . 23 THR HG22 1 1 10 5405 1 1 23 THR HG23 H -3.475 -10.271 -10.498 1.00 . A A . 23 THR HG23 1 1 10 5406 1 1 23 THR N N -1.122 -11.265 -9.598 1.00 . A A . 23 THR N 1 1 10 5407 1 1 23 THR O O 1.394 -9.964 -11.857 1.00 . A A . 23 THR O 1 1 10 5408 1 1 23 THR OG1 O -1.585 -8.466 -10.523 1.00 . A A . 23 THR OG1 1 1 10 5409 1 1 24 ASN C C 2.301 -7.424 -9.482 1.00 . A A . 24 ASN C 1 1 10 5410 1 1 24 ASN CA C 2.454 -8.949 -9.304 1.00 . A A . 24 ASN CA 1 1 10 5411 1 1 24 ASN CB C 3.713 -9.501 -10.006 1.00 . A A . 24 ASN CB 1 1 10 5412 1 1 24 ASN CG C 3.889 -11.001 -9.844 1.00 . A A . 24 ASN CG 1 1 10 5413 1 1 24 ASN H H 0.650 -9.878 -8.801 1.00 . A A . 24 ASN H 1 1 10 5414 1 1 24 ASN HA H 2.610 -9.090 -8.236 1.00 . A A . 24 ASN HA 1 1 10 5415 1 1 24 ASN HB2 H 3.690 -9.248 -11.065 1.00 . A A . 24 ASN HB2 1 1 10 5416 1 1 24 ASN HB3 H 4.592 -9.018 -9.578 1.00 . A A . 24 ASN HB3 1 1 10 5417 1 1 24 ASN HD21 H 2.844 -11.344 -11.530 1.00 . A A . 24 ASN HD21 1 1 10 5418 1 1 24 ASN HD22 H 3.498 -12.766 -10.690 1.00 . A A . 24 ASN HD22 1 1 10 5419 1 1 24 ASN N N 1.236 -9.714 -9.618 1.00 . A A . 24 ASN N 1 1 10 5420 1 1 24 ASN ND2 N 3.395 -11.772 -10.792 1.00 . A A . 24 ASN ND2 1 1 10 5421 1 1 24 ASN O O 3.293 -6.699 -9.388 1.00 . A A . 24 ASN O 1 1 10 5422 1 1 24 ASN OD1 O 4.466 -11.479 -8.879 1.00 . A A . 24 ASN OD1 1 1 10 5423 1 1 25 ALA C C 1.138 -4.789 -8.417 1.00 . A A . 25 ALA C 1 1 10 5424 1 1 25 ALA CA C 0.846 -5.466 -9.775 1.00 . A A . 25 ALA CA 1 1 10 5425 1 1 25 ALA CB C -0.595 -5.215 -10.231 1.00 . A A . 25 ALA CB 1 1 10 5426 1 1 25 ALA H H 0.288 -7.529 -9.836 1.00 . A A . 25 ALA H 1 1 10 5427 1 1 25 ALA HA H 1.518 -5.034 -10.518 1.00 . A A . 25 ALA HA 1 1 10 5428 1 1 25 ALA HB1 H -0.774 -5.717 -11.183 1.00 . A A . 25 ALA HB1 1 1 10 5429 1 1 25 ALA HB2 H -1.296 -5.589 -9.484 1.00 . A A . 25 ALA HB2 1 1 10 5430 1 1 25 ALA HB3 H -0.753 -4.146 -10.365 1.00 . A A . 25 ALA HB3 1 1 10 5431 1 1 25 ALA N N 1.085 -6.911 -9.733 1.00 . A A . 25 ALA N 1 1 10 5432 1 1 25 ALA O O 1.021 -5.414 -7.363 1.00 . A A . 25 ALA O 1 1 10 5433 1 1 26 SER C C 1.344 -1.280 -7.302 1.00 . A A . 26 SER C 1 1 10 5434 1 1 26 SER CA C 1.849 -2.724 -7.231 1.00 . A A . 26 SER CA 1 1 10 5435 1 1 26 SER CB C 3.364 -2.745 -6.979 1.00 . A A . 26 SER CB 1 1 10 5436 1 1 26 SER H H 1.506 -2.973 -9.295 1.00 . A A . 26 SER H 1 1 10 5437 1 1 26 SER HA H 1.383 -3.194 -6.370 1.00 . A A . 26 SER HA 1 1 10 5438 1 1 26 SER HB2 H 3.594 -2.107 -6.125 1.00 . A A . 26 SER HB2 1 1 10 5439 1 1 26 SER HB3 H 3.676 -3.759 -6.737 1.00 . A A . 26 SER HB3 1 1 10 5440 1 1 26 SER HG H 4.041 -2.962 -8.790 1.00 . A A . 26 SER HG 1 1 10 5441 1 1 26 SER N N 1.494 -3.497 -8.430 1.00 . A A . 26 SER N 1 1 10 5442 1 1 26 SER O O 1.202 -0.723 -8.389 1.00 . A A . 26 SER O 1 1 10 5443 1 1 26 SER OG O 4.095 -2.295 -8.101 1.00 . A A . 26 SER OG 1 1 10 5444 1 1 27 GLN C C 1.300 1.336 -4.742 1.00 . A A . 27 GLN C 1 1 10 5445 1 1 27 GLN CA C 0.664 0.720 -5.995 1.00 . A A . 27 GLN CA 1 1 10 5446 1 1 27 GLN CB C -0.876 0.862 -5.930 1.00 . A A . 27 GLN CB 1 1 10 5447 1 1 27 GLN CD C -1.023 3.189 -7.031 1.00 . A A . 27 GLN CD 1 1 10 5448 1 1 27 GLN CG C -1.473 1.725 -7.055 1.00 . A A . 27 GLN CG 1 1 10 5449 1 1 27 GLN H H 1.108 -1.230 -5.278 1.00 . A A . 27 GLN H 1 1 10 5450 1 1 27 GLN HA H 1.043 1.255 -6.867 1.00 . A A . 27 GLN HA 1 1 10 5451 1 1 27 GLN HB2 H -1.339 -0.124 -5.982 1.00 . A A . 27 GLN HB2 1 1 10 5452 1 1 27 GLN HB3 H -1.170 1.294 -4.972 1.00 . A A . 27 GLN HB3 1 1 10 5453 1 1 27 GLN HE21 H -2.917 4.011 -6.707 1.00 . A A . 27 GLN HE21 1 1 10 5454 1 1 27 GLN HE22 H -1.552 5.074 -7.000 1.00 . A A . 27 GLN HE22 1 1 10 5455 1 1 27 GLN HG2 H -1.202 1.296 -8.020 1.00 . A A . 27 GLN HG2 1 1 10 5456 1 1 27 GLN HG3 H -2.559 1.689 -6.971 1.00 . A A . 27 GLN HG3 1 1 10 5457 1 1 27 GLN N N 1.046 -0.687 -6.138 1.00 . A A . 27 GLN N 1 1 10 5458 1 1 27 GLN NE2 N -1.930 4.144 -6.980 1.00 . A A . 27 GLN NE2 1 1 10 5459 1 1 27 GLN O O 1.241 0.746 -3.663 1.00 . A A . 27 GLN O 1 1 10 5460 1 1 27 GLN OE1 O 0.160 3.506 -7.032 1.00 . A A . 27 GLN OE1 1 1 10 5461 1 1 28 PHE C C 1.252 4.169 -3.017 1.00 . A A . 28 PHE C 1 1 10 5462 1 1 28 PHE CA C 2.343 3.356 -3.736 1.00 . A A . 28 PHE CA 1 1 10 5463 1 1 28 PHE CB C 3.558 4.178 -4.174 1.00 . A A . 28 PHE CB 1 1 10 5464 1 1 28 PHE CD1 C 5.416 2.698 -3.308 1.00 . A A . 28 PHE CD1 1 1 10 5465 1 1 28 PHE CD2 C 5.234 3.052 -5.711 1.00 . A A . 28 PHE CD2 1 1 10 5466 1 1 28 PHE CE1 C 6.533 1.872 -3.511 1.00 . A A . 28 PHE CE1 1 1 10 5467 1 1 28 PHE CE2 C 6.349 2.219 -5.915 1.00 . A A . 28 PHE CE2 1 1 10 5468 1 1 28 PHE CG C 4.773 3.303 -4.406 1.00 . A A . 28 PHE CG 1 1 10 5469 1 1 28 PHE CZ C 7.002 1.633 -4.815 1.00 . A A . 28 PHE CZ 1 1 10 5470 1 1 28 PHE H H 1.755 3.019 -5.770 1.00 . A A . 28 PHE H 1 1 10 5471 1 1 28 PHE HA H 2.697 2.655 -2.980 1.00 . A A . 28 PHE HA 1 1 10 5472 1 1 28 PHE HB2 H 3.319 4.742 -5.077 1.00 . A A . 28 PHE HB2 1 1 10 5473 1 1 28 PHE HB3 H 3.818 4.891 -3.391 1.00 . A A . 28 PHE HB3 1 1 10 5474 1 1 28 PHE HD1 H 5.050 2.841 -2.302 1.00 . A A . 28 PHE HD1 1 1 10 5475 1 1 28 PHE HD2 H 4.724 3.490 -6.556 1.00 . A A . 28 PHE HD2 1 1 10 5476 1 1 28 PHE HE1 H 7.012 1.419 -2.657 1.00 . A A . 28 PHE HE1 1 1 10 5477 1 1 28 PHE HE2 H 6.700 2.027 -6.918 1.00 . A A . 28 PHE HE2 1 1 10 5478 1 1 28 PHE HZ H 7.857 0.990 -4.977 1.00 . A A . 28 PHE HZ 1 1 10 5479 1 1 28 PHE N N 1.833 2.558 -4.866 1.00 . A A . 28 PHE N 1 1 10 5480 1 1 28 PHE O O 1.534 4.983 -2.137 1.00 . A A . 28 PHE O 1 1 10 5481 1 1 29 GLU C C -1.552 3.448 -1.640 1.00 . A A . 29 GLU C 1 1 10 5482 1 1 29 GLU CA C -1.227 4.422 -2.791 1.00 . A A . 29 GLU CA 1 1 10 5483 1 1 29 GLU CB C -2.312 4.388 -3.873 1.00 . A A . 29 GLU CB 1 1 10 5484 1 1 29 GLU CD C -4.747 4.543 -4.599 1.00 . A A . 29 GLU CD 1 1 10 5485 1 1 29 GLU CG C -3.754 4.643 -3.431 1.00 . A A . 29 GLU CG 1 1 10 5486 1 1 29 GLU H H -0.101 3.303 -4.184 1.00 . A A . 29 GLU H 1 1 10 5487 1 1 29 GLU HA H -1.110 5.435 -2.405 1.00 . A A . 29 GLU HA 1 1 10 5488 1 1 29 GLU HB2 H -2.051 5.152 -4.605 1.00 . A A . 29 GLU HB2 1 1 10 5489 1 1 29 GLU HB3 H -2.280 3.406 -4.347 1.00 . A A . 29 GLU HB3 1 1 10 5490 1 1 29 GLU HG2 H -4.038 3.905 -2.680 1.00 . A A . 29 GLU HG2 1 1 10 5491 1 1 29 GLU HG3 H -3.813 5.635 -2.978 1.00 . A A . 29 GLU HG3 1 1 10 5492 1 1 29 GLU N N 0.004 3.965 -3.432 1.00 . A A . 29 GLU N 1 1 10 5493 1 1 29 GLU O O -1.163 2.279 -1.691 1.00 . A A . 29 GLU O 1 1 10 5494 1 1 29 GLU OE1 O -4.363 4.206 -5.753 1.00 . A A . 29 GLU OE1 1 1 10 5495 1 1 29 GLU OE2 O -5.951 4.786 -4.353 1.00 . A A . 29 GLU OE2 1 1 10 5496 1 1 30 ARG C C -4.112 3.144 0.870 1.00 . A A . 30 ARG C 1 1 10 5497 1 1 30 ARG CA C -2.607 3.063 0.558 1.00 . A A . 30 ARG CA 1 1 10 5498 1 1 30 ARG CB C -1.704 3.424 1.760 1.00 . A A . 30 ARG CB 1 1 10 5499 1 1 30 ARG CD C 0.758 3.768 2.470 1.00 . A A . 30 ARG CD 1 1 10 5500 1 1 30 ARG CG C -0.218 3.141 1.464 1.00 . A A . 30 ARG CG 1 1 10 5501 1 1 30 ARG CZ C 2.410 4.675 0.843 1.00 . A A . 30 ARG CZ 1 1 10 5502 1 1 30 ARG H H -2.605 4.857 -0.597 1.00 . A A . 30 ARG H 1 1 10 5503 1 1 30 ARG HA H -2.396 2.028 0.313 1.00 . A A . 30 ARG HA 1 1 10 5504 1 1 30 ARG HB2 H -1.834 4.481 1.994 1.00 . A A . 30 ARG HB2 1 1 10 5505 1 1 30 ARG HB3 H -2.006 2.834 2.627 1.00 . A A . 30 ARG HB3 1 1 10 5506 1 1 30 ARG HD2 H 0.406 4.759 2.761 1.00 . A A . 30 ARG HD2 1 1 10 5507 1 1 30 ARG HD3 H 0.804 3.146 3.367 1.00 . A A . 30 ARG HD3 1 1 10 5508 1 1 30 ARG HE H 2.763 3.136 2.019 1.00 . A A . 30 ARG HE 1 1 10 5509 1 1 30 ARG HG2 H -0.041 2.067 1.421 1.00 . A A . 30 ARG HG2 1 1 10 5510 1 1 30 ARG HG3 H 0.019 3.538 0.482 1.00 . A A . 30 ARG HG3 1 1 10 5511 1 1 30 ARG HH11 H 0.834 5.884 1.006 1.00 . A A . 30 ARG HH11 1 1 10 5512 1 1 30 ARG HH12 H 1.665 5.849 -0.538 1.00 . A A . 30 ARG HH12 1 1 10 5513 1 1 30 ARG HH21 H 3.975 3.560 0.317 1.00 . A A . 30 ARG HH21 1 1 10 5514 1 1 30 ARG HH22 H 3.660 4.986 -0.690 1.00 . A A . 30 ARG HH22 1 1 10 5515 1 1 30 ARG N N -2.270 3.906 -0.601 1.00 . A A . 30 ARG N 1 1 10 5516 1 1 30 ARG NE N 2.099 3.881 1.861 1.00 . A A . 30 ARG NE 1 1 10 5517 1 1 30 ARG NH1 N 1.648 5.669 0.466 1.00 . A A . 30 ARG NH1 1 1 10 5518 1 1 30 ARG NH2 N 3.472 4.428 0.124 1.00 . A A . 30 ARG NH2 1 1 10 5519 1 1 30 ARG O O -4.521 4.005 1.648 1.00 . A A . 30 ARG O 1 1 10 5520 1 1 31 PRO C C -6.743 1.142 1.551 1.00 . A A . 31 PRO C 1 1 10 5521 1 1 31 PRO CA C -6.381 2.195 0.480 1.00 . A A . 31 PRO CA 1 1 10 5522 1 1 31 PRO CB C -6.918 1.820 -0.906 1.00 . A A . 31 PRO CB 1 1 10 5523 1 1 31 PRO CD C -4.566 1.304 -0.766 1.00 . A A . 31 PRO CD 1 1 10 5524 1 1 31 PRO CG C -5.868 0.834 -1.417 1.00 . A A . 31 PRO CG 1 1 10 5525 1 1 31 PRO HA H -6.784 3.163 0.779 1.00 . A A . 31 PRO HA 1 1 10 5526 1 1 31 PRO HB2 H -7.913 1.374 -0.877 1.00 . A A . 31 PRO HB2 1 1 10 5527 1 1 31 PRO HB3 H -6.924 2.706 -1.543 1.00 . A A . 31 PRO HB3 1 1 10 5528 1 1 31 PRO HD2 H -4.078 0.450 -0.313 1.00 . A A . 31 PRO HD2 1 1 10 5529 1 1 31 PRO HD3 H -3.891 1.743 -1.496 1.00 . A A . 31 PRO HD3 1 1 10 5530 1 1 31 PRO HG2 H -6.109 -0.166 -1.057 1.00 . A A . 31 PRO HG2 1 1 10 5531 1 1 31 PRO HG3 H -5.803 0.846 -2.505 1.00 . A A . 31 PRO HG3 1 1 10 5532 1 1 31 PRO N N -4.937 2.265 0.267 1.00 . A A . 31 PRO N 1 1 10 5533 1 1 31 PRO O O -5.868 0.504 2.144 1.00 . A A . 31 PRO O 1 1 10 5534 1 1 32 SER C C -9.795 -0.870 2.091 1.00 . A A . 32 SER C 1 1 10 5535 1 1 32 SER CA C -8.550 -0.148 2.644 1.00 . A A . 32 SER CA 1 1 10 5536 1 1 32 SER CB C -8.798 0.406 4.055 1.00 . A A . 32 SER CB 1 1 10 5537 1 1 32 SER H H -8.723 1.518 1.315 1.00 . A A . 32 SER H 1 1 10 5538 1 1 32 SER HA H -7.777 -0.912 2.727 1.00 . A A . 32 SER HA 1 1 10 5539 1 1 32 SER HB2 H -7.892 0.887 4.427 1.00 . A A . 32 SER HB2 1 1 10 5540 1 1 32 SER HB3 H -9.607 1.136 4.026 1.00 . A A . 32 SER HB3 1 1 10 5541 1 1 32 SER HG H -9.797 -1.195 4.421 1.00 . A A . 32 SER HG 1 1 10 5542 1 1 32 SER N N -8.045 0.928 1.776 1.00 . A A . 32 SER N 1 1 10 5543 1 1 32 SER O O -10.455 -1.584 2.850 1.00 . A A . 32 SER O 1 1 10 5544 1 1 32 SER OG O -9.149 -0.655 4.918 1.00 . A A . 32 SER OG 1 1 10 5545 1 1 33 GLY C C -11.632 -0.617 -1.171 1.00 . A A . 33 GLY C 1 1 10 5546 1 1 33 GLY CA C -11.306 -1.274 0.160 1.00 . A A . 33 GLY CA 1 1 10 5547 1 1 33 GLY H H -9.568 -0.117 0.186 1.00 . A A . 33 GLY H 1 1 10 5548 1 1 33 GLY HA2 H -11.130 -2.332 -0.020 1.00 . A A . 33 GLY HA2 1 1 10 5549 1 1 33 GLY HA3 H -12.177 -1.172 0.807 1.00 . A A . 33 GLY HA3 1 1 10 5550 1 1 33 GLY N N -10.132 -0.680 0.806 1.00 . A A . 33 GLY N 1 1 10 5551 1 1 33 GLY O O -10.713 -0.094 -1.842 1.00 . A A . 33 GLY O 1 1 10 5552 1 1 33 GLY OXT O -12.808 -0.662 -1.576 1.00 . A A . 33 GLY OXT 1 1 10 5553 2 2 1 NAG C1 C 13.084 0.328 -0.979 1.00 . B A . 101 NAG C1 1 1 10 5554 2 2 1 NAG C2 C 12.773 1.776 -1.411 1.00 . B A . 101 NAG C2 1 1 10 5555 2 2 1 NAG C3 C 11.521 1.730 -2.295 1.00 . B A . 101 NAG C3 1 1 10 5556 2 2 1 NAG C4 C 11.785 0.865 -3.529 1.00 . B A . 101 NAG C4 1 1 10 5557 2 2 1 NAG C5 C 12.176 -0.552 -3.093 1.00 . B A . 101 NAG C5 1 1 10 5558 2 2 1 NAG C6 C 12.523 -1.520 -4.221 1.00 . B A . 101 NAG C6 1 1 10 5559 2 2 1 NAG C7 C 13.535 3.210 0.434 1.00 . B A . 101 NAG C7 1 1 10 5560 2 2 1 NAG C8 C 13.108 4.212 1.513 1.00 . B A . 101 NAG C8 1 1 10 5561 2 2 1 NAG H1 H 12.237 -0.101 -0.444 1.00 . B A . 101 NAG H1 1 1 10 5562 2 2 1 NAG H2 H 13.613 2.170 -1.987 1.00 . B A . 101 NAG H2 1 1 10 5563 2 2 1 NAG H3 H 10.697 1.298 -1.721 1.00 . B A . 101 NAG H3 1 1 10 5564 2 2 1 NAG H4 H 12.565 1.310 -4.148 1.00 . B A . 101 NAG H4 1 1 10 5565 2 2 1 NAG H5 H 11.346 -0.965 -2.536 1.00 . B A . 101 NAG H5 1 1 10 5566 2 2 1 NAG H61 H 12.624 -2.527 -3.816 1.00 . B A . 101 NAG H61 1 1 10 5567 2 2 1 NAG H62 H 11.745 -1.535 -4.982 1.00 . B A . 101 NAG H62 1 1 10 5568 2 2 1 NAG H81 H 13.921 4.915 1.699 1.00 . B A . 101 NAG H81 1 1 10 5569 2 2 1 NAG H82 H 12.883 3.679 2.435 1.00 . B A . 101 NAG H82 1 1 10 5570 2 2 1 NAG H83 H 12.229 4.770 1.188 1.00 . B A . 101 NAG H83 1 1 10 5571 2 2 1 NAG HN2 H 11.593 2.773 0.074 1.00 . B A . 101 NAG HN2 1 1 10 5572 2 2 1 NAG HO3 H 11.098 3.654 -1.984 1.00 . B A . 101 NAG HO3 1 1 10 5573 2 2 1 NAG HO4 H 10.261 1.763 -4.278 1.00 . B A . 101 NAG HO4 1 1 10 5574 2 2 1 NAG HO6 H 14.380 -0.975 -4.033 1.00 . B A . 101 NAG HO6 1 1 10 5575 2 2 1 NAG N2 N 12.546 2.652 -0.263 1.00 . B A . 101 NAG N2 1 1 10 5576 2 2 1 NAG O3 O 11.141 3.055 -2.740 1.00 . B A . 101 NAG O3 1 1 10 5577 2 2 1 NAG O4 O 10.549 0.840 -4.255 1.00 . B A . 101 NAG O4 1 1 10 5578 2 2 1 NAG O5 O 13.346 -0.460 -2.189 1.00 . B A . 101 NAG O5 1 1 10 5579 2 2 1 NAG O6 O 13.783 -1.119 -4.776 1.00 . B A . 101 NAG O6 1 1 10 5580 2 2 1 NAG O7 O 14.711 2.924 0.220 1.00 . B A . 101 NAG O7 1 1 11 5581 1 1 1 LYS C C -8.290 1.185 -3.410 1.00 . A A . 1 LYS C 1 1 11 5582 1 1 1 LYS CA C -9.191 2.033 -2.516 1.00 . A A . 1 LYS CA 1 1 11 5583 1 1 1 LYS CB C -10.219 2.838 -3.341 1.00 . A A . 1 LYS CB 1 1 11 5584 1 1 1 LYS CD C -10.279 5.327 -4.107 1.00 . A A . 1 LYS CD 1 1 11 5585 1 1 1 LYS CE C -9.270 6.487 -4.027 1.00 . A A . 1 LYS CE 1 1 11 5586 1 1 1 LYS CG C -9.613 3.942 -4.245 1.00 . A A . 1 LYS CG 1 1 11 5587 1 1 1 LYS H1 H -7.730 3.476 -2.250 1.00 . A A . 1 LYS H1 1 1 11 5588 1 1 1 LYS H2 H -7.822 2.431 -0.994 1.00 . A A . 1 LYS H2 1 1 11 5589 1 1 1 LYS H3 H -8.981 3.593 -1.187 1.00 . A A . 1 LYS H3 1 1 11 5590 1 1 1 LYS HA H -9.743 1.364 -1.857 1.00 . A A . 1 LYS HA 1 1 11 5591 1 1 1 LYS HB2 H -10.785 2.147 -3.968 1.00 . A A . 1 LYS HB2 1 1 11 5592 1 1 1 LYS HB3 H -10.930 3.276 -2.639 1.00 . A A . 1 LYS HB3 1 1 11 5593 1 1 1 LYS HD2 H -10.924 5.487 -4.973 1.00 . A A . 1 LYS HD2 1 1 11 5594 1 1 1 LYS HD3 H -10.917 5.369 -3.225 1.00 . A A . 1 LYS HD3 1 1 11 5595 1 1 1 LYS HE2 H -8.642 6.484 -4.921 1.00 . A A . 1 LYS HE2 1 1 11 5596 1 1 1 LYS HE3 H -9.838 7.421 -4.013 1.00 . A A . 1 LYS HE3 1 1 11 5597 1 1 1 LYS HG2 H -8.550 4.046 -4.049 1.00 . A A . 1 LYS HG2 1 1 11 5598 1 1 1 LYS HG3 H -9.692 3.621 -5.285 1.00 . A A . 1 LYS HG3 1 1 11 5599 1 1 1 LYS HZ1 H -7.996 7.300 -2.581 1.00 . A A . 1 LYS HZ1 1 1 11 5600 1 1 1 LYS HZ2 H -8.973 6.121 -1.992 1.00 . A A . 1 LYS HZ2 1 1 11 5601 1 1 1 LYS HZ3 H -7.673 5.717 -2.904 1.00 . A A . 1 LYS HZ3 1 1 11 5602 1 1 1 LYS N N -8.376 2.937 -1.676 1.00 . A A . 1 LYS N 1 1 11 5603 1 1 1 LYS NZ N -8.422 6.415 -2.810 1.00 . A A . 1 LYS NZ 1 1 11 5604 1 1 1 LYS O O -7.452 1.746 -4.103 1.00 . A A . 1 LYS O 1 1 11 5605 1 1 2 LEU C C -8.512 -2.252 -4.763 1.00 . A A . 2 LEU C 1 1 11 5606 1 1 2 LEU CA C -7.695 -1.014 -4.329 1.00 . A A . 2 LEU CA 1 1 11 5607 1 1 2 LEU CB C -6.307 -1.359 -3.746 1.00 . A A . 2 LEU CB 1 1 11 5608 1 1 2 LEU CD1 C -6.909 -3.227 -2.066 1.00 . A A . 2 LEU CD1 1 1 11 5609 1 1 2 LEU CD2 C -4.750 -2.027 -1.929 1.00 . A A . 2 LEU CD2 1 1 11 5610 1 1 2 LEU CG C -6.219 -1.882 -2.295 1.00 . A A . 2 LEU CG 1 1 11 5611 1 1 2 LEU H H -9.151 -0.616 -2.864 1.00 . A A . 2 LEU H 1 1 11 5612 1 1 2 LEU HA H -7.517 -0.427 -5.227 1.00 . A A . 2 LEU HA 1 1 11 5613 1 1 2 LEU HB2 H -5.824 -2.083 -4.405 1.00 . A A . 2 LEU HB2 1 1 11 5614 1 1 2 LEU HB3 H -5.711 -0.446 -3.799 1.00 . A A . 2 LEU HB3 1 1 11 5615 1 1 2 LEU HD11 H -6.706 -3.904 -2.892 1.00 . A A . 2 LEU HD11 1 1 11 5616 1 1 2 LEU HD12 H -6.538 -3.695 -1.154 1.00 . A A . 2 LEU HD12 1 1 11 5617 1 1 2 LEU HD13 H -7.985 -3.085 -1.977 1.00 . A A . 2 LEU HD13 1 1 11 5618 1 1 2 LEU HD21 H -4.210 -1.100 -2.125 1.00 . A A . 2 LEU HD21 1 1 11 5619 1 1 2 LEU HD22 H -4.685 -2.245 -0.869 1.00 . A A . 2 LEU HD22 1 1 11 5620 1 1 2 LEU HD23 H -4.297 -2.838 -2.494 1.00 . A A . 2 LEU HD23 1 1 11 5621 1 1 2 LEU HG H -6.630 -1.158 -1.594 1.00 . A A . 2 LEU HG 1 1 11 5622 1 1 2 LEU N N -8.436 -0.147 -3.404 1.00 . A A . 2 LEU N 1 1 11 5623 1 1 2 LEU O O -9.436 -2.632 -4.043 1.00 . A A . 2 LEU O 1 1 11 5624 1 1 3 PRO C C -8.600 -5.340 -5.610 1.00 . A A . 3 PRO C 1 1 11 5625 1 1 3 PRO CA C -8.919 -4.059 -6.414 1.00 . A A . 3 PRO CA 1 1 11 5626 1 1 3 PRO CB C -8.488 -4.241 -7.880 1.00 . A A . 3 PRO CB 1 1 11 5627 1 1 3 PRO CD C -7.293 -2.387 -6.953 1.00 . A A . 3 PRO CD 1 1 11 5628 1 1 3 PRO CG C -7.837 -2.920 -8.273 1.00 . A A . 3 PRO CG 1 1 11 5629 1 1 3 PRO HA H -9.989 -3.858 -6.378 1.00 . A A . 3 PRO HA 1 1 11 5630 1 1 3 PRO HB2 H -7.754 -5.043 -7.965 1.00 . A A . 3 PRO HB2 1 1 11 5631 1 1 3 PRO HB3 H -9.344 -4.458 -8.520 1.00 . A A . 3 PRO HB3 1 1 11 5632 1 1 3 PRO HD2 H -6.300 -2.796 -6.764 1.00 . A A . 3 PRO HD2 1 1 11 5633 1 1 3 PRO HD3 H -7.242 -1.301 -7.010 1.00 . A A . 3 PRO HD3 1 1 11 5634 1 1 3 PRO HG2 H -7.048 -3.057 -9.012 1.00 . A A . 3 PRO HG2 1 1 11 5635 1 1 3 PRO HG3 H -8.600 -2.238 -8.649 1.00 . A A . 3 PRO HG3 1 1 11 5636 1 1 3 PRO N N -8.218 -2.863 -5.933 1.00 . A A . 3 PRO N 1 1 11 5637 1 1 3 PRO O O -7.612 -5.382 -4.871 1.00 . A A . 3 PRO O 1 1 11 5638 1 1 4 PRO C C -7.617 -8.229 -5.568 1.00 . A A . 4 PRO C 1 1 11 5639 1 1 4 PRO CA C -9.057 -7.763 -5.290 1.00 . A A . 4 PRO CA 1 1 11 5640 1 1 4 PRO CB C -10.077 -8.710 -5.932 1.00 . A A . 4 PRO CB 1 1 11 5641 1 1 4 PRO CD C -10.611 -6.475 -6.570 1.00 . A A . 4 PRO CD 1 1 11 5642 1 1 4 PRO CG C -11.273 -7.802 -6.204 1.00 . A A . 4 PRO CG 1 1 11 5643 1 1 4 PRO HA H -9.226 -7.742 -4.213 1.00 . A A . 4 PRO HA 1 1 11 5644 1 1 4 PRO HB2 H -9.693 -9.091 -6.880 1.00 . A A . 4 PRO HB2 1 1 11 5645 1 1 4 PRO HB3 H -10.339 -9.533 -5.267 1.00 . A A . 4 PRO HB3 1 1 11 5646 1 1 4 PRO HD2 H -10.390 -6.460 -7.638 1.00 . A A . 4 PRO HD2 1 1 11 5647 1 1 4 PRO HD3 H -11.271 -5.648 -6.307 1.00 . A A . 4 PRO HD3 1 1 11 5648 1 1 4 PRO HG2 H -11.896 -8.182 -7.015 1.00 . A A . 4 PRO HG2 1 1 11 5649 1 1 4 PRO HG3 H -11.858 -7.680 -5.291 1.00 . A A . 4 PRO HG3 1 1 11 5650 1 1 4 PRO N N -9.366 -6.431 -5.815 1.00 . A A . 4 PRO N 1 1 11 5651 1 1 4 PRO O O -7.065 -8.007 -6.648 1.00 . A A . 4 PRO O 1 1 11 5652 1 1 5 GLY C C -4.496 -8.572 -4.440 1.00 . A A . 5 GLY C 1 1 11 5653 1 1 5 GLY CA C -5.684 -9.510 -4.684 1.00 . A A . 5 GLY CA 1 1 11 5654 1 1 5 GLY H H -7.501 -9.013 -3.705 1.00 . A A . 5 GLY H 1 1 11 5655 1 1 5 GLY HA2 H -5.620 -10.325 -3.963 1.00 . A A . 5 GLY HA2 1 1 11 5656 1 1 5 GLY HA3 H -5.573 -9.932 -5.682 1.00 . A A . 5 GLY HA3 1 1 11 5657 1 1 5 GLY N N -7.007 -8.887 -4.576 1.00 . A A . 5 GLY N 1 1 11 5658 1 1 5 GLY O O -3.395 -9.071 -4.212 1.00 . A A . 5 GLY O 1 1 11 5659 1 1 6 TRP C C -3.619 -6.229 -2.529 1.00 . A A . 6 TRP C 1 1 11 5660 1 1 6 TRP CA C -3.718 -6.242 -4.059 1.00 . A A . 6 TRP CA 1 1 11 5661 1 1 6 TRP CB C -4.112 -4.869 -4.615 1.00 . A A . 6 TRP CB 1 1 11 5662 1 1 6 TRP CD1 C -5.085 -5.213 -6.928 1.00 . A A . 6 TRP CD1 1 1 11 5663 1 1 6 TRP CD2 C -3.213 -3.974 -6.967 1.00 . A A . 6 TRP CD2 1 1 11 5664 1 1 6 TRP CE2 C -3.687 -4.064 -8.311 1.00 . A A . 6 TRP CE2 1 1 11 5665 1 1 6 TRP CE3 C -2.033 -3.226 -6.754 1.00 . A A . 6 TRP CE3 1 1 11 5666 1 1 6 TRP CG C -4.132 -4.719 -6.107 1.00 . A A . 6 TRP CG 1 1 11 5667 1 1 6 TRP CH2 C -1.879 -2.690 -9.136 1.00 . A A . 6 TRP CH2 1 1 11 5668 1 1 6 TRP CZ2 C -3.039 -3.441 -9.387 1.00 . A A . 6 TRP CZ2 1 1 11 5669 1 1 6 TRP CZ3 C -1.380 -2.592 -7.826 1.00 . A A . 6 TRP CZ3 1 1 11 5670 1 1 6 TRP H H -5.627 -6.880 -4.638 1.00 . A A . 6 TRP H 1 1 11 5671 1 1 6 TRP HA H -2.743 -6.498 -4.464 1.00 . A A . 6 TRP HA 1 1 11 5672 1 1 6 TRP HB2 H -5.099 -4.607 -4.242 1.00 . A A . 6 TRP HB2 1 1 11 5673 1 1 6 TRP HB3 H -3.413 -4.140 -4.219 1.00 . A A . 6 TRP HB3 1 1 11 5674 1 1 6 TRP HD1 H -5.944 -5.783 -6.601 1.00 . A A . 6 TRP HD1 1 1 11 5675 1 1 6 TRP HE1 H -5.396 -5.100 -9.020 1.00 . A A . 6 TRP HE1 1 1 11 5676 1 1 6 TRP HE3 H -1.638 -3.131 -5.752 1.00 . A A . 6 TRP HE3 1 1 11 5677 1 1 6 TRP HH2 H -1.369 -2.190 -9.949 1.00 . A A . 6 TRP HH2 1 1 11 5678 1 1 6 TRP HZ2 H -3.428 -3.530 -10.390 1.00 . A A . 6 TRP HZ2 1 1 11 5679 1 1 6 TRP HZ3 H -0.490 -2.013 -7.646 1.00 . A A . 6 TRP HZ3 1 1 11 5680 1 1 6 TRP N N -4.701 -7.246 -4.467 1.00 . A A . 6 TRP N 1 1 11 5681 1 1 6 TRP NE1 N -4.814 -4.850 -8.231 1.00 . A A . 6 TRP NE1 1 1 11 5682 1 1 6 TRP O O -4.512 -5.726 -1.849 1.00 . A A . 6 TRP O 1 1 11 5683 1 1 7 GLU C C -1.071 -6.455 -0.010 1.00 . A A . 7 GLU C 1 1 11 5684 1 1 7 GLU CA C -2.390 -7.063 -0.549 1.00 . A A . 7 GLU CA 1 1 11 5685 1 1 7 GLU CB C -2.519 -8.591 -0.401 1.00 . A A . 7 GLU CB 1 1 11 5686 1 1 7 GLU CD C -2.238 -8.663 2.137 1.00 . A A . 7 GLU CD 1 1 11 5687 1 1 7 GLU CG C -3.065 -9.103 0.936 1.00 . A A . 7 GLU CG 1 1 11 5688 1 1 7 GLU H H -1.827 -7.209 -2.579 1.00 . A A . 7 GLU H 1 1 11 5689 1 1 7 GLU HA H -3.217 -6.605 -0.007 1.00 . A A . 7 GLU HA 1 1 11 5690 1 1 7 GLU HB2 H -3.220 -8.957 -1.155 1.00 . A A . 7 GLU HB2 1 1 11 5691 1 1 7 GLU HB3 H -1.565 -9.048 -0.631 1.00 . A A . 7 GLU HB3 1 1 11 5692 1 1 7 GLU HG2 H -4.089 -8.743 1.049 1.00 . A A . 7 GLU HG2 1 1 11 5693 1 1 7 GLU HG3 H -3.105 -10.192 0.910 1.00 . A A . 7 GLU HG3 1 1 11 5694 1 1 7 GLU N N -2.540 -6.794 -1.982 1.00 . A A . 7 GLU N 1 1 11 5695 1 1 7 GLU O O -0.096 -6.323 -0.751 1.00 . A A . 7 GLU O 1 1 11 5696 1 1 7 GLU OE1 O -1.138 -9.220 2.372 1.00 . A A . 7 GLU OE1 1 1 11 5697 1 1 7 GLU OE2 O -2.697 -7.734 2.840 1.00 . A A . 7 GLU OE2 1 1 11 5698 1 1 8 LYS C C 1.411 -5.928 1.876 1.00 . A A . 8 LYS C 1 1 11 5699 1 1 8 LYS CA C 0.023 -5.266 1.912 1.00 . A A . 8 LYS CA 1 1 11 5700 1 1 8 LYS CB C -0.391 -4.925 3.360 1.00 . A A . 8 LYS CB 1 1 11 5701 1 1 8 LYS CD C -1.295 -6.175 5.432 1.00 . A A . 8 LYS CD 1 1 11 5702 1 1 8 LYS CE C -1.326 -7.562 6.094 1.00 . A A . 8 LYS CE 1 1 11 5703 1 1 8 LYS CG C -0.249 -6.128 4.312 1.00 . A A . 8 LYS CG 1 1 11 5704 1 1 8 LYS H H -1.817 -6.351 1.871 1.00 . A A . 8 LYS H 1 1 11 5705 1 1 8 LYS HA H 0.091 -4.324 1.363 1.00 . A A . 8 LYS HA 1 1 11 5706 1 1 8 LYS HB2 H 0.227 -4.107 3.733 1.00 . A A . 8 LYS HB2 1 1 11 5707 1 1 8 LYS HB3 H -1.427 -4.583 3.353 1.00 . A A . 8 LYS HB3 1 1 11 5708 1 1 8 LYS HD2 H -1.060 -5.415 6.178 1.00 . A A . 8 LYS HD2 1 1 11 5709 1 1 8 LYS HD3 H -2.283 -5.965 5.019 1.00 . A A . 8 LYS HD3 1 1 11 5710 1 1 8 LYS HE2 H -0.346 -7.781 6.527 1.00 . A A . 8 LYS HE2 1 1 11 5711 1 1 8 LYS HE3 H -2.060 -7.531 6.904 1.00 . A A . 8 LYS HE3 1 1 11 5712 1 1 8 LYS HG2 H -0.349 -7.034 3.724 1.00 . A A . 8 LYS HG2 1 1 11 5713 1 1 8 LYS HG3 H 0.751 -6.130 4.749 1.00 . A A . 8 LYS HG3 1 1 11 5714 1 1 8 LYS HZ1 H -2.004 -9.475 5.554 1.00 . A A . 8 LYS HZ1 1 1 11 5715 1 1 8 LYS HZ2 H -2.426 -8.259 4.479 1.00 . A A . 8 LYS HZ2 1 1 11 5716 1 1 8 LYS HZ3 H -0.966 -8.807 4.444 1.00 . A A . 8 LYS HZ3 1 1 11 5717 1 1 8 LYS N N -1.046 -6.057 1.272 1.00 . A A . 8 LYS N 1 1 11 5718 1 1 8 LYS NZ N -1.705 -8.616 5.120 1.00 . A A . 8 LYS NZ 1 1 11 5719 1 1 8 LYS O O 1.558 -7.115 2.166 1.00 . A A . 8 LYS O 1 1 11 5720 1 1 9 ARG C C 4.735 -4.414 2.223 1.00 . A A . 9 ARG C 1 1 11 5721 1 1 9 ARG CA C 3.870 -5.519 1.587 1.00 . A A . 9 ARG CA 1 1 11 5722 1 1 9 ARG CB C 4.351 -5.752 0.143 1.00 . A A . 9 ARG CB 1 1 11 5723 1 1 9 ARG CD C 3.654 -8.237 -0.338 1.00 . A A . 9 ARG CD 1 1 11 5724 1 1 9 ARG CG C 3.633 -6.757 -0.765 1.00 . A A . 9 ARG CG 1 1 11 5725 1 1 9 ARG CZ C 1.524 -9.625 -0.310 1.00 . A A . 9 ARG CZ 1 1 11 5726 1 1 9 ARG H H 2.232 -4.160 1.380 1.00 . A A . 9 ARG H 1 1 11 5727 1 1 9 ARG HA H 4.011 -6.434 2.167 1.00 . A A . 9 ARG HA 1 1 11 5728 1 1 9 ARG HB2 H 4.288 -4.785 -0.353 1.00 . A A . 9 ARG HB2 1 1 11 5729 1 1 9 ARG HB3 H 5.400 -6.049 0.160 1.00 . A A . 9 ARG HB3 1 1 11 5730 1 1 9 ARG HD2 H 3.947 -8.833 -1.202 1.00 . A A . 9 ARG HD2 1 1 11 5731 1 1 9 ARG HD3 H 4.424 -8.378 0.424 1.00 . A A . 9 ARG HD3 1 1 11 5732 1 1 9 ARG HE H 2.049 -8.304 1.061 1.00 . A A . 9 ARG HE 1 1 11 5733 1 1 9 ARG HG2 H 2.627 -6.396 -0.969 1.00 . A A . 9 ARG HG2 1 1 11 5734 1 1 9 ARG HG3 H 4.177 -6.722 -1.708 1.00 . A A . 9 ARG HG3 1 1 11 5735 1 1 9 ARG HH11 H 2.472 -9.897 -2.051 1.00 . A A . 9 ARG HH11 1 1 11 5736 1 1 9 ARG HH12 H 0.960 -10.787 -1.843 1.00 . A A . 9 ARG HH12 1 1 11 5737 1 1 9 ARG HH21 H 0.129 -9.610 1.239 1.00 . A A . 9 ARG HH21 1 1 11 5738 1 1 9 ARG HH22 H -0.125 -10.690 -0.112 1.00 . A A . 9 ARG HH22 1 1 11 5739 1 1 9 ARG N N 2.446 -5.135 1.597 1.00 . A A . 9 ARG N 1 1 11 5740 1 1 9 ARG NE N 2.363 -8.725 0.187 1.00 . A A . 9 ARG NE 1 1 11 5741 1 1 9 ARG NH1 N 1.686 -10.171 -1.493 1.00 . A A . 9 ARG NH1 1 1 11 5742 1 1 9 ARG NH2 N 0.472 -10.029 0.357 1.00 . A A . 9 ARG NH2 1 1 11 5743 1 1 9 ARG O O 4.227 -3.375 2.644 1.00 . A A . 9 ARG O 1 1 11 5744 1 1 10 MET C C 8.400 -3.938 2.003 1.00 . A A . 10 MET C 1 1 11 5745 1 1 10 MET CA C 7.086 -3.738 2.766 1.00 . A A . 10 MET CA 1 1 11 5746 1 1 10 MET CB C 7.350 -4.101 4.239 1.00 . A A . 10 MET CB 1 1 11 5747 1 1 10 MET CE C 5.334 -2.906 7.713 1.00 . A A . 10 MET CE 1 1 11 5748 1 1 10 MET CG C 6.325 -3.498 5.198 1.00 . A A . 10 MET CG 1 1 11 5749 1 1 10 MET H H 6.412 -5.462 1.786 1.00 . A A . 10 MET H 1 1 11 5750 1 1 10 MET HA H 6.772 -2.699 2.700 1.00 . A A . 10 MET HA 1 1 11 5751 1 1 10 MET HB2 H 7.368 -5.186 4.357 1.00 . A A . 10 MET HB2 1 1 11 5752 1 1 10 MET HB3 H 8.329 -3.713 4.528 1.00 . A A . 10 MET HB3 1 1 11 5753 1 1 10 MET HE1 H 5.504 -1.851 7.500 1.00 . A A . 10 MET HE1 1 1 11 5754 1 1 10 MET HE2 H 4.361 -3.205 7.321 1.00 . A A . 10 MET HE2 1 1 11 5755 1 1 10 MET HE3 H 5.353 -3.063 8.791 1.00 . A A . 10 MET HE3 1 1 11 5756 1 1 10 MET HG2 H 6.358 -2.415 5.085 1.00 . A A . 10 MET HG2 1 1 11 5757 1 1 10 MET HG3 H 5.329 -3.852 4.936 1.00 . A A . 10 MET HG3 1 1 11 5758 1 1 10 MET N N 6.058 -4.608 2.192 1.00 . A A . 10 MET N 1 1 11 5759 1 1 10 MET O O 8.832 -5.065 1.770 1.00 . A A . 10 MET O 1 1 11 5760 1 1 10 MET SD S 6.636 -3.898 6.937 1.00 . A A . 10 MET SD 1 1 11 5761 1 1 11 PHE C C 11.425 -2.907 2.133 1.00 . A A . 11 PHE C 1 1 11 5762 1 1 11 PHE CA C 10.366 -2.799 1.023 1.00 . A A . 11 PHE CA 1 1 11 5763 1 1 11 PHE CB C 10.547 -1.502 0.230 1.00 . A A . 11 PHE CB 1 1 11 5764 1 1 11 PHE CD1 C 10.281 -2.323 -2.144 1.00 . A A . 11 PHE CD1 1 1 11 5765 1 1 11 PHE CD2 C 8.752 -0.599 -1.342 1.00 . A A . 11 PHE CD2 1 1 11 5766 1 1 11 PHE CE1 C 9.683 -2.268 -3.414 1.00 . A A . 11 PHE CE1 1 1 11 5767 1 1 11 PHE CE2 C 8.163 -0.543 -2.618 1.00 . A A . 11 PHE CE2 1 1 11 5768 1 1 11 PHE CG C 9.826 -1.484 -1.106 1.00 . A A . 11 PHE CG 1 1 11 5769 1 1 11 PHE CZ C 8.629 -1.371 -3.652 1.00 . A A . 11 PHE CZ 1 1 11 5770 1 1 11 PHE H H 8.554 -1.936 1.741 1.00 . A A . 11 PHE H 1 1 11 5771 1 1 11 PHE HA H 10.493 -3.626 0.329 1.00 . A A . 11 PHE HA 1 1 11 5772 1 1 11 PHE HB2 H 10.213 -0.672 0.844 1.00 . A A . 11 PHE HB2 1 1 11 5773 1 1 11 PHE HB3 H 11.607 -1.352 0.028 1.00 . A A . 11 PHE HB3 1 1 11 5774 1 1 11 PHE HD1 H 11.116 -2.988 -1.986 1.00 . A A . 11 PHE HD1 1 1 11 5775 1 1 11 PHE HD2 H 8.357 0.030 -0.556 1.00 . A A . 11 PHE HD2 1 1 11 5776 1 1 11 PHE HE1 H 10.039 -2.902 -4.215 1.00 . A A . 11 PHE HE1 1 1 11 5777 1 1 11 PHE HE2 H 7.336 0.121 -2.815 1.00 . A A . 11 PHE HE2 1 1 11 5778 1 1 11 PHE HZ H 8.176 -1.315 -4.631 1.00 . A A . 11 PHE HZ 1 1 11 5779 1 1 11 PHE N N 9.016 -2.830 1.584 1.00 . A A . 11 PHE N 1 1 11 5780 1 1 11 PHE O O 11.170 -2.552 3.283 1.00 . A A . 11 PHE O 1 1 11 5781 1 1 12 ALA C C 14.224 -2.205 3.441 1.00 . A A . 12 ALA C 1 1 11 5782 1 1 12 ALA CA C 13.767 -3.492 2.717 1.00 . A A . 12 ALA CA 1 1 11 5783 1 1 12 ALA CB C 14.933 -4.134 1.954 1.00 . A A . 12 ALA CB 1 1 11 5784 1 1 12 ALA H H 12.828 -3.588 0.821 1.00 . A A . 12 ALA H 1 1 11 5785 1 1 12 ALA HA H 13.445 -4.191 3.491 1.00 . A A . 12 ALA HA 1 1 11 5786 1 1 12 ALA HB1 H 15.752 -4.338 2.645 1.00 . A A . 12 ALA HB1 1 1 11 5787 1 1 12 ALA HB2 H 14.614 -5.074 1.505 1.00 . A A . 12 ALA HB2 1 1 11 5788 1 1 12 ALA HB3 H 15.289 -3.459 1.173 1.00 . A A . 12 ALA HB3 1 1 11 5789 1 1 12 ALA N N 12.653 -3.312 1.775 1.00 . A A . 12 ALA N 1 1 11 5790 1 1 12 ALA O O 14.965 -2.284 4.416 1.00 . A A . 12 ALA O 1 1 11 5791 1 1 13 ASN C C 12.792 0.620 4.627 1.00 . A A . 13 ASN C 1 1 11 5792 1 1 13 ASN CA C 13.948 0.264 3.657 1.00 . A A . 13 ASN CA 1 1 11 5793 1 1 13 ASN CB C 14.148 1.342 2.567 1.00 . A A . 13 ASN CB 1 1 11 5794 1 1 13 ASN CG C 12.962 1.473 1.617 1.00 . A A . 13 ASN CG 1 1 11 5795 1 1 13 ASN H H 13.143 -1.040 2.198 1.00 . A A . 13 ASN H 1 1 11 5796 1 1 13 ASN HA H 14.855 0.222 4.262 1.00 . A A . 13 ASN HA 1 1 11 5797 1 1 13 ASN HB2 H 14.318 2.308 3.041 1.00 . A A . 13 ASN HB2 1 1 11 5798 1 1 13 ASN HB3 H 15.037 1.091 1.990 1.00 . A A . 13 ASN HB3 1 1 11 5799 1 1 13 ASN HD21 H 14.079 2.399 0.189 1.00 . A A . 13 ASN HD21 1 1 11 5800 1 1 13 ASN N N 13.766 -1.030 2.991 1.00 . A A . 13 ASN N 1 1 11 5801 1 1 13 ASN ND2 N 13.175 2.025 0.423 1.00 . A A . 13 ASN ND2 1 1 11 5802 1 1 13 ASN O O 12.816 1.698 5.215 1.00 . A A . 13 ASN O 1 1 11 5803 1 1 13 ASN OD1 O 11.860 1.030 1.938 1.00 . A A . 13 ASN OD1 1 1 11 5804 1 1 14 GLY C C 9.389 0.603 4.900 1.00 . A A . 14 GLY C 1 1 11 5805 1 1 14 GLY CA C 10.597 -0.023 5.615 1.00 . A A . 14 GLY CA 1 1 11 5806 1 1 14 GLY H H 11.790 -1.125 4.259 1.00 . A A . 14 GLY H 1 1 11 5807 1 1 14 GLY HA2 H 10.280 -0.985 6.018 1.00 . A A . 14 GLY HA2 1 1 11 5808 1 1 14 GLY HA3 H 10.865 0.622 6.454 1.00 . A A . 14 GLY HA3 1 1 11 5809 1 1 14 GLY N N 11.773 -0.245 4.770 1.00 . A A . 14 GLY N 1 1 11 5810 1 1 14 GLY O O 8.482 1.084 5.575 1.00 . A A . 14 GLY O 1 1 11 5811 1 1 15 THR C C 7.169 0.457 2.454 1.00 . A A . 15 THR C 1 1 11 5812 1 1 15 THR CA C 8.330 1.376 2.807 1.00 . A A . 15 THR CA 1 1 11 5813 1 1 15 THR CB C 8.932 2.004 1.542 1.00 . A A . 15 THR CB 1 1 11 5814 1 1 15 THR CG2 C 7.980 2.890 0.742 1.00 . A A . 15 THR CG2 1 1 11 5815 1 1 15 THR H H 10.068 0.146 3.024 1.00 . A A . 15 THR H 1 1 11 5816 1 1 15 THR HA H 7.954 2.194 3.413 1.00 . A A . 15 THR HA 1 1 11 5817 1 1 15 THR HB H 9.294 1.219 0.887 1.00 . A A . 15 THR HB 1 1 11 5818 1 1 15 THR HG1 H 10.757 2.141 2.082 1.00 . A A . 15 THR HG1 1 1 11 5819 1 1 15 THR HG21 H 7.073 2.342 0.491 1.00 . A A . 15 THR HG21 1 1 11 5820 1 1 15 THR HG22 H 7.717 3.776 1.321 1.00 . A A . 15 THR HG22 1 1 11 5821 1 1 15 THR HG23 H 8.468 3.192 -0.188 1.00 . A A . 15 THR HG23 1 1 11 5822 1 1 15 THR N N 9.349 0.620 3.559 1.00 . A A . 15 THR N 1 1 11 5823 1 1 15 THR O O 7.381 -0.575 1.820 1.00 . A A . 15 THR O 1 1 11 5824 1 1 15 THR OG1 O 10.031 2.790 1.917 1.00 . A A . 15 THR OG1 1 1 11 5825 1 1 16 VAL C C 4.042 0.297 1.402 1.00 . A A . 16 VAL C 1 1 11 5826 1 1 16 VAL CA C 4.753 -0.007 2.715 1.00 . A A . 16 VAL CA 1 1 11 5827 1 1 16 VAL CB C 3.793 0.236 3.905 1.00 . A A . 16 VAL CB 1 1 11 5828 1 1 16 VAL CG1 C 2.377 -0.328 3.700 1.00 . A A . 16 VAL CG1 1 1 11 5829 1 1 16 VAL CG2 C 4.351 -0.424 5.169 1.00 . A A . 16 VAL CG2 1 1 11 5830 1 1 16 VAL H H 5.823 1.729 3.299 1.00 . A A . 16 VAL H 1 1 11 5831 1 1 16 VAL HA H 5.050 -1.055 2.718 1.00 . A A . 16 VAL HA 1 1 11 5832 1 1 16 VAL HB H 3.709 1.310 4.078 1.00 . A A . 16 VAL HB 1 1 11 5833 1 1 16 VAL HG11 H 1.863 0.208 2.903 1.00 . A A . 16 VAL HG11 1 1 11 5834 1 1 16 VAL HG12 H 2.424 -1.390 3.452 1.00 . A A . 16 VAL HG12 1 1 11 5835 1 1 16 VAL HG13 H 1.793 -0.204 4.613 1.00 . A A . 16 VAL HG13 1 1 11 5836 1 1 16 VAL HG21 H 4.310 -1.507 5.053 1.00 . A A . 16 VAL HG21 1 1 11 5837 1 1 16 VAL HG22 H 5.380 -0.108 5.344 1.00 . A A . 16 VAL HG22 1 1 11 5838 1 1 16 VAL HG23 H 3.747 -0.137 6.031 1.00 . A A . 16 VAL HG23 1 1 11 5839 1 1 16 VAL N N 5.945 0.843 2.828 1.00 . A A . 16 VAL N 1 1 11 5840 1 1 16 VAL O O 3.900 1.450 1.000 1.00 . A A . 16 VAL O 1 1 11 5841 1 1 17 TYR C C 1.839 -1.911 -0.518 1.00 . A A . 17 TYR C 1 1 11 5842 1 1 17 TYR CA C 2.804 -0.723 -0.486 1.00 . A A . 17 TYR CA 1 1 11 5843 1 1 17 TYR CB C 3.774 -0.757 -1.686 1.00 . A A . 17 TYR CB 1 1 11 5844 1 1 17 TYR CD1 C 5.829 -2.055 -1.023 1.00 . A A . 17 TYR CD1 1 1 11 5845 1 1 17 TYR CD2 C 4.325 -3.070 -2.654 1.00 . A A . 17 TYR CD2 1 1 11 5846 1 1 17 TYR CE1 C 6.700 -3.151 -1.127 1.00 . A A . 17 TYR CE1 1 1 11 5847 1 1 17 TYR CE2 C 5.197 -4.172 -2.763 1.00 . A A . 17 TYR CE2 1 1 11 5848 1 1 17 TYR CG C 4.650 -1.999 -1.789 1.00 . A A . 17 TYR CG 1 1 11 5849 1 1 17 TYR CZ C 6.391 -4.209 -2.009 1.00 . A A . 17 TYR CZ 1 1 11 5850 1 1 17 TYR H H 3.692 -1.691 1.160 1.00 . A A . 17 TYR H 1 1 11 5851 1 1 17 TYR HA H 2.221 0.197 -0.520 1.00 . A A . 17 TYR HA 1 1 11 5852 1 1 17 TYR HB2 H 3.215 -0.633 -2.611 1.00 . A A . 17 TYR HB2 1 1 11 5853 1 1 17 TYR HB3 H 4.442 0.103 -1.611 1.00 . A A . 17 TYR HB3 1 1 11 5854 1 1 17 TYR HD1 H 6.082 -1.236 -0.367 1.00 . A A . 17 TYR HD1 1 1 11 5855 1 1 17 TYR HD2 H 3.415 -3.064 -3.240 1.00 . A A . 17 TYR HD2 1 1 11 5856 1 1 17 TYR HE1 H 7.610 -3.148 -0.548 1.00 . A A . 17 TYR HE1 1 1 11 5857 1 1 17 TYR HE2 H 4.956 -5.010 -3.401 1.00 . A A . 17 TYR HE2 1 1 11 5858 1 1 17 TYR HH H 8.020 -5.161 -1.588 1.00 . A A . 17 TYR HH 1 1 11 5859 1 1 17 TYR N N 3.589 -0.769 0.745 1.00 . A A . 17 TYR N 1 1 11 5860 1 1 17 TYR O O 1.869 -2.760 0.371 1.00 . A A . 17 TYR O 1 1 11 5861 1 1 17 TYR OH O 7.216 -5.285 -2.096 1.00 . A A . 17 TYR OH 1 1 11 5862 1 1 18 TYR C C 0.599 -3.820 -3.193 1.00 . A A . 18 TYR C 1 1 11 5863 1 1 18 TYR CA C 0.196 -3.178 -1.869 1.00 . A A . 18 TYR CA 1 1 11 5864 1 1 18 TYR CB C -1.287 -2.791 -1.850 1.00 . A A . 18 TYR CB 1 1 11 5865 1 1 18 TYR CD1 C -1.259 -1.397 0.244 1.00 . A A . 18 TYR CD1 1 1 11 5866 1 1 18 TYR CD2 C -2.670 -3.372 0.202 1.00 . A A . 18 TYR CD2 1 1 11 5867 1 1 18 TYR CE1 C -1.551 -1.199 1.591 1.00 . A A . 18 TYR CE1 1 1 11 5868 1 1 18 TYR CE2 C -3.047 -3.128 1.534 1.00 . A A . 18 TYR CE2 1 1 11 5869 1 1 18 TYR CG C -1.769 -2.507 -0.445 1.00 . A A . 18 TYR CG 1 1 11 5870 1 1 18 TYR CZ C -2.456 -2.059 2.250 1.00 . A A . 18 TYR CZ 1 1 11 5871 1 1 18 TYR H H 0.878 -1.194 -2.146 1.00 . A A . 18 TYR H 1 1 11 5872 1 1 18 TYR HA H 0.342 -3.924 -1.089 1.00 . A A . 18 TYR HA 1 1 11 5873 1 1 18 TYR HB2 H -1.448 -1.913 -2.479 1.00 . A A . 18 TYR HB2 1 1 11 5874 1 1 18 TYR HB3 H -1.870 -3.614 -2.263 1.00 . A A . 18 TYR HB3 1 1 11 5875 1 1 18 TYR HD1 H -0.612 -0.690 -0.249 1.00 . A A . 18 TYR HD1 1 1 11 5876 1 1 18 TYR HD2 H -3.110 -4.196 -0.340 1.00 . A A . 18 TYR HD2 1 1 11 5877 1 1 18 TYR HE1 H -1.065 -0.368 2.067 1.00 . A A . 18 TYR HE1 1 1 11 5878 1 1 18 TYR HE2 H -3.800 -3.753 1.982 1.00 . A A . 18 TYR HE2 1 1 11 5879 1 1 18 TYR HH H -3.332 -2.531 3.912 1.00 . A A . 18 TYR HH 1 1 11 5880 1 1 18 TYR N N 1.036 -2.019 -1.576 1.00 . A A . 18 TYR N 1 1 11 5881 1 1 18 TYR O O 0.964 -3.145 -4.158 1.00 . A A . 18 TYR O 1 1 11 5882 1 1 18 TYR OH O -2.787 -1.832 3.549 1.00 . A A . 18 TYR OH 1 1 11 5883 1 1 19 PHE C C -0.069 -6.983 -4.688 1.00 . A A . 19 PHE C 1 1 11 5884 1 1 19 PHE CA C 1.024 -6.009 -4.278 1.00 . A A . 19 PHE CA 1 1 11 5885 1 1 19 PHE CB C 2.247 -6.751 -3.751 1.00 . A A . 19 PHE CB 1 1 11 5886 1 1 19 PHE CD1 C 2.537 -9.001 -4.872 1.00 . A A . 19 PHE CD1 1 1 11 5887 1 1 19 PHE CD2 C 4.080 -7.205 -5.431 1.00 . A A . 19 PHE CD2 1 1 11 5888 1 1 19 PHE CE1 C 3.253 -9.876 -5.706 1.00 . A A . 19 PHE CE1 1 1 11 5889 1 1 19 PHE CE2 C 4.792 -8.076 -6.270 1.00 . A A . 19 PHE CE2 1 1 11 5890 1 1 19 PHE CG C 2.954 -7.665 -4.727 1.00 . A A . 19 PHE CG 1 1 11 5891 1 1 19 PHE CZ C 4.384 -9.414 -6.401 1.00 . A A . 19 PHE CZ 1 1 11 5892 1 1 19 PHE H H 0.225 -5.632 -2.371 1.00 . A A . 19 PHE H 1 1 11 5893 1 1 19 PHE HA H 1.332 -5.411 -5.134 1.00 . A A . 19 PHE HA 1 1 11 5894 1 1 19 PHE HB2 H 2.954 -5.999 -3.413 1.00 . A A . 19 PHE HB2 1 1 11 5895 1 1 19 PHE HB3 H 1.940 -7.349 -2.893 1.00 . A A . 19 PHE HB3 1 1 11 5896 1 1 19 PHE HD1 H 1.668 -9.349 -4.337 1.00 . A A . 19 PHE HD1 1 1 11 5897 1 1 19 PHE HD2 H 4.415 -6.186 -5.325 1.00 . A A . 19 PHE HD2 1 1 11 5898 1 1 19 PHE HE1 H 2.949 -10.907 -5.816 1.00 . A A . 19 PHE HE1 1 1 11 5899 1 1 19 PHE HE2 H 5.654 -7.703 -6.803 1.00 . A A . 19 PHE HE2 1 1 11 5900 1 1 19 PHE HZ H 4.923 -10.088 -7.053 1.00 . A A . 19 PHE HZ 1 1 11 5901 1 1 19 PHE N N 0.526 -5.149 -3.217 1.00 . A A . 19 PHE N 1 1 11 5902 1 1 19 PHE O O -0.584 -7.739 -3.861 1.00 . A A . 19 PHE O 1 1 11 5903 1 1 20 ASN C C -0.671 -9.273 -6.709 1.00 . A A . 20 ASN C 1 1 11 5904 1 1 20 ASN CA C -1.346 -7.905 -6.559 1.00 . A A . 20 ASN CA 1 1 11 5905 1 1 20 ASN CB C -1.854 -7.350 -7.889 1.00 . A A . 20 ASN CB 1 1 11 5906 1 1 20 ASN CG C -2.956 -8.245 -8.413 1.00 . A A . 20 ASN CG 1 1 11 5907 1 1 20 ASN H H 0.069 -6.340 -6.601 1.00 . A A . 20 ASN H 1 1 11 5908 1 1 20 ASN HA H -2.201 -8.017 -5.904 1.00 . A A . 20 ASN HA 1 1 11 5909 1 1 20 ASN HB2 H -2.226 -6.340 -7.761 1.00 . A A . 20 ASN HB2 1 1 11 5910 1 1 20 ASN HB3 H -1.037 -7.311 -8.607 1.00 . A A . 20 ASN HB3 1 1 11 5911 1 1 20 ASN HD21 H -4.421 -7.165 -7.510 1.00 . A A . 20 ASN HD21 1 1 11 5912 1 1 20 ASN HD22 H -4.929 -8.597 -8.370 1.00 . A A . 20 ASN HD22 1 1 11 5913 1 1 20 ASN N N -0.432 -6.955 -5.966 1.00 . A A . 20 ASN N 1 1 11 5914 1 1 20 ASN ND2 N -4.196 -7.980 -8.063 1.00 . A A . 20 ASN ND2 1 1 11 5915 1 1 20 ASN O O -0.071 -9.565 -7.747 1.00 . A A . 20 ASN O 1 1 11 5916 1 1 20 ASN OD1 O -2.684 -9.220 -9.098 1.00 . A A . 20 ASN OD1 1 1 11 5917 1 1 21 HIS C C -0.999 -12.472 -6.698 1.00 . A A . 21 HIS C 1 1 11 5918 1 1 21 HIS CA C -0.233 -11.505 -5.768 1.00 . A A . 21 HIS CA 1 1 11 5919 1 1 21 HIS CB C 0.089 -12.050 -4.361 1.00 . A A . 21 HIS CB 1 1 11 5920 1 1 21 HIS CD2 C -2.289 -12.480 -3.531 1.00 . A A . 21 HIS CD2 1 1 11 5921 1 1 21 HIS CE1 C -2.044 -11.883 -1.424 1.00 . A A . 21 HIS CE1 1 1 11 5922 1 1 21 HIS CG C -1.016 -12.030 -3.336 1.00 . A A . 21 HIS CG 1 1 11 5923 1 1 21 HIS H H -1.324 -9.863 -4.877 1.00 . A A . 21 HIS H 1 1 11 5924 1 1 21 HIS HA H 0.734 -11.411 -6.261 1.00 . A A . 21 HIS HA 1 1 11 5925 1 1 21 HIS HB2 H 0.457 -13.072 -4.448 1.00 . A A . 21 HIS HB2 1 1 11 5926 1 1 21 HIS HB3 H 0.913 -11.464 -3.961 1.00 . A A . 21 HIS HB3 1 1 11 5927 1 1 21 HIS HD2 H -2.693 -12.883 -4.449 1.00 . A A . 21 HIS HD2 1 1 11 5928 1 1 21 HIS HE1 H -2.266 -11.726 -0.378 1.00 . A A . 21 HIS HE1 1 1 11 5929 1 1 21 HIS HE2 H -3.879 -12.634 -2.113 1.00 . A A . 21 HIS HE2 1 1 11 5930 1 1 21 HIS N N -0.801 -10.147 -5.704 1.00 . A A . 21 HIS N 1 1 11 5931 1 1 21 HIS ND1 N -0.851 -11.650 -1.999 1.00 . A A . 21 HIS ND1 1 1 11 5932 1 1 21 HIS NE2 N -2.926 -12.368 -2.316 1.00 . A A . 21 HIS NE2 1 1 11 5933 1 1 21 HIS O O -0.962 -13.684 -6.500 1.00 . A A . 21 HIS O 1 1 11 5934 1 1 22 ILE C C -1.571 -12.314 -10.159 1.00 . A A . 22 ILE C 1 1 11 5935 1 1 22 ILE CA C -2.291 -12.678 -8.835 1.00 . A A . 22 ILE CA 1 1 11 5936 1 1 22 ILE CB C -3.825 -12.423 -8.878 1.00 . A A . 22 ILE CB 1 1 11 5937 1 1 22 ILE CD1 C -5.983 -12.369 -7.426 1.00 . A A . 22 ILE CD1 1 1 11 5938 1 1 22 ILE CG1 C -4.485 -12.696 -7.501 1.00 . A A . 22 ILE CG1 1 1 11 5939 1 1 22 ILE CG2 C -4.493 -13.275 -9.974 1.00 . A A . 22 ILE CG2 1 1 11 5940 1 1 22 ILE H H -1.725 -10.928 -7.797 1.00 . A A . 22 ILE H 1 1 11 5941 1 1 22 ILE HA H -2.136 -13.746 -8.678 1.00 . A A . 22 ILE HA 1 1 11 5942 1 1 22 ILE HB H -3.995 -11.377 -9.126 1.00 . A A . 22 ILE HB 1 1 11 5943 1 1 22 ILE HD11 H -6.560 -13.078 -8.018 1.00 . A A . 22 ILE HD11 1 1 11 5944 1 1 22 ILE HD12 H -6.313 -12.439 -6.390 1.00 . A A . 22 ILE HD12 1 1 11 5945 1 1 22 ILE HD13 H -6.161 -11.354 -7.786 1.00 . A A . 22 ILE HD13 1 1 11 5946 1 1 22 ILE HG12 H -4.338 -13.742 -7.229 1.00 . A A . 22 ILE HG12 1 1 11 5947 1 1 22 ILE HG13 H -4.004 -12.083 -6.739 1.00 . A A . 22 ILE HG13 1 1 11 5948 1 1 22 ILE HG21 H -4.326 -14.335 -9.780 1.00 . A A . 22 ILE HG21 1 1 11 5949 1 1 22 ILE HG22 H -5.563 -13.079 -10.019 1.00 . A A . 22 ILE HG22 1 1 11 5950 1 1 22 ILE HG23 H -4.087 -13.023 -10.953 1.00 . A A . 22 ILE HG23 1 1 11 5951 1 1 22 ILE N N -1.681 -11.937 -7.721 1.00 . A A . 22 ILE N 1 1 11 5952 1 1 22 ILE O O -1.611 -13.085 -11.114 1.00 . A A . 22 ILE O 1 1 11 5953 1 1 23 THR C C 1.216 -10.128 -11.207 1.00 . A A . 23 THR C 1 1 11 5954 1 1 23 THR CA C -0.216 -10.625 -11.420 1.00 . A A . 23 THR CA 1 1 11 5955 1 1 23 THR CB C -1.006 -9.428 -11.973 1.00 . A A . 23 THR CB 1 1 11 5956 1 1 23 THR CG2 C -2.424 -9.784 -12.422 1.00 . A A . 23 THR CG2 1 1 11 5957 1 1 23 THR H H -0.889 -10.568 -9.399 1.00 . A A . 23 THR H 1 1 11 5958 1 1 23 THR HA H -0.184 -11.394 -12.192 1.00 . A A . 23 THR HA 1 1 11 5959 1 1 23 THR HB H -0.472 -9.023 -12.833 1.00 . A A . 23 THR HB 1 1 11 5960 1 1 23 THR HG1 H -1.730 -8.754 -10.316 1.00 . A A . 23 THR HG1 1 1 11 5961 1 1 23 THR HG21 H -2.378 -10.556 -13.191 1.00 . A A . 23 THR HG21 1 1 11 5962 1 1 23 THR HG22 H -3.017 -10.154 -11.586 1.00 . A A . 23 THR HG22 1 1 11 5963 1 1 23 THR HG23 H -2.904 -8.899 -12.837 1.00 . A A . 23 THR HG23 1 1 11 5964 1 1 23 THR N N -0.864 -11.173 -10.210 1.00 . A A . 23 THR N 1 1 11 5965 1 1 23 THR O O 1.964 -10.047 -12.180 1.00 . A A . 23 THR O 1 1 11 5966 1 1 23 THR OG1 O -1.078 -8.429 -10.979 1.00 . A A . 23 THR OG1 1 1 11 5967 1 1 24 ASN C C 2.792 -7.603 -9.682 1.00 . A A . 24 ASN C 1 1 11 5968 1 1 24 ASN CA C 2.832 -9.140 -9.527 1.00 . A A . 24 ASN CA 1 1 11 5969 1 1 24 ASN CB C 4.113 -9.757 -10.130 1.00 . A A . 24 ASN CB 1 1 11 5970 1 1 24 ASN CG C 4.179 -11.273 -10.027 1.00 . A A . 24 ASN CG 1 1 11 5971 1 1 24 ASN H H 0.938 -9.934 -9.202 1.00 . A A . 24 ASN H 1 1 11 5972 1 1 24 ASN HA H 2.880 -9.306 -8.453 1.00 . A A . 24 ASN HA 1 1 11 5973 1 1 24 ASN HB2 H 4.209 -9.461 -11.174 1.00 . A A . 24 ASN HB2 1 1 11 5974 1 1 24 ASN HB3 H 4.978 -9.354 -9.604 1.00 . A A . 24 ASN HB3 1 1 11 5975 1 1 24 ASN HD21 H 3.293 -11.467 -11.821 1.00 . A A . 24 ASN HD21 1 1 11 5976 1 1 24 ASN HD22 H 3.790 -12.968 -11.011 1.00 . A A . 24 ASN HD22 1 1 11 5977 1 1 24 ASN N N 1.604 -9.816 -9.960 1.00 . A A . 24 ASN N 1 1 11 5978 1 1 24 ASN ND2 N 3.743 -11.967 -11.058 1.00 . A A . 24 ASN ND2 1 1 11 5979 1 1 24 ASN O O 3.826 -6.962 -9.489 1.00 . A A . 24 ASN O 1 1 11 5980 1 1 24 ASN OD1 O 4.622 -11.834 -9.037 1.00 . A A . 24 ASN OD1 1 1 11 5981 1 1 25 ALA C C 1.689 -4.959 -8.568 1.00 . A A . 25 ALA C 1 1 11 5982 1 1 25 ALA CA C 1.544 -5.523 -10.000 1.00 . A A . 25 ALA CA 1 1 11 5983 1 1 25 ALA CB C 0.214 -5.112 -10.640 1.00 . A A . 25 ALA CB 1 1 11 5984 1 1 25 ALA H H 0.789 -7.515 -10.177 1.00 . A A . 25 ALA H 1 1 11 5985 1 1 25 ALA HA H 2.355 -5.118 -10.609 1.00 . A A . 25 ALA HA 1 1 11 5986 1 1 25 ALA HB1 H 0.175 -4.027 -10.740 1.00 . A A . 25 ALA HB1 1 1 11 5987 1 1 25 ALA HB2 H 0.127 -5.558 -11.632 1.00 . A A . 25 ALA HB2 1 1 11 5988 1 1 25 ALA HB3 H -0.621 -5.443 -10.024 1.00 . A A . 25 ALA HB3 1 1 11 5989 1 1 25 ALA N N 1.643 -6.988 -10.013 1.00 . A A . 25 ALA N 1 1 11 5990 1 1 25 ALA O O 1.341 -5.635 -7.603 1.00 . A A . 25 ALA O 1 1 11 5991 1 1 26 SER C C 2.149 -1.590 -7.100 1.00 . A A . 26 SER C 1 1 11 5992 1 1 26 SER CA C 2.390 -3.097 -7.090 1.00 . A A . 26 SER CA 1 1 11 5993 1 1 26 SER CB C 3.831 -3.330 -6.627 1.00 . A A . 26 SER CB 1 1 11 5994 1 1 26 SER H H 2.456 -3.176 -9.211 1.00 . A A . 26 SER H 1 1 11 5995 1 1 26 SER HA H 1.721 -3.550 -6.363 1.00 . A A . 26 SER HA 1 1 11 5996 1 1 26 SER HB2 H 3.974 -2.867 -5.650 1.00 . A A . 26 SER HB2 1 1 11 5997 1 1 26 SER HB3 H 4.023 -4.397 -6.534 1.00 . A A . 26 SER HB3 1 1 11 5998 1 1 26 SER HG H 4.352 -1.921 -7.865 1.00 . A A . 26 SER HG 1 1 11 5999 1 1 26 SER N N 2.165 -3.717 -8.410 1.00 . A A . 26 SER N 1 1 11 6000 1 1 26 SER O O 2.618 -0.919 -8.021 1.00 . A A . 26 SER O 1 1 11 6001 1 1 26 SER OG O 4.737 -2.754 -7.550 1.00 . A A . 26 SER OG 1 1 11 6002 1 1 27 GLN C C 1.207 0.766 -4.402 1.00 . A A . 27 GLN C 1 1 11 6003 1 1 27 GLN CA C 1.276 0.381 -5.891 1.00 . A A . 27 GLN CA 1 1 11 6004 1 1 27 GLN CB C -0.006 0.773 -6.658 1.00 . A A . 27 GLN CB 1 1 11 6005 1 1 27 GLN CD C 0.896 3.089 -7.243 1.00 . A A . 27 GLN CD 1 1 11 6006 1 1 27 GLN CG C -0.301 2.280 -6.746 1.00 . A A . 27 GLN CG 1 1 11 6007 1 1 27 GLN H H 1.184 -1.660 -5.295 1.00 . A A . 27 GLN H 1 1 11 6008 1 1 27 GLN HA H 2.126 0.907 -6.330 1.00 . A A . 27 GLN HA 1 1 11 6009 1 1 27 GLN HB2 H 0.079 0.401 -7.680 1.00 . A A . 27 GLN HB2 1 1 11 6010 1 1 27 GLN HB3 H -0.862 0.278 -6.196 1.00 . A A . 27 GLN HB3 1 1 11 6011 1 1 27 GLN HE21 H 0.376 2.964 -9.219 1.00 . A A . 27 GLN HE21 1 1 11 6012 1 1 27 GLN HE22 H 1.845 3.831 -8.801 1.00 . A A . 27 GLN HE22 1 1 11 6013 1 1 27 GLN HG2 H -1.144 2.434 -7.420 1.00 . A A . 27 GLN HG2 1 1 11 6014 1 1 27 GLN HG3 H -0.594 2.655 -5.769 1.00 . A A . 27 GLN HG3 1 1 11 6015 1 1 27 GLN N N 1.497 -1.058 -6.059 1.00 . A A . 27 GLN N 1 1 11 6016 1 1 27 GLN NE2 N 1.033 3.303 -8.537 1.00 . A A . 27 GLN NE2 1 1 11 6017 1 1 27 GLN O O 0.834 -0.041 -3.554 1.00 . A A . 27 GLN O 1 1 11 6018 1 1 27 GLN OE1 O 1.735 3.516 -6.464 1.00 . A A . 27 GLN OE1 1 1 11 6019 1 1 28 PHE C C 0.172 2.869 -2.146 1.00 . A A . 28 PHE C 1 1 11 6020 1 1 28 PHE CA C 1.567 2.562 -2.723 1.00 . A A . 28 PHE CA 1 1 11 6021 1 1 28 PHE CB C 2.444 3.821 -2.714 1.00 . A A . 28 PHE CB 1 1 11 6022 1 1 28 PHE CD1 C 4.708 2.856 -2.165 1.00 . A A . 28 PHE CD1 1 1 11 6023 1 1 28 PHE CD2 C 4.415 3.956 -4.317 1.00 . A A . 28 PHE CD2 1 1 11 6024 1 1 28 PHE CE1 C 6.045 2.577 -2.488 1.00 . A A . 28 PHE CE1 1 1 11 6025 1 1 28 PHE CE2 C 5.756 3.678 -4.638 1.00 . A A . 28 PHE CE2 1 1 11 6026 1 1 28 PHE CG C 3.890 3.548 -3.076 1.00 . A A . 28 PHE CG 1 1 11 6027 1 1 28 PHE CZ C 6.574 2.991 -3.722 1.00 . A A . 28 PHE CZ 1 1 11 6028 1 1 28 PHE H H 1.840 2.650 -4.832 1.00 . A A . 28 PHE H 1 1 11 6029 1 1 28 PHE HA H 2.030 1.828 -2.063 1.00 . A A . 28 PHE HA 1 1 11 6030 1 1 28 PHE HB2 H 2.026 4.558 -3.402 1.00 . A A . 28 PHE HB2 1 1 11 6031 1 1 28 PHE HB3 H 2.430 4.254 -1.713 1.00 . A A . 28 PHE HB3 1 1 11 6032 1 1 28 PHE HD1 H 4.304 2.529 -1.219 1.00 . A A . 28 PHE HD1 1 1 11 6033 1 1 28 PHE HD2 H 3.791 4.479 -5.029 1.00 . A A . 28 PHE HD2 1 1 11 6034 1 1 28 PHE HE1 H 6.658 2.038 -1.783 1.00 . A A . 28 PHE HE1 1 1 11 6035 1 1 28 PHE HE2 H 6.158 3.993 -5.589 1.00 . A A . 28 PHE HE2 1 1 11 6036 1 1 28 PHE HZ H 7.605 2.782 -3.966 1.00 . A A . 28 PHE HZ 1 1 11 6037 1 1 28 PHE N N 1.551 2.018 -4.087 1.00 . A A . 28 PHE N 1 1 11 6038 1 1 28 PHE O O 0.052 3.140 -0.953 1.00 . A A . 28 PHE O 1 1 11 6039 1 1 29 GLU C C -2.717 1.833 -1.620 1.00 . A A . 29 GLU C 1 1 11 6040 1 1 29 GLU CA C -2.270 2.993 -2.530 1.00 . A A . 29 GLU CA 1 1 11 6041 1 1 29 GLU CB C -3.177 3.166 -3.769 1.00 . A A . 29 GLU CB 1 1 11 6042 1 1 29 GLU CD C -5.263 4.214 -2.594 1.00 . A A . 29 GLU CD 1 1 11 6043 1 1 29 GLU CG C -4.705 3.147 -3.550 1.00 . A A . 29 GLU CG 1 1 11 6044 1 1 29 GLU H H -0.725 2.561 -3.927 1.00 . A A . 29 GLU H 1 1 11 6045 1 1 29 GLU HA H -2.311 3.909 -1.943 1.00 . A A . 29 GLU HA 1 1 11 6046 1 1 29 GLU HB2 H -2.913 4.108 -4.254 1.00 . A A . 29 GLU HB2 1 1 11 6047 1 1 29 GLU HB3 H -2.946 2.365 -4.472 1.00 . A A . 29 GLU HB3 1 1 11 6048 1 1 29 GLU HG2 H -5.178 3.274 -4.526 1.00 . A A . 29 GLU HG2 1 1 11 6049 1 1 29 GLU HG3 H -4.986 2.163 -3.174 1.00 . A A . 29 GLU HG3 1 1 11 6050 1 1 29 GLU N N -0.882 2.828 -2.972 1.00 . A A . 29 GLU N 1 1 11 6051 1 1 29 GLU O O -2.280 0.694 -1.779 1.00 . A A . 29 GLU O 1 1 11 6052 1 1 29 GLU OE1 O -4.556 4.601 -1.638 1.00 . A A . 29 GLU OE1 1 1 11 6053 1 1 29 GLU OE2 O -6.453 4.596 -2.702 1.00 . A A . 29 GLU OE2 1 1 11 6054 1 1 30 ARG C C -5.670 1.249 0.441 1.00 . A A . 30 ARG C 1 1 11 6055 1 1 30 ARG CA C -4.127 1.248 0.374 1.00 . A A . 30 ARG CA 1 1 11 6056 1 1 30 ARG CB C -3.416 1.549 1.711 1.00 . A A . 30 ARG CB 1 1 11 6057 1 1 30 ARG CD C -3.315 4.146 1.961 1.00 . A A . 30 ARG CD 1 1 11 6058 1 1 30 ARG CG C -3.811 2.798 2.518 1.00 . A A . 30 ARG CG 1 1 11 6059 1 1 30 ARG CZ C -5.451 5.289 1.250 1.00 . A A . 30 ARG CZ 1 1 11 6060 1 1 30 ARG H H -4.024 3.068 -0.740 1.00 . A A . 30 ARG H 1 1 11 6061 1 1 30 ARG HA H -3.829 0.239 0.086 1.00 . A A . 30 ARG HA 1 1 11 6062 1 1 30 ARG HB2 H -3.580 0.697 2.367 1.00 . A A . 30 ARG HB2 1 1 11 6063 1 1 30 ARG HB3 H -2.342 1.591 1.527 1.00 . A A . 30 ARG HB3 1 1 11 6064 1 1 30 ARG HD2 H -3.160 4.833 2.795 1.00 . A A . 30 ARG HD2 1 1 11 6065 1 1 30 ARG HD3 H -2.351 4.001 1.470 1.00 . A A . 30 ARG HD3 1 1 11 6066 1 1 30 ARG HE H -4.060 4.743 0.014 1.00 . A A . 30 ARG HE 1 1 11 6067 1 1 30 ARG HG2 H -4.891 2.818 2.673 1.00 . A A . 30 ARG HG2 1 1 11 6068 1 1 30 ARG HG3 H -3.349 2.675 3.498 1.00 . A A . 30 ARG HG3 1 1 11 6069 1 1 30 ARG HH11 H -5.302 5.274 3.236 1.00 . A A . 30 ARG HH11 1 1 11 6070 1 1 30 ARG HH12 H -6.895 5.679 2.597 1.00 . A A . 30 ARG HH12 1 1 11 6071 1 1 30 ARG HH21 H -5.808 5.339 -0.695 1.00 . A A . 30 ARG HH21 1 1 11 6072 1 1 30 ARG HH22 H -7.121 6.044 0.297 1.00 . A A . 30 ARG HH22 1 1 11 6073 1 1 30 ARG N N -3.618 2.139 -0.676 1.00 . A A . 30 ARG N 1 1 11 6074 1 1 30 ARG NE N -4.263 4.759 1.016 1.00 . A A . 30 ARG NE 1 1 11 6075 1 1 30 ARG NH1 N -5.902 5.486 2.462 1.00 . A A . 30 ARG NH1 1 1 11 6076 1 1 30 ARG NH2 N -6.192 5.604 0.224 1.00 . A A . 30 ARG NH2 1 1 11 6077 1 1 30 ARG O O -6.293 2.172 -0.085 1.00 . A A . 30 ARG O 1 1 11 6078 1 1 31 PRO C C -8.662 1.201 1.413 1.00 . A A . 31 PRO C 1 1 11 6079 1 1 31 PRO CA C -7.784 0.039 0.963 1.00 . A A . 31 PRO CA 1 1 11 6080 1 1 31 PRO CB C -8.090 -1.242 1.753 1.00 . A A . 31 PRO CB 1 1 11 6081 1 1 31 PRO CD C -5.720 -0.904 1.715 1.00 . A A . 31 PRO CD 1 1 11 6082 1 1 31 PRO CG C -6.772 -2.008 1.735 1.00 . A A . 31 PRO CG 1 1 11 6083 1 1 31 PRO HA H -8.026 -0.122 -0.060 1.00 . A A . 31 PRO HA 1 1 11 6084 1 1 31 PRO HB2 H -8.347 -1.009 2.788 1.00 . A A . 31 PRO HB2 1 1 11 6085 1 1 31 PRO HB3 H -8.892 -1.816 1.288 1.00 . A A . 31 PRO HB3 1 1 11 6086 1 1 31 PRO HD2 H -5.466 -0.623 2.738 1.00 . A A . 31 PRO HD2 1 1 11 6087 1 1 31 PRO HD3 H -4.836 -1.253 1.189 1.00 . A A . 31 PRO HD3 1 1 11 6088 1 1 31 PRO HG2 H -6.664 -2.652 2.607 1.00 . A A . 31 PRO HG2 1 1 11 6089 1 1 31 PRO HG3 H -6.702 -2.592 0.820 1.00 . A A . 31 PRO HG3 1 1 11 6090 1 1 31 PRO N N -6.328 0.232 1.039 1.00 . A A . 31 PRO N 1 1 11 6091 1 1 31 PRO O O -9.571 1.637 0.706 1.00 . A A . 31 PRO O 1 1 11 6092 1 1 32 SER C C -9.180 4.035 2.861 1.00 . A A . 32 SER C 1 1 11 6093 1 1 32 SER CA C -9.085 2.614 3.449 1.00 . A A . 32 SER CA 1 1 11 6094 1 1 32 SER CB C -8.467 2.620 4.856 1.00 . A A . 32 SER CB 1 1 11 6095 1 1 32 SER H H -7.532 1.175 2.936 1.00 . A A . 32 SER H 1 1 11 6096 1 1 32 SER HA H -10.105 2.241 3.552 1.00 . A A . 32 SER HA 1 1 11 6097 1 1 32 SER HB2 H -9.085 3.223 5.521 1.00 . A A . 32 SER HB2 1 1 11 6098 1 1 32 SER HB3 H -8.416 1.601 5.245 1.00 . A A . 32 SER HB3 1 1 11 6099 1 1 32 SER HG H -7.303 4.031 4.359 1.00 . A A . 32 SER HG 1 1 11 6100 1 1 32 SER N N -8.350 1.661 2.609 1.00 . A A . 32 SER N 1 1 11 6101 1 1 32 SER O O -8.421 4.929 3.254 1.00 . A A . 32 SER O 1 1 11 6102 1 1 32 SER OG O -7.169 3.171 4.793 1.00 . A A . 32 SER OG 1 1 11 6103 1 1 33 GLY C C -9.587 5.755 0.061 1.00 . A A . 33 GLY C 1 1 11 6104 1 1 33 GLY CA C -10.407 5.544 1.317 1.00 . A A . 33 GLY CA 1 1 11 6105 1 1 33 GLY H H -10.614 3.439 1.569 1.00 . A A . 33 GLY H 1 1 11 6106 1 1 33 GLY HA2 H -11.460 5.598 1.043 1.00 . A A . 33 GLY HA2 1 1 11 6107 1 1 33 GLY HA3 H -10.184 6.354 2.012 1.00 . A A . 33 GLY HA3 1 1 11 6108 1 1 33 GLY N N -10.122 4.245 1.936 1.00 . A A . 33 GLY N 1 1 11 6109 1 1 33 GLY O O -8.653 6.582 0.067 1.00 . A A . 33 GLY O 1 1 11 6110 1 1 33 GLY OXT O -9.844 5.057 -0.939 1.00 . A A . 33 GLY OXT 1 1 11 6111 2 2 1 NAG C1 C 12.250 1.807 -0.681 1.00 . B A . 101 NAG C1 1 1 11 6112 2 2 1 NAG C2 C 11.723 3.095 -1.353 1.00 . B A . 101 NAG C2 1 1 11 6113 2 2 1 NAG C3 C 10.731 2.621 -2.430 1.00 . B A . 101 NAG C3 1 1 11 6114 2 2 1 NAG C4 C 11.506 1.822 -3.469 1.00 . B A . 101 NAG C4 1 1 11 6115 2 2 1 NAG C5 C 12.165 0.592 -2.838 1.00 . B A . 101 NAG C5 1 1 11 6116 2 2 1 NAG C6 C 13.039 -0.214 -3.796 1.00 . B A . 101 NAG C6 1 1 11 6117 2 2 1 NAG C7 C 10.819 5.278 -0.658 1.00 . B A . 101 NAG C7 1 1 11 6118 2 2 1 NAG C8 C 10.265 6.117 0.502 1.00 . B A . 101 NAG C8 1 1 11 6119 2 2 1 NAG H1 H 11.404 1.216 -0.331 1.00 . B A . 101 NAG H1 1 1 11 6120 2 2 1 NAG H2 H 12.549 3.628 -1.826 1.00 . B A . 101 NAG H2 1 1 11 6121 2 2 1 NAG H3 H 9.966 1.982 -1.973 1.00 . B A . 101 NAG H3 1 1 11 6122 2 2 1 NAG H4 H 12.249 2.471 -3.927 1.00 . B A . 101 NAG H4 1 1 11 6123 2 2 1 NAG H5 H 11.375 -0.051 -2.475 1.00 . B A . 101 NAG H5 1 1 11 6124 2 2 1 NAG H61 H 13.233 -1.198 -3.369 1.00 . B A . 101 NAG H61 1 1 11 6125 2 2 1 NAG H62 H 12.554 -0.351 -4.763 1.00 . B A . 101 NAG H62 1 1 11 6126 2 2 1 NAG H81 H 10.853 5.940 1.403 1.00 . B A . 101 NAG H81 1 1 11 6127 2 2 1 NAG H82 H 9.227 5.841 0.689 1.00 . B A . 101 NAG H82 1 1 11 6128 2 2 1 NAG H83 H 10.313 7.177 0.247 1.00 . B A . 101 NAG H83 1 1 11 6129 2 2 1 NAG HN2 H 10.810 3.619 0.508 1.00 . B A . 101 NAG HN2 1 1 11 6130 2 2 1 NAG HO3 H 10.385 4.578 -2.713 1.00 . B A . 101 NAG HO3 1 1 11 6131 2 2 1 NAG HO4 H 9.995 2.196 -4.589 1.00 . B A . 101 NAG HO4 1 1 11 6132 2 2 1 NAG HO6 H 14.569 0.753 -3.076 1.00 . B A . 101 NAG HO6 1 1 11 6133 2 2 1 NAG N2 N 11.094 4.002 -0.390 1.00 . B A . 101 NAG N2 1 1 11 6134 2 2 1 NAG O3 O 10.099 3.724 -3.127 1.00 . B A . 101 NAG O3 1 1 11 6135 2 2 1 NAG O4 O 10.550 1.415 -4.451 1.00 . B A . 101 NAG O4 1 1 11 6136 2 2 1 NAG O5 O 12.990 1.019 -1.674 1.00 . B A . 101 NAG O5 1 1 11 6137 2 2 1 NAG O6 O 14.284 0.480 -3.954 1.00 . B A . 101 NAG O6 1 1 11 6138 2 2 1 NAG O7 O 10.977 5.735 -1.788 1.00 . B A . 101 NAG O7 1 1 12 6139 1 1 1 LYS C C -7.734 1.308 -4.290 1.00 . A A . 1 LYS C 1 1 12 6140 1 1 1 LYS CA C -8.591 2.417 -3.678 1.00 . A A . 1 LYS CA 1 1 12 6141 1 1 1 LYS CB C -9.627 2.951 -4.701 1.00 . A A . 1 LYS CB 1 1 12 6142 1 1 1 LYS CD C -8.329 4.198 -6.619 1.00 . A A . 1 LYS CD 1 1 12 6143 1 1 1 LYS CE C -7.220 3.776 -7.602 1.00 . A A . 1 LYS CE 1 1 12 6144 1 1 1 LYS CG C -9.223 3.016 -6.195 1.00 . A A . 1 LYS CG 1 1 12 6145 1 1 1 LYS H1 H -8.372 4.210 -2.671 1.00 . A A . 1 LYS H1 1 1 12 6146 1 1 1 LYS H2 H -7.174 3.933 -3.769 1.00 . A A . 1 LYS H2 1 1 12 6147 1 1 1 LYS H3 H -7.168 3.148 -2.344 1.00 . A A . 1 LYS H3 1 1 12 6148 1 1 1 LYS HA H -9.160 1.964 -2.867 1.00 . A A . 1 LYS HA 1 1 12 6149 1 1 1 LYS HB2 H -10.481 2.272 -4.648 1.00 . A A . 1 LYS HB2 1 1 12 6150 1 1 1 LYS HB3 H -9.992 3.929 -4.381 1.00 . A A . 1 LYS HB3 1 1 12 6151 1 1 1 LYS HD2 H -8.962 4.933 -7.119 1.00 . A A . 1 LYS HD2 1 1 12 6152 1 1 1 LYS HD3 H -7.898 4.694 -5.753 1.00 . A A . 1 LYS HD3 1 1 12 6153 1 1 1 LYS HE2 H -7.597 2.979 -8.246 1.00 . A A . 1 LYS HE2 1 1 12 6154 1 1 1 LYS HE3 H -6.962 4.633 -8.231 1.00 . A A . 1 LYS HE3 1 1 12 6155 1 1 1 LYS HG2 H -8.769 2.074 -6.500 1.00 . A A . 1 LYS HG2 1 1 12 6156 1 1 1 LYS HG3 H -10.144 3.094 -6.775 1.00 . A A . 1 LYS HG3 1 1 12 6157 1 1 1 LYS HZ1 H -5.322 2.836 -7.461 1.00 . A A . 1 LYS HZ1 1 1 12 6158 1 1 1 LYS HZ2 H -5.518 4.146 -6.477 1.00 . A A . 1 LYS HZ2 1 1 12 6159 1 1 1 LYS HZ3 H -6.229 2.723 -6.106 1.00 . A A . 1 LYS HZ3 1 1 12 6160 1 1 1 LYS N N -7.780 3.499 -3.075 1.00 . A A . 1 LYS N 1 1 12 6161 1 1 1 LYS NZ N -6.002 3.333 -6.887 1.00 . A A . 1 LYS NZ 1 1 12 6162 1 1 1 LYS O O -6.662 1.588 -4.833 1.00 . A A . 1 LYS O 1 1 12 6163 1 1 2 LEU C C -8.765 -2.230 -4.926 1.00 . A A . 2 LEU C 1 1 12 6164 1 1 2 LEU CA C -7.700 -1.111 -4.922 1.00 . A A . 2 LEU CA 1 1 12 6165 1 1 2 LEU CB C -6.350 -1.570 -4.336 1.00 . A A . 2 LEU CB 1 1 12 6166 1 1 2 LEU CD1 C -6.971 -3.093 -2.348 1.00 . A A . 2 LEU CD1 1 1 12 6167 1 1 2 LEU CD2 C -4.777 -1.937 -2.465 1.00 . A A . 2 LEU CD2 1 1 12 6168 1 1 2 LEU CG C -6.250 -1.825 -2.817 1.00 . A A . 2 LEU CG 1 1 12 6169 1 1 2 LEU H H -9.096 -0.130 -3.741 1.00 . A A . 2 LEU H 1 1 12 6170 1 1 2 LEU HA H -7.520 -0.820 -5.958 1.00 . A A . 2 LEU HA 1 1 12 6171 1 1 2 LEU HB2 H -6.034 -2.474 -4.858 1.00 . A A . 2 LEU HB2 1 1 12 6172 1 1 2 LEU HB3 H -5.620 -0.806 -4.598 1.00 . A A . 2 LEU HB3 1 1 12 6173 1 1 2 LEU HD11 H -6.853 -3.893 -3.075 1.00 . A A . 2 LEU HD11 1 1 12 6174 1 1 2 LEU HD12 H -6.568 -3.440 -1.397 1.00 . A A . 2 LEU HD12 1 1 12 6175 1 1 2 LEU HD13 H -8.032 -2.890 -2.215 1.00 . A A . 2 LEU HD13 1 1 12 6176 1 1 2 LEU HD21 H -4.695 -1.998 -1.387 1.00 . A A . 2 LEU HD21 1 1 12 6177 1 1 2 LEU HD22 H -4.349 -2.828 -2.918 1.00 . A A . 2 LEU HD22 1 1 12 6178 1 1 2 LEU HD23 H -4.231 -1.053 -2.797 1.00 . A A . 2 LEU HD23 1 1 12 6179 1 1 2 LEU HG H -6.622 -0.979 -2.245 1.00 . A A . 2 LEU HG 1 1 12 6180 1 1 2 LEU N N -8.225 0.066 -4.221 1.00 . A A . 2 LEU N 1 1 12 6181 1 1 2 LEU O O -9.626 -2.224 -4.043 1.00 . A A . 2 LEU O 1 1 12 6182 1 1 3 PRO C C -9.088 -5.534 -5.169 1.00 . A A . 3 PRO C 1 1 12 6183 1 1 3 PRO CA C -9.656 -4.310 -5.931 1.00 . A A . 3 PRO CA 1 1 12 6184 1 1 3 PRO CB C -9.824 -4.601 -7.427 1.00 . A A . 3 PRO CB 1 1 12 6185 1 1 3 PRO CD C -7.968 -3.106 -7.131 1.00 . A A . 3 PRO CD 1 1 12 6186 1 1 3 PRO CG C -8.448 -4.274 -7.996 1.00 . A A . 3 PRO CG 1 1 12 6187 1 1 3 PRO HA H -10.622 -4.036 -5.508 1.00 . A A . 3 PRO HA 1 1 12 6188 1 1 3 PRO HB2 H -10.101 -5.635 -7.633 1.00 . A A . 3 PRO HB2 1 1 12 6189 1 1 3 PRO HB3 H -10.564 -3.920 -7.850 1.00 . A A . 3 PRO HB3 1 1 12 6190 1 1 3 PRO HD2 H -6.901 -3.200 -6.926 1.00 . A A . 3 PRO HD2 1 1 12 6191 1 1 3 PRO HD3 H -8.171 -2.170 -7.650 1.00 . A A . 3 PRO HD3 1 1 12 6192 1 1 3 PRO HG2 H -7.801 -5.137 -7.859 1.00 . A A . 3 PRO HG2 1 1 12 6193 1 1 3 PRO HG3 H -8.500 -4.000 -9.050 1.00 . A A . 3 PRO HG3 1 1 12 6194 1 1 3 PRO N N -8.750 -3.162 -5.900 1.00 . A A . 3 PRO N 1 1 12 6195 1 1 3 PRO O O -7.903 -5.559 -4.820 1.00 . A A . 3 PRO O 1 1 12 6196 1 1 4 PRO C C -8.200 -8.430 -5.134 1.00 . A A . 4 PRO C 1 1 12 6197 1 1 4 PRO CA C -9.453 -7.881 -4.433 1.00 . A A . 4 PRO CA 1 1 12 6198 1 1 4 PRO CB C -10.647 -8.826 -4.591 1.00 . A A . 4 PRO CB 1 1 12 6199 1 1 4 PRO CD C -11.344 -6.621 -5.174 1.00 . A A . 4 PRO CD 1 1 12 6200 1 1 4 PRO CG C -11.845 -7.887 -4.483 1.00 . A A . 4 PRO CG 1 1 12 6201 1 1 4 PRO HA H -9.243 -7.758 -3.370 1.00 . A A . 4 PRO HA 1 1 12 6202 1 1 4 PRO HB2 H -10.637 -9.284 -5.582 1.00 . A A . 4 PRO HB2 1 1 12 6203 1 1 4 PRO HB3 H -10.663 -9.593 -3.815 1.00 . A A . 4 PRO HB3 1 1 12 6204 1 1 4 PRO HD2 H -11.547 -6.689 -6.242 1.00 . A A . 4 PRO HD2 1 1 12 6205 1 1 4 PRO HD3 H -11.839 -5.746 -4.750 1.00 . A A . 4 PRO HD3 1 1 12 6206 1 1 4 PRO HG2 H -12.728 -8.296 -4.976 1.00 . A A . 4 PRO HG2 1 1 12 6207 1 1 4 PRO HG3 H -12.053 -7.675 -3.433 1.00 . A A . 4 PRO HG3 1 1 12 6208 1 1 4 PRO N N -9.904 -6.586 -4.947 1.00 . A A . 4 PRO N 1 1 12 6209 1 1 4 PRO O O -8.044 -8.307 -6.349 1.00 . A A . 4 PRO O 1 1 12 6210 1 1 5 GLY C C -4.810 -8.767 -4.669 1.00 . A A . 5 GLY C 1 1 12 6211 1 1 5 GLY CA C -6.056 -9.642 -4.831 1.00 . A A . 5 GLY CA 1 1 12 6212 1 1 5 GLY H H -7.479 -9.084 -3.356 1.00 . A A . 5 GLY H 1 1 12 6213 1 1 5 GLY HA2 H -5.887 -10.572 -4.288 1.00 . A A . 5 GLY HA2 1 1 12 6214 1 1 5 GLY HA3 H -6.161 -9.882 -5.889 1.00 . A A . 5 GLY HA3 1 1 12 6215 1 1 5 GLY N N -7.299 -9.029 -4.348 1.00 . A A . 5 GLY N 1 1 12 6216 1 1 5 GLY O O -3.698 -9.280 -4.776 1.00 . A A . 5 GLY O 1 1 12 6217 1 1 6 TRP C C -3.791 -6.577 -2.478 1.00 . A A . 6 TRP C 1 1 12 6218 1 1 6 TRP CA C -3.910 -6.552 -4.010 1.00 . A A . 6 TRP CA 1 1 12 6219 1 1 6 TRP CB C -4.219 -5.165 -4.576 1.00 . A A . 6 TRP CB 1 1 12 6220 1 1 6 TRP CD1 C -5.317 -5.579 -6.827 1.00 . A A . 6 TRP CD1 1 1 12 6221 1 1 6 TRP CD2 C -3.426 -4.386 -7.012 1.00 . A A . 6 TRP CD2 1 1 12 6222 1 1 6 TRP CE2 C -3.962 -4.533 -8.327 1.00 . A A . 6 TRP CE2 1 1 12 6223 1 1 6 TRP CE3 C -2.215 -3.667 -6.895 1.00 . A A . 6 TRP CE3 1 1 12 6224 1 1 6 TRP CG C -4.318 -5.064 -6.073 1.00 . A A . 6 TRP CG 1 1 12 6225 1 1 6 TRP CH2 C -2.150 -3.277 -9.312 1.00 . A A . 6 TRP CH2 1 1 12 6226 1 1 6 TRP CZ2 C -3.346 -3.994 -9.466 1.00 . A A . 6 TRP CZ2 1 1 12 6227 1 1 6 TRP CZ3 C -1.590 -3.122 -8.033 1.00 . A A . 6 TRP CZ3 1 1 12 6228 1 1 6 TRP H H -5.906 -7.059 -4.354 1.00 . A A . 6 TRP H 1 1 12 6229 1 1 6 TRP HA H -2.968 -6.885 -4.438 1.00 . A A . 6 TRP HA 1 1 12 6230 1 1 6 TRP HB2 H -5.159 -4.817 -4.154 1.00 . A A . 6 TRP HB2 1 1 12 6231 1 1 6 TRP HB3 H -3.438 -4.493 -4.241 1.00 . A A . 6 TRP HB3 1 1 12 6232 1 1 6 TRP HD1 H -6.170 -6.125 -6.438 1.00 . A A . 6 TRP HD1 1 1 12 6233 1 1 6 TRP HE1 H -5.748 -5.520 -8.899 1.00 . A A . 6 TRP HE1 1 1 12 6234 1 1 6 TRP HE3 H -1.767 -3.531 -5.921 1.00 . A A . 6 TRP HE3 1 1 12 6235 1 1 6 TRP HH2 H -1.661 -2.842 -10.172 1.00 . A A . 6 TRP HH2 1 1 12 6236 1 1 6 TRP HZ2 H -3.785 -4.126 -10.444 1.00 . A A . 6 TRP HZ2 1 1 12 6237 1 1 6 TRP HZ3 H -0.677 -2.564 -7.932 1.00 . A A . 6 TRP HZ3 1 1 12 6238 1 1 6 TRP N N -4.980 -7.467 -4.397 1.00 . A A . 6 TRP N 1 1 12 6239 1 1 6 TRP NE1 N -5.108 -5.273 -8.155 1.00 . A A . 6 TRP NE1 1 1 12 6240 1 1 6 TRP O O -4.717 -6.181 -1.773 1.00 . A A . 6 TRP O 1 1 12 6241 1 1 7 GLU C C -1.291 -6.486 0.050 1.00 . A A . 7 GLU C 1 1 12 6242 1 1 7 GLU CA C -2.429 -7.347 -0.545 1.00 . A A . 7 GLU CA 1 1 12 6243 1 1 7 GLU CB C -2.135 -8.868 -0.515 1.00 . A A . 7 GLU CB 1 1 12 6244 1 1 7 GLU CD C -1.760 -9.095 1.969 1.00 . A A . 7 GLU CD 1 1 12 6245 1 1 7 GLU CG C -2.535 -9.605 0.766 1.00 . A A . 7 GLU CG 1 1 12 6246 1 1 7 GLU H H -1.905 -7.346 -2.580 1.00 . A A . 7 GLU H 1 1 12 6247 1 1 7 GLU HA H -3.346 -7.157 0.015 1.00 . A A . 7 GLU HA 1 1 12 6248 1 1 7 GLU HB2 H -2.697 -9.350 -1.317 1.00 . A A . 7 GLU HB2 1 1 12 6249 1 1 7 GLU HB3 H -1.080 -9.039 -0.723 1.00 . A A . 7 GLU HB3 1 1 12 6250 1 1 7 GLU HG2 H -3.607 -9.478 0.930 1.00 . A A . 7 GLU HG2 1 1 12 6251 1 1 7 GLU HG3 H -2.337 -10.670 0.636 1.00 . A A . 7 GLU HG3 1 1 12 6252 1 1 7 GLU N N -2.649 -7.034 -1.960 1.00 . A A . 7 GLU N 1 1 12 6253 1 1 7 GLU O O -0.290 -6.230 -0.630 1.00 . A A . 7 GLU O 1 1 12 6254 1 1 7 GLU OE1 O -0.553 -9.409 2.105 1.00 . A A . 7 GLU OE1 1 1 12 6255 1 1 7 GLU OE2 O -2.322 -8.278 2.727 1.00 . A A . 7 GLU OE2 1 1 12 6256 1 1 8 LYS C C 0.869 -5.588 2.138 1.00 . A A . 8 LYS C 1 1 12 6257 1 1 8 LYS CA C -0.535 -5.019 1.915 1.00 . A A . 8 LYS CA 1 1 12 6258 1 1 8 LYS CB C -1.131 -4.294 3.147 1.00 . A A . 8 LYS CB 1 1 12 6259 1 1 8 LYS CD C -1.868 -5.934 5.004 1.00 . A A . 8 LYS CD 1 1 12 6260 1 1 8 LYS CE C -1.166 -7.136 5.644 1.00 . A A . 8 LYS CE 1 1 12 6261 1 1 8 LYS CG C -0.880 -4.841 4.564 1.00 . A A . 8 LYS CG 1 1 12 6262 1 1 8 LYS H H -2.156 -6.461 1.878 1.00 . A A . 8 LYS H 1 1 12 6263 1 1 8 LYS HA H -0.428 -4.239 1.157 1.00 . A A . 8 LYS HA 1 1 12 6264 1 1 8 LYS HB2 H -0.705 -3.289 3.136 1.00 . A A . 8 LYS HB2 1 1 12 6265 1 1 8 LYS HB3 H -2.205 -4.177 3.009 1.00 . A A . 8 LYS HB3 1 1 12 6266 1 1 8 LYS HD2 H -2.551 -5.504 5.737 1.00 . A A . 8 LYS HD2 1 1 12 6267 1 1 8 LYS HD3 H -2.474 -6.265 4.161 1.00 . A A . 8 LYS HD3 1 1 12 6268 1 1 8 LYS HE2 H -0.461 -6.781 6.401 1.00 . A A . 8 LYS HE2 1 1 12 6269 1 1 8 LYS HE3 H -1.923 -7.751 6.138 1.00 . A A . 8 LYS HE3 1 1 12 6270 1 1 8 LYS HG2 H 0.151 -5.174 4.671 1.00 . A A . 8 LYS HG2 1 1 12 6271 1 1 8 LYS HG3 H -0.998 -4.009 5.261 1.00 . A A . 8 LYS HG3 1 1 12 6272 1 1 8 LYS HZ1 H 0.218 -7.405 4.102 1.00 . A A . 8 LYS HZ1 1 1 12 6273 1 1 8 LYS HZ2 H -0.043 -8.775 5.009 1.00 . A A . 8 LYS HZ2 1 1 12 6274 1 1 8 LYS HZ3 H -1.145 -8.237 3.902 1.00 . A A . 8 LYS HZ3 1 1 12 6275 1 1 8 LYS N N -1.438 -6.021 1.307 1.00 . A A . 8 LYS N 1 1 12 6276 1 1 8 LYS NZ N -0.470 -7.949 4.625 1.00 . A A . 8 LYS NZ 1 1 12 6277 1 1 8 LYS O O 1.040 -6.618 2.793 1.00 . A A . 8 LYS O 1 1 12 6278 1 1 9 ARG C C 4.218 -4.207 1.945 1.00 . A A . 9 ARG C 1 1 12 6279 1 1 9 ARG CA C 3.263 -5.318 1.473 1.00 . A A . 9 ARG CA 1 1 12 6280 1 1 9 ARG CB C 3.411 -5.605 -0.031 1.00 . A A . 9 ARG CB 1 1 12 6281 1 1 9 ARG CD C 4.120 -8.055 -0.511 1.00 . A A . 9 ARG CD 1 1 12 6282 1 1 9 ARG CG C 4.519 -6.572 -0.436 1.00 . A A . 9 ARG CG 1 1 12 6283 1 1 9 ARG CZ C 2.397 -8.917 1.092 1.00 . A A . 9 ARG CZ 1 1 12 6284 1 1 9 ARG H H 1.679 -4.022 1.119 1.00 . A A . 9 ARG H 1 1 12 6285 1 1 9 ARG HA H 3.438 -6.221 2.058 1.00 . A A . 9 ARG HA 1 1 12 6286 1 1 9 ARG HB2 H 2.477 -5.996 -0.440 1.00 . A A . 9 ARG HB2 1 1 12 6287 1 1 9 ARG HB3 H 3.584 -4.651 -0.532 1.00 . A A . 9 ARG HB3 1 1 12 6288 1 1 9 ARG HD2 H 3.354 -8.181 -1.276 1.00 . A A . 9 ARG HD2 1 1 12 6289 1 1 9 ARG HD3 H 4.993 -8.620 -0.847 1.00 . A A . 9 ARG HD3 1 1 12 6290 1 1 9 ARG HE H 4.360 -8.991 1.384 1.00 . A A . 9 ARG HE 1 1 12 6291 1 1 9 ARG HG2 H 4.774 -6.278 -1.445 1.00 . A A . 9 ARG HG2 1 1 12 6292 1 1 9 ARG HG3 H 5.396 -6.435 0.193 1.00 . A A . 9 ARG HG3 1 1 12 6293 1 1 9 ARG HH11 H 1.379 -7.826 -0.314 1.00 . A A . 9 ARG HH11 1 1 12 6294 1 1 9 ARG HH12 H 0.463 -8.759 0.874 1.00 . A A . 9 ARG HH12 1 1 12 6295 1 1 9 ARG HH21 H 2.804 -10.063 2.733 1.00 . A A . 9 ARG HH21 1 1 12 6296 1 1 9 ARG HH22 H 1.101 -9.752 2.313 1.00 . A A . 9 ARG HH22 1 1 12 6297 1 1 9 ARG N N 1.872 -4.899 1.599 1.00 . A A . 9 ARG N 1 1 12 6298 1 1 9 ARG NE N 3.654 -8.633 0.763 1.00 . A A . 9 ARG NE 1 1 12 6299 1 1 9 ARG NH1 N 1.350 -8.512 0.422 1.00 . A A . 9 ARG NH1 1 1 12 6300 1 1 9 ARG NH2 N 2.113 -9.643 2.144 1.00 . A A . 9 ARG NH2 1 1 12 6301 1 1 9 ARG O O 3.796 -3.068 2.157 1.00 . A A . 9 ARG O 1 1 12 6302 1 1 10 MET C C 7.924 -3.885 1.948 1.00 . A A . 10 MET C 1 1 12 6303 1 1 10 MET CA C 6.527 -3.537 2.469 1.00 . A A . 10 MET CA 1 1 12 6304 1 1 10 MET CB C 6.548 -3.363 3.998 1.00 . A A . 10 MET CB 1 1 12 6305 1 1 10 MET CE C 8.292 -3.128 6.803 1.00 . A A . 10 MET CE 1 1 12 6306 1 1 10 MET CG C 7.054 -4.588 4.772 1.00 . A A . 10 MET CG 1 1 12 6307 1 1 10 MET H H 5.850 -5.441 1.854 1.00 . A A . 10 MET H 1 1 12 6308 1 1 10 MET HA H 6.243 -2.581 2.036 1.00 . A A . 10 MET HA 1 1 12 6309 1 1 10 MET HB2 H 7.185 -2.510 4.230 1.00 . A A . 10 MET HB2 1 1 12 6310 1 1 10 MET HB3 H 5.541 -3.134 4.343 1.00 . A A . 10 MET HB3 1 1 12 6311 1 1 10 MET HE1 H 9.220 -3.445 6.327 1.00 . A A . 10 MET HE1 1 1 12 6312 1 1 10 MET HE2 H 7.959 -2.188 6.365 1.00 . A A . 10 MET HE2 1 1 12 6313 1 1 10 MET HE3 H 8.466 -2.980 7.869 1.00 . A A . 10 MET HE3 1 1 12 6314 1 1 10 MET HG2 H 6.434 -5.445 4.511 1.00 . A A . 10 MET HG2 1 1 12 6315 1 1 10 MET HG3 H 8.080 -4.807 4.475 1.00 . A A . 10 MET HG3 1 1 12 6316 1 1 10 MET N N 5.515 -4.512 2.056 1.00 . A A . 10 MET N 1 1 12 6317 1 1 10 MET O O 8.308 -5.051 1.881 1.00 . A A . 10 MET O 1 1 12 6318 1 1 10 MET SD S 7.020 -4.403 6.575 1.00 . A A . 10 MET SD 1 1 12 6319 1 1 11 PHE C C 10.999 -2.974 2.306 1.00 . A A . 11 PHE C 1 1 12 6320 1 1 11 PHE CA C 10.049 -2.930 1.098 1.00 . A A . 11 PHE CA 1 1 12 6321 1 1 11 PHE CB C 10.350 -1.718 0.214 1.00 . A A . 11 PHE CB 1 1 12 6322 1 1 11 PHE CD1 C 10.174 -2.727 -2.089 1.00 . A A . 11 PHE CD1 1 1 12 6323 1 1 11 PHE CD2 C 8.661 -0.897 -1.518 1.00 . A A . 11 PHE CD2 1 1 12 6324 1 1 11 PHE CE1 C 9.632 -2.781 -3.384 1.00 . A A . 11 PHE CE1 1 1 12 6325 1 1 11 PHE CE2 C 8.126 -0.955 -2.820 1.00 . A A . 11 PHE CE2 1 1 12 6326 1 1 11 PHE CG C 9.700 -1.782 -1.154 1.00 . A A . 11 PHE CG 1 1 12 6327 1 1 11 PHE CZ C 8.612 -1.888 -3.750 1.00 . A A . 11 PHE CZ 1 1 12 6328 1 1 11 PHE H H 8.240 -1.926 1.571 1.00 . A A . 11 PHE H 1 1 12 6329 1 1 11 PHE HA H 10.197 -3.822 0.494 1.00 . A A . 11 PHE HA 1 1 12 6330 1 1 11 PHE HB2 H 10.029 -0.821 0.734 1.00 . A A . 11 PHE HB2 1 1 12 6331 1 1 11 PHE HB3 H 11.428 -1.644 0.065 1.00 . A A . 11 PHE HB3 1 1 12 6332 1 1 11 PHE HD1 H 10.981 -3.395 -1.830 1.00 . A A . 11 PHE HD1 1 1 12 6333 1 1 11 PHE HD2 H 8.239 -0.190 -0.811 1.00 . A A . 11 PHE HD2 1 1 12 6334 1 1 11 PHE HE1 H 10.006 -3.495 -4.104 1.00 . A A . 11 PHE HE1 1 1 12 6335 1 1 11 PHE HE2 H 7.317 -0.305 -3.110 1.00 . A A . 11 PHE HE2 1 1 12 6336 1 1 11 PHE HZ H 8.199 -1.923 -4.747 1.00 . A A . 11 PHE HZ 1 1 12 6337 1 1 11 PHE N N 8.657 -2.853 1.527 1.00 . A A . 11 PHE N 1 1 12 6338 1 1 11 PHE O O 10.681 -2.458 3.377 1.00 . A A . 11 PHE O 1 1 12 6339 1 1 12 ALA C C 13.731 -2.336 3.759 1.00 . A A . 12 ALA C 1 1 12 6340 1 1 12 ALA CA C 13.221 -3.668 3.165 1.00 . A A . 12 ALA CA 1 1 12 6341 1 1 12 ALA CB C 14.383 -4.492 2.599 1.00 . A A . 12 ALA CB 1 1 12 6342 1 1 12 ALA H H 12.432 -3.930 1.218 1.00 . A A . 12 ALA H 1 1 12 6343 1 1 12 ALA HA H 12.775 -4.231 3.986 1.00 . A A . 12 ALA HA 1 1 12 6344 1 1 12 ALA HB1 H 14.017 -5.457 2.244 1.00 . A A . 12 ALA HB1 1 1 12 6345 1 1 12 ALA HB2 H 14.858 -3.958 1.775 1.00 . A A . 12 ALA HB2 1 1 12 6346 1 1 12 ALA HB3 H 15.122 -4.666 3.382 1.00 . A A . 12 ALA HB3 1 1 12 6347 1 1 12 ALA N N 12.208 -3.520 2.112 1.00 . A A . 12 ALA N 1 1 12 6348 1 1 12 ALA O O 14.309 -2.333 4.842 1.00 . A A . 12 ALA O 1 1 12 6349 1 1 13 ASN C C 12.570 0.676 4.490 1.00 . A A . 13 ASN C 1 1 12 6350 1 1 13 ASN CA C 13.726 0.146 3.604 1.00 . A A . 13 ASN CA 1 1 12 6351 1 1 13 ASN CB C 14.023 1.085 2.410 1.00 . A A . 13 ASN CB 1 1 12 6352 1 1 13 ASN CG C 12.871 1.200 1.416 1.00 . A A . 13 ASN CG 1 1 12 6353 1 1 13 ASN H H 12.985 -1.272 2.213 1.00 . A A . 13 ASN H 1 1 12 6354 1 1 13 ASN HA H 14.613 0.120 4.239 1.00 . A A . 13 ASN HA 1 1 12 6355 1 1 13 ASN HB2 H 14.253 2.081 2.786 1.00 . A A . 13 ASN HB2 1 1 12 6356 1 1 13 ASN HB3 H 14.904 0.714 1.886 1.00 . A A . 13 ASN HB3 1 1 12 6357 1 1 13 ASN HD21 H 14.069 1.978 -0.034 1.00 . A A . 13 ASN HD21 1 1 12 6358 1 1 13 ASN N N 13.487 -1.205 3.084 1.00 . A A . 13 ASN N 1 1 12 6359 1 1 13 ASN ND2 N 13.143 1.660 0.196 1.00 . A A . 13 ASN ND2 1 1 12 6360 1 1 13 ASN O O 12.655 1.804 4.970 1.00 . A A . 13 ASN O 1 1 12 6361 1 1 13 ASN OD1 O 11.741 0.831 1.734 1.00 . A A . 13 ASN OD1 1 1 12 6362 1 1 14 GLY C C 9.158 0.880 4.641 1.00 . A A . 14 GLY C 1 1 12 6363 1 1 14 GLY CA C 10.311 0.285 5.463 1.00 . A A . 14 GLY CA 1 1 12 6364 1 1 14 GLY H H 11.454 -1.020 4.252 1.00 . A A . 14 GLY H 1 1 12 6365 1 1 14 GLY HA2 H 9.934 -0.602 5.970 1.00 . A A . 14 GLY HA2 1 1 12 6366 1 1 14 GLY HA3 H 10.596 1.013 6.224 1.00 . A A . 14 GLY HA3 1 1 12 6367 1 1 14 GLY N N 11.490 -0.099 4.683 1.00 . A A . 14 GLY N 1 1 12 6368 1 1 14 GLY O O 8.249 1.464 5.228 1.00 . A A . 14 GLY O 1 1 12 6369 1 1 15 THR C C 7.022 0.590 2.142 1.00 . A A . 15 THR C 1 1 12 6370 1 1 15 THR CA C 8.215 1.483 2.441 1.00 . A A . 15 THR CA 1 1 12 6371 1 1 15 THR CB C 8.887 1.959 1.148 1.00 . A A . 15 THR CB 1 1 12 6372 1 1 15 THR CG2 C 8.014 2.858 0.274 1.00 . A A . 15 THR CG2 1 1 12 6373 1 1 15 THR H H 9.875 0.198 2.849 1.00 . A A . 15 THR H 1 1 12 6374 1 1 15 THR HA H 7.860 2.374 2.944 1.00 . A A . 15 THR HA 1 1 12 6375 1 1 15 THR HB H 9.194 1.104 0.558 1.00 . A A . 15 THR HB 1 1 12 6376 1 1 15 THR HG1 H 10.707 2.003 1.728 1.00 . A A . 15 THR HG1 1 1 12 6377 1 1 15 THR HG21 H 7.062 2.373 0.066 1.00 . A A . 15 THR HG21 1 1 12 6378 1 1 15 THR HG22 H 7.831 3.806 0.779 1.00 . A A . 15 THR HG22 1 1 12 6379 1 1 15 THR HG23 H 8.527 3.042 -0.673 1.00 . A A . 15 THR HG23 1 1 12 6380 1 1 15 THR N N 9.165 0.759 3.306 1.00 . A A . 15 THR N 1 1 12 6381 1 1 15 THR O O 7.195 -0.470 1.546 1.00 . A A . 15 THR O 1 1 12 6382 1 1 15 THR OG1 O 10.035 2.689 1.489 1.00 . A A . 15 THR OG1 1 1 12 6383 1 1 16 VAL C C 3.852 0.510 1.167 1.00 . A A . 16 VAL C 1 1 12 6384 1 1 16 VAL CA C 4.598 0.207 2.462 1.00 . A A . 16 VAL CA 1 1 12 6385 1 1 16 VAL CB C 3.704 0.455 3.701 1.00 . A A . 16 VAL CB 1 1 12 6386 1 1 16 VAL CG1 C 2.221 0.086 3.521 1.00 . A A . 16 VAL CG1 1 1 12 6387 1 1 16 VAL CG2 C 4.231 -0.386 4.870 1.00 . A A . 16 VAL CG2 1 1 12 6388 1 1 16 VAL H H 5.739 1.917 2.994 1.00 . A A . 16 VAL H 1 1 12 6389 1 1 16 VAL HA H 4.870 -0.847 2.452 1.00 . A A . 16 VAL HA 1 1 12 6390 1 1 16 VAL HB H 3.756 1.510 3.973 1.00 . A A . 16 VAL HB 1 1 12 6391 1 1 16 VAL HG11 H 2.125 -0.955 3.203 1.00 . A A . 16 VAL HG11 1 1 12 6392 1 1 16 VAL HG12 H 1.691 0.218 4.464 1.00 . A A . 16 VAL HG12 1 1 12 6393 1 1 16 VAL HG13 H 1.755 0.737 2.781 1.00 . A A . 16 VAL HG13 1 1 12 6394 1 1 16 VAL HG21 H 3.698 -0.124 5.783 1.00 . A A . 16 VAL HG21 1 1 12 6395 1 1 16 VAL HG22 H 4.066 -1.444 4.653 1.00 . A A . 16 VAL HG22 1 1 12 6396 1 1 16 VAL HG23 H 5.295 -0.204 5.019 1.00 . A A . 16 VAL HG23 1 1 12 6397 1 1 16 VAL N N 5.820 1.019 2.540 1.00 . A A . 16 VAL N 1 1 12 6398 1 1 16 VAL O O 3.786 1.647 0.702 1.00 . A A . 16 VAL O 1 1 12 6399 1 1 17 TYR C C 1.597 -1.747 -0.686 1.00 . A A . 17 TYR C 1 1 12 6400 1 1 17 TYR CA C 2.572 -0.563 -0.674 1.00 . A A . 17 TYR CA 1 1 12 6401 1 1 17 TYR CB C 3.584 -0.648 -1.832 1.00 . A A . 17 TYR CB 1 1 12 6402 1 1 17 TYR CD1 C 5.561 -2.015 -1.085 1.00 . A A . 17 TYR CD1 1 1 12 6403 1 1 17 TYR CD2 C 4.107 -2.951 -2.798 1.00 . A A . 17 TYR CD2 1 1 12 6404 1 1 17 TYR CE1 C 6.426 -3.115 -1.206 1.00 . A A . 17 TYR CE1 1 1 12 6405 1 1 17 TYR CE2 C 4.984 -4.042 -2.942 1.00 . A A . 17 TYR CE2 1 1 12 6406 1 1 17 TYR CG C 4.417 -1.915 -1.894 1.00 . A A . 17 TYR CG 1 1 12 6407 1 1 17 TYR CZ C 6.160 -4.112 -2.165 1.00 . A A . 17 TYR CZ 1 1 12 6408 1 1 17 TYR H H 3.364 -1.461 1.051 1.00 . A A . 17 TYR H 1 1 12 6409 1 1 17 TYR HA H 1.997 0.359 -0.769 1.00 . A A . 17 TYR HA 1 1 12 6410 1 1 17 TYR HB2 H 3.061 -0.517 -2.780 1.00 . A A . 17 TYR HB2 1 1 12 6411 1 1 17 TYR HB3 H 4.287 0.181 -1.741 1.00 . A A . 17 TYR HB3 1 1 12 6412 1 1 17 TYR HD1 H 5.802 -1.218 -0.398 1.00 . A A . 17 TYR HD1 1 1 12 6413 1 1 17 TYR HD2 H 3.211 -2.904 -3.396 1.00 . A A . 17 TYR HD2 1 1 12 6414 1 1 17 TYR HE1 H 7.318 -3.149 -0.606 1.00 . A A . 17 TYR HE1 1 1 12 6415 1 1 17 TYR HE2 H 4.774 -4.834 -3.644 1.00 . A A . 17 TYR HE2 1 1 12 6416 1 1 17 TYR HH H 7.856 -4.988 -1.880 1.00 . A A . 17 TYR HH 1 1 12 6417 1 1 17 TYR N N 3.304 -0.556 0.586 1.00 . A A . 17 TYR N 1 1 12 6418 1 1 17 TYR O O 1.546 -2.524 0.261 1.00 . A A . 17 TYR O 1 1 12 6419 1 1 17 TYR OH O 7.025 -5.148 -2.329 1.00 . A A . 17 TYR OH 1 1 12 6420 1 1 18 TYR C C 0.428 -3.820 -3.238 1.00 . A A . 18 TYR C 1 1 12 6421 1 1 18 TYR CA C -0.027 -3.073 -1.992 1.00 . A A . 18 TYR CA 1 1 12 6422 1 1 18 TYR CB C -1.489 -2.631 -2.074 1.00 . A A . 18 TYR CB 1 1 12 6423 1 1 18 TYR CD1 C -1.511 -0.903 -0.240 1.00 . A A . 18 TYR CD1 1 1 12 6424 1 1 18 TYR CD2 C -2.849 -2.913 0.050 1.00 . A A . 18 TYR CD2 1 1 12 6425 1 1 18 TYR CE1 C -1.767 -0.541 1.083 1.00 . A A . 18 TYR CE1 1 1 12 6426 1 1 18 TYR CE2 C -3.256 -2.453 1.316 1.00 . A A . 18 TYR CE2 1 1 12 6427 1 1 18 TYR CG C -1.986 -2.128 -0.736 1.00 . A A . 18 TYR CG 1 1 12 6428 1 1 18 TYR CZ C -2.667 -1.291 1.866 1.00 . A A . 18 TYR CZ 1 1 12 6429 1 1 18 TYR H H 0.771 -1.159 -2.432 1.00 . A A . 18 TYR H 1 1 12 6430 1 1 18 TYR HA H 0.055 -3.760 -1.151 1.00 . A A . 18 TYR HA 1 1 12 6431 1 1 18 TYR HB2 H -1.597 -1.846 -2.826 1.00 . A A . 18 TYR HB2 1 1 12 6432 1 1 18 TYR HB3 H -2.092 -3.485 -2.382 1.00 . A A . 18 TYR HB3 1 1 12 6433 1 1 18 TYR HD1 H -0.887 -0.257 -0.839 1.00 . A A . 18 TYR HD1 1 1 12 6434 1 1 18 TYR HD2 H -3.239 -3.845 -0.337 1.00 . A A . 18 TYR HD2 1 1 12 6435 1 1 18 TYR HE1 H -1.246 0.311 1.460 1.00 . A A . 18 TYR HE1 1 1 12 6436 1 1 18 TYR HE2 H -4.001 -3.014 1.854 1.00 . A A . 18 TYR HE2 1 1 12 6437 1 1 18 TYR HH H -3.604 -1.460 3.551 1.00 . A A . 18 TYR HH 1 1 12 6438 1 1 18 TYR N N 0.837 -1.917 -1.762 1.00 . A A . 18 TYR N 1 1 12 6439 1 1 18 TYR O O 0.816 -3.210 -4.234 1.00 . A A . 18 TYR O 1 1 12 6440 1 1 18 TYR OH O -2.991 -0.859 3.116 1.00 . A A . 18 TYR OH 1 1 12 6441 1 1 19 PHE C C -0.095 -7.050 -4.632 1.00 . A A . 19 PHE C 1 1 12 6442 1 1 19 PHE CA C 0.957 -6.062 -4.135 1.00 . A A . 19 PHE CA 1 1 12 6443 1 1 19 PHE CB C 2.122 -6.781 -3.455 1.00 . A A . 19 PHE CB 1 1 12 6444 1 1 19 PHE CD1 C 3.779 -7.306 -5.281 1.00 . A A . 19 PHE CD1 1 1 12 6445 1 1 19 PHE CD2 C 2.618 -9.154 -4.196 1.00 . A A . 19 PHE CD2 1 1 12 6446 1 1 19 PHE CE1 C 4.505 -8.218 -6.063 1.00 . A A . 19 PHE CE1 1 1 12 6447 1 1 19 PHE CE2 C 3.343 -10.069 -4.981 1.00 . A A . 19 PHE CE2 1 1 12 6448 1 1 19 PHE CG C 2.852 -7.772 -4.333 1.00 . A A . 19 PHE CG 1 1 12 6449 1 1 19 PHE CZ C 4.298 -9.601 -5.902 1.00 . A A . 19 PHE CZ 1 1 12 6450 1 1 19 PHE H H 0.059 -5.577 -2.294 1.00 . A A . 19 PHE H 1 1 12 6451 1 1 19 PHE HA H 1.347 -5.505 -4.989 1.00 . A A . 19 PHE HA 1 1 12 6452 1 1 19 PHE HB2 H 2.837 -6.034 -3.112 1.00 . A A . 19 PHE HB2 1 1 12 6453 1 1 19 PHE HB3 H 1.748 -7.297 -2.572 1.00 . A A . 19 PHE HB3 1 1 12 6454 1 1 19 PHE HD1 H 3.944 -6.248 -5.413 1.00 . A A . 19 PHE HD1 1 1 12 6455 1 1 19 PHE HD2 H 1.888 -9.518 -3.488 1.00 . A A . 19 PHE HD2 1 1 12 6456 1 1 19 PHE HE1 H 5.213 -7.838 -6.786 1.00 . A A . 19 PHE HE1 1 1 12 6457 1 1 19 PHE HE2 H 3.171 -11.131 -4.873 1.00 . A A . 19 PHE HE2 1 1 12 6458 1 1 19 PHE HZ H 4.860 -10.306 -6.499 1.00 . A A . 19 PHE HZ 1 1 12 6459 1 1 19 PHE N N 0.381 -5.148 -3.161 1.00 . A A . 19 PHE N 1 1 12 6460 1 1 19 PHE O O -0.679 -7.791 -3.840 1.00 . A A . 19 PHE O 1 1 12 6461 1 1 20 ASN C C -0.536 -9.376 -6.691 1.00 . A A . 20 ASN C 1 1 12 6462 1 1 20 ASN CA C -1.215 -8.005 -6.598 1.00 . A A . 20 ASN CA 1 1 12 6463 1 1 20 ASN CB C -1.615 -7.478 -7.978 1.00 . A A . 20 ASN CB 1 1 12 6464 1 1 20 ASN CG C -2.663 -8.396 -8.576 1.00 . A A . 20 ASN CG 1 1 12 6465 1 1 20 ASN H H 0.196 -6.439 -6.550 1.00 . A A . 20 ASN H 1 1 12 6466 1 1 20 ASN HA H -2.119 -8.107 -6.009 1.00 . A A . 20 ASN HA 1 1 12 6467 1 1 20 ASN HB2 H -2.002 -6.468 -7.903 1.00 . A A . 20 ASN HB2 1 1 12 6468 1 1 20 ASN HB3 H -0.744 -7.452 -8.628 1.00 . A A . 20 ASN HB3 1 1 12 6469 1 1 20 ASN HD21 H -4.214 -7.276 -7.875 1.00 . A A . 20 ASN HD21 1 1 12 6470 1 1 20 ASN HD22 H -4.608 -8.750 -8.755 1.00 . A A . 20 ASN HD22 1 1 12 6471 1 1 20 ASN N N -0.347 -7.046 -5.940 1.00 . A A . 20 ASN N 1 1 12 6472 1 1 20 ASN ND2 N -3.931 -8.109 -8.376 1.00 . A A . 20 ASN ND2 1 1 12 6473 1 1 20 ASN O O 0.240 -9.631 -7.615 1.00 . A A . 20 ASN O 1 1 12 6474 1 1 20 ASN OD1 O -2.337 -9.403 -9.191 1.00 . A A . 20 ASN OD1 1 1 12 6475 1 1 21 HIS C C -0.599 -12.560 -6.850 1.00 . A A . 21 HIS C 1 1 12 6476 1 1 21 HIS CA C -0.186 -11.598 -5.717 1.00 . A A . 21 HIS CA 1 1 12 6477 1 1 21 HIS CB C -0.365 -12.215 -4.322 1.00 . A A . 21 HIS CB 1 1 12 6478 1 1 21 HIS CD2 C -2.492 -13.632 -4.449 1.00 . A A . 21 HIS CD2 1 1 12 6479 1 1 21 HIS CE1 C -3.773 -12.466 -3.081 1.00 . A A . 21 HIS CE1 1 1 12 6480 1 1 21 HIS CG C -1.790 -12.561 -3.974 1.00 . A A . 21 HIS CG 1 1 12 6481 1 1 21 HIS H H -1.524 -10.056 -5.038 1.00 . A A . 21 HIS H 1 1 12 6482 1 1 21 HIS HA H 0.884 -11.433 -5.855 1.00 . A A . 21 HIS HA 1 1 12 6483 1 1 21 HIS HB2 H 0.248 -13.114 -4.251 1.00 . A A . 21 HIS HB2 1 1 12 6484 1 1 21 HIS HB3 H 0.010 -11.511 -3.578 1.00 . A A . 21 HIS HB3 1 1 12 6485 1 1 21 HIS HD2 H -2.124 -14.381 -5.137 1.00 . A A . 21 HIS HD2 1 1 12 6486 1 1 21 HIS HE1 H -4.621 -12.149 -2.491 1.00 . A A . 21 HIS HE1 1 1 12 6487 1 1 21 HIS HE2 H -4.508 -14.197 -4.020 1.00 . A A . 21 HIS HE2 1 1 12 6488 1 1 21 HIS N N -0.842 -10.283 -5.760 1.00 . A A . 21 HIS N 1 1 12 6489 1 1 21 HIS ND1 N -2.596 -11.828 -3.109 1.00 . A A . 21 HIS ND1 1 1 12 6490 1 1 21 HIS NE2 N -3.743 -13.552 -3.878 1.00 . A A . 21 HIS NE2 1 1 12 6491 1 1 21 HIS O O -0.140 -13.700 -6.862 1.00 . A A . 21 HIS O 1 1 12 6492 1 1 22 ILE C C -0.995 -12.534 -10.204 1.00 . A A . 22 ILE C 1 1 12 6493 1 1 22 ILE CA C -1.850 -12.908 -8.975 1.00 . A A . 22 ILE CA 1 1 12 6494 1 1 22 ILE CB C -3.371 -12.732 -9.236 1.00 . A A . 22 ILE CB 1 1 12 6495 1 1 22 ILE CD1 C -4.492 -11.886 -7.047 1.00 . A A . 22 ILE CD1 1 1 12 6496 1 1 22 ILE CG1 C -4.246 -13.066 -7.998 1.00 . A A . 22 ILE CG1 1 1 12 6497 1 1 22 ILE CG2 C -3.837 -13.638 -10.392 1.00 . A A . 22 ILE CG2 1 1 12 6498 1 1 22 ILE H H -1.792 -11.177 -7.752 1.00 . A A . 22 ILE H 1 1 12 6499 1 1 22 ILE HA H -1.668 -13.966 -8.775 1.00 . A A . 22 ILE HA 1 1 12 6500 1 1 22 ILE HB H -3.567 -11.702 -9.534 1.00 . A A . 22 ILE HB 1 1 12 6501 1 1 22 ILE HD11 H -3.580 -11.587 -6.534 1.00 . A A . 22 ILE HD11 1 1 12 6502 1 1 22 ILE HD12 H -4.889 -11.037 -7.605 1.00 . A A . 22 ILE HD12 1 1 12 6503 1 1 22 ILE HD13 H -5.220 -12.186 -6.294 1.00 . A A . 22 ILE HD13 1 1 12 6504 1 1 22 ILE HG12 H -5.231 -13.394 -8.330 1.00 . A A . 22 ILE HG12 1 1 12 6505 1 1 22 ILE HG13 H -3.799 -13.892 -7.444 1.00 . A A . 22 ILE HG13 1 1 12 6506 1 1 22 ILE HG21 H -3.607 -14.681 -10.170 1.00 . A A . 22 ILE HG21 1 1 12 6507 1 1 22 ILE HG22 H -4.913 -13.533 -10.546 1.00 . A A . 22 ILE HG22 1 1 12 6508 1 1 22 ILE HG23 H -3.351 -13.353 -11.324 1.00 . A A . 22 ILE HG23 1 1 12 6509 1 1 22 ILE N N -1.442 -12.126 -7.799 1.00 . A A . 22 ILE N 1 1 12 6510 1 1 22 ILE O O -0.838 -13.342 -11.117 1.00 . A A . 22 ILE O 1 1 12 6511 1 1 23 THR C C 1.689 -10.201 -11.061 1.00 . A A . 23 THR C 1 1 12 6512 1 1 23 THR CA C 0.302 -10.759 -11.382 1.00 . A A . 23 THR CA 1 1 12 6513 1 1 23 THR CB C -0.506 -9.616 -12.014 1.00 . A A . 23 THR CB 1 1 12 6514 1 1 23 THR CG2 C -1.872 -10.056 -12.545 1.00 . A A . 23 THR CG2 1 1 12 6515 1 1 23 THR H H -0.604 -10.712 -9.438 1.00 . A A . 23 THR H 1 1 12 6516 1 1 23 THR HA H 0.441 -11.530 -12.140 1.00 . A A . 23 THR HA 1 1 12 6517 1 1 23 THR HB H 0.064 -9.201 -12.845 1.00 . A A . 23 THR HB 1 1 12 6518 1 1 23 THR HG1 H -1.367 -8.947 -10.415 1.00 . A A . 23 THR HG1 1 1 12 6519 1 1 23 THR HG21 H -2.504 -10.420 -11.735 1.00 . A A . 23 THR HG21 1 1 12 6520 1 1 23 THR HG22 H -2.361 -9.210 -13.026 1.00 . A A . 23 THR HG22 1 1 12 6521 1 1 23 THR HG23 H -1.739 -10.852 -13.278 1.00 . A A . 23 THR HG23 1 1 12 6522 1 1 23 THR N N -0.410 -11.327 -10.220 1.00 . A A . 23 THR N 1 1 12 6523 1 1 23 THR O O 2.508 -10.089 -11.973 1.00 . A A . 23 THR O 1 1 12 6524 1 1 23 THR OG1 O -0.702 -8.603 -11.052 1.00 . A A . 23 THR OG1 1 1 12 6525 1 1 24 ASN C C 3.033 -7.623 -9.467 1.00 . A A . 24 ASN C 1 1 12 6526 1 1 24 ASN CA C 3.124 -9.151 -9.266 1.00 . A A . 24 ASN CA 1 1 12 6527 1 1 24 ASN CB C 4.477 -9.720 -9.750 1.00 . A A . 24 ASN CB 1 1 12 6528 1 1 24 ASN CG C 4.600 -11.230 -9.633 1.00 . A A . 24 ASN CG 1 1 12 6529 1 1 24 ASN H H 1.238 -10.023 -9.090 1.00 . A A . 24 ASN H 1 1 12 6530 1 1 24 ASN HA H 3.089 -9.296 -8.187 1.00 . A A . 24 ASN HA 1 1 12 6531 1 1 24 ASN HB2 H 4.649 -9.426 -10.785 1.00 . A A . 24 ASN HB2 1 1 12 6532 1 1 24 ASN HB3 H 5.276 -9.277 -9.156 1.00 . A A . 24 ASN HB3 1 1 12 6533 1 1 24 ASN HD21 H 3.808 -11.472 -11.466 1.00 . A A . 24 ASN HD21 1 1 12 6534 1 1 24 ASN HD22 H 4.315 -12.947 -10.610 1.00 . A A . 24 ASN HD22 1 1 12 6535 1 1 24 ASN N N 1.963 -9.881 -9.789 1.00 . A A . 24 ASN N 1 1 12 6536 1 1 24 ASN ND2 N 4.236 -11.949 -10.675 1.00 . A A . 24 ASN ND2 1 1 12 6537 1 1 24 ASN O O 4.003 -6.925 -9.170 1.00 . A A . 24 ASN O 1 1 12 6538 1 1 24 ASN OD1 O 5.034 -11.768 -8.626 1.00 . A A . 24 ASN OD1 1 1 12 6539 1 1 25 ALA C C 1.699 -5.004 -8.600 1.00 . A A . 25 ALA C 1 1 12 6540 1 1 25 ALA CA C 1.711 -5.631 -10.011 1.00 . A A . 25 ALA CA 1 1 12 6541 1 1 25 ALA CB C 0.417 -5.330 -10.776 1.00 . A A . 25 ALA CB 1 1 12 6542 1 1 25 ALA H H 1.101 -7.663 -10.184 1.00 . A A . 25 ALA H 1 1 12 6543 1 1 25 ALA HA H 2.545 -5.198 -10.566 1.00 . A A . 25 ALA HA 1 1 12 6544 1 1 25 ALA HB1 H 0.314 -4.253 -10.913 1.00 . A A . 25 ALA HB1 1 1 12 6545 1 1 25 ALA HB2 H 0.447 -5.808 -11.757 1.00 . A A . 25 ALA HB2 1 1 12 6546 1 1 25 ALA HB3 H -0.445 -5.702 -10.223 1.00 . A A . 25 ALA HB3 1 1 12 6547 1 1 25 ALA N N 1.901 -7.082 -9.949 1.00 . A A . 25 ALA N 1 1 12 6548 1 1 25 ALA O O 1.388 -5.680 -7.618 1.00 . A A . 25 ALA O 1 1 12 6549 1 1 26 SER C C 1.624 -1.582 -7.222 1.00 . A A . 26 SER C 1 1 12 6550 1 1 26 SER CA C 2.120 -3.036 -7.182 1.00 . A A . 26 SER CA 1 1 12 6551 1 1 26 SER CB C 3.564 -3.145 -6.676 1.00 . A A . 26 SER CB 1 1 12 6552 1 1 26 SER H H 2.269 -3.147 -9.283 1.00 . A A . 26 SER H 1 1 12 6553 1 1 26 SER HA H 1.492 -3.566 -6.472 1.00 . A A . 26 SER HA 1 1 12 6554 1 1 26 SER HB2 H 3.631 -2.756 -5.663 1.00 . A A . 26 SER HB2 1 1 12 6555 1 1 26 SER HB3 H 3.851 -4.197 -6.655 1.00 . A A . 26 SER HB3 1 1 12 6556 1 1 26 SER HG H 5.360 -2.592 -7.207 1.00 . A A . 26 SER HG 1 1 12 6557 1 1 26 SER N N 2.013 -3.708 -8.483 1.00 . A A . 26 SER N 1 1 12 6558 1 1 26 SER O O 1.667 -0.925 -8.261 1.00 . A A . 26 SER O 1 1 12 6559 1 1 26 SER OG O 4.461 -2.444 -7.514 1.00 . A A . 26 SER OG 1 1 12 6560 1 1 27 GLN C C 0.845 0.785 -4.529 1.00 . A A . 27 GLN C 1 1 12 6561 1 1 27 GLN CA C 0.510 0.234 -5.926 1.00 . A A . 27 GLN CA 1 1 12 6562 1 1 27 GLN CB C -1.020 0.129 -6.135 1.00 . A A . 27 GLN CB 1 1 12 6563 1 1 27 GLN CD C -3.249 1.404 -6.094 1.00 . A A . 27 GLN CD 1 1 12 6564 1 1 27 GLN CG C -1.720 1.498 -6.123 1.00 . A A . 27 GLN CG 1 1 12 6565 1 1 27 GLN H H 1.034 -1.726 -5.286 1.00 . A A . 27 GLN H 1 1 12 6566 1 1 27 GLN HA H 0.922 0.904 -6.682 1.00 . A A . 27 GLN HA 1 1 12 6567 1 1 27 GLN HB2 H -1.219 -0.344 -7.099 1.00 . A A . 27 GLN HB2 1 1 12 6568 1 1 27 GLN HB3 H -1.446 -0.501 -5.352 1.00 . A A . 27 GLN HB3 1 1 12 6569 1 1 27 GLN HE21 H -3.304 1.283 -4.054 1.00 . A A . 27 GLN HE21 1 1 12 6570 1 1 27 GLN HE22 H -4.862 1.272 -4.898 1.00 . A A . 27 GLN HE22 1 1 12 6571 1 1 27 GLN HG2 H -1.401 2.045 -5.242 1.00 . A A . 27 GLN HG2 1 1 12 6572 1 1 27 GLN HG3 H -1.415 2.064 -7.002 1.00 . A A . 27 GLN HG3 1 1 12 6573 1 1 27 GLN N N 1.102 -1.100 -6.086 1.00 . A A . 27 GLN N 1 1 12 6574 1 1 27 GLN NE2 N -3.846 1.277 -4.924 1.00 . A A . 27 GLN NE2 1 1 12 6575 1 1 27 GLN O O 0.456 0.191 -3.526 1.00 . A A . 27 GLN O 1 1 12 6576 1 1 27 GLN OE1 O -3.932 1.514 -7.107 1.00 . A A . 27 GLN OE1 1 1 12 6577 1 1 28 PHE C C 0.556 3.126 -2.469 1.00 . A A . 28 PHE C 1 1 12 6578 1 1 28 PHE CA C 1.822 2.588 -3.154 1.00 . A A . 28 PHE CA 1 1 12 6579 1 1 28 PHE CB C 2.829 3.726 -3.363 1.00 . A A . 28 PHE CB 1 1 12 6580 1 1 28 PHE CD1 C 5.008 2.672 -2.661 1.00 . A A . 28 PHE CD1 1 1 12 6581 1 1 28 PHE CD2 C 4.760 3.378 -4.979 1.00 . A A . 28 PHE CD2 1 1 12 6582 1 1 28 PHE CE1 C 6.307 2.217 -2.939 1.00 . A A . 28 PHE CE1 1 1 12 6583 1 1 28 PHE CE2 C 6.064 2.929 -5.254 1.00 . A A . 28 PHE CE2 1 1 12 6584 1 1 28 PHE CG C 4.230 3.250 -3.681 1.00 . A A . 28 PHE CG 1 1 12 6585 1 1 28 PHE CZ C 6.838 2.349 -4.233 1.00 . A A . 28 PHE CZ 1 1 12 6586 1 1 28 PHE H H 1.906 2.361 -5.276 1.00 . A A . 28 PHE H 1 1 12 6587 1 1 28 PHE HA H 2.266 1.864 -2.472 1.00 . A A . 28 PHE HA 1 1 12 6588 1 1 28 PHE HB2 H 2.475 4.388 -4.155 1.00 . A A . 28 PHE HB2 1 1 12 6589 1 1 28 PHE HB3 H 2.884 4.315 -2.446 1.00 . A A . 28 PHE HB3 1 1 12 6590 1 1 28 PHE HD1 H 4.605 2.571 -1.663 1.00 . A A . 28 PHE HD1 1 1 12 6591 1 1 28 PHE HD2 H 4.176 3.829 -5.768 1.00 . A A . 28 PHE HD2 1 1 12 6592 1 1 28 PHE HE1 H 6.893 1.764 -2.154 1.00 . A A . 28 PHE HE1 1 1 12 6593 1 1 28 PHE HE2 H 6.474 3.034 -6.248 1.00 . A A . 28 PHE HE2 1 1 12 6594 1 1 28 PHE HZ H 7.841 2.007 -4.442 1.00 . A A . 28 PHE HZ 1 1 12 6595 1 1 28 PHE N N 1.542 1.927 -4.442 1.00 . A A . 28 PHE N 1 1 12 6596 1 1 28 PHE O O 0.443 3.084 -1.245 1.00 . A A . 28 PHE O 1 1 12 6597 1 1 29 GLU C C -2.498 2.920 -2.140 1.00 . A A . 29 GLU C 1 1 12 6598 1 1 29 GLU CA C -1.710 4.072 -2.804 1.00 . A A . 29 GLU CA 1 1 12 6599 1 1 29 GLU CB C -2.446 4.645 -4.022 1.00 . A A . 29 GLU CB 1 1 12 6600 1 1 29 GLU CD C -4.770 5.215 -4.752 1.00 . A A . 29 GLU CD 1 1 12 6601 1 1 29 GLU CG C -3.700 5.460 -3.688 1.00 . A A . 29 GLU CG 1 1 12 6602 1 1 29 GLU H H -0.236 3.623 -4.255 1.00 . A A . 29 GLU H 1 1 12 6603 1 1 29 GLU HA H -1.561 4.869 -2.074 1.00 . A A . 29 GLU HA 1 1 12 6604 1 1 29 GLU HB2 H -1.768 5.289 -4.585 1.00 . A A . 29 GLU HB2 1 1 12 6605 1 1 29 GLU HB3 H -2.720 3.815 -4.667 1.00 . A A . 29 GLU HB3 1 1 12 6606 1 1 29 GLU HG2 H -4.090 5.166 -2.712 1.00 . A A . 29 GLU HG2 1 1 12 6607 1 1 29 GLU HG3 H -3.446 6.520 -3.642 1.00 . A A . 29 GLU HG3 1 1 12 6608 1 1 29 GLU N N -0.399 3.618 -3.261 1.00 . A A . 29 GLU N 1 1 12 6609 1 1 29 GLU O O -2.479 1.778 -2.606 1.00 . A A . 29 GLU O 1 1 12 6610 1 1 29 GLU OE1 O -4.505 5.382 -5.962 1.00 . A A . 29 GLU OE1 1 1 12 6611 1 1 29 GLU OE2 O -5.854 4.711 -4.394 1.00 . A A . 29 GLU OE2 1 1 12 6612 1 1 30 ARG C C -5.402 2.198 -0.355 1.00 . A A . 30 ARG C 1 1 12 6613 1 1 30 ARG CA C -3.870 2.273 -0.151 1.00 . A A . 30 ARG CA 1 1 12 6614 1 1 30 ARG CB C -3.457 2.544 1.308 1.00 . A A . 30 ARG CB 1 1 12 6615 1 1 30 ARG CD C -1.483 2.756 2.955 1.00 . A A . 30 ARG CD 1 1 12 6616 1 1 30 ARG CG C -2.002 3.011 1.526 1.00 . A A . 30 ARG CG 1 1 12 6617 1 1 30 ARG CZ C -3.352 2.844 4.634 1.00 . A A . 30 ARG CZ 1 1 12 6618 1 1 30 ARG H H -3.264 4.201 -0.779 1.00 . A A . 30 ARG H 1 1 12 6619 1 1 30 ARG HA H -3.477 1.288 -0.410 1.00 . A A . 30 ARG HA 1 1 12 6620 1 1 30 ARG HB2 H -4.131 3.282 1.745 1.00 . A A . 30 ARG HB2 1 1 12 6621 1 1 30 ARG HB3 H -3.575 1.604 1.839 1.00 . A A . 30 ARG HB3 1 1 12 6622 1 1 30 ARG HD2 H -1.418 1.683 3.137 1.00 . A A . 30 ARG HD2 1 1 12 6623 1 1 30 ARG HD3 H -0.472 3.158 3.029 1.00 . A A . 30 ARG HD3 1 1 12 6624 1 1 30 ARG HE H -2.120 4.344 4.217 1.00 . A A . 30 ARG HE 1 1 12 6625 1 1 30 ARG HG2 H -1.344 2.486 0.833 1.00 . A A . 30 ARG HG2 1 1 12 6626 1 1 30 ARG HG3 H -1.934 4.078 1.308 1.00 . A A . 30 ARG HG3 1 1 12 6627 1 1 30 ARG HH11 H -3.203 0.946 3.895 1.00 . A A . 30 ARG HH11 1 1 12 6628 1 1 30 ARG HH12 H -4.661 1.304 4.794 1.00 . A A . 30 ARG HH12 1 1 12 6629 1 1 30 ARG HH21 H -3.877 4.536 5.652 1.00 . A A . 30 ARG HH21 1 1 12 6630 1 1 30 ARG HH22 H -4.846 3.085 5.923 1.00 . A A . 30 ARG HH22 1 1 12 6631 1 1 30 ARG N N -3.220 3.234 -1.057 1.00 . A A . 30 ARG N 1 1 12 6632 1 1 30 ARG NE N -2.321 3.386 3.991 1.00 . A A . 30 ARG NE 1 1 12 6633 1 1 30 ARG NH1 N -3.723 1.595 4.469 1.00 . A A . 30 ARG NH1 1 1 12 6634 1 1 30 ARG NH2 N -4.062 3.572 5.454 1.00 . A A . 30 ARG NH2 1 1 12 6635 1 1 30 ARG O O -5.971 3.092 -0.989 1.00 . A A . 30 ARG O 1 1 12 6636 1 1 31 PRO C C -8.451 2.086 0.126 1.00 . A A . 31 PRO C 1 1 12 6637 1 1 31 PRO CA C -7.532 0.906 -0.172 1.00 . A A . 31 PRO CA 1 1 12 6638 1 1 31 PRO CB C -7.942 -0.328 0.644 1.00 . A A . 31 PRO CB 1 1 12 6639 1 1 31 PRO CD C -5.574 0.036 0.891 1.00 . A A . 31 PRO CD 1 1 12 6640 1 1 31 PRO CG C -6.635 -1.058 0.923 1.00 . A A . 31 PRO CG 1 1 12 6641 1 1 31 PRO HA H -7.636 0.700 -1.215 1.00 . A A . 31 PRO HA 1 1 12 6642 1 1 31 PRO HB2 H -8.383 -0.027 1.596 1.00 . A A . 31 PRO HB2 1 1 12 6643 1 1 31 PRO HB3 H -8.641 -0.957 0.092 1.00 . A A . 31 PRO HB3 1 1 12 6644 1 1 31 PRO HD2 H -5.395 0.383 1.909 1.00 . A A . 31 PRO HD2 1 1 12 6645 1 1 31 PRO HD3 H -4.660 -0.351 0.447 1.00 . A A . 31 PRO HD3 1 1 12 6646 1 1 31 PRO HG2 H -6.656 -1.564 1.888 1.00 . A A . 31 PRO HG2 1 1 12 6647 1 1 31 PRO HG3 H -6.441 -1.776 0.132 1.00 . A A . 31 PRO HG3 1 1 12 6648 1 1 31 PRO N N -6.103 1.128 0.091 1.00 . A A . 31 PRO N 1 1 12 6649 1 1 31 PRO O O -9.317 2.434 -0.677 1.00 . A A . 31 PRO O 1 1 12 6650 1 1 32 SER C C -8.727 3.593 3.536 1.00 . A A . 32 SER C 1 1 12 6651 1 1 32 SER CA C -8.784 3.818 2.018 1.00 . A A . 32 SER CA 1 1 12 6652 1 1 32 SER CB C -10.239 4.132 1.628 1.00 . A A . 32 SER CB 1 1 12 6653 1 1 32 SER H H -7.336 2.253 1.627 1.00 . A A . 32 SER H 1 1 12 6654 1 1 32 SER HA H -8.198 4.715 1.813 1.00 . A A . 32 SER HA 1 1 12 6655 1 1 32 SER HB2 H -10.863 3.252 1.798 1.00 . A A . 32 SER HB2 1 1 12 6656 1 1 32 SER HB3 H -10.611 4.951 2.246 1.00 . A A . 32 SER HB3 1 1 12 6657 1 1 32 SER HG H -10.005 3.726 -0.228 1.00 . A A . 32 SER HG 1 1 12 6658 1 1 32 SER N N -8.166 2.698 1.269 1.00 . A A . 32 SER N 1 1 12 6659 1 1 32 SER O O -8.833 4.556 4.291 1.00 . A A . 32 SER O 1 1 12 6660 1 1 32 SER OG O -10.326 4.515 0.274 1.00 . A A . 32 SER OG 1 1 12 6661 1 1 33 GLY C C -6.760 1.559 5.489 1.00 . A A . 33 GLY C 1 1 12 6662 1 1 33 GLY CA C -8.225 1.941 5.351 1.00 . A A . 33 GLY CA 1 1 12 6663 1 1 33 GLY H H -8.440 1.595 3.299 1.00 . A A . 33 GLY H 1 1 12 6664 1 1 33 GLY HA2 H -8.432 2.760 6.041 1.00 . A A . 33 GLY HA2 1 1 12 6665 1 1 33 GLY HA3 H -8.829 1.080 5.629 1.00 . A A . 33 GLY HA3 1 1 12 6666 1 1 33 GLY N N -8.519 2.341 3.971 1.00 . A A . 33 GLY N 1 1 12 6667 1 1 33 GLY O O -6.263 0.778 4.648 1.00 . A A . 33 GLY O 1 1 12 6668 1 1 33 GLY OXT O -6.081 2.128 6.365 1.00 . A A . 33 GLY OXT 1 1 12 6669 2 2 1 NAG C1 C 12.243 1.406 -0.923 1.00 . B A . 101 NAG C1 1 1 12 6670 2 2 1 NAG C2 C 11.810 2.664 -1.712 1.00 . B A . 101 NAG C2 1 1 12 6671 2 2 1 NAG C3 C 10.818 2.151 -2.772 1.00 . B A . 101 NAG C3 1 1 12 6672 2 2 1 NAG C4 C 11.579 1.241 -3.728 1.00 . B A . 101 NAG C4 1 1 12 6673 2 2 1 NAG C5 C 12.166 0.036 -2.987 1.00 . B A . 101 NAG C5 1 1 12 6674 2 2 1 NAG C6 C 13.039 -0.871 -3.854 1.00 . B A . 101 NAG C6 1 1 12 6675 2 2 1 NAG C7 C 11.022 4.946 -1.235 1.00 . B A . 101 NAG C7 1 1 12 6676 2 2 1 NAG C8 C 10.489 5.916 -0.170 1.00 . B A . 101 NAG C8 1 1 12 6677 2 2 1 NAG H1 H 11.355 0.890 -0.559 1.00 . B A . 101 NAG H1 1 1 12 6678 2 2 1 NAG H2 H 12.678 3.105 -2.206 1.00 . B A . 101 NAG H2 1 1 12 6679 2 2 1 NAG H3 H 10.016 1.584 -2.285 1.00 . B A . 101 NAG H3 1 1 12 6680 2 2 1 NAG H4 H 12.360 1.818 -4.215 1.00 . B A . 101 NAG H4 1 1 12 6681 2 2 1 NAG H5 H 11.339 -0.548 -2.608 1.00 . B A . 101 NAG H5 1 1 12 6682 2 2 1 NAG H61 H 13.209 -1.815 -3.337 1.00 . B A . 101 NAG H61 1 1 12 6683 2 2 1 NAG H62 H 12.564 -1.085 -4.810 1.00 . B A . 101 NAG H62 1 1 12 6684 2 2 1 NAG H81 H 11.003 5.746 0.777 1.00 . B A . 101 NAG H81 1 1 12 6685 2 2 1 NAG H82 H 9.420 5.754 -0.034 1.00 . B A . 101 NAG H82 1 1 12 6686 2 2 1 NAG H83 H 10.659 6.944 -0.489 1.00 . B A . 101 NAG H83 1 1 12 6687 2 2 1 NAG HN2 H 10.888 3.398 0.069 1.00 . B A . 101 NAG HN2 1 1 12 6688 2 2 1 NAG HO3 H 10.580 4.091 -3.227 1.00 . B A . 101 NAG HO3 1 1 12 6689 2 2 1 NAG HO4 H 10.123 1.602 -4.918 1.00 . B A . 101 NAG HO4 1 1 12 6690 2 2 1 NAG HO6 H 14.595 0.101 -3.197 1.00 . B A . 101 NAG HO6 1 1 12 6691 2 2 1 NAG N2 N 11.217 3.687 -0.849 1.00 . B A . 101 NAG N2 1 1 12 6692 2 2 1 NAG O3 O 10.251 3.223 -3.568 1.00 . B A . 101 NAG O3 1 1 12 6693 2 2 1 NAG O4 O 10.625 0.803 -4.700 1.00 . B A . 101 NAG O4 1 1 12 6694 2 2 1 NAG O5 O 12.970 0.508 -1.826 1.00 . B A . 101 NAG O5 1 1 12 6695 2 2 1 NAG O6 O 14.298 -0.218 -4.056 1.00 . B A . 101 NAG O6 1 1 12 6696 2 2 1 NAG O7 O 11.230 5.291 -2.397 1.00 . B A . 101 NAG O7 1 1 13 6697 1 1 1 LYS C C -9.805 -1.272 -3.047 1.00 . A A . 1 LYS C 1 1 13 6698 1 1 1 LYS CA C -10.894 -0.440 -2.382 1.00 . A A . 1 LYS CA 1 1 13 6699 1 1 1 LYS CB C -10.316 0.767 -1.624 1.00 . A A . 1 LYS CB 1 1 13 6700 1 1 1 LYS CD C -8.944 2.864 -1.702 1.00 . A A . 1 LYS CD 1 1 13 6701 1 1 1 LYS CE C -8.190 3.902 -2.536 1.00 . A A . 1 LYS CE 1 1 13 6702 1 1 1 LYS CG C -9.555 1.740 -2.544 1.00 . A A . 1 LYS CG 1 1 13 6703 1 1 1 LYS H1 H -12.591 -0.760 -1.235 1.00 . A A . 1 LYS H1 1 1 13 6704 1 1 1 LYS H2 H -11.308 -1.441 -0.615 1.00 . A A . 1 LYS H2 1 1 13 6705 1 1 1 LYS H3 H -12.023 -2.145 -1.953 1.00 . A A . 1 LYS H3 1 1 13 6706 1 1 1 LYS HA H -11.511 -0.056 -3.194 1.00 . A A . 1 LYS HA 1 1 13 6707 1 1 1 LYS HB2 H -11.137 1.311 -1.153 1.00 . A A . 1 LYS HB2 1 1 13 6708 1 1 1 LYS HB3 H -9.646 0.413 -0.839 1.00 . A A . 1 LYS HB3 1 1 13 6709 1 1 1 LYS HD2 H -9.739 3.364 -1.153 1.00 . A A . 1 LYS HD2 1 1 13 6710 1 1 1 LYS HD3 H -8.246 2.421 -0.996 1.00 . A A . 1 LYS HD3 1 1 13 6711 1 1 1 LYS HE2 H -7.483 3.388 -3.193 1.00 . A A . 1 LYS HE2 1 1 13 6712 1 1 1 LYS HE3 H -8.899 4.457 -3.154 1.00 . A A . 1 LYS HE3 1 1 13 6713 1 1 1 LYS HG2 H -8.752 1.217 -3.064 1.00 . A A . 1 LYS HG2 1 1 13 6714 1 1 1 LYS HG3 H -10.244 2.162 -3.277 1.00 . A A . 1 LYS HG3 1 1 13 6715 1 1 1 LYS HZ1 H -8.064 5.285 -0.973 1.00 . A A . 1 LYS HZ1 1 1 13 6716 1 1 1 LYS HZ2 H -6.770 4.303 -1.089 1.00 . A A . 1 LYS HZ2 1 1 13 6717 1 1 1 LYS HZ3 H -6.887 5.511 -2.156 1.00 . A A . 1 LYS HZ3 1 1 13 6718 1 1 1 LYS N N -11.756 -1.277 -1.514 1.00 . A A . 1 LYS N 1 1 13 6719 1 1 1 LYS NZ N -7.453 4.821 -1.643 1.00 . A A . 1 LYS NZ 1 1 13 6720 1 1 1 LYS O O -9.782 -1.307 -4.271 1.00 . A A . 1 LYS O 1 1 13 6721 1 1 2 LEU C C -8.746 -4.030 -3.595 1.00 . A A . 2 LEU C 1 1 13 6722 1 1 2 LEU CA C -7.985 -2.925 -2.821 1.00 . A A . 2 LEU CA 1 1 13 6723 1 1 2 LEU CB C -7.152 -3.543 -1.679 1.00 . A A . 2 LEU CB 1 1 13 6724 1 1 2 LEU CD1 C -5.376 -3.428 0.069 1.00 . A A . 2 LEU CD1 1 1 13 6725 1 1 2 LEU CD2 C -5.098 -2.013 -1.955 1.00 . A A . 2 LEU CD2 1 1 13 6726 1 1 2 LEU CG C -6.124 -2.620 -0.992 1.00 . A A . 2 LEU CG 1 1 13 6727 1 1 2 LEU H H -8.968 -1.874 -1.271 1.00 . A A . 2 LEU H 1 1 13 6728 1 1 2 LEU HA H -7.303 -2.415 -3.496 1.00 . A A . 2 LEU HA 1 1 13 6729 1 1 2 LEU HB2 H -7.836 -3.932 -0.923 1.00 . A A . 2 LEU HB2 1 1 13 6730 1 1 2 LEU HB3 H -6.612 -4.396 -2.082 1.00 . A A . 2 LEU HB3 1 1 13 6731 1 1 2 LEU HD11 H -4.804 -4.231 -0.401 1.00 . A A . 2 LEU HD11 1 1 13 6732 1 1 2 LEU HD12 H -4.700 -2.777 0.619 1.00 . A A . 2 LEU HD12 1 1 13 6733 1 1 2 LEU HD13 H -6.084 -3.866 0.771 1.00 . A A . 2 LEU HD13 1 1 13 6734 1 1 2 LEU HD21 H -4.587 -2.800 -2.507 1.00 . A A . 2 LEU HD21 1 1 13 6735 1 1 2 LEU HD22 H -5.586 -1.337 -2.655 1.00 . A A . 2 LEU HD22 1 1 13 6736 1 1 2 LEU HD23 H -4.361 -1.437 -1.393 1.00 . A A . 2 LEU HD23 1 1 13 6737 1 1 2 LEU HG H -6.644 -1.805 -0.491 1.00 . A A . 2 LEU HG 1 1 13 6738 1 1 2 LEU N N -8.933 -1.943 -2.278 1.00 . A A . 2 LEU N 1 1 13 6739 1 1 2 LEU O O -9.606 -4.675 -2.991 1.00 . A A . 2 LEU O 1 1 13 6740 1 1 3 PRO C C -8.734 -6.728 -5.232 1.00 . A A . 3 PRO C 1 1 13 6741 1 1 3 PRO CA C -9.128 -5.301 -5.690 1.00 . A A . 3 PRO CA 1 1 13 6742 1 1 3 PRO CB C -8.717 -5.047 -7.151 1.00 . A A . 3 PRO CB 1 1 13 6743 1 1 3 PRO CD C -7.700 -3.370 -5.771 1.00 . A A . 3 PRO CD 1 1 13 6744 1 1 3 PRO CG C -8.217 -3.606 -7.183 1.00 . A A . 3 PRO CG 1 1 13 6745 1 1 3 PRO HA H -10.209 -5.186 -5.604 1.00 . A A . 3 PRO HA 1 1 13 6746 1 1 3 PRO HB2 H -7.908 -5.716 -7.444 1.00 . A A . 3 PRO HB2 1 1 13 6747 1 1 3 PRO HB3 H -9.560 -5.174 -7.829 1.00 . A A . 3 PRO HB3 1 1 13 6748 1 1 3 PRO HD2 H -6.649 -3.648 -5.701 1.00 . A A . 3 PRO HD2 1 1 13 6749 1 1 3 PRO HD3 H -7.818 -2.315 -5.524 1.00 . A A . 3 PRO HD3 1 1 13 6750 1 1 3 PRO HG2 H -7.436 -3.461 -7.930 1.00 . A A . 3 PRO HG2 1 1 13 6751 1 1 3 PRO HG3 H -9.058 -2.936 -7.375 1.00 . A A . 3 PRO HG3 1 1 13 6752 1 1 3 PRO N N -8.498 -4.231 -4.907 1.00 . A A . 3 PRO N 1 1 13 6753 1 1 3 PRO O O -7.833 -6.893 -4.404 1.00 . A A . 3 PRO O 1 1 13 6754 1 1 4 PRO C C -7.447 -9.444 -5.675 1.00 . A A . 4 PRO C 1 1 13 6755 1 1 4 PRO CA C -8.958 -9.180 -5.572 1.00 . A A . 4 PRO CA 1 1 13 6756 1 1 4 PRO CB C -9.749 -10.006 -6.593 1.00 . A A . 4 PRO CB 1 1 13 6757 1 1 4 PRO CD C -10.471 -7.738 -6.729 1.00 . A A . 4 PRO CD 1 1 13 6758 1 1 4 PRO CG C -11.005 -9.167 -6.812 1.00 . A A . 4 PRO CG 1 1 13 6759 1 1 4 PRO HA H -9.301 -9.448 -4.572 1.00 . A A . 4 PRO HA 1 1 13 6760 1 1 4 PRO HB2 H -9.196 -10.078 -7.531 1.00 . A A . 4 PRO HB2 1 1 13 6761 1 1 4 PRO HB3 H -9.988 -10.999 -6.212 1.00 . A A . 4 PRO HB3 1 1 13 6762 1 1 4 PRO HD2 H -10.124 -7.429 -7.715 1.00 . A A . 4 PRO HD2 1 1 13 6763 1 1 4 PRO HD3 H -11.253 -7.065 -6.373 1.00 . A A . 4 PRO HD3 1 1 13 6764 1 1 4 PRO HG2 H -11.468 -9.371 -7.778 1.00 . A A . 4 PRO HG2 1 1 13 6765 1 1 4 PRO HG3 H -11.711 -9.342 -5.999 1.00 . A A . 4 PRO HG3 1 1 13 6766 1 1 4 PRO N N -9.342 -7.787 -5.809 1.00 . A A . 4 PRO N 1 1 13 6767 1 1 4 PRO O O -6.790 -9.070 -6.650 1.00 . A A . 4 PRO O 1 1 13 6768 1 1 5 GLY C C -4.488 -9.412 -4.248 1.00 . A A . 5 GLY C 1 1 13 6769 1 1 5 GLY CA C -5.493 -10.515 -4.596 1.00 . A A . 5 GLY CA 1 1 13 6770 1 1 5 GLY H H -7.481 -10.385 -3.878 1.00 . A A . 5 GLY H 1 1 13 6771 1 1 5 GLY HA2 H -5.391 -11.302 -3.850 1.00 . A A . 5 GLY HA2 1 1 13 6772 1 1 5 GLY HA3 H -5.216 -10.925 -5.564 1.00 . A A . 5 GLY HA3 1 1 13 6773 1 1 5 GLY N N -6.897 -10.106 -4.650 1.00 . A A . 5 GLY N 1 1 13 6774 1 1 5 GLY O O -3.288 -9.682 -4.280 1.00 . A A . 5 GLY O 1 1 13 6775 1 1 6 TRP C C -3.847 -7.196 -1.938 1.00 . A A . 6 TRP C 1 1 13 6776 1 1 6 TRP CA C -4.063 -7.119 -3.459 1.00 . A A . 6 TRP CA 1 1 13 6777 1 1 6 TRP CB C -4.635 -5.767 -3.879 1.00 . A A . 6 TRP CB 1 1 13 6778 1 1 6 TRP CD1 C -5.368 -5.881 -6.304 1.00 . A A . 6 TRP CD1 1 1 13 6779 1 1 6 TRP CD2 C -3.527 -4.638 -6.027 1.00 . A A . 6 TRP CD2 1 1 13 6780 1 1 6 TRP CE2 C -3.869 -4.573 -7.412 1.00 . A A . 6 TRP CE2 1 1 13 6781 1 1 6 TRP CE3 C -2.348 -3.973 -5.629 1.00 . A A . 6 TRP CE3 1 1 13 6782 1 1 6 TRP CG C -4.527 -5.447 -5.340 1.00 . A A . 6 TRP CG 1 1 13 6783 1 1 6 TRP CH2 C -1.934 -3.215 -7.917 1.00 . A A . 6 TRP CH2 1 1 13 6784 1 1 6 TRP CZ2 C -3.099 -3.870 -8.350 1.00 . A A . 6 TRP CZ2 1 1 13 6785 1 1 6 TRP CZ3 C -1.561 -3.280 -6.565 1.00 . A A . 6 TRP CZ3 1 1 13 6786 1 1 6 TRP H H -5.926 -7.970 -3.945 1.00 . A A . 6 TRP H 1 1 13 6787 1 1 6 TRP HA H -3.098 -7.217 -3.944 1.00 . A A . 6 TRP HA 1 1 13 6788 1 1 6 TRP HB2 H -5.682 -5.717 -3.585 1.00 . A A . 6 TRP HB2 1 1 13 6789 1 1 6 TRP HB3 H -4.106 -4.994 -3.329 1.00 . A A . 6 TRP HB3 1 1 13 6790 1 1 6 TRP HD1 H -6.212 -6.533 -6.131 1.00 . A A . 6 TRP HD1 1 1 13 6791 1 1 6 TRP HE1 H -5.492 -5.528 -8.389 1.00 . A A . 6 TRP HE1 1 1 13 6792 1 1 6 TRP HE3 H -2.049 -4.009 -4.592 1.00 . A A . 6 TRP HE3 1 1 13 6793 1 1 6 TRP HH2 H -1.327 -2.662 -8.621 1.00 . A A . 6 TRP HH2 1 1 13 6794 1 1 6 TRP HZ2 H -3.392 -3.840 -9.388 1.00 . A A . 6 TRP HZ2 1 1 13 6795 1 1 6 TRP HZ3 H -0.662 -2.786 -6.240 1.00 . A A . 6 TRP HZ3 1 1 13 6796 1 1 6 TRP N N -4.937 -8.188 -3.936 1.00 . A A . 6 TRP N 1 1 13 6797 1 1 6 TRP NE1 N -4.999 -5.353 -7.524 1.00 . A A . 6 TRP NE1 1 1 13 6798 1 1 6 TRP O O -4.803 -7.258 -1.167 1.00 . A A . 6 TRP O 1 1 13 6799 1 1 7 GLU C C -1.268 -6.027 0.281 1.00 . A A . 7 GLU C 1 1 13 6800 1 1 7 GLU CA C -2.121 -7.247 -0.118 1.00 . A A . 7 GLU CA 1 1 13 6801 1 1 7 GLU CB C -1.303 -8.543 0.078 1.00 . A A . 7 GLU CB 1 1 13 6802 1 1 7 GLU CD C 1.000 -9.528 -0.522 1.00 . A A . 7 GLU CD 1 1 13 6803 1 1 7 GLU CG C -0.198 -8.705 -0.984 1.00 . A A . 7 GLU CG 1 1 13 6804 1 1 7 GLU H H -1.837 -7.117 -2.204 1.00 . A A . 7 GLU H 1 1 13 6805 1 1 7 GLU HA H -2.983 -7.287 0.547 1.00 . A A . 7 GLU HA 1 1 13 6806 1 1 7 GLU HB2 H -0.857 -8.527 1.073 1.00 . A A . 7 GLU HB2 1 1 13 6807 1 1 7 GLU HB3 H -1.970 -9.404 0.024 1.00 . A A . 7 GLU HB3 1 1 13 6808 1 1 7 GLU HG2 H -0.633 -9.160 -1.876 1.00 . A A . 7 GLU HG2 1 1 13 6809 1 1 7 GLU HG3 H 0.184 -7.723 -1.259 1.00 . A A . 7 GLU HG3 1 1 13 6810 1 1 7 GLU N N -2.582 -7.157 -1.509 1.00 . A A . 7 GLU N 1 1 13 6811 1 1 7 GLU O O -0.682 -5.363 -0.574 1.00 . A A . 7 GLU O 1 1 13 6812 1 1 7 GLU OE1 O 1.793 -9.010 0.293 1.00 . A A . 7 GLU OE1 1 1 13 6813 1 1 7 GLU OE2 O 1.252 -10.608 -1.101 1.00 . A A . 7 GLU OE2 1 1 13 6814 1 1 8 LYS C C 1.171 -5.381 2.254 1.00 . A A . 8 LYS C 1 1 13 6815 1 1 8 LYS CA C -0.236 -4.776 2.184 1.00 . A A . 8 LYS CA 1 1 13 6816 1 1 8 LYS CB C -0.765 -4.376 3.576 1.00 . A A . 8 LYS CB 1 1 13 6817 1 1 8 LYS CD C 1.391 -3.580 4.793 1.00 . A A . 8 LYS CD 1 1 13 6818 1 1 8 LYS CE C 1.911 -2.598 5.850 1.00 . A A . 8 LYS CE 1 1 13 6819 1 1 8 LYS CG C -0.023 -3.228 4.292 1.00 . A A . 8 LYS CG 1 1 13 6820 1 1 8 LYS H H -1.632 -6.374 2.240 1.00 . A A . 8 LYS H 1 1 13 6821 1 1 8 LYS HA H -0.203 -3.889 1.549 1.00 . A A . 8 LYS HA 1 1 13 6822 1 1 8 LYS HB2 H -1.803 -4.061 3.456 1.00 . A A . 8 LYS HB2 1 1 13 6823 1 1 8 LYS HB3 H -0.771 -5.253 4.227 1.00 . A A . 8 LYS HB3 1 1 13 6824 1 1 8 LYS HD2 H 1.406 -4.592 5.200 1.00 . A A . 8 LYS HD2 1 1 13 6825 1 1 8 LYS HD3 H 2.081 -3.537 3.952 1.00 . A A . 8 LYS HD3 1 1 13 6826 1 1 8 LYS HE2 H 2.989 -2.752 5.957 1.00 . A A . 8 LYS HE2 1 1 13 6827 1 1 8 LYS HE3 H 1.753 -1.578 5.491 1.00 . A A . 8 LYS HE3 1 1 13 6828 1 1 8 LYS HG2 H 0.038 -2.366 3.628 1.00 . A A . 8 LYS HG2 1 1 13 6829 1 1 8 LYS HG3 H -0.634 -2.944 5.151 1.00 . A A . 8 LYS HG3 1 1 13 6830 1 1 8 LYS HZ1 H 1.617 -2.130 7.841 1.00 . A A . 8 LYS HZ1 1 1 13 6831 1 1 8 LYS HZ2 H 0.256 -2.663 7.084 1.00 . A A . 8 LYS HZ2 1 1 13 6832 1 1 8 LYS HZ3 H 1.434 -3.728 7.507 1.00 . A A . 8 LYS HZ3 1 1 13 6833 1 1 8 LYS N N -1.158 -5.760 1.592 1.00 . A A . 8 LYS N 1 1 13 6834 1 1 8 LYS NZ N 1.256 -2.793 7.166 1.00 . A A . 8 LYS NZ 1 1 13 6835 1 1 8 LYS O O 1.385 -6.354 2.974 1.00 . A A . 8 LYS O 1 1 13 6836 1 1 9 ARG C C 4.510 -4.162 1.810 1.00 . A A . 9 ARG C 1 1 13 6837 1 1 9 ARG CA C 3.505 -5.247 1.377 1.00 . A A . 9 ARG CA 1 1 13 6838 1 1 9 ARG CB C 3.582 -5.624 -0.111 1.00 . A A . 9 ARG CB 1 1 13 6839 1 1 9 ARG CD C 5.169 -7.663 -0.007 1.00 . A A . 9 ARG CD 1 1 13 6840 1 1 9 ARG CG C 4.873 -6.279 -0.596 1.00 . A A . 9 ARG CG 1 1 13 6841 1 1 9 ARG CZ C 4.542 -9.453 -1.655 1.00 . A A . 9 ARG CZ 1 1 13 6842 1 1 9 ARG H H 1.940 -3.925 1.024 1.00 . A A . 9 ARG H 1 1 13 6843 1 1 9 ARG HA H 3.663 -6.137 1.990 1.00 . A A . 9 ARG HA 1 1 13 6844 1 1 9 ARG HB2 H 2.758 -6.303 -0.343 1.00 . A A . 9 ARG HB2 1 1 13 6845 1 1 9 ARG HB3 H 3.427 -4.717 -0.701 1.00 . A A . 9 ARG HB3 1 1 13 6846 1 1 9 ARG HD2 H 6.216 -7.907 -0.196 1.00 . A A . 9 ARG HD2 1 1 13 6847 1 1 9 ARG HD3 H 5.033 -7.638 1.073 1.00 . A A . 9 ARG HD3 1 1 13 6848 1 1 9 ARG HE H 3.408 -8.889 -0.113 1.00 . A A . 9 ARG HE 1 1 13 6849 1 1 9 ARG HG2 H 4.783 -6.342 -1.676 1.00 . A A . 9 ARG HG2 1 1 13 6850 1 1 9 ARG HG3 H 5.713 -5.631 -0.374 1.00 . A A . 9 ARG HG3 1 1 13 6851 1 1 9 ARG HH11 H 6.155 -8.440 -2.239 1.00 . A A . 9 ARG HH11 1 1 13 6852 1 1 9 ARG HH12 H 5.670 -9.742 -3.299 1.00 . A A . 9 ARG HH12 1 1 13 6853 1 1 9 ARG HH21 H 2.847 -10.564 -1.470 1.00 . A A . 9 ARG HH21 1 1 13 6854 1 1 9 ARG HH22 H 3.899 -10.985 -2.797 1.00 . A A . 9 ARG HH22 1 1 13 6855 1 1 9 ARG N N 2.134 -4.773 1.556 1.00 . A A . 9 ARG N 1 1 13 6856 1 1 9 ARG NE N 4.310 -8.712 -0.580 1.00 . A A . 9 ARG NE 1 1 13 6857 1 1 9 ARG NH1 N 5.564 -9.223 -2.448 1.00 . A A . 9 ARG NH1 1 1 13 6858 1 1 9 ARG NH2 N 3.744 -10.439 -1.977 1.00 . A A . 9 ARG NH2 1 1 13 6859 1 1 9 ARG O O 4.132 -3.015 2.058 1.00 . A A . 9 ARG O 1 1 13 6860 1 1 10 MET C C 8.229 -3.935 1.771 1.00 . A A . 10 MET C 1 1 13 6861 1 1 10 MET CA C 6.845 -3.566 2.316 1.00 . A A . 10 MET CA 1 1 13 6862 1 1 10 MET CB C 6.877 -3.444 3.850 1.00 . A A . 10 MET CB 1 1 13 6863 1 1 10 MET CE C 7.675 -6.269 6.843 1.00 . A A . 10 MET CE 1 1 13 6864 1 1 10 MET CG C 7.259 -4.737 4.581 1.00 . A A . 10 MET CG 1 1 13 6865 1 1 10 MET H H 6.101 -5.442 1.684 1.00 . A A . 10 MET H 1 1 13 6866 1 1 10 MET HA H 6.586 -2.590 1.912 1.00 . A A . 10 MET HA 1 1 13 6867 1 1 10 MET HB2 H 7.587 -2.663 4.129 1.00 . A A . 10 MET HB2 1 1 13 6868 1 1 10 MET HB3 H 5.892 -3.138 4.198 1.00 . A A . 10 MET HB3 1 1 13 6869 1 1 10 MET HE1 H 8.700 -6.411 6.498 1.00 . A A . 10 MET HE1 1 1 13 6870 1 1 10 MET HE2 H 7.643 -6.374 7.928 1.00 . A A . 10 MET HE2 1 1 13 6871 1 1 10 MET HE3 H 7.030 -7.020 6.388 1.00 . A A . 10 MET HE3 1 1 13 6872 1 1 10 MET HG2 H 6.615 -5.546 4.239 1.00 . A A . 10 MET HG2 1 1 13 6873 1 1 10 MET HG3 H 8.291 -4.991 4.341 1.00 . A A . 10 MET HG3 1 1 13 6874 1 1 10 MET N N 5.801 -4.502 1.895 1.00 . A A . 10 MET N 1 1 13 6875 1 1 10 MET O O 8.598 -5.105 1.690 1.00 . A A . 10 MET O 1 1 13 6876 1 1 10 MET SD S 7.103 -4.613 6.382 1.00 . A A . 10 MET SD 1 1 13 6877 1 1 11 PHE C C 11.247 -3.035 2.260 1.00 . A A . 11 PHE C 1 1 13 6878 1 1 11 PHE CA C 10.380 -2.944 0.997 1.00 . A A . 11 PHE CA 1 1 13 6879 1 1 11 PHE CB C 10.712 -1.671 0.209 1.00 . A A . 11 PHE CB 1 1 13 6880 1 1 11 PHE CD1 C 10.511 -2.387 -2.207 1.00 . A A . 11 PHE CD1 1 1 13 6881 1 1 11 PHE CD2 C 9.023 -0.634 -1.392 1.00 . A A . 11 PHE CD2 1 1 13 6882 1 1 11 PHE CE1 C 9.942 -2.284 -3.487 1.00 . A A . 11 PHE CE1 1 1 13 6883 1 1 11 PHE CE2 C 8.467 -0.527 -2.680 1.00 . A A . 11 PHE CE2 1 1 13 6884 1 1 11 PHE CG C 10.049 -1.572 -1.152 1.00 . A A . 11 PHE CG 1 1 13 6885 1 1 11 PHE CZ C 8.920 -1.350 -3.724 1.00 . A A . 11 PHE CZ 1 1 13 6886 1 1 11 PHE H H 8.571 -1.975 1.454 1.00 . A A . 11 PHE H 1 1 13 6887 1 1 11 PHE HA H 10.570 -3.803 0.357 1.00 . A A . 11 PHE HA 1 1 13 6888 1 1 11 PHE HB2 H 10.460 -0.795 0.807 1.00 . A A . 11 PHE HB2 1 1 13 6889 1 1 11 PHE HB3 H 11.783 -1.654 0.041 1.00 . A A . 11 PHE HB3 1 1 13 6890 1 1 11 PHE HD1 H 11.332 -3.069 -2.053 1.00 . A A . 11 PHE HD1 1 1 13 6891 1 1 11 PHE HD2 H 8.646 -0.001 -0.598 1.00 . A A . 11 PHE HD2 1 1 13 6892 1 1 11 PHE HE1 H 10.300 -2.905 -4.296 1.00 . A A . 11 PHE HE1 1 1 13 6893 1 1 11 PHE HE2 H 7.673 0.175 -2.877 1.00 . A A . 11 PHE HE2 1 1 13 6894 1 1 11 PHE HZ H 8.484 -1.262 -4.709 1.00 . A A . 11 PHE HZ 1 1 13 6895 1 1 11 PHE N N 8.973 -2.904 1.369 1.00 . A A . 11 PHE N 1 1 13 6896 1 1 11 PHE O O 11.036 -2.271 3.204 1.00 . A A . 11 PHE O 1 1 13 6897 1 1 12 ALA C C 13.912 -2.983 3.898 1.00 . A A . 12 ALA C 1 1 13 6898 1 1 12 ALA CA C 13.091 -4.204 3.436 1.00 . A A . 12 ALA CA 1 1 13 6899 1 1 12 ALA CB C 14.004 -5.389 3.106 1.00 . A A . 12 ALA CB 1 1 13 6900 1 1 12 ALA H H 12.372 -4.540 1.473 1.00 . A A . 12 ALA H 1 1 13 6901 1 1 12 ALA HA H 12.450 -4.493 4.273 1.00 . A A . 12 ALA HA 1 1 13 6902 1 1 12 ALA HB1 H 13.403 -6.262 2.847 1.00 . A A . 12 ALA HB1 1 1 13 6903 1 1 12 ALA HB2 H 14.659 -5.138 2.270 1.00 . A A . 12 ALA HB2 1 1 13 6904 1 1 12 ALA HB3 H 14.616 -5.631 3.976 1.00 . A A . 12 ALA HB3 1 1 13 6905 1 1 12 ALA N N 12.234 -3.941 2.273 1.00 . A A . 12 ALA N 1 1 13 6906 1 1 12 ALA O O 14.188 -2.841 5.085 1.00 . A A . 12 ALA O 1 1 13 6907 1 1 13 ASN C C 13.840 0.266 3.848 1.00 . A A . 13 ASN C 1 1 13 6908 1 1 13 ASN CA C 14.838 -0.756 3.247 1.00 . A A . 13 ASN CA 1 1 13 6909 1 1 13 ASN CB C 15.544 -0.248 1.968 1.00 . A A . 13 ASN CB 1 1 13 6910 1 1 13 ASN CG C 14.666 -0.273 0.722 1.00 . A A . 13 ASN CG 1 1 13 6911 1 1 13 ASN H H 14.022 -2.244 2.004 1.00 . A A . 13 ASN H 1 1 13 6912 1 1 13 ASN HA H 15.607 -0.890 4.010 1.00 . A A . 13 ASN HA 1 1 13 6913 1 1 13 ASN HB2 H 15.920 0.762 2.139 1.00 . A A . 13 ASN HB2 1 1 13 6914 1 1 13 ASN HB3 H 16.406 -0.885 1.769 1.00 . A A . 13 ASN HB3 1 1 13 6915 1 1 13 ASN HD21 H 14.819 1.754 0.482 1.00 . A A . 13 ASN HD21 1 1 13 6916 1 1 13 ASN N N 14.247 -2.071 2.979 1.00 . A A . 13 ASN N 1 1 13 6917 1 1 13 ASN ND2 N 14.417 0.886 0.121 1.00 . A A . 13 ASN ND2 1 1 13 6918 1 1 13 ASN O O 14.193 1.432 4.008 1.00 . A A . 13 ASN O 1 1 13 6919 1 1 13 ASN OD1 O 14.179 -1.338 0.349 1.00 . A A . 13 ASN OD1 1 1 13 6920 1 1 14 GLY C C 10.662 1.448 4.097 1.00 . A A . 14 GLY C 1 1 13 6921 1 1 14 GLY CA C 11.632 0.627 4.942 1.00 . A A . 14 GLY CA 1 1 13 6922 1 1 14 GLY H H 12.330 -1.101 3.957 1.00 . A A . 14 GLY H 1 1 13 6923 1 1 14 GLY HA2 H 11.049 -0.062 5.552 1.00 . A A . 14 GLY HA2 1 1 13 6924 1 1 14 GLY HA3 H 12.158 1.305 5.615 1.00 . A A . 14 GLY HA3 1 1 13 6925 1 1 14 GLY N N 12.608 -0.149 4.176 1.00 . A A . 14 GLY N 1 1 13 6926 1 1 14 GLY O O 10.678 2.678 4.160 1.00 . A A . 14 GLY O 1 1 13 6927 1 1 15 THR C C 7.521 0.612 2.341 1.00 . A A . 15 THR C 1 1 13 6928 1 1 15 THR CA C 8.694 1.544 2.623 1.00 . A A . 15 THR CA 1 1 13 6929 1 1 15 THR CB C 9.208 2.227 1.346 1.00 . A A . 15 THR CB 1 1 13 6930 1 1 15 THR CG2 C 8.141 2.953 0.534 1.00 . A A . 15 THR CG2 1 1 13 6931 1 1 15 THR H H 9.828 -0.192 3.180 1.00 . A A . 15 THR H 1 1 13 6932 1 1 15 THR HA H 8.327 2.326 3.279 1.00 . A A . 15 THR HA 1 1 13 6933 1 1 15 THR HB H 9.714 1.498 0.716 1.00 . A A . 15 THR HB 1 1 13 6934 1 1 15 THR HG1 H 10.331 3.112 2.670 1.00 . A A . 15 THR HG1 1 1 13 6935 1 1 15 THR HG21 H 7.659 3.708 1.156 1.00 . A A . 15 THR HG21 1 1 13 6936 1 1 15 THR HG22 H 8.622 3.449 -0.310 1.00 . A A . 15 THR HG22 1 1 13 6937 1 1 15 THR HG23 H 7.399 2.249 0.163 1.00 . A A . 15 THR HG23 1 1 13 6938 1 1 15 THR N N 9.794 0.819 3.293 1.00 . A A . 15 THR N 1 1 13 6939 1 1 15 THR O O 7.723 -0.470 1.800 1.00 . A A . 15 THR O 1 1 13 6940 1 1 15 THR OG1 O 10.116 3.238 1.712 1.00 . A A . 15 THR OG1 1 1 13 6941 1 1 16 VAL C C 4.402 0.540 1.201 1.00 . A A . 16 VAL C 1 1 13 6942 1 1 16 VAL CA C 5.080 0.219 2.528 1.00 . A A . 16 VAL CA 1 1 13 6943 1 1 16 VAL CB C 4.122 0.456 3.722 1.00 . A A . 16 VAL CB 1 1 13 6944 1 1 16 VAL CG1 C 2.638 0.146 3.456 1.00 . A A . 16 VAL CG1 1 1 13 6945 1 1 16 VAL CG2 C 4.556 -0.443 4.886 1.00 . A A . 16 VAL CG2 1 1 13 6946 1 1 16 VAL H H 6.169 1.963 3.049 1.00 . A A . 16 VAL H 1 1 13 6947 1 1 16 VAL HA H 5.348 -0.836 2.515 1.00 . A A . 16 VAL HA 1 1 13 6948 1 1 16 VAL HB H 4.192 1.499 4.034 1.00 . A A . 16 VAL HB 1 1 13 6949 1 1 16 VAL HG11 H 2.240 0.824 2.700 1.00 . A A . 16 VAL HG11 1 1 13 6950 1 1 16 VAL HG12 H 2.517 -0.883 3.114 1.00 . A A . 16 VAL HG12 1 1 13 6951 1 1 16 VAL HG13 H 2.059 0.299 4.365 1.00 . A A . 16 VAL HG13 1 1 13 6952 1 1 16 VAL HG21 H 4.388 -1.486 4.614 1.00 . A A . 16 VAL HG21 1 1 13 6953 1 1 16 VAL HG22 H 5.614 -0.291 5.103 1.00 . A A . 16 VAL HG22 1 1 13 6954 1 1 16 VAL HG23 H 3.977 -0.200 5.776 1.00 . A A . 16 VAL HG23 1 1 13 6955 1 1 16 VAL N N 6.298 1.032 2.679 1.00 . A A . 16 VAL N 1 1 13 6956 1 1 16 VAL O O 4.383 1.683 0.750 1.00 . A A . 16 VAL O 1 1 13 6957 1 1 17 TYR C C 2.013 -1.545 -0.653 1.00 . A A . 17 TYR C 1 1 13 6958 1 1 17 TYR CA C 3.072 -0.438 -0.645 1.00 . A A . 17 TYR CA 1 1 13 6959 1 1 17 TYR CB C 4.033 -0.534 -1.842 1.00 . A A . 17 TYR CB 1 1 13 6960 1 1 17 TYR CD1 C 6.002 -1.962 -1.229 1.00 . A A . 17 TYR CD1 1 1 13 6961 1 1 17 TYR CD2 C 4.412 -2.844 -2.853 1.00 . A A . 17 TYR CD2 1 1 13 6962 1 1 17 TYR CE1 C 6.829 -3.079 -1.420 1.00 . A A . 17 TYR CE1 1 1 13 6963 1 1 17 TYR CE2 C 5.243 -3.959 -3.053 1.00 . A A . 17 TYR CE2 1 1 13 6964 1 1 17 TYR CG C 4.813 -1.826 -1.964 1.00 . A A . 17 TYR CG 1 1 13 6965 1 1 17 TYR CZ C 6.470 -4.064 -2.364 1.00 . A A . 17 TYR CZ 1 1 13 6966 1 1 17 TYR H H 3.880 -1.424 1.026 1.00 . A A . 17 TYR H 1 1 13 6967 1 1 17 TYR HA H 2.552 0.520 -0.697 1.00 . A A . 17 TYR HA 1 1 13 6968 1 1 17 TYR HB2 H 3.488 -0.367 -2.767 1.00 . A A . 17 TYR HB2 1 1 13 6969 1 1 17 TYR HB3 H 4.762 0.276 -1.760 1.00 . A A . 17 TYR HB3 1 1 13 6970 1 1 17 TYR HD1 H 6.295 -1.171 -0.550 1.00 . A A . 17 TYR HD1 1 1 13 6971 1 1 17 TYR HD2 H 3.484 -2.777 -3.403 1.00 . A A . 17 TYR HD2 1 1 13 6972 1 1 17 TYR HE1 H 7.752 -3.146 -0.870 1.00 . A A . 17 TYR HE1 1 1 13 6973 1 1 17 TYR HE2 H 4.957 -4.737 -3.738 1.00 . A A . 17 TYR HE2 1 1 13 6974 1 1 17 TYR HH H 8.148 -4.998 -2.192 1.00 . A A . 17 TYR HH 1 1 13 6975 1 1 17 TYR N N 3.842 -0.502 0.590 1.00 . A A . 17 TYR N 1 1 13 6976 1 1 17 TYR O O 1.876 -2.303 0.307 1.00 . A A . 17 TYR O 1 1 13 6977 1 1 17 TYR OH O 7.280 -5.138 -2.576 1.00 . A A . 17 TYR OH 1 1 13 6978 1 1 18 TYR C C 0.563 -3.452 -3.212 1.00 . A A . 18 TYR C 1 1 13 6979 1 1 18 TYR CA C 0.234 -2.659 -1.951 1.00 . A A . 18 TYR CA 1 1 13 6980 1 1 18 TYR CB C -1.149 -1.997 -1.955 1.00 . A A . 18 TYR CB 1 1 13 6981 1 1 18 TYR CD1 C -1.972 -1.945 0.440 1.00 . A A . 18 TYR CD1 1 1 13 6982 1 1 18 TYR CD2 C -0.875 0.029 -0.474 1.00 . A A . 18 TYR CD2 1 1 13 6983 1 1 18 TYR CE1 C -2.013 -1.337 1.706 1.00 . A A . 18 TYR CE1 1 1 13 6984 1 1 18 TYR CE2 C -0.862 0.621 0.797 1.00 . A A . 18 TYR CE2 1 1 13 6985 1 1 18 TYR CG C -1.390 -1.269 -0.647 1.00 . A A . 18 TYR CG 1 1 13 6986 1 1 18 TYR CZ C -1.431 -0.062 1.895 1.00 . A A . 18 TYR CZ 1 1 13 6987 1 1 18 TYR H H 1.357 -0.952 -2.476 1.00 . A A . 18 TYR H 1 1 13 6988 1 1 18 TYR HA H 0.262 -3.341 -1.108 1.00 . A A . 18 TYR HA 1 1 13 6989 1 1 18 TYR HB2 H -1.217 -1.291 -2.782 1.00 . A A . 18 TYR HB2 1 1 13 6990 1 1 18 TYR HB3 H -1.914 -2.763 -2.092 1.00 . A A . 18 TYR HB3 1 1 13 6991 1 1 18 TYR HD1 H -2.361 -2.945 0.310 1.00 . A A . 18 TYR HD1 1 1 13 6992 1 1 18 TYR HD2 H -0.436 0.558 -1.309 1.00 . A A . 18 TYR HD2 1 1 13 6993 1 1 18 TYR HE1 H -2.481 -1.866 2.520 1.00 . A A . 18 TYR HE1 1 1 13 6994 1 1 18 TYR HE2 H -0.424 1.603 0.911 1.00 . A A . 18 TYR HE2 1 1 13 6995 1 1 18 TYR HH H -1.878 -0.032 3.782 1.00 . A A . 18 TYR HH 1 1 13 6996 1 1 18 TYR N N 1.264 -1.649 -1.744 1.00 . A A . 18 TYR N 1 1 13 6997 1 1 18 TYR O O 0.887 -2.868 -4.245 1.00 . A A . 18 TYR O 1 1 13 6998 1 1 18 TYR OH O -1.447 0.517 3.126 1.00 . A A . 18 TYR OH 1 1 13 6999 1 1 19 PHE C C -0.077 -6.716 -4.515 1.00 . A A . 19 PHE C 1 1 13 7000 1 1 19 PHE CA C 1.012 -5.722 -4.117 1.00 . A A . 19 PHE CA 1 1 13 7001 1 1 19 PHE CB C 2.212 -6.462 -3.518 1.00 . A A . 19 PHE CB 1 1 13 7002 1 1 19 PHE CD1 C 3.875 -7.063 -5.320 1.00 . A A . 19 PHE CD1 1 1 13 7003 1 1 19 PHE CD2 C 2.509 -8.838 -4.366 1.00 . A A . 19 PHE CD2 1 1 13 7004 1 1 19 PHE CE1 C 4.562 -8.006 -6.098 1.00 . A A . 19 PHE CE1 1 1 13 7005 1 1 19 PHE CE2 C 3.197 -9.784 -5.148 1.00 . A A . 19 PHE CE2 1 1 13 7006 1 1 19 PHE CG C 2.869 -7.477 -4.429 1.00 . A A . 19 PHE CG 1 1 13 7007 1 1 19 PHE CZ C 4.236 -9.371 -5.998 1.00 . A A . 19 PHE CZ 1 1 13 7008 1 1 19 PHE H H 0.231 -5.182 -2.218 1.00 . A A . 19 PHE H 1 1 13 7009 1 1 19 PHE HA H 1.338 -5.184 -5.006 1.00 . A A . 19 PHE HA 1 1 13 7010 1 1 19 PHE HB2 H 2.957 -5.724 -3.227 1.00 . A A . 19 PHE HB2 1 1 13 7011 1 1 19 PHE HB3 H 1.899 -6.971 -2.607 1.00 . A A . 19 PHE HB3 1 1 13 7012 1 1 19 PHE HD1 H 4.133 -6.019 -5.407 1.00 . A A . 19 PHE HD1 1 1 13 7013 1 1 19 PHE HD2 H 1.722 -9.168 -3.699 1.00 . A A . 19 PHE HD2 1 1 13 7014 1 1 19 PHE HE1 H 5.338 -7.667 -6.767 1.00 . A A . 19 PHE HE1 1 1 13 7015 1 1 19 PHE HE2 H 2.936 -10.829 -5.093 1.00 . A A . 19 PHE HE2 1 1 13 7016 1 1 19 PHE HZ H 4.769 -10.102 -6.590 1.00 . A A . 19 PHE HZ 1 1 13 7017 1 1 19 PHE N N 0.530 -4.781 -3.105 1.00 . A A . 19 PHE N 1 1 13 7018 1 1 19 PHE O O -0.796 -7.207 -3.653 1.00 . A A . 19 PHE O 1 1 13 7019 1 1 20 ASN C C -0.471 -9.408 -6.482 1.00 . A A . 20 ASN C 1 1 13 7020 1 1 20 ASN CA C -1.132 -8.036 -6.298 1.00 . A A . 20 ASN CA 1 1 13 7021 1 1 20 ASN CB C -1.752 -7.540 -7.601 1.00 . A A . 20 ASN CB 1 1 13 7022 1 1 20 ASN CG C -2.843 -8.498 -8.040 1.00 . A A . 20 ASN CG 1 1 13 7023 1 1 20 ASN H H 0.443 -6.618 -6.478 1.00 . A A . 20 ASN H 1 1 13 7024 1 1 20 ASN HA H -1.940 -8.144 -5.577 1.00 . A A . 20 ASN HA 1 1 13 7025 1 1 20 ASN HB2 H -2.161 -6.546 -7.465 1.00 . A A . 20 ASN HB2 1 1 13 7026 1 1 20 ASN HB3 H -0.982 -7.484 -8.367 1.00 . A A . 20 ASN HB3 1 1 13 7027 1 1 20 ASN HD21 H -4.238 -7.539 -6.940 1.00 . A A . 20 ASN HD21 1 1 13 7028 1 1 20 ASN HD22 H -4.805 -8.963 -7.752 1.00 . A A . 20 ASN HD22 1 1 13 7029 1 1 20 ASN N N -0.184 -7.048 -5.802 1.00 . A A . 20 ASN N 1 1 13 7030 1 1 20 ASN ND2 N -4.047 -8.329 -7.539 1.00 . A A . 20 ASN ND2 1 1 13 7031 1 1 20 ASN O O 0.242 -9.636 -7.463 1.00 . A A . 20 ASN O 1 1 13 7032 1 1 20 ASN OD1 O -2.585 -9.431 -8.789 1.00 . A A . 20 ASN OD1 1 1 13 7033 1 1 21 HIS C C -0.583 -12.586 -6.766 1.00 . A A . 21 HIS C 1 1 13 7034 1 1 21 HIS CA C -0.105 -11.673 -5.618 1.00 . A A . 21 HIS CA 1 1 13 7035 1 1 21 HIS CB C -0.153 -12.344 -4.231 1.00 . A A . 21 HIS CB 1 1 13 7036 1 1 21 HIS CD2 C -2.679 -12.831 -4.267 1.00 . A A . 21 HIS CD2 1 1 13 7037 1 1 21 HIS CE1 C -2.705 -14.622 -2.982 1.00 . A A . 21 HIS CE1 1 1 13 7038 1 1 21 HIS CG C -1.402 -13.116 -3.877 1.00 . A A . 21 HIS CG 1 1 13 7039 1 1 21 HIS H H -1.381 -10.138 -4.807 1.00 . A A . 21 HIS H 1 1 13 7040 1 1 21 HIS HA H 0.948 -11.503 -5.834 1.00 . A A . 21 HIS HA 1 1 13 7041 1 1 21 HIS HB2 H 0.686 -13.039 -4.174 1.00 . A A . 21 HIS HB2 1 1 13 7042 1 1 21 HIS HB3 H 0.016 -11.590 -3.461 1.00 . A A . 21 HIS HB3 1 1 13 7043 1 1 21 HIS HD2 H -2.981 -12.017 -4.905 1.00 . A A . 21 HIS HD2 1 1 13 7044 1 1 21 HIS HE1 H -3.053 -15.477 -2.419 1.00 . A A . 21 HIS HE1 1 1 13 7045 1 1 21 HIS HE2 H -4.486 -13.875 -3.790 1.00 . A A . 21 HIS HE2 1 1 13 7046 1 1 21 HIS N N -0.738 -10.348 -5.570 1.00 . A A . 21 HIS N 1 1 13 7047 1 1 21 HIS ND1 N -1.422 -14.249 -3.066 1.00 . A A . 21 HIS ND1 1 1 13 7048 1 1 21 HIS NE2 N -3.485 -13.790 -3.694 1.00 . A A . 21 HIS NE2 1 1 13 7049 1 1 21 HIS O O -0.040 -13.676 -6.924 1.00 . A A . 21 HIS O 1 1 13 7050 1 1 22 ILE C C -1.207 -12.431 -10.045 1.00 . A A . 22 ILE C 1 1 13 7051 1 1 22 ILE CA C -1.995 -12.872 -8.795 1.00 . A A . 22 ILE CA 1 1 13 7052 1 1 22 ILE CB C -3.517 -12.661 -9.030 1.00 . A A . 22 ILE CB 1 1 13 7053 1 1 22 ILE CD1 C -4.366 -14.100 -7.028 1.00 . A A . 22 ILE CD1 1 1 13 7054 1 1 22 ILE CG1 C -4.388 -12.751 -7.757 1.00 . A A . 22 ILE CG1 1 1 13 7055 1 1 22 ILE CG2 C -4.067 -13.629 -10.095 1.00 . A A . 22 ILE CG2 1 1 13 7056 1 1 22 ILE H H -1.942 -11.224 -7.450 1.00 . A A . 22 ILE H 1 1 13 7057 1 1 22 ILE HA H -1.817 -13.939 -8.651 1.00 . A A . 22 ILE HA 1 1 13 7058 1 1 22 ILE HB H -3.659 -11.654 -9.420 1.00 . A A . 22 ILE HB 1 1 13 7059 1 1 22 ILE HD11 H -3.350 -14.352 -6.726 1.00 . A A . 22 ILE HD11 1 1 13 7060 1 1 22 ILE HD12 H -4.996 -14.030 -6.140 1.00 . A A . 22 ILE HD12 1 1 13 7061 1 1 22 ILE HD13 H -4.761 -14.886 -7.670 1.00 . A A . 22 ILE HD13 1 1 13 7062 1 1 22 ILE HG12 H -4.071 -11.977 -7.062 1.00 . A A . 22 ILE HG12 1 1 13 7063 1 1 22 ILE HG13 H -5.422 -12.526 -8.024 1.00 . A A . 22 ILE HG13 1 1 13 7064 1 1 22 ILE HG21 H -5.149 -13.524 -10.176 1.00 . A A . 22 ILE HG21 1 1 13 7065 1 1 22 ILE HG22 H -3.638 -13.401 -11.071 1.00 . A A . 22 ILE HG22 1 1 13 7066 1 1 22 ILE HG23 H -3.823 -14.659 -9.838 1.00 . A A . 22 ILE HG23 1 1 13 7067 1 1 22 ILE N N -1.548 -12.146 -7.592 1.00 . A A . 22 ILE N 1 1 13 7068 1 1 22 ILE O O -1.108 -13.191 -11.006 1.00 . A A . 22 ILE O 1 1 13 7069 1 1 23 THR C C 1.325 -9.943 -11.031 1.00 . A A . 23 THR C 1 1 13 7070 1 1 23 THR CA C -0.049 -10.577 -11.236 1.00 . A A . 23 THR CA 1 1 13 7071 1 1 23 THR CB C -0.968 -9.458 -11.755 1.00 . A A . 23 THR CB 1 1 13 7072 1 1 23 THR CG2 C -2.352 -9.945 -12.189 1.00 . A A . 23 THR CG2 1 1 13 7073 1 1 23 THR H H -0.775 -10.641 -9.218 1.00 . A A . 23 THR H 1 1 13 7074 1 1 23 THR HA H 0.063 -11.315 -12.031 1.00 . A A . 23 THR HA 1 1 13 7075 1 1 23 THR HB H -0.496 -8.984 -12.617 1.00 . A A . 23 THR HB 1 1 13 7076 1 1 23 THR HG1 H -1.730 -8.883 -10.071 1.00 . A A . 23 THR HG1 1 1 13 7077 1 1 23 THR HG21 H -2.903 -10.355 -11.344 1.00 . A A . 23 THR HG21 1 1 13 7078 1 1 23 THR HG22 H -2.912 -9.109 -12.607 1.00 . A A . 23 THR HG22 1 1 13 7079 1 1 23 THR HG23 H -2.243 -10.715 -12.953 1.00 . A A . 23 THR HG23 1 1 13 7080 1 1 23 THR N N -0.640 -11.215 -10.042 1.00 . A A . 23 THR N 1 1 13 7081 1 1 23 THR O O 1.947 -9.553 -12.017 1.00 . A A . 23 THR O 1 1 13 7082 1 1 23 THR OG1 O -1.123 -8.491 -10.738 1.00 . A A . 23 THR OG1 1 1 13 7083 1 1 24 ASN C C 2.821 -7.506 -9.663 1.00 . A A . 24 ASN C 1 1 13 7084 1 1 24 ASN CA C 2.984 -9.029 -9.420 1.00 . A A . 24 ASN CA 1 1 13 7085 1 1 24 ASN CB C 4.235 -9.677 -10.068 1.00 . A A . 24 ASN CB 1 1 13 7086 1 1 24 ASN CG C 5.547 -9.452 -9.327 1.00 . A A . 24 ASN CG 1 1 13 7087 1 1 24 ASN H H 1.211 -10.089 -9.003 1.00 . A A . 24 ASN H 1 1 13 7088 1 1 24 ASN HA H 3.083 -9.140 -8.341 1.00 . A A . 24 ASN HA 1 1 13 7089 1 1 24 ASN HB2 H 4.087 -10.756 -10.125 1.00 . A A . 24 ASN HB2 1 1 13 7090 1 1 24 ASN HB3 H 4.348 -9.303 -11.085 1.00 . A A . 24 ASN HB3 1 1 13 7091 1 1 24 ASN HD21 H 5.465 -7.462 -9.612 1.00 . A A . 24 ASN HD21 1 1 13 7092 1 1 24 ASN HD22 H 6.939 -8.104 -8.850 1.00 . A A . 24 ASN HD22 1 1 13 7093 1 1 24 ASN N N 1.793 -9.800 -9.785 1.00 . A A . 24 ASN N 1 1 13 7094 1 1 24 ASN ND2 N 6.048 -8.238 -9.290 1.00 . A A . 24 ASN ND2 1 1 13 7095 1 1 24 ASN O O 3.813 -6.776 -9.628 1.00 . A A . 24 ASN O 1 1 13 7096 1 1 24 ASN OD1 O 6.133 -10.369 -8.774 1.00 . A A . 24 ASN OD1 1 1 13 7097 1 1 25 ALA C C 1.611 -4.924 -8.523 1.00 . A A . 25 ALA C 1 1 13 7098 1 1 25 ALA CA C 1.377 -5.544 -9.920 1.00 . A A . 25 ALA CA 1 1 13 7099 1 1 25 ALA CB C -0.037 -5.254 -10.439 1.00 . A A . 25 ALA CB 1 1 13 7100 1 1 25 ALA H H 0.782 -7.593 -9.992 1.00 . A A . 25 ALA H 1 1 13 7101 1 1 25 ALA HA H 2.091 -5.096 -10.614 1.00 . A A . 25 ALA HA 1 1 13 7102 1 1 25 ALA HB1 H -0.782 -5.634 -9.742 1.00 . A A . 25 ALA HB1 1 1 13 7103 1 1 25 ALA HB2 H -0.175 -4.178 -10.552 1.00 . A A . 25 ALA HB2 1 1 13 7104 1 1 25 ALA HB3 H -0.178 -5.730 -11.411 1.00 . A A . 25 ALA HB3 1 1 13 7105 1 1 25 ALA N N 1.598 -6.994 -9.903 1.00 . A A . 25 ALA N 1 1 13 7106 1 1 25 ALA O O 1.489 -5.604 -7.503 1.00 . A A . 25 ALA O 1 1 13 7107 1 1 26 SER C C 1.817 -1.425 -7.293 1.00 . A A . 26 SER C 1 1 13 7108 1 1 26 SER CA C 2.194 -2.908 -7.208 1.00 . A A . 26 SER CA 1 1 13 7109 1 1 26 SER CB C 3.683 -3.010 -6.857 1.00 . A A . 26 SER CB 1 1 13 7110 1 1 26 SER H H 2.016 -3.082 -9.312 1.00 . A A . 26 SER H 1 1 13 7111 1 1 26 SER HA H 1.626 -3.373 -6.409 1.00 . A A . 26 SER HA 1 1 13 7112 1 1 26 SER HB2 H 3.865 -2.510 -5.906 1.00 . A A . 26 SER HB2 1 1 13 7113 1 1 26 SER HB3 H 3.965 -4.055 -6.739 1.00 . A A . 26 SER HB3 1 1 13 7114 1 1 26 SER HG H 3.988 -1.635 -8.205 1.00 . A A . 26 SER HG 1 1 13 7115 1 1 26 SER N N 1.918 -3.621 -8.463 1.00 . A A . 26 SER N 1 1 13 7116 1 1 26 SER O O 2.143 -0.785 -8.293 1.00 . A A . 26 SER O 1 1 13 7117 1 1 26 SER OG O 4.471 -2.404 -7.867 1.00 . A A . 26 SER OG 1 1 13 7118 1 1 27 GLN C C 1.287 1.057 -4.681 1.00 . A A . 27 GLN C 1 1 13 7119 1 1 27 GLN CA C 0.912 0.554 -6.081 1.00 . A A . 27 GLN CA 1 1 13 7120 1 1 27 GLN CB C -0.589 0.788 -6.356 1.00 . A A . 27 GLN CB 1 1 13 7121 1 1 27 GLN CD C -2.998 0.503 -5.534 1.00 . A A . 27 GLN CD 1 1 13 7122 1 1 27 GLN CG C -1.522 0.237 -5.257 1.00 . A A . 27 GLN CG 1 1 13 7123 1 1 27 GLN H H 1.060 -1.453 -5.403 1.00 . A A . 27 GLN H 1 1 13 7124 1 1 27 GLN HA H 1.487 1.123 -6.813 1.00 . A A . 27 GLN HA 1 1 13 7125 1 1 27 GLN HB2 H -0.760 1.861 -6.444 1.00 . A A . 27 GLN HB2 1 1 13 7126 1 1 27 GLN HB3 H -0.847 0.329 -7.313 1.00 . A A . 27 GLN HB3 1 1 13 7127 1 1 27 GLN HE21 H -3.364 1.203 -3.628 1.00 . A A . 27 GLN HE21 1 1 13 7128 1 1 27 GLN HE22 H -4.704 1.139 -4.791 1.00 . A A . 27 GLN HE22 1 1 13 7129 1 1 27 GLN HG2 H -1.382 -0.837 -5.156 1.00 . A A . 27 GLN HG2 1 1 13 7130 1 1 27 GLN HG3 H -1.274 0.701 -4.303 1.00 . A A . 27 GLN HG3 1 1 13 7131 1 1 27 GLN N N 1.236 -0.871 -6.223 1.00 . A A . 27 GLN N 1 1 13 7132 1 1 27 GLN NE2 N -3.742 0.982 -4.556 1.00 . A A . 27 GLN NE2 1 1 13 7133 1 1 27 GLN O O 1.274 0.282 -3.729 1.00 . A A . 27 GLN O 1 1 13 7134 1 1 27 GLN OE1 O -3.504 0.295 -6.625 1.00 . A A . 27 GLN OE1 1 1 13 7135 1 1 28 PHE C C 0.408 3.411 -2.528 1.00 . A A . 28 PHE C 1 1 13 7136 1 1 28 PHE CA C 1.720 2.950 -3.186 1.00 . A A . 28 PHE CA 1 1 13 7137 1 1 28 PHE CB C 2.731 4.101 -3.270 1.00 . A A . 28 PHE CB 1 1 13 7138 1 1 28 PHE CD1 C 4.899 2.989 -2.585 1.00 . A A . 28 PHE CD1 1 1 13 7139 1 1 28 PHE CD2 C 4.702 3.849 -4.855 1.00 . A A . 28 PHE CD2 1 1 13 7140 1 1 28 PHE CE1 C 6.208 2.563 -2.861 1.00 . A A . 28 PHE CE1 1 1 13 7141 1 1 28 PHE CE2 C 6.010 3.412 -5.132 1.00 . A A . 28 PHE CE2 1 1 13 7142 1 1 28 PHE CG C 4.142 3.640 -3.579 1.00 . A A . 28 PHE CG 1 1 13 7143 1 1 28 PHE CZ C 6.764 2.769 -4.134 1.00 . A A . 28 PHE CZ 1 1 13 7144 1 1 28 PHE H H 1.574 2.977 -5.316 1.00 . A A . 28 PHE H 1 1 13 7145 1 1 28 PHE HA H 2.149 2.201 -2.518 1.00 . A A . 28 PHE HA 1 1 13 7146 1 1 28 PHE HB2 H 2.403 4.821 -4.021 1.00 . A A . 28 PHE HB2 1 1 13 7147 1 1 28 PHE HB3 H 2.757 4.617 -2.309 1.00 . A A . 28 PHE HB3 1 1 13 7148 1 1 28 PHE HD1 H 4.484 2.803 -1.603 1.00 . A A . 28 PHE HD1 1 1 13 7149 1 1 28 PHE HD2 H 4.133 4.347 -5.626 1.00 . A A . 28 PHE HD2 1 1 13 7150 1 1 28 PHE HE1 H 6.774 2.073 -2.085 1.00 . A A . 28 PHE HE1 1 1 13 7151 1 1 28 PHE HE2 H 6.437 3.574 -6.111 1.00 . A A . 28 PHE HE2 1 1 13 7152 1 1 28 PHE HZ H 7.770 2.434 -4.348 1.00 . A A . 28 PHE HZ 1 1 13 7153 1 1 28 PHE N N 1.531 2.361 -4.519 1.00 . A A . 28 PHE N 1 1 13 7154 1 1 28 PHE O O 0.385 3.601 -1.314 1.00 . A A . 28 PHE O 1 1 13 7155 1 1 29 GLU C C -2.598 3.055 -1.790 1.00 . A A . 29 GLU C 1 1 13 7156 1 1 29 GLU CA C -1.948 4.076 -2.739 1.00 . A A . 29 GLU CA 1 1 13 7157 1 1 29 GLU CB C -2.927 4.511 -3.852 1.00 . A A . 29 GLU CB 1 1 13 7158 1 1 29 GLU CD C -4.234 6.170 -2.378 1.00 . A A . 29 GLU CD 1 1 13 7159 1 1 29 GLU CG C -3.437 5.954 -3.674 1.00 . A A . 29 GLU CG 1 1 13 7160 1 1 29 GLU H H -0.641 3.390 -4.280 1.00 . A A . 29 GLU H 1 1 13 7161 1 1 29 GLU HA H -1.690 4.958 -2.150 1.00 . A A . 29 GLU HA 1 1 13 7162 1 1 29 GLU HB2 H -2.428 4.450 -4.820 1.00 . A A . 29 GLU HB2 1 1 13 7163 1 1 29 GLU HB3 H -3.784 3.836 -3.881 1.00 . A A . 29 GLU HB3 1 1 13 7164 1 1 29 GLU HG2 H -2.582 6.632 -3.686 1.00 . A A . 29 GLU HG2 1 1 13 7165 1 1 29 GLU HG3 H -4.066 6.202 -4.530 1.00 . A A . 29 GLU HG3 1 1 13 7166 1 1 29 GLU N N -0.682 3.582 -3.292 1.00 . A A . 29 GLU N 1 1 13 7167 1 1 29 GLU O O -2.755 1.878 -2.127 1.00 . A A . 29 GLU O 1 1 13 7168 1 1 29 GLU OE1 O -3.640 6.118 -1.279 1.00 . A A . 29 GLU OE1 1 1 13 7169 1 1 29 GLU OE2 O -5.469 6.380 -2.426 1.00 . A A . 29 GLU OE2 1 1 13 7170 1 1 30 ARG C C -5.023 2.701 0.615 1.00 . A A . 30 ARG C 1 1 13 7171 1 1 30 ARG CA C -3.490 2.792 0.547 1.00 . A A . 30 ARG CA 1 1 13 7172 1 1 30 ARG CB C -2.832 3.312 1.847 1.00 . A A . 30 ARG CB 1 1 13 7173 1 1 30 ARG CD C -4.050 5.535 2.387 1.00 . A A . 30 ARG CD 1 1 13 7174 1 1 30 ARG CG C -2.723 4.825 2.080 1.00 . A A . 30 ARG CG 1 1 13 7175 1 1 30 ARG CZ C -5.802 6.812 1.135 1.00 . A A . 30 ARG CZ 1 1 13 7176 1 1 30 ARG H H -3.002 4.563 -0.556 1.00 . A A . 30 ARG H 1 1 13 7177 1 1 30 ARG HA H -3.144 1.768 0.407 1.00 . A A . 30 ARG HA 1 1 13 7178 1 1 30 ARG HB2 H -3.319 2.868 2.713 1.00 . A A . 30 ARG HB2 1 1 13 7179 1 1 30 ARG HB3 H -1.807 2.954 1.854 1.00 . A A . 30 ARG HB3 1 1 13 7180 1 1 30 ARG HD2 H -4.735 4.835 2.870 1.00 . A A . 30 ARG HD2 1 1 13 7181 1 1 30 ARG HD3 H -3.839 6.347 3.085 1.00 . A A . 30 ARG HD3 1 1 13 7182 1 1 30 ARG HE H -4.191 6.053 0.292 1.00 . A A . 30 ARG HE 1 1 13 7183 1 1 30 ARG HG2 H -2.085 4.960 2.954 1.00 . A A . 30 ARG HG2 1 1 13 7184 1 1 30 ARG HG3 H -2.203 5.281 1.239 1.00 . A A . 30 ARG HG3 1 1 13 7185 1 1 30 ARG HH11 H -6.234 6.609 3.062 1.00 . A A . 30 ARG HH11 1 1 13 7186 1 1 30 ARG HH12 H -7.417 7.500 2.129 1.00 . A A . 30 ARG HH12 1 1 13 7187 1 1 30 ARG HH21 H -5.709 7.049 -0.875 1.00 . A A . 30 ARG HH21 1 1 13 7188 1 1 30 ARG HH22 H -7.034 7.874 -0.059 1.00 . A A . 30 ARG HH22 1 1 13 7189 1 1 30 ARG N N -3.000 3.544 -0.614 1.00 . A A . 30 ARG N 1 1 13 7190 1 1 30 ARG NE N -4.680 6.117 1.192 1.00 . A A . 30 ARG NE 1 1 13 7191 1 1 30 ARG NH1 N -6.532 7.035 2.203 1.00 . A A . 30 ARG NH1 1 1 13 7192 1 1 30 ARG NH2 N -6.223 7.291 -0.010 1.00 . A A . 30 ARG NH2 1 1 13 7193 1 1 30 ARG O O -5.710 3.475 -0.058 1.00 . A A . 30 ARG O 1 1 13 7194 1 1 31 PRO C C -7.798 2.835 1.960 1.00 . A A . 31 PRO C 1 1 13 7195 1 1 31 PRO CA C -7.027 1.570 1.558 1.00 . A A . 31 PRO CA 1 1 13 7196 1 1 31 PRO CB C -7.190 0.494 2.632 1.00 . A A . 31 PRO CB 1 1 13 7197 1 1 31 PRO CD C -4.892 0.611 1.995 1.00 . A A . 31 PRO CD 1 1 13 7198 1 1 31 PRO CG C -5.972 -0.386 2.402 1.00 . A A . 31 PRO CG 1 1 13 7199 1 1 31 PRO HA H -7.439 1.181 0.626 1.00 . A A . 31 PRO HA 1 1 13 7200 1 1 31 PRO HB2 H -7.133 0.941 3.626 1.00 . A A . 31 PRO HB2 1 1 13 7201 1 1 31 PRO HB3 H -8.120 -0.064 2.513 1.00 . A A . 31 PRO HB3 1 1 13 7202 1 1 31 PRO HD2 H -4.359 0.949 2.883 1.00 . A A . 31 PRO HD2 1 1 13 7203 1 1 31 PRO HD3 H -4.208 0.133 1.293 1.00 . A A . 31 PRO HD3 1 1 13 7204 1 1 31 PRO HG2 H -5.705 -0.934 3.300 1.00 . A A . 31 PRO HG2 1 1 13 7205 1 1 31 PRO HG3 H -6.172 -1.072 1.583 1.00 . A A . 31 PRO HG3 1 1 13 7206 1 1 31 PRO N N -5.586 1.733 1.372 1.00 . A A . 31 PRO N 1 1 13 7207 1 1 31 PRO O O -7.260 3.857 2.391 1.00 . A A . 31 PRO O 1 1 13 7208 1 1 32 SER C C -11.522 3.216 2.199 1.00 . A A . 32 SER C 1 1 13 7209 1 1 32 SER CA C -10.095 3.797 2.163 1.00 . A A . 32 SER CA 1 1 13 7210 1 1 32 SER CB C -10.057 5.007 1.202 1.00 . A A . 32 SER CB 1 1 13 7211 1 1 32 SER H H -9.460 1.890 1.398 1.00 . A A . 32 SER H 1 1 13 7212 1 1 32 SER HA H -9.857 4.144 3.169 1.00 . A A . 32 SER HA 1 1 13 7213 1 1 32 SER HB2 H -10.602 4.769 0.290 1.00 . A A . 32 SER HB2 1 1 13 7214 1 1 32 SER HB3 H -10.556 5.850 1.680 1.00 . A A . 32 SER HB3 1 1 13 7215 1 1 32 SER HG H -8.135 4.942 1.509 1.00 . A A . 32 SER HG 1 1 13 7216 1 1 32 SER N N -9.114 2.761 1.775 1.00 . A A . 32 SER N 1 1 13 7217 1 1 32 SER O O -12.495 3.952 2.051 1.00 . A A . 32 SER O 1 1 13 7218 1 1 32 SER OG O -8.732 5.385 0.859 1.00 . A A . 32 SER OG 1 1 13 7219 1 1 33 GLY C C -12.553 0.047 1.083 1.00 . A A . 33 GLY C 1 1 13 7220 1 1 33 GLY CA C -12.822 1.065 2.183 1.00 . A A . 33 GLY CA 1 1 13 7221 1 1 33 GLY H H -10.799 1.328 2.485 1.00 . A A . 33 GLY H 1 1 13 7222 1 1 33 GLY HA2 H -13.042 0.534 3.107 1.00 . A A . 33 GLY HA2 1 1 13 7223 1 1 33 GLY HA3 H -13.680 1.674 1.894 1.00 . A A . 33 GLY HA3 1 1 13 7224 1 1 33 GLY N N -11.624 1.887 2.334 1.00 . A A . 33 GLY N 1 1 13 7225 1 1 33 GLY O O -13.415 -0.106 0.192 1.00 . A A . 33 GLY O 1 1 13 7226 1 1 33 GLY OXT O -11.425 -0.503 1.048 1.00 . A A . 33 GLY OXT 1 1 13 7227 2 2 1 NAG C1 C 13.230 1.060 -0.697 1.00 . B A . 101 NAG C1 1 1 13 7228 2 2 1 NAG C2 C 12.847 2.542 -0.880 1.00 . B A . 101 NAG C2 1 1 13 7229 2 2 1 NAG C3 C 11.597 2.584 -1.766 1.00 . B A . 101 NAG C3 1 1 13 7230 2 2 1 NAG C4 C 11.898 1.953 -3.126 1.00 . B A . 101 NAG C4 1 1 13 7231 2 2 1 NAG C5 C 12.360 0.504 -2.935 1.00 . B A . 101 NAG C5 1 1 13 7232 2 2 1 NAG C6 C 12.755 -0.238 -4.208 1.00 . B A . 101 NAG C6 1 1 13 7233 2 2 1 NAG C7 C 13.543 3.689 1.179 1.00 . B A . 101 NAG C7 1 1 13 7234 2 2 1 NAG C8 C 13.074 4.487 2.402 1.00 . B A . 101 NAG C8 1 1 13 7235 2 2 1 NAG H1 H 12.410 0.504 -0.243 1.00 . B A . 101 NAG H1 1 1 13 7236 2 2 1 NAG H2 H 13.664 3.066 -1.378 1.00 . B A . 101 NAG H2 1 1 13 7237 2 2 1 NAG H3 H 10.797 2.018 -1.276 1.00 . B A . 101 NAG H3 1 1 13 7238 2 2 1 NAG H4 H 12.653 2.534 -3.658 1.00 . B A . 101 NAG H4 1 1 13 7239 2 2 1 NAG H5 H 11.552 -0.038 -2.461 1.00 . B A . 101 NAG H5 1 1 13 7240 2 2 1 NAG H61 H 12.903 -1.295 -3.981 1.00 . B A . 101 NAG H61 1 1 13 7241 2 2 1 NAG H62 H 11.979 -0.159 -4.967 1.00 . B A . 101 NAG H62 1 1 13 7242 2 2 1 NAG H81 H 12.176 5.058 2.161 1.00 . B A . 101 NAG H81 1 1 13 7243 2 2 1 NAG H82 H 13.859 5.179 2.707 1.00 . B A . 101 NAG H82 1 1 13 7244 2 2 1 NAG H83 H 12.867 3.805 3.223 1.00 . B A . 101 NAG H83 1 1 13 7245 2 2 1 NAG HN2 H 11.623 3.229 0.741 1.00 . B A . 101 NAG HN2 1 1 13 7246 2 2 1 NAG HO3 H 11.103 4.413 -1.141 1.00 . B A . 101 NAG HO3 1 1 13 7247 2 2 1 NAG HO4 H 10.325 2.886 -3.710 1.00 . B A . 101 NAG HO4 1 1 13 7248 2 2 1 NAG HO6 H 14.584 0.354 -3.914 1.00 . B A . 101 NAG HO6 1 1 13 7249 2 2 1 NAG N2 N 12.581 3.202 0.397 1.00 . B A . 101 NAG N2 1 1 13 7250 2 2 1 NAG O3 O 11.155 3.945 -1.983 1.00 . B A . 101 NAG O3 1 1 13 7251 2 2 1 NAG O4 O 10.663 1.991 -3.850 1.00 . B A . 101 NAG O4 1 1 13 7252 2 2 1 NAG O5 O 13.526 0.498 -2.020 1.00 . B A . 101 NAG O5 1 1 13 7253 2 2 1 NAG O6 O 13.994 0.311 -4.675 1.00 . B A . 101 NAG O6 1 1 13 7254 2 2 1 NAG O7 O 14.732 3.497 0.926 1.00 . B A . 101 NAG O7 1 1 14 7255 1 1 1 LYS C C -10.738 -2.695 1.489 1.00 . A A . 1 LYS C 1 1 14 7256 1 1 1 LYS CA C -11.757 -2.299 2.553 1.00 . A A . 1 LYS CA 1 1 14 7257 1 1 1 LYS CB C -13.007 -3.191 2.431 1.00 . A A . 1 LYS CB 1 1 14 7258 1 1 1 LYS CD C -13.440 -3.585 4.934 1.00 . A A . 1 LYS CD 1 1 14 7259 1 1 1 LYS CE C -14.475 -3.526 6.069 1.00 . A A . 1 LYS CE 1 1 14 7260 1 1 1 LYS CG C -14.002 -3.063 3.600 1.00 . A A . 1 LYS CG 1 1 14 7261 1 1 1 LYS H1 H -12.211 -0.647 1.410 1.00 . A A . 1 LYS H1 1 1 14 7262 1 1 1 LYS H2 H -11.297 -0.301 2.703 1.00 . A A . 1 LYS H2 1 1 14 7263 1 1 1 LYS H3 H -12.907 -0.612 2.923 1.00 . A A . 1 LYS H3 1 1 14 7264 1 1 1 LYS HA H -11.303 -2.457 3.530 1.00 . A A . 1 LYS HA 1 1 14 7265 1 1 1 LYS HB2 H -13.526 -2.948 1.503 1.00 . A A . 1 LYS HB2 1 1 14 7266 1 1 1 LYS HB3 H -12.691 -4.234 2.366 1.00 . A A . 1 LYS HB3 1 1 14 7267 1 1 1 LYS HD2 H -13.095 -4.615 4.813 1.00 . A A . 1 LYS HD2 1 1 14 7268 1 1 1 LYS HD3 H -12.586 -2.973 5.228 1.00 . A A . 1 LYS HD3 1 1 14 7269 1 1 1 LYS HE2 H -13.963 -3.737 7.013 1.00 . A A . 1 LYS HE2 1 1 14 7270 1 1 1 LYS HE3 H -14.875 -2.510 6.128 1.00 . A A . 1 LYS HE3 1 1 14 7271 1 1 1 LYS HG2 H -14.299 -2.020 3.715 1.00 . A A . 1 LYS HG2 1 1 14 7272 1 1 1 LYS HG3 H -14.891 -3.639 3.342 1.00 . A A . 1 LYS HG3 1 1 14 7273 1 1 1 LYS HZ1 H -16.241 -4.435 6.645 1.00 . A A . 1 LYS HZ1 1 1 14 7274 1 1 1 LYS HZ2 H -16.069 -4.317 5.015 1.00 . A A . 1 LYS HZ2 1 1 14 7275 1 1 1 LYS HZ3 H -15.216 -5.444 5.852 1.00 . A A . 1 LYS HZ3 1 1 14 7276 1 1 1 LYS N N -12.086 -0.866 2.395 1.00 . A A . 1 LYS N 1 1 14 7277 1 1 1 LYS NZ N -15.580 -4.500 5.880 1.00 . A A . 1 LYS NZ 1 1 14 7278 1 1 1 LYS O O -10.939 -2.358 0.329 1.00 . A A . 1 LYS O 1 1 14 7279 1 1 2 LEU C C -9.308 -4.840 -0.091 1.00 . A A . 2 LEU C 1 1 14 7280 1 1 2 LEU CA C -8.652 -3.943 0.991 1.00 . A A . 2 LEU CA 1 1 14 7281 1 1 2 LEU CB C -7.658 -4.713 1.884 1.00 . A A . 2 LEU CB 1 1 14 7282 1 1 2 LEU CD1 C -5.494 -3.911 0.810 1.00 . A A . 2 LEU CD1 1 1 14 7283 1 1 2 LEU CD2 C -5.504 -5.896 2.275 1.00 . A A . 2 LEU CD2 1 1 14 7284 1 1 2 LEU CG C -6.323 -5.119 1.239 1.00 . A A . 2 LEU CG 1 1 14 7285 1 1 2 LEU H H -9.574 -3.665 2.856 1.00 . A A . 2 LEU H 1 1 14 7286 1 1 2 LEU HA H -8.143 -3.098 0.528 1.00 . A A . 2 LEU HA 1 1 14 7287 1 1 2 LEU HB2 H -7.426 -4.098 2.755 1.00 . A A . 2 LEU HB2 1 1 14 7288 1 1 2 LEU HB3 H -8.152 -5.616 2.249 1.00 . A A . 2 LEU HB3 1 1 14 7289 1 1 2 LEU HD11 H -5.325 -3.244 1.656 1.00 . A A . 2 LEU HD11 1 1 14 7290 1 1 2 LEU HD12 H -4.543 -4.258 0.413 1.00 . A A . 2 LEU HD12 1 1 14 7291 1 1 2 LEU HD13 H -6.006 -3.368 0.023 1.00 . A A . 2 LEU HD13 1 1 14 7292 1 1 2 LEU HD21 H -5.376 -5.304 3.181 1.00 . A A . 2 LEU HD21 1 1 14 7293 1 1 2 LEU HD22 H -6.013 -6.828 2.518 1.00 . A A . 2 LEU HD22 1 1 14 7294 1 1 2 LEU HD23 H -4.525 -6.130 1.868 1.00 . A A . 2 LEU HD23 1 1 14 7295 1 1 2 LEU HG H -6.503 -5.749 0.372 1.00 . A A . 2 LEU HG 1 1 14 7296 1 1 2 LEU N N -9.677 -3.403 1.888 1.00 . A A . 2 LEU N 1 1 14 7297 1 1 2 LEU O O -9.994 -5.794 0.282 1.00 . A A . 2 LEU O 1 1 14 7298 1 1 3 PRO C C -9.384 -6.592 -2.848 1.00 . A A . 3 PRO C 1 1 14 7299 1 1 3 PRO CA C -9.950 -5.212 -2.447 1.00 . A A . 3 PRO CA 1 1 14 7300 1 1 3 PRO CB C -9.935 -4.244 -3.635 1.00 . A A . 3 PRO CB 1 1 14 7301 1 1 3 PRO CD C -8.443 -3.420 -1.966 1.00 . A A . 3 PRO CD 1 1 14 7302 1 1 3 PRO CG C -8.598 -3.527 -3.481 1.00 . A A . 3 PRO CG 1 1 14 7303 1 1 3 PRO HA H -10.975 -5.327 -2.100 1.00 . A A . 3 PRO HA 1 1 14 7304 1 1 3 PRO HB2 H -10.008 -4.754 -4.596 1.00 . A A . 3 PRO HB2 1 1 14 7305 1 1 3 PRO HB3 H -10.746 -3.523 -3.525 1.00 . A A . 3 PRO HB3 1 1 14 7306 1 1 3 PRO HD2 H -7.389 -3.469 -1.699 1.00 . A A . 3 PRO HD2 1 1 14 7307 1 1 3 PRO HD3 H -8.889 -2.488 -1.621 1.00 . A A . 3 PRO HD3 1 1 14 7308 1 1 3 PRO HG2 H -7.800 -4.146 -3.887 1.00 . A A . 3 PRO HG2 1 1 14 7309 1 1 3 PRO HG3 H -8.607 -2.549 -3.963 1.00 . A A . 3 PRO HG3 1 1 14 7310 1 1 3 PRO N N -9.180 -4.537 -1.400 1.00 . A A . 3 PRO N 1 1 14 7311 1 1 3 PRO O O -8.194 -6.855 -2.654 1.00 . A A . 3 PRO O 1 1 14 7312 1 1 4 PRO C C -8.496 -8.798 -4.746 1.00 . A A . 4 PRO C 1 1 14 7313 1 1 4 PRO CA C -9.810 -8.782 -3.954 1.00 . A A . 4 PRO CA 1 1 14 7314 1 1 4 PRO CB C -10.979 -9.286 -4.808 1.00 . A A . 4 PRO CB 1 1 14 7315 1 1 4 PRO CD C -11.631 -7.253 -3.737 1.00 . A A . 4 PRO CD 1 1 14 7316 1 1 4 PRO CG C -12.186 -8.611 -4.165 1.00 . A A . 4 PRO CG 1 1 14 7317 1 1 4 PRO HA H -9.712 -9.431 -3.084 1.00 . A A . 4 PRO HA 1 1 14 7318 1 1 4 PRO HB2 H -10.877 -8.934 -5.836 1.00 . A A . 4 PRO HB2 1 1 14 7319 1 1 4 PRO HB3 H -11.061 -10.373 -4.780 1.00 . A A . 4 PRO HB3 1 1 14 7320 1 1 4 PRO HD2 H -11.750 -6.537 -4.551 1.00 . A A . 4 PRO HD2 1 1 14 7321 1 1 4 PRO HD3 H -12.161 -6.911 -2.849 1.00 . A A . 4 PRO HD3 1 1 14 7322 1 1 4 PRO HG2 H -13.016 -8.508 -4.865 1.00 . A A . 4 PRO HG2 1 1 14 7323 1 1 4 PRO HG3 H -12.495 -9.174 -3.283 1.00 . A A . 4 PRO HG3 1 1 14 7324 1 1 4 PRO N N -10.211 -7.459 -3.474 1.00 . A A . 4 PRO N 1 1 14 7325 1 1 4 PRO O O -8.281 -7.992 -5.653 1.00 . A A . 4 PRO O 1 1 14 7326 1 1 5 GLY C C -5.210 -9.013 -4.688 1.00 . A A . 5 GLY C 1 1 14 7327 1 1 5 GLY CA C -6.340 -9.973 -5.070 1.00 . A A . 5 GLY CA 1 1 14 7328 1 1 5 GLY H H -7.841 -10.347 -3.621 1.00 . A A . 5 GLY H 1 1 14 7329 1 1 5 GLY HA2 H -6.005 -10.987 -4.858 1.00 . A A . 5 GLY HA2 1 1 14 7330 1 1 5 GLY HA3 H -6.493 -9.883 -6.146 1.00 . A A . 5 GLY HA3 1 1 14 7331 1 1 5 GLY N N -7.616 -9.741 -4.395 1.00 . A A . 5 GLY N 1 1 14 7332 1 1 5 GLY O O -4.067 -9.288 -5.041 1.00 . A A . 5 GLY O 1 1 14 7333 1 1 6 TRP C C -4.187 -7.379 -1.969 1.00 . A A . 6 TRP C 1 1 14 7334 1 1 6 TRP CA C -4.505 -7.007 -3.420 1.00 . A A . 6 TRP CA 1 1 14 7335 1 1 6 TRP CB C -5.005 -5.569 -3.539 1.00 . A A . 6 TRP CB 1 1 14 7336 1 1 6 TRP CD1 C -6.076 -5.208 -5.814 1.00 . A A . 6 TRP CD1 1 1 14 7337 1 1 6 TRP CD2 C -3.997 -4.365 -5.685 1.00 . A A . 6 TRP CD2 1 1 14 7338 1 1 6 TRP CE2 C -4.479 -4.087 -6.999 1.00 . A A . 6 TRP CE2 1 1 14 7339 1 1 6 TRP CE3 C -2.678 -3.963 -5.384 1.00 . A A . 6 TRP CE3 1 1 14 7340 1 1 6 TRP CG C -5.046 -5.061 -4.948 1.00 . A A . 6 TRP CG 1 1 14 7341 1 1 6 TRP CH2 C -2.387 -3.046 -7.628 1.00 . A A . 6 TRP CH2 1 1 14 7342 1 1 6 TRP CZ2 C -3.697 -3.432 -7.961 1.00 . A A . 6 TRP CZ2 1 1 14 7343 1 1 6 TRP CZ3 C -1.881 -3.312 -6.344 1.00 . A A . 6 TRP CZ3 1 1 14 7344 1 1 6 TRP H H -6.453 -7.676 -3.753 1.00 . A A . 6 TRP H 1 1 14 7345 1 1 6 TRP HA H -3.574 -7.077 -3.975 1.00 . A A . 6 TRP HA 1 1 14 7346 1 1 6 TRP HB2 H -5.994 -5.488 -3.090 1.00 . A A . 6 TRP HB2 1 1 14 7347 1 1 6 TRP HB3 H -4.340 -4.929 -2.966 1.00 . A A . 6 TRP HB3 1 1 14 7348 1 1 6 TRP HD1 H -7.011 -5.709 -5.582 1.00 . A A . 6 TRP HD1 1 1 14 7349 1 1 6 TRP HE1 H -6.391 -4.559 -7.803 1.00 . A A . 6 TRP HE1 1 1 14 7350 1 1 6 TRP HE3 H -2.276 -4.173 -4.406 1.00 . A A . 6 TRP HE3 1 1 14 7351 1 1 6 TRP HH2 H -1.766 -2.546 -8.358 1.00 . A A . 6 TRP HH2 1 1 14 7352 1 1 6 TRP HZ2 H -4.087 -3.226 -8.947 1.00 . A A . 6 TRP HZ2 1 1 14 7353 1 1 6 TRP HZ3 H -0.870 -3.018 -6.103 1.00 . A A . 6 TRP HZ3 1 1 14 7354 1 1 6 TRP N N -5.499 -7.890 -4.021 1.00 . A A . 6 TRP N 1 1 14 7355 1 1 6 TRP NE1 N -5.753 -4.618 -7.020 1.00 . A A . 6 TRP NE1 1 1 14 7356 1 1 6 TRP O O -5.091 -7.683 -1.193 1.00 . A A . 6 TRP O 1 1 14 7357 1 1 7 GLU C C -1.459 -6.292 0.204 1.00 . A A . 7 GLU C 1 1 14 7358 1 1 7 GLU CA C -2.492 -7.369 -0.180 1.00 . A A . 7 GLU CA 1 1 14 7359 1 1 7 GLU CB C -2.022 -8.796 0.142 1.00 . A A . 7 GLU CB 1 1 14 7360 1 1 7 GLU CD C -0.278 -10.635 -0.232 1.00 . A A . 7 GLU CD 1 1 14 7361 1 1 7 GLU CG C -0.852 -9.297 -0.719 1.00 . A A . 7 GLU CG 1 1 14 7362 1 1 7 GLU H H -2.172 -7.106 -2.257 1.00 . A A . 7 GLU H 1 1 14 7363 1 1 7 GLU HA H -3.364 -7.196 0.443 1.00 . A A . 7 GLU HA 1 1 14 7364 1 1 7 GLU HB2 H -1.732 -8.810 1.194 1.00 . A A . 7 GLU HB2 1 1 14 7365 1 1 7 GLU HB3 H -2.862 -9.481 0.019 1.00 . A A . 7 GLU HB3 1 1 14 7366 1 1 7 GLU HG2 H -1.177 -9.394 -1.754 1.00 . A A . 7 GLU HG2 1 1 14 7367 1 1 7 GLU HG3 H -0.051 -8.555 -0.689 1.00 . A A . 7 GLU HG3 1 1 14 7368 1 1 7 GLU N N -2.915 -7.261 -1.577 1.00 . A A . 7 GLU N 1 1 14 7369 1 1 7 GLU O O -0.786 -5.706 -0.646 1.00 . A A . 7 GLU O 1 1 14 7370 1 1 7 GLU OE1 O -0.373 -10.916 0.986 1.00 . A A . 7 GLU OE1 1 1 14 7371 1 1 7 GLU OE2 O 0.519 -11.250 -0.974 1.00 . A A . 7 GLU OE2 1 1 14 7372 1 1 8 LYS C C 0.994 -5.527 2.135 1.00 . A A . 8 LYS C 1 1 14 7373 1 1 8 LYS CA C -0.452 -4.999 2.087 1.00 . A A . 8 LYS CA 1 1 14 7374 1 1 8 LYS CB C -0.992 -4.638 3.484 1.00 . A A . 8 LYS CB 1 1 14 7375 1 1 8 LYS CD C -0.876 -3.104 5.525 1.00 . A A . 8 LYS CD 1 1 14 7376 1 1 8 LYS CE C -2.391 -2.873 5.691 1.00 . A A . 8 LYS CE 1 1 14 7377 1 1 8 LYS CG C -0.402 -3.346 4.079 1.00 . A A . 8 LYS CG 1 1 14 7378 1 1 8 LYS H H -1.902 -6.549 2.164 1.00 . A A . 8 LYS H 1 1 14 7379 1 1 8 LYS HA H -0.474 -4.109 1.454 1.00 . A A . 8 LYS HA 1 1 14 7380 1 1 8 LYS HB2 H -2.072 -4.511 3.408 1.00 . A A . 8 LYS HB2 1 1 14 7381 1 1 8 LYS HB3 H -0.798 -5.471 4.164 1.00 . A A . 8 LYS HB3 1 1 14 7382 1 1 8 LYS HD2 H -0.602 -3.978 6.118 1.00 . A A . 8 LYS HD2 1 1 14 7383 1 1 8 LYS HD3 H -0.332 -2.253 5.940 1.00 . A A . 8 LYS HD3 1 1 14 7384 1 1 8 LYS HE2 H -2.936 -3.551 5.031 1.00 . A A . 8 LYS HE2 1 1 14 7385 1 1 8 LYS HE3 H -2.666 -3.126 6.719 1.00 . A A . 8 LYS HE3 1 1 14 7386 1 1 8 LYS HG2 H 0.686 -3.425 4.087 1.00 . A A . 8 LYS HG2 1 1 14 7387 1 1 8 LYS HG3 H -0.678 -2.495 3.456 1.00 . A A . 8 LYS HG3 1 1 14 7388 1 1 8 LYS HZ1 H -2.487 -1.169 4.499 1.00 . A A . 8 LYS HZ1 1 1 14 7389 1 1 8 LYS HZ2 H -3.811 -1.350 5.458 1.00 . A A . 8 LYS HZ2 1 1 14 7390 1 1 8 LYS HZ3 H -2.380 -0.845 6.103 1.00 . A A . 8 LYS HZ3 1 1 14 7391 1 1 8 LYS N N -1.351 -6.011 1.511 1.00 . A A . 8 LYS N 1 1 14 7392 1 1 8 LYS NZ N -2.788 -1.470 5.424 1.00 . A A . 8 LYS NZ 1 1 14 7393 1 1 8 LYS O O 1.228 -6.691 2.484 1.00 . A A . 8 LYS O 1 1 14 7394 1 1 9 ARG C C 4.319 -3.960 2.058 1.00 . A A . 9 ARG C 1 1 14 7395 1 1 9 ARG CA C 3.373 -5.074 1.593 1.00 . A A . 9 ARG CA 1 1 14 7396 1 1 9 ARG CB C 3.509 -5.345 0.088 1.00 . A A . 9 ARG CB 1 1 14 7397 1 1 9 ARG CD C 4.202 -7.814 -0.289 1.00 . A A . 9 ARG CD 1 1 14 7398 1 1 9 ARG CG C 4.608 -6.336 -0.280 1.00 . A A . 9 ARG CG 1 1 14 7399 1 1 9 ARG CZ C 2.563 -9.275 0.876 1.00 . A A . 9 ARG CZ 1 1 14 7400 1 1 9 ARG H H 1.795 -3.782 1.351 1.00 . A A . 9 ARG H 1 1 14 7401 1 1 9 ARG HA H 3.602 -5.958 2.187 1.00 . A A . 9 ARG HA 1 1 14 7402 1 1 9 ARG HB2 H 2.571 -5.723 -0.325 1.00 . A A . 9 ARG HB2 1 1 14 7403 1 1 9 ARG HB3 H 3.704 -4.394 -0.409 1.00 . A A . 9 ARG HB3 1 1 14 7404 1 1 9 ARG HD2 H 3.694 -8.014 -1.235 1.00 . A A . 9 ARG HD2 1 1 14 7405 1 1 9 ARG HD3 H 5.104 -8.428 -0.251 1.00 . A A . 9 ARG HD3 1 1 14 7406 1 1 9 ARG HE H 2.972 -7.457 1.435 1.00 . A A . 9 ARG HE 1 1 14 7407 1 1 9 ARG HG2 H 4.864 -6.077 -1.295 1.00 . A A . 9 ARG HG2 1 1 14 7408 1 1 9 ARG HG3 H 5.482 -6.192 0.350 1.00 . A A . 9 ARG HG3 1 1 14 7409 1 1 9 ARG HH11 H 3.499 -10.232 -0.613 1.00 . A A . 9 ARG HH11 1 1 14 7410 1 1 9 ARG HH12 H 1.951 -10.895 -0.156 1.00 . A A . 9 ARG HH12 1 1 14 7411 1 1 9 ARG HH21 H 1.349 -8.465 2.256 1.00 . A A . 9 ARG HH21 1 1 14 7412 1 1 9 ARG HH22 H 0.890 -10.076 1.664 1.00 . A A . 9 ARG HH22 1 1 14 7413 1 1 9 ARG N N 1.976 -4.694 1.770 1.00 . A A . 9 ARG N 1 1 14 7414 1 1 9 ARG NE N 3.299 -8.179 0.812 1.00 . A A . 9 ARG NE 1 1 14 7415 1 1 9 ARG NH1 N 2.756 -10.279 0.054 1.00 . A A . 9 ARG NH1 1 1 14 7416 1 1 9 ARG NH2 N 1.587 -9.313 1.745 1.00 . A A . 9 ARG NH2 1 1 14 7417 1 1 9 ARG O O 3.889 -2.829 2.283 1.00 . A A . 9 ARG O 1 1 14 7418 1 1 10 MET C C 8.008 -3.637 2.055 1.00 . A A . 10 MET C 1 1 14 7419 1 1 10 MET CA C 6.619 -3.296 2.603 1.00 . A A . 10 MET CA 1 1 14 7420 1 1 10 MET CB C 6.661 -3.267 4.143 1.00 . A A . 10 MET CB 1 1 14 7421 1 1 10 MET CE C 9.076 -3.138 6.580 1.00 . A A . 10 MET CE 1 1 14 7422 1 1 10 MET CG C 7.403 -2.030 4.663 1.00 . A A . 10 MET CG 1 1 14 7423 1 1 10 MET H H 5.954 -5.187 1.945 1.00 . A A . 10 MET H 1 1 14 7424 1 1 10 MET HA H 6.326 -2.316 2.236 1.00 . A A . 10 MET HA 1 1 14 7425 1 1 10 MET HB2 H 5.646 -3.243 4.540 1.00 . A A . 10 MET HB2 1 1 14 7426 1 1 10 MET HB3 H 7.149 -4.172 4.508 1.00 . A A . 10 MET HB3 1 1 14 7427 1 1 10 MET HE1 H 8.771 -4.124 6.231 1.00 . A A . 10 MET HE1 1 1 14 7428 1 1 10 MET HE2 H 9.909 -2.781 5.974 1.00 . A A . 10 MET HE2 1 1 14 7429 1 1 10 MET HE3 H 9.393 -3.209 7.620 1.00 . A A . 10 MET HE3 1 1 14 7430 1 1 10 MET HG2 H 8.370 -1.950 4.175 1.00 . A A . 10 MET HG2 1 1 14 7431 1 1 10 MET HG3 H 6.822 -1.152 4.393 1.00 . A A . 10 MET HG3 1 1 14 7432 1 1 10 MET N N 5.617 -4.260 2.155 1.00 . A A . 10 MET N 1 1 14 7433 1 1 10 MET O O 8.410 -4.798 2.017 1.00 . A A . 10 MET O 1 1 14 7434 1 1 10 MET SD S 7.687 -1.979 6.450 1.00 . A A . 10 MET SD 1 1 14 7435 1 1 11 PHE C C 11.000 -2.748 2.531 1.00 . A A . 11 PHE C 1 1 14 7436 1 1 11 PHE CA C 10.142 -2.647 1.263 1.00 . A A . 11 PHE CA 1 1 14 7437 1 1 11 PHE CB C 10.480 -1.379 0.470 1.00 . A A . 11 PHE CB 1 1 14 7438 1 1 11 PHE CD1 C 10.345 -2.105 -1.943 1.00 . A A . 11 PHE CD1 1 1 14 7439 1 1 11 PHE CD2 C 8.736 -0.456 -1.141 1.00 . A A . 11 PHE CD2 1 1 14 7440 1 1 11 PHE CE1 C 9.768 -2.058 -3.223 1.00 . A A . 11 PHE CE1 1 1 14 7441 1 1 11 PHE CE2 C 8.161 -0.417 -2.425 1.00 . A A . 11 PHE CE2 1 1 14 7442 1 1 11 PHE CG C 9.827 -1.315 -0.896 1.00 . A A . 11 PHE CG 1 1 14 7443 1 1 11 PHE CZ C 8.671 -1.216 -3.463 1.00 . A A . 11 PHE CZ 1 1 14 7444 1 1 11 PHE H H 8.305 -1.679 1.661 1.00 . A A . 11 PHE H 1 1 14 7445 1 1 11 PHE HA H 10.331 -3.510 0.627 1.00 . A A . 11 PHE HA 1 1 14 7446 1 1 11 PHE HB2 H 10.211 -0.498 1.054 1.00 . A A . 11 PHE HB2 1 1 14 7447 1 1 11 PHE HB3 H 11.554 -1.355 0.315 1.00 . A A . 11 PHE HB3 1 1 14 7448 1 1 11 PHE HD1 H 11.212 -2.727 -1.780 1.00 . A A . 11 PHE HD1 1 1 14 7449 1 1 11 PHE HD2 H 8.324 0.166 -0.353 1.00 . A A . 11 PHE HD2 1 1 14 7450 1 1 11 PHE HE1 H 10.169 -2.662 -4.025 1.00 . A A . 11 PHE HE1 1 1 14 7451 1 1 11 PHE HE2 H 7.306 0.205 -2.625 1.00 . A A . 11 PHE HE2 1 1 14 7452 1 1 11 PHE HZ H 8.220 -1.180 -4.443 1.00 . A A . 11 PHE HZ 1 1 14 7453 1 1 11 PHE N N 8.731 -2.601 1.627 1.00 . A A . 11 PHE N 1 1 14 7454 1 1 11 PHE O O 10.746 -2.031 3.500 1.00 . A A . 11 PHE O 1 1 14 7455 1 1 12 ALA C C 13.583 -2.633 4.261 1.00 . A A . 12 ALA C 1 1 14 7456 1 1 12 ALA CA C 12.860 -3.880 3.711 1.00 . A A . 12 ALA CA 1 1 14 7457 1 1 12 ALA CB C 13.862 -4.983 3.353 1.00 . A A . 12 ALA CB 1 1 14 7458 1 1 12 ALA H H 12.206 -4.176 1.716 1.00 . A A . 12 ALA H 1 1 14 7459 1 1 12 ALA HA H 12.215 -4.254 4.508 1.00 . A A . 12 ALA HA 1 1 14 7460 1 1 12 ALA HB1 H 14.524 -4.645 2.553 1.00 . A A . 12 ALA HB1 1 1 14 7461 1 1 12 ALA HB2 H 14.462 -5.229 4.230 1.00 . A A . 12 ALA HB2 1 1 14 7462 1 1 12 ALA HB3 H 13.330 -5.878 3.029 1.00 . A A . 12 ALA HB3 1 1 14 7463 1 1 12 ALA N N 12.025 -3.611 2.532 1.00 . A A . 12 ALA N 1 1 14 7464 1 1 12 ALA O O 13.771 -2.510 5.468 1.00 . A A . 12 ALA O 1 1 14 7465 1 1 13 ASN C C 13.360 0.622 4.273 1.00 . A A . 13 ASN C 1 1 14 7466 1 1 13 ASN CA C 14.432 -0.343 3.706 1.00 . A A . 13 ASN CA 1 1 14 7467 1 1 13 ASN CB C 15.171 0.216 2.466 1.00 . A A . 13 ASN CB 1 1 14 7468 1 1 13 ASN CG C 14.357 0.159 1.177 1.00 . A A . 13 ASN CG 1 1 14 7469 1 1 13 ASN H H 13.762 -1.846 2.398 1.00 . A A . 13 ASN H 1 1 14 7470 1 1 13 ASN HA H 15.171 -0.454 4.502 1.00 . A A . 13 ASN HA 1 1 14 7471 1 1 13 ASN HB2 H 15.484 1.242 2.664 1.00 . A A . 13 ASN HB2 1 1 14 7472 1 1 13 ASN HB3 H 16.074 -0.372 2.304 1.00 . A A . 13 ASN HB3 1 1 14 7473 1 1 13 ASN HD21 H 14.452 2.189 0.943 1.00 . A A . 13 ASN HD21 1 1 14 7474 1 1 13 ASN N N 13.924 -1.681 3.388 1.00 . A A . 13 ASN N 1 1 14 7475 1 1 13 ASN ND2 N 14.093 1.309 0.567 1.00 . A A . 13 ASN ND2 1 1 14 7476 1 1 13 ASN O O 13.649 1.801 4.464 1.00 . A A . 13 ASN O 1 1 14 7477 1 1 13 ASN OD1 O 13.926 -0.921 0.778 1.00 . A A . 13 ASN OD1 1 1 14 7478 1 1 14 GLY C C 10.144 1.686 4.398 1.00 . A A . 14 GLY C 1 1 14 7479 1 1 14 GLY CA C 11.086 0.859 5.271 1.00 . A A . 14 GLY CA 1 1 14 7480 1 1 14 GLY H H 11.917 -0.816 4.297 1.00 . A A . 14 GLY H 1 1 14 7481 1 1 14 GLY HA2 H 10.489 0.127 5.815 1.00 . A A . 14 GLY HA2 1 1 14 7482 1 1 14 GLY HA3 H 11.547 1.525 6.002 1.00 . A A . 14 GLY HA3 1 1 14 7483 1 1 14 GLY N N 12.136 0.146 4.540 1.00 . A A . 14 GLY N 1 1 14 7484 1 1 14 GLY O O 10.146 2.914 4.479 1.00 . A A . 14 GLY O 1 1 14 7485 1 1 15 THR C C 7.087 0.842 2.502 1.00 . A A . 15 THR C 1 1 14 7486 1 1 15 THR CA C 8.234 1.784 2.845 1.00 . A A . 15 THR CA 1 1 14 7487 1 1 15 THR CB C 8.779 2.499 1.600 1.00 . A A . 15 THR CB 1 1 14 7488 1 1 15 THR CG2 C 7.727 3.263 0.803 1.00 . A A . 15 THR CG2 1 1 14 7489 1 1 15 THR H H 9.365 0.054 3.426 1.00 . A A . 15 THR H 1 1 14 7490 1 1 15 THR HA H 7.830 2.548 3.497 1.00 . A A . 15 THR HA 1 1 14 7491 1 1 15 THR HB H 9.285 1.783 0.954 1.00 . A A . 15 THR HB 1 1 14 7492 1 1 15 THR HG1 H 9.858 3.357 2.978 1.00 . A A . 15 THR HG1 1 1 14 7493 1 1 15 THR HG21 H 8.213 3.748 -0.044 1.00 . A A . 15 THR HG21 1 1 14 7494 1 1 15 THR HG22 H 6.956 2.587 0.438 1.00 . A A . 15 THR HG22 1 1 14 7495 1 1 15 THR HG23 H 7.274 4.029 1.434 1.00 . A A . 15 THR HG23 1 1 14 7496 1 1 15 THR N N 9.314 1.061 3.551 1.00 . A A . 15 THR N 1 1 14 7497 1 1 15 THR O O 7.330 -0.212 1.924 1.00 . A A . 15 THR O 1 1 14 7498 1 1 15 THR OG1 O 9.688 3.490 2.013 1.00 . A A . 15 THR OG1 1 1 14 7499 1 1 16 VAL C C 3.963 0.654 1.366 1.00 . A A . 16 VAL C 1 1 14 7500 1 1 16 VAL CA C 4.658 0.363 2.693 1.00 . A A . 16 VAL CA 1 1 14 7501 1 1 16 VAL CB C 3.683 0.565 3.882 1.00 . A A . 16 VAL CB 1 1 14 7502 1 1 16 VAL CG1 C 2.254 0.046 3.643 1.00 . A A . 16 VAL CG1 1 1 14 7503 1 1 16 VAL CG2 C 4.219 -0.178 5.111 1.00 . A A . 16 VAL CG2 1 1 14 7504 1 1 16 VAL H H 5.692 2.129 3.251 1.00 . A A . 16 VAL H 1 1 14 7505 1 1 16 VAL HA H 4.966 -0.679 2.690 1.00 . A A . 16 VAL HA 1 1 14 7506 1 1 16 VAL HB H 3.619 1.629 4.111 1.00 . A A . 16 VAL HB 1 1 14 7507 1 1 16 VAL HG11 H 2.273 -1.010 3.368 1.00 . A A . 16 VAL HG11 1 1 14 7508 1 1 16 VAL HG12 H 1.662 0.164 4.551 1.00 . A A . 16 VAL HG12 1 1 14 7509 1 1 16 VAL HG13 H 1.767 0.617 2.853 1.00 . A A . 16 VAL HG13 1 1 14 7510 1 1 16 VAL HG21 H 3.565 -0.003 5.965 1.00 . A A . 16 VAL HG21 1 1 14 7511 1 1 16 VAL HG22 H 4.251 -1.249 4.903 1.00 . A A . 16 VAL HG22 1 1 14 7512 1 1 16 VAL HG23 H 5.216 0.180 5.363 1.00 . A A . 16 VAL HG23 1 1 14 7513 1 1 16 VAL N N 5.847 1.219 2.841 1.00 . A A . 16 VAL N 1 1 14 7514 1 1 16 VAL O O 3.877 1.799 0.926 1.00 . A A . 16 VAL O 1 1 14 7515 1 1 17 TYR C C 1.704 -1.517 -0.577 1.00 . A A . 17 TYR C 1 1 14 7516 1 1 17 TYR CA C 2.733 -0.382 -0.520 1.00 . A A . 17 TYR CA 1 1 14 7517 1 1 17 TYR CB C 3.740 -0.466 -1.683 1.00 . A A . 17 TYR CB 1 1 14 7518 1 1 17 TYR CD1 C 5.702 -1.883 -1.001 1.00 . A A . 17 TYR CD1 1 1 14 7519 1 1 17 TYR CD2 C 4.181 -2.777 -2.683 1.00 . A A . 17 TYR CD2 1 1 14 7520 1 1 17 TYR CE1 C 6.551 -2.988 -1.172 1.00 . A A . 17 TYR CE1 1 1 14 7521 1 1 17 TYR CE2 C 5.021 -3.894 -2.851 1.00 . A A . 17 TYR CE2 1 1 14 7522 1 1 17 TYR CG C 4.541 -1.752 -1.781 1.00 . A A . 17 TYR CG 1 1 14 7523 1 1 17 TYR CZ C 6.228 -3.981 -2.122 1.00 . A A . 17 TYR CZ 1 1 14 7524 1 1 17 TYR H H 3.545 -1.331 1.181 1.00 . A A . 17 TYR H 1 1 14 7525 1 1 17 TYR HA H 2.193 0.564 -0.598 1.00 . A A . 17 TYR HA 1 1 14 7526 1 1 17 TYR HB2 H 3.221 -0.299 -2.626 1.00 . A A . 17 TYR HB2 1 1 14 7527 1 1 17 TYR HB3 H 4.456 0.351 -1.575 1.00 . A A . 17 TYR HB3 1 1 14 7528 1 1 17 TYR HD1 H 5.963 -1.100 -0.304 1.00 . A A . 17 TYR HD1 1 1 14 7529 1 1 17 TYR HD2 H 3.274 -2.713 -3.264 1.00 . A A . 17 TYR HD2 1 1 14 7530 1 1 17 TYR HE1 H 7.462 -3.042 -0.600 1.00 . A A . 17 TYR HE1 1 1 14 7531 1 1 17 TYR HE2 H 4.750 -4.692 -3.531 1.00 . A A . 17 TYR HE2 1 1 14 7532 1 1 17 TYR HH H 7.902 -4.913 -1.866 1.00 . A A . 17 TYR HH 1 1 14 7533 1 1 17 TYR N N 3.467 -0.413 0.740 1.00 . A A . 17 TYR N 1 1 14 7534 1 1 17 TYR O O 1.599 -2.336 0.337 1.00 . A A . 17 TYR O 1 1 14 7535 1 1 17 TYR OH O 7.061 -5.039 -2.309 1.00 . A A . 17 TYR OH 1 1 14 7536 1 1 18 TYR C C 0.444 -3.443 -3.190 1.00 . A A . 18 TYR C 1 1 14 7537 1 1 18 TYR CA C -0.001 -2.631 -1.987 1.00 . A A . 18 TYR CA 1 1 14 7538 1 1 18 TYR CB C -1.379 -2.001 -2.182 1.00 . A A . 18 TYR CB 1 1 14 7539 1 1 18 TYR CD1 C -2.382 -2.294 0.093 1.00 . A A . 18 TYR CD1 1 1 14 7540 1 1 18 TYR CD2 C -1.476 -0.107 -0.523 1.00 . A A . 18 TYR CD2 1 1 14 7541 1 1 18 TYR CE1 C -2.628 -1.831 1.392 1.00 . A A . 18 TYR CE1 1 1 14 7542 1 1 18 TYR CE2 C -1.653 0.335 0.794 1.00 . A A . 18 TYR CE2 1 1 14 7543 1 1 18 TYR CG C -1.823 -1.428 -0.864 1.00 . A A . 18 TYR CG 1 1 14 7544 1 1 18 TYR CZ C -2.248 -0.520 1.746 1.00 . A A . 18 TYR CZ 1 1 14 7545 1 1 18 TYR H H 1.009 -0.825 -2.350 1.00 . A A . 18 TYR H 1 1 14 7546 1 1 18 TYR HA H -0.068 -3.311 -1.136 1.00 . A A . 18 TYR HA 1 1 14 7547 1 1 18 TYR HB2 H -1.337 -1.220 -2.944 1.00 . A A . 18 TYR HB2 1 1 14 7548 1 1 18 TYR HB3 H -2.091 -2.761 -2.499 1.00 . A A . 18 TYR HB3 1 1 14 7549 1 1 18 TYR HD1 H -2.579 -3.326 -0.160 1.00 . A A . 18 TYR HD1 1 1 14 7550 1 1 18 TYR HD2 H -1.020 0.556 -1.248 1.00 . A A . 18 TYR HD2 1 1 14 7551 1 1 18 TYR HE1 H -3.074 -2.490 2.118 1.00 . A A . 18 TYR HE1 1 1 14 7552 1 1 18 TYR HE2 H -1.323 1.326 1.054 1.00 . A A . 18 TYR HE2 1 1 14 7553 1 1 18 TYR HH H -3.529 -0.102 3.103 1.00 . A A . 18 TYR HH 1 1 14 7554 1 1 18 TYR N N 0.969 -1.589 -1.682 1.00 . A A . 18 TYR N 1 1 14 7555 1 1 18 TYR O O 0.864 -2.901 -4.211 1.00 . A A . 18 TYR O 1 1 14 7556 1 1 18 TYR OH O -2.508 -0.072 2.999 1.00 . A A . 18 TYR OH 1 1 14 7557 1 1 19 PHE C C -0.290 -6.672 -4.377 1.00 . A A . 19 PHE C 1 1 14 7558 1 1 19 PHE CA C 0.860 -5.762 -3.951 1.00 . A A . 19 PHE CA 1 1 14 7559 1 1 19 PHE CB C 1.981 -6.522 -3.238 1.00 . A A . 19 PHE CB 1 1 14 7560 1 1 19 PHE CD1 C 3.626 -7.256 -4.994 1.00 . A A . 19 PHE CD1 1 1 14 7561 1 1 19 PHE CD2 C 2.233 -8.952 -3.925 1.00 . A A . 19 PHE CD2 1 1 14 7562 1 1 19 PHE CE1 C 4.264 -8.252 -5.746 1.00 . A A . 19 PHE CE1 1 1 14 7563 1 1 19 PHE CE2 C 2.871 -9.949 -4.684 1.00 . A A . 19 PHE CE2 1 1 14 7564 1 1 19 PHE CG C 2.622 -7.605 -4.072 1.00 . A A . 19 PHE CG 1 1 14 7565 1 1 19 PHE CZ C 3.891 -9.600 -5.588 1.00 . A A . 19 PHE CZ 1 1 14 7566 1 1 19 PHE H H -0.009 -5.127 -2.156 1.00 . A A . 19 PHE H 1 1 14 7567 1 1 19 PHE HA H 1.276 -5.283 -4.837 1.00 . A A . 19 PHE HA 1 1 14 7568 1 1 19 PHE HB2 H 2.752 -5.808 -2.951 1.00 . A A . 19 PHE HB2 1 1 14 7569 1 1 19 PHE HB3 H 1.599 -6.959 -2.316 1.00 . A A . 19 PHE HB3 1 1 14 7570 1 1 19 PHE HD1 H 3.912 -6.221 -5.129 1.00 . A A . 19 PHE HD1 1 1 14 7571 1 1 19 PHE HD2 H 1.446 -9.233 -3.235 1.00 . A A . 19 PHE HD2 1 1 14 7572 1 1 19 PHE HE1 H 5.038 -7.966 -6.443 1.00 . A A . 19 PHE HE1 1 1 14 7573 1 1 19 PHE HE2 H 2.580 -10.984 -4.570 1.00 . A A . 19 PHE HE2 1 1 14 7574 1 1 19 PHE HZ H 4.375 -10.368 -6.174 1.00 . A A . 19 PHE HZ 1 1 14 7575 1 1 19 PHE N N 0.355 -4.760 -3.035 1.00 . A A . 19 PHE N 1 1 14 7576 1 1 19 PHE O O -0.901 -7.349 -3.551 1.00 . A A . 19 PHE O 1 1 14 7577 1 1 20 ASN C C -1.017 -8.961 -6.381 1.00 . A A . 20 ASN C 1 1 14 7578 1 1 20 ASN CA C -1.599 -7.548 -6.251 1.00 . A A . 20 ASN CA 1 1 14 7579 1 1 20 ASN CB C -2.060 -6.981 -7.593 1.00 . A A . 20 ASN CB 1 1 14 7580 1 1 20 ASN CG C -3.193 -7.823 -8.143 1.00 . A A . 20 ASN CG 1 1 14 7581 1 1 20 ASN H H -0.117 -6.046 -6.305 1.00 . A A . 20 ASN H 1 1 14 7582 1 1 20 ASN HA H -2.462 -7.592 -5.596 1.00 . A A . 20 ASN HA 1 1 14 7583 1 1 20 ASN HB2 H -2.380 -5.952 -7.483 1.00 . A A . 20 ASN HB2 1 1 14 7584 1 1 20 ASN HB3 H -1.226 -6.990 -8.293 1.00 . A A . 20 ASN HB3 1 1 14 7585 1 1 20 ASN HD21 H -4.652 -6.639 -7.331 1.00 . A A . 20 ASN HD21 1 1 14 7586 1 1 20 ASN HD22 H -5.159 -8.046 -8.253 1.00 . A A . 20 ASN HD22 1 1 14 7587 1 1 20 ASN N N -0.618 -6.658 -5.666 1.00 . A A . 20 ASN N 1 1 14 7588 1 1 20 ASN ND2 N -4.432 -7.456 -7.887 1.00 . A A . 20 ASN ND2 1 1 14 7589 1 1 20 ASN O O -0.324 -9.269 -7.350 1.00 . A A . 20 ASN O 1 1 14 7590 1 1 20 ASN OD1 O -2.954 -8.838 -8.785 1.00 . A A . 20 ASN OD1 1 1 14 7591 1 1 21 HIS C C -1.366 -12.133 -6.491 1.00 . A A . 21 HIS C 1 1 14 7592 1 1 21 HIS CA C -0.796 -11.211 -5.397 1.00 . A A . 21 HIS CA 1 1 14 7593 1 1 21 HIS CB C -0.982 -11.778 -3.984 1.00 . A A . 21 HIS CB 1 1 14 7594 1 1 21 HIS CD2 C -3.238 -12.984 -3.918 1.00 . A A . 21 HIS CD2 1 1 14 7595 1 1 21 HIS CE1 C -4.316 -11.656 -2.522 1.00 . A A . 21 HIS CE1 1 1 14 7596 1 1 21 HIS CG C -2.417 -11.957 -3.553 1.00 . A A . 21 HIS CG 1 1 14 7597 1 1 21 HIS H H -1.964 -9.580 -4.690 1.00 . A A . 21 HIS H 1 1 14 7598 1 1 21 HIS HA H 0.278 -11.162 -5.585 1.00 . A A . 21 HIS HA 1 1 14 7599 1 1 21 HIS HB2 H -0.463 -12.732 -3.908 1.00 . A A . 21 HIS HB2 1 1 14 7600 1 1 21 HIS HB3 H -0.498 -11.098 -3.287 1.00 . A A . 21 HIS HB3 1 1 14 7601 1 1 21 HIS HD2 H -2.975 -13.800 -4.577 1.00 . A A . 21 HIS HD2 1 1 14 7602 1 1 21 HIS HE1 H -5.082 -11.240 -1.883 1.00 . A A . 21 HIS HE1 1 1 14 7603 1 1 21 HIS HE2 H -5.243 -13.377 -3.294 1.00 . A A . 21 HIS HE2 1 1 14 7604 1 1 21 HIS N N -1.310 -9.841 -5.426 1.00 . A A . 21 HIS N 1 1 14 7605 1 1 21 HIS ND1 N -3.100 -11.117 -2.676 1.00 . A A . 21 HIS ND1 1 1 14 7606 1 1 21 HIS NE2 N -4.432 -12.776 -3.261 1.00 . A A . 21 HIS NE2 1 1 14 7607 1 1 21 HIS O O -1.019 -13.312 -6.516 1.00 . A A . 21 HIS O 1 1 14 7608 1 1 22 ILE C C -1.801 -12.025 -9.827 1.00 . A A . 22 ILE C 1 1 14 7609 1 1 22 ILE CA C -2.671 -12.361 -8.593 1.00 . A A . 22 ILE CA 1 1 14 7610 1 1 22 ILE CB C -4.189 -12.105 -8.808 1.00 . A A . 22 ILE CB 1 1 14 7611 1 1 22 ILE CD1 C -6.500 -12.397 -7.637 1.00 . A A . 22 ILE CD1 1 1 14 7612 1 1 22 ILE CG1 C -4.978 -12.576 -7.558 1.00 . A A . 22 ILE CG1 1 1 14 7613 1 1 22 ILE CG2 C -4.722 -12.799 -10.077 1.00 . A A . 22 ILE CG2 1 1 14 7614 1 1 22 ILE H H -2.482 -10.648 -7.346 1.00 . A A . 22 ILE H 1 1 14 7615 1 1 22 ILE HA H -2.546 -13.431 -8.418 1.00 . A A . 22 ILE HA 1 1 14 7616 1 1 22 ILE HB H -4.349 -11.033 -8.927 1.00 . A A . 22 ILE HB 1 1 14 7617 1 1 22 ILE HD11 H -6.935 -12.582 -6.655 1.00 . A A . 22 ILE HD11 1 1 14 7618 1 1 22 ILE HD12 H -6.742 -11.381 -7.951 1.00 . A A . 22 ILE HD12 1 1 14 7619 1 1 22 ILE HD13 H -6.932 -13.110 -8.339 1.00 . A A . 22 ILE HD13 1 1 14 7620 1 1 22 ILE HG12 H -4.764 -13.630 -7.374 1.00 . A A . 22 ILE HG12 1 1 14 7621 1 1 22 ILE HG13 H -4.639 -12.012 -6.689 1.00 . A A . 22 ILE HG13 1 1 14 7622 1 1 22 ILE HG21 H -4.222 -12.410 -10.964 1.00 . A A . 22 ILE HG21 1 1 14 7623 1 1 22 ILE HG22 H -4.555 -13.875 -10.014 1.00 . A A . 22 ILE HG22 1 1 14 7624 1 1 22 ILE HG23 H -5.785 -12.603 -10.210 1.00 . A A . 22 ILE HG23 1 1 14 7625 1 1 22 ILE N N -2.208 -11.624 -7.405 1.00 . A A . 22 ILE N 1 1 14 7626 1 1 22 ILE O O -1.752 -12.808 -10.773 1.00 . A A . 22 ILE O 1 1 14 7627 1 1 23 THR C C 1.087 -9.907 -10.701 1.00 . A A . 23 THR C 1 1 14 7628 1 1 23 THR CA C -0.345 -10.368 -10.986 1.00 . A A . 23 THR CA 1 1 14 7629 1 1 23 THR CB C -1.084 -9.163 -11.586 1.00 . A A . 23 THR CB 1 1 14 7630 1 1 23 THR CG2 C -2.478 -9.502 -12.119 1.00 . A A . 23 THR CG2 1 1 14 7631 1 1 23 THR H H -1.171 -10.291 -9.003 1.00 . A A . 23 THR H 1 1 14 7632 1 1 23 THR HA H -0.279 -11.139 -11.754 1.00 . A A . 23 THR HA 1 1 14 7633 1 1 23 THR HB H -0.493 -8.768 -12.414 1.00 . A A . 23 THR HB 1 1 14 7634 1 1 23 THR HG1 H -1.903 -8.464 -9.977 1.00 . A A . 23 THR HG1 1 1 14 7635 1 1 23 THR HG21 H -2.401 -10.289 -12.868 1.00 . A A . 23 THR HG21 1 1 14 7636 1 1 23 THR HG22 H -3.130 -9.839 -11.313 1.00 . A A . 23 THR HG22 1 1 14 7637 1 1 23 THR HG23 H -2.912 -8.614 -12.580 1.00 . A A . 23 THR HG23 1 1 14 7638 1 1 23 THR N N -1.078 -10.895 -9.814 1.00 . A A . 23 THR N 1 1 14 7639 1 1 23 THR O O 1.885 -9.833 -11.634 1.00 . A A . 23 THR O 1 1 14 7640 1 1 23 THR OG1 O -1.207 -8.161 -10.603 1.00 . A A . 23 THR OG1 1 1 14 7641 1 1 24 ASN C C 2.616 -7.443 -9.070 1.00 . A A . 24 ASN C 1 1 14 7642 1 1 24 ASN CA C 2.632 -8.980 -8.916 1.00 . A A . 24 ASN CA 1 1 14 7643 1 1 24 ASN CB C 3.937 -9.605 -9.458 1.00 . A A . 24 ASN CB 1 1 14 7644 1 1 24 ASN CG C 3.984 -11.123 -9.378 1.00 . A A . 24 ASN CG 1 1 14 7645 1 1 24 ASN H H 0.704 -9.743 -8.725 1.00 . A A . 24 ASN H 1 1 14 7646 1 1 24 ASN HA H 2.617 -9.159 -7.841 1.00 . A A . 24 ASN HA 1 1 14 7647 1 1 24 ASN HB2 H 4.093 -9.295 -10.491 1.00 . A A . 24 ASN HB2 1 1 14 7648 1 1 24 ASN HB3 H 4.775 -9.219 -8.879 1.00 . A A . 24 ASN HB3 1 1 14 7649 1 1 24 ASN HD21 H 3.135 -11.277 -11.194 1.00 . A A . 24 ASN HD21 1 1 14 7650 1 1 24 ASN HD22 H 3.588 -12.797 -10.391 1.00 . A A . 24 ASN HD22 1 1 14 7651 1 1 24 ASN N N 1.419 -9.625 -9.435 1.00 . A A . 24 ASN N 1 1 14 7652 1 1 24 ASN ND2 N 3.560 -11.794 -10.429 1.00 . A A . 24 ASN ND2 1 1 14 7653 1 1 24 ASN O O 3.627 -6.804 -8.778 1.00 . A A . 24 ASN O 1 1 14 7654 1 1 24 ASN OD1 O 4.411 -11.706 -8.394 1.00 . A A . 24 ASN OD1 1 1 14 7655 1 1 25 ALA C C 1.560 -4.670 -8.299 1.00 . A A . 25 ALA C 1 1 14 7656 1 1 25 ALA CA C 1.444 -5.370 -9.666 1.00 . A A . 25 ALA CA 1 1 14 7657 1 1 25 ALA CB C 0.142 -4.988 -10.383 1.00 . A A . 25 ALA CB 1 1 14 7658 1 1 25 ALA H H 0.666 -7.349 -9.738 1.00 . A A . 25 ALA H 1 1 14 7659 1 1 25 ALA HA H 2.281 -5.050 -10.290 1.00 . A A . 25 ALA HA 1 1 14 7660 1 1 25 ALA HB1 H -0.720 -5.262 -9.775 1.00 . A A . 25 ALA HB1 1 1 14 7661 1 1 25 ALA HB2 H 0.122 -3.912 -10.557 1.00 . A A . 25 ALA HB2 1 1 14 7662 1 1 25 ALA HB3 H 0.084 -5.504 -11.343 1.00 . A A . 25 ALA HB3 1 1 14 7663 1 1 25 ALA N N 1.510 -6.827 -9.524 1.00 . A A . 25 ALA N 1 1 14 7664 1 1 25 ALA O O 0.841 -5.018 -7.365 1.00 . A A . 25 ALA O 1 1 14 7665 1 1 26 SER C C 2.448 -1.474 -7.034 1.00 . A A . 26 SER C 1 1 14 7666 1 1 26 SER CA C 2.728 -2.973 -6.917 1.00 . A A . 26 SER CA 1 1 14 7667 1 1 26 SER CB C 4.185 -3.186 -6.501 1.00 . A A . 26 SER CB 1 1 14 7668 1 1 26 SER H H 3.051 -3.441 -8.950 1.00 . A A . 26 SER H 1 1 14 7669 1 1 26 SER HA H 2.105 -3.387 -6.130 1.00 . A A . 26 SER HA 1 1 14 7670 1 1 26 SER HB2 H 4.369 -2.679 -5.555 1.00 . A A . 26 SER HB2 1 1 14 7671 1 1 26 SER HB3 H 4.379 -4.248 -6.353 1.00 . A A . 26 SER HB3 1 1 14 7672 1 1 26 SER HG H 4.635 -1.816 -7.792 1.00 . A A . 26 SER HG 1 1 14 7673 1 1 26 SER N N 2.450 -3.679 -8.175 1.00 . A A . 26 SER N 1 1 14 7674 1 1 26 SER O O 3.061 -0.816 -7.877 1.00 . A A . 26 SER O 1 1 14 7675 1 1 26 SER OG O 5.037 -2.655 -7.497 1.00 . A A . 26 SER OG 1 1 14 7676 1 1 27 GLN C C 1.253 0.993 -4.676 1.00 . A A . 27 GLN C 1 1 14 7677 1 1 27 GLN CA C 1.207 0.481 -6.121 1.00 . A A . 27 GLN CA 1 1 14 7678 1 1 27 GLN CB C -0.197 0.660 -6.725 1.00 . A A . 27 GLN CB 1 1 14 7679 1 1 27 GLN CD C -1.558 0.711 -8.874 1.00 . A A . 27 GLN CD 1 1 14 7680 1 1 27 GLN CG C -0.170 0.560 -8.259 1.00 . A A . 27 GLN CG 1 1 14 7681 1 1 27 GLN H H 1.172 -1.531 -5.447 1.00 . A A . 27 GLN H 1 1 14 7682 1 1 27 GLN HA H 1.915 1.074 -6.703 1.00 . A A . 27 GLN HA 1 1 14 7683 1 1 27 GLN HB2 H -0.872 -0.097 -6.319 1.00 . A A . 27 GLN HB2 1 1 14 7684 1 1 27 GLN HB3 H -0.583 1.639 -6.447 1.00 . A A . 27 GLN HB3 1 1 14 7685 1 1 27 GLN HE21 H -1.614 2.746 -8.545 1.00 . A A . 27 GLN HE21 1 1 14 7686 1 1 27 GLN HE22 H -3.014 1.982 -9.325 1.00 . A A . 27 GLN HE22 1 1 14 7687 1 1 27 GLN HG2 H 0.477 1.344 -8.656 1.00 . A A . 27 GLN HG2 1 1 14 7688 1 1 27 GLN HG3 H 0.233 -0.407 -8.558 1.00 . A A . 27 GLN HG3 1 1 14 7689 1 1 27 GLN N N 1.580 -0.938 -6.169 1.00 . A A . 27 GLN N 1 1 14 7690 1 1 27 GLN NE2 N -2.101 1.910 -8.923 1.00 . A A . 27 GLN NE2 1 1 14 7691 1 1 27 GLN O O 0.948 0.254 -3.743 1.00 . A A . 27 GLN O 1 1 14 7692 1 1 27 GLN OE1 O -2.167 -0.246 -9.324 1.00 . A A . 27 GLN OE1 1 1 14 7693 1 1 28 PHE C C 0.262 3.362 -2.717 1.00 . A A . 28 PHE C 1 1 14 7694 1 1 28 PHE CA C 1.655 2.882 -3.143 1.00 . A A . 28 PHE CA 1 1 14 7695 1 1 28 PHE CB C 2.630 4.064 -3.163 1.00 . A A . 28 PHE CB 1 1 14 7696 1 1 28 PHE CD1 C 4.792 3.051 -2.357 1.00 . A A . 28 PHE CD1 1 1 14 7697 1 1 28 PHE CD2 C 4.649 3.789 -4.673 1.00 . A A . 28 PHE CD2 1 1 14 7698 1 1 28 PHE CE1 C 6.107 2.614 -2.578 1.00 . A A . 28 PHE CE1 1 1 14 7699 1 1 28 PHE CE2 C 5.967 3.350 -4.894 1.00 . A A . 28 PHE CE2 1 1 14 7700 1 1 28 PHE CG C 4.062 3.640 -3.403 1.00 . A A . 28 PHE CG 1 1 14 7701 1 1 28 PHE CZ C 6.697 2.760 -3.846 1.00 . A A . 28 PHE CZ 1 1 14 7702 1 1 28 PHE H H 1.666 2.898 -5.273 1.00 . A A . 28 PHE H 1 1 14 7703 1 1 28 PHE HA H 2.010 2.160 -2.406 1.00 . A A . 28 PHE HA 1 1 14 7704 1 1 28 PHE HB2 H 2.325 4.778 -3.931 1.00 . A A . 28 PHE HB2 1 1 14 7705 1 1 28 PHE HB3 H 2.585 4.574 -2.199 1.00 . A A . 28 PHE HB3 1 1 14 7706 1 1 28 PHE HD1 H 4.341 2.914 -1.384 1.00 . A A . 28 PHE HD1 1 1 14 7707 1 1 28 PHE HD2 H 4.085 4.229 -5.484 1.00 . A A . 28 PHE HD2 1 1 14 7708 1 1 28 PHE HE1 H 6.644 2.150 -1.768 1.00 . A A . 28 PHE HE1 1 1 14 7709 1 1 28 PHE HE2 H 6.412 3.457 -5.871 1.00 . A A . 28 PHE HE2 1 1 14 7710 1 1 28 PHE HZ H 7.705 2.411 -4.019 1.00 . A A . 28 PHE HZ 1 1 14 7711 1 1 28 PHE N N 1.623 2.261 -4.475 1.00 . A A . 28 PHE N 1 1 14 7712 1 1 28 PHE O O -0.063 3.375 -1.532 1.00 . A A . 28 PHE O 1 1 14 7713 1 1 29 GLU C C -2.785 3.323 -2.795 1.00 . A A . 29 GLU C 1 1 14 7714 1 1 29 GLU CA C -1.893 4.283 -3.601 1.00 . A A . 29 GLU CA 1 1 14 7715 1 1 29 GLU CB C -2.457 4.538 -5.018 1.00 . A A . 29 GLU CB 1 1 14 7716 1 1 29 GLU CD C -0.542 4.466 -6.729 1.00 . A A . 29 GLU CD 1 1 14 7717 1 1 29 GLU CG C -1.535 5.351 -5.952 1.00 . A A . 29 GLU CG 1 1 14 7718 1 1 29 GLU H H -0.122 3.749 -4.638 1.00 . A A . 29 GLU H 1 1 14 7719 1 1 29 GLU HA H -1.840 5.240 -3.081 1.00 . A A . 29 GLU HA 1 1 14 7720 1 1 29 GLU HB2 H -2.690 3.589 -5.502 1.00 . A A . 29 GLU HB2 1 1 14 7721 1 1 29 GLU HB3 H -3.392 5.086 -4.901 1.00 . A A . 29 GLU HB3 1 1 14 7722 1 1 29 GLU HG2 H -2.164 5.881 -6.672 1.00 . A A . 29 GLU HG2 1 1 14 7723 1 1 29 GLU HG3 H -0.999 6.107 -5.373 1.00 . A A . 29 GLU HG3 1 1 14 7724 1 1 29 GLU N N -0.543 3.748 -3.707 1.00 . A A . 29 GLU N 1 1 14 7725 1 1 29 GLU O O -3.121 2.234 -3.257 1.00 . A A . 29 GLU O 1 1 14 7726 1 1 29 GLU OE1 O 0.540 4.156 -6.173 1.00 . A A . 29 GLU OE1 1 1 14 7727 1 1 29 GLU OE2 O -0.897 4.041 -7.850 1.00 . A A . 29 GLU OE2 1 1 14 7728 1 1 30 ARG C C -5.286 2.597 -0.936 1.00 . A A . 30 ARG C 1 1 14 7729 1 1 30 ARG CA C -3.821 2.893 -0.575 1.00 . A A . 30 ARG CA 1 1 14 7730 1 1 30 ARG CB C -3.680 3.564 0.802 1.00 . A A . 30 ARG CB 1 1 14 7731 1 1 30 ARG CD C -4.061 3.287 3.306 1.00 . A A . 30 ARG CD 1 1 14 7732 1 1 30 ARG CG C -4.367 2.748 1.905 1.00 . A A . 30 ARG CG 1 1 14 7733 1 1 30 ARG CZ C -4.927 2.637 5.589 1.00 . A A . 30 ARG CZ 1 1 14 7734 1 1 30 ARG H H -2.833 4.638 -1.261 1.00 . A A . 30 ARG H 1 1 14 7735 1 1 30 ARG HA H -3.280 1.952 -0.537 1.00 . A A . 30 ARG HA 1 1 14 7736 1 1 30 ARG HB2 H -2.614 3.637 1.027 1.00 . A A . 30 ARG HB2 1 1 14 7737 1 1 30 ARG HB3 H -4.108 4.568 0.775 1.00 . A A . 30 ARG HB3 1 1 14 7738 1 1 30 ARG HD2 H -2.980 3.364 3.433 1.00 . A A . 30 ARG HD2 1 1 14 7739 1 1 30 ARG HD3 H -4.505 4.279 3.405 1.00 . A A . 30 ARG HD3 1 1 14 7740 1 1 30 ARG HE H -4.729 1.409 4.024 1.00 . A A . 30 ARG HE 1 1 14 7741 1 1 30 ARG HG2 H -5.448 2.759 1.758 1.00 . A A . 30 ARG HG2 1 1 14 7742 1 1 30 ARG HG3 H -4.019 1.723 1.830 1.00 . A A . 30 ARG HG3 1 1 14 7743 1 1 30 ARG HH11 H -4.464 4.572 5.498 1.00 . A A . 30 ARG HH11 1 1 14 7744 1 1 30 ARG HH12 H -5.071 4.035 7.044 1.00 . A A . 30 ARG HH12 1 1 14 7745 1 1 30 ARG HH21 H -5.450 0.719 6.013 1.00 . A A . 30 ARG HH21 1 1 14 7746 1 1 30 ARG HH22 H -5.649 1.875 7.316 1.00 . A A . 30 ARG HH22 1 1 14 7747 1 1 30 ARG N N -3.157 3.735 -1.575 1.00 . A A . 30 ARG N 1 1 14 7748 1 1 30 ARG NE N -4.599 2.375 4.330 1.00 . A A . 30 ARG NE 1 1 14 7749 1 1 30 ARG NH1 N -4.818 3.844 6.093 1.00 . A A . 30 ARG NH1 1 1 14 7750 1 1 30 ARG NH2 N -5.374 1.684 6.374 1.00 . A A . 30 ARG NH2 1 1 14 7751 1 1 30 ARG O O -6.122 3.496 -0.827 1.00 . A A . 30 ARG O 1 1 14 7752 1 1 31 PRO C C -7.947 0.716 -0.555 1.00 . A A . 31 PRO C 1 1 14 7753 1 1 31 PRO CA C -7.018 1.029 -1.727 1.00 . A A . 31 PRO CA 1 1 14 7754 1 1 31 PRO CB C -6.838 -0.122 -2.673 1.00 . A A . 31 PRO CB 1 1 14 7755 1 1 31 PRO CD C -4.821 0.163 -1.411 1.00 . A A . 31 PRO CD 1 1 14 7756 1 1 31 PRO CG C -5.701 -0.921 -2.035 1.00 . A A . 31 PRO CG 1 1 14 7757 1 1 31 PRO HA H -7.443 1.867 -2.283 1.00 . A A . 31 PRO HA 1 1 14 7758 1 1 31 PRO HB2 H -7.765 -0.671 -2.778 1.00 . A A . 31 PRO HB2 1 1 14 7759 1 1 31 PRO HB3 H -6.525 0.334 -3.602 1.00 . A A . 31 PRO HB3 1 1 14 7760 1 1 31 PRO HD2 H -4.476 -0.156 -0.427 1.00 . A A . 31 PRO HD2 1 1 14 7761 1 1 31 PRO HD3 H -3.967 0.349 -2.058 1.00 . A A . 31 PRO HD3 1 1 14 7762 1 1 31 PRO HG2 H -6.102 -1.554 -1.248 1.00 . A A . 31 PRO HG2 1 1 14 7763 1 1 31 PRO HG3 H -5.157 -1.513 -2.772 1.00 . A A . 31 PRO HG3 1 1 14 7764 1 1 31 PRO N N -5.660 1.353 -1.300 1.00 . A A . 31 PRO N 1 1 14 7765 1 1 31 PRO O O -8.555 -0.343 -0.400 1.00 . A A . 31 PRO O 1 1 14 7766 1 1 32 SER C C -8.759 0.708 2.503 1.00 . A A . 32 SER C 1 1 14 7767 1 1 32 SER CA C -8.977 1.812 1.437 1.00 . A A . 32 SER CA 1 1 14 7768 1 1 32 SER CB C -10.435 1.891 0.957 1.00 . A A . 32 SER CB 1 1 14 7769 1 1 32 SER H H -7.580 2.515 -0.147 1.00 . A A . 32 SER H 1 1 14 7770 1 1 32 SER HA H -8.755 2.757 1.934 1.00 . A A . 32 SER HA 1 1 14 7771 1 1 32 SER HB2 H -11.081 2.159 1.794 1.00 . A A . 32 SER HB2 1 1 14 7772 1 1 32 SER HB3 H -10.522 2.665 0.194 1.00 . A A . 32 SER HB3 1 1 14 7773 1 1 32 SER HG H -10.090 0.205 0.001 1.00 . A A . 32 SER HG 1 1 14 7774 1 1 32 SER N N -8.094 1.739 0.260 1.00 . A A . 32 SER N 1 1 14 7775 1 1 32 SER O O -9.708 0.308 3.184 1.00 . A A . 32 SER O 1 1 14 7776 1 1 32 SER OG O -10.865 0.651 0.416 1.00 . A A . 32 SER OG 1 1 14 7777 1 1 33 GLY C C -5.711 -0.625 4.114 1.00 . A A . 33 GLY C 1 1 14 7778 1 1 33 GLY CA C -7.133 -0.837 3.617 1.00 . A A . 33 GLY CA 1 1 14 7779 1 1 33 GLY H H -6.780 0.533 2.054 1.00 . A A . 33 GLY H 1 1 14 7780 1 1 33 GLY HA2 H -7.800 -0.816 4.481 1.00 . A A . 33 GLY HA2 1 1 14 7781 1 1 33 GLY HA3 H -7.186 -1.818 3.151 1.00 . A A . 33 GLY HA3 1 1 14 7782 1 1 33 GLY N N -7.528 0.191 2.641 1.00 . A A . 33 GLY N 1 1 14 7783 1 1 33 GLY O O -4.867 -0.167 3.319 1.00 . A A . 33 GLY O 1 1 14 7784 1 1 33 GLY OXT O -5.429 -0.794 5.318 1.00 . A A . 33 GLY OXT 1 1 14 7785 2 2 1 NAG C1 C 12.925 1.447 -0.284 1.00 . B A . 101 NAG C1 1 1 14 7786 2 2 1 NAG C2 C 12.506 2.918 -0.478 1.00 . B A . 101 NAG C2 1 1 14 7787 2 2 1 NAG C3 C 11.278 2.920 -1.396 1.00 . B A . 101 NAG C3 1 1 14 7788 2 2 1 NAG C4 C 11.637 2.302 -2.748 1.00 . B A . 101 NAG C4 1 1 14 7789 2 2 1 NAG C5 C 12.139 0.867 -2.549 1.00 . B A . 101 NAG C5 1 1 14 7790 2 2 1 NAG C6 C 12.603 0.153 -3.816 1.00 . B A . 101 NAG C6 1 1 14 7791 2 2 1 NAG C7 C 13.112 4.078 1.606 1.00 . B A . 101 NAG C7 1 1 14 7792 2 2 1 NAG C8 C 12.581 4.850 2.821 1.00 . B A . 101 NAG C8 1 1 14 7793 2 2 1 NAG H1 H 12.108 0.866 0.146 1.00 . B A . 101 NAG H1 1 1 14 7794 2 2 1 NAG H2 H 13.321 3.466 -0.956 1.00 . B A . 101 NAG H2 1 1 14 7795 2 2 1 NAG H3 H 10.485 2.330 -0.929 1.00 . B A . 101 NAG H3 1 1 14 7796 2 2 1 NAG H4 H 12.385 2.909 -3.259 1.00 . B A . 101 NAG H4 1 1 14 7797 2 2 1 NAG H5 H 11.335 0.293 -2.109 1.00 . B A . 101 NAG H5 1 1 14 7798 2 2 1 NAG H61 H 12.752 -0.905 -3.603 1.00 . B A . 101 NAG H61 1 1 14 7799 2 2 1 NAG H62 H 11.868 0.242 -4.614 1.00 . B A . 101 NAG H62 1 1 14 7800 2 2 1 NAG H81 H 11.693 5.422 2.547 1.00 . B A . 101 NAG H81 1 1 14 7801 2 2 1 NAG H82 H 13.348 5.539 3.178 1.00 . B A . 101 NAG H82 1 1 14 7802 2 2 1 NAG H83 H 12.335 4.151 3.617 1.00 . B A . 101 NAG H83 1 1 14 7803 2 2 1 NAG HN2 H 11.222 3.568 1.107 1.00 . B A . 101 NAG HN2 1 1 14 7804 2 2 1 NAG HO3 H 10.701 4.728 -0.783 1.00 . B A . 101 NAG HO3 1 1 14 7805 2 2 1 NAG HO4 H 10.050 3.183 -3.377 1.00 . B A . 101 NAG HO4 1 1 14 7806 2 2 1 NAG HO6 H 14.398 0.780 -3.409 1.00 . B A . 101 NAG HO6 1 1 14 7807 2 2 1 NAG N2 N 12.188 3.571 0.791 1.00 . B A . 101 NAG N2 1 1 14 7808 2 2 1 NAG O3 O 10.796 4.265 -1.625 1.00 . B A . 101 NAG O3 1 1 14 7809 2 2 1 NAG O4 O 10.420 2.299 -3.505 1.00 . B A . 101 NAG O4 1 1 14 7810 2 2 1 NAG O5 O 13.275 0.893 -1.596 1.00 . B A . 101 NAG O5 1 1 14 7811 2 2 1 NAG O6 O 13.859 0.724 -4.208 1.00 . B A . 101 NAG O6 1 1 14 7812 2 2 1 NAG O7 O 14.312 3.921 1.390 1.00 . B A . 101 NAG O7 1 1 15 7813 1 1 1 LYS C C -8.135 1.382 -2.581 1.00 . A A . 1 LYS C 1 1 15 7814 1 1 1 LYS CA C -8.689 2.661 -1.945 1.00 . A A . 1 LYS CA 1 1 15 7815 1 1 1 LYS CB C -9.599 3.434 -2.923 1.00 . A A . 1 LYS CB 1 1 15 7816 1 1 1 LYS CD C -10.527 5.857 -3.165 1.00 . A A . 1 LYS CD 1 1 15 7817 1 1 1 LYS CE C -9.328 6.378 -3.983 1.00 . A A . 1 LYS CE 1 1 15 7818 1 1 1 LYS CG C -10.295 4.637 -2.254 1.00 . A A . 1 LYS CG 1 1 15 7819 1 1 1 LYS H1 H -7.007 3.789 -2.325 1.00 . A A . 1 LYS H1 1 1 15 7820 1 1 1 LYS H2 H -6.964 3.044 -0.853 1.00 . A A . 1 LYS H2 1 1 15 7821 1 1 1 LYS H3 H -7.888 4.379 -1.086 1.00 . A A . 1 LYS H3 1 1 15 7822 1 1 1 LYS HA H -9.279 2.378 -1.074 1.00 . A A . 1 LYS HA 1 1 15 7823 1 1 1 LYS HB2 H -8.991 3.767 -3.764 1.00 . A A . 1 LYS HB2 1 1 15 7824 1 1 1 LYS HB3 H -10.365 2.764 -3.314 1.00 . A A . 1 LYS HB3 1 1 15 7825 1 1 1 LYS HD2 H -11.321 5.605 -3.870 1.00 . A A . 1 LYS HD2 1 1 15 7826 1 1 1 LYS HD3 H -10.899 6.672 -2.542 1.00 . A A . 1 LYS HD3 1 1 15 7827 1 1 1 LYS HE2 H -9.106 5.662 -4.779 1.00 . A A . 1 LYS HE2 1 1 15 7828 1 1 1 LYS HE3 H -9.634 7.310 -4.464 1.00 . A A . 1 LYS HE3 1 1 15 7829 1 1 1 LYS HG2 H -11.259 4.303 -1.871 1.00 . A A . 1 LYS HG2 1 1 15 7830 1 1 1 LYS HG3 H -9.732 4.968 -1.389 1.00 . A A . 1 LYS HG3 1 1 15 7831 1 1 1 LYS HZ1 H -8.236 6.549 -2.174 1.00 . A A . 1 LYS HZ1 1 1 15 7832 1 1 1 LYS HZ2 H -7.385 5.907 -3.413 1.00 . A A . 1 LYS HZ2 1 1 15 7833 1 1 1 LYS HZ3 H -7.690 7.517 -3.395 1.00 . A A . 1 LYS HZ3 1 1 15 7834 1 1 1 LYS N N -7.563 3.518 -1.518 1.00 . A A . 1 LYS N 1 1 15 7835 1 1 1 LYS NZ N -8.095 6.617 -3.190 1.00 . A A . 1 LYS NZ 1 1 15 7836 1 1 1 LYS O O -7.977 1.333 -3.794 1.00 . A A . 1 LYS O 1 1 15 7837 1 1 2 LEU C C -7.918 -1.585 -3.304 1.00 . A A . 2 LEU C 1 1 15 7838 1 1 2 LEU CA C -7.107 -0.846 -2.211 1.00 . A A . 2 LEU CA 1 1 15 7839 1 1 2 LEU CB C -6.893 -1.743 -0.971 1.00 . A A . 2 LEU CB 1 1 15 7840 1 1 2 LEU CD1 C -4.865 -2.937 -1.910 1.00 . A A . 2 LEU CD1 1 1 15 7841 1 1 2 LEU CD2 C -6.030 -3.879 0.082 1.00 . A A . 2 LEU CD2 1 1 15 7842 1 1 2 LEU CG C -6.212 -3.104 -1.220 1.00 . A A . 2 LEU CG 1 1 15 7843 1 1 2 LEU H H -7.938 0.451 -0.769 1.00 . A A . 2 LEU H 1 1 15 7844 1 1 2 LEU HA H -6.129 -0.561 -2.595 1.00 . A A . 2 LEU HA 1 1 15 7845 1 1 2 LEU HB2 H -6.278 -1.190 -0.265 1.00 . A A . 2 LEU HB2 1 1 15 7846 1 1 2 LEU HB3 H -7.860 -1.929 -0.502 1.00 . A A . 2 LEU HB3 1 1 15 7847 1 1 2 LEU HD11 H -4.345 -3.890 -1.913 1.00 . A A . 2 LEU HD11 1 1 15 7848 1 1 2 LEU HD12 H -5.010 -2.637 -2.942 1.00 . A A . 2 LEU HD12 1 1 15 7849 1 1 2 LEU HD13 H -4.271 -2.184 -1.396 1.00 . A A . 2 LEU HD13 1 1 15 7850 1 1 2 LEU HD21 H -5.636 -4.871 -0.135 1.00 . A A . 2 LEU HD21 1 1 15 7851 1 1 2 LEU HD22 H -5.337 -3.352 0.727 1.00 . A A . 2 LEU HD22 1 1 15 7852 1 1 2 LEU HD23 H -6.992 -3.995 0.580 1.00 . A A . 2 LEU HD23 1 1 15 7853 1 1 2 LEU HG H -6.834 -3.730 -1.835 1.00 . A A . 2 LEU HG 1 1 15 7854 1 1 2 LEU N N -7.789 0.378 -1.761 1.00 . A A . 2 LEU N 1 1 15 7855 1 1 2 LEU O O -9.034 -2.020 -3.013 1.00 . A A . 2 LEU O 1 1 15 7856 1 1 3 PRO C C -8.063 -4.074 -5.301 1.00 . A A . 3 PRO C 1 1 15 7857 1 1 3 PRO CA C -8.063 -2.551 -5.570 1.00 . A A . 3 PRO CA 1 1 15 7858 1 1 3 PRO CB C -7.339 -2.199 -6.876 1.00 . A A . 3 PRO CB 1 1 15 7859 1 1 3 PRO CD C -6.213 -1.101 -5.082 1.00 . A A . 3 PRO CD 1 1 15 7860 1 1 3 PRO CG C -5.945 -1.776 -6.419 1.00 . A A . 3 PRO CG 1 1 15 7861 1 1 3 PRO HA H -9.093 -2.203 -5.637 1.00 . A A . 3 PRO HA 1 1 15 7862 1 1 3 PRO HB2 H -7.298 -3.040 -7.571 1.00 . A A . 3 PRO HB2 1 1 15 7863 1 1 3 PRO HB3 H -7.837 -1.350 -7.346 1.00 . A A . 3 PRO HB3 1 1 15 7864 1 1 3 PRO HD2 H -5.332 -1.181 -4.450 1.00 . A A . 3 PRO HD2 1 1 15 7865 1 1 3 PRO HD3 H -6.453 -0.052 -5.251 1.00 . A A . 3 PRO HD3 1 1 15 7866 1 1 3 PRO HG2 H -5.332 -2.654 -6.244 1.00 . A A . 3 PRO HG2 1 1 15 7867 1 1 3 PRO HG3 H -5.466 -1.101 -7.130 1.00 . A A . 3 PRO HG3 1 1 15 7868 1 1 3 PRO N N -7.379 -1.782 -4.526 1.00 . A A . 3 PRO N 1 1 15 7869 1 1 3 PRO O O -7.164 -4.594 -4.635 1.00 . A A . 3 PRO O 1 1 15 7870 1 1 4 PRO C C -8.067 -7.084 -6.189 1.00 . A A . 4 PRO C 1 1 15 7871 1 1 4 PRO CA C -9.207 -6.252 -5.585 1.00 . A A . 4 PRO CA 1 1 15 7872 1 1 4 PRO CB C -10.570 -6.627 -6.177 1.00 . A A . 4 PRO CB 1 1 15 7873 1 1 4 PRO CD C -10.107 -4.347 -6.723 1.00 . A A . 4 PRO CD 1 1 15 7874 1 1 4 PRO CG C -10.779 -5.597 -7.285 1.00 . A A . 4 PRO CG 1 1 15 7875 1 1 4 PRO HA H -9.234 -6.416 -4.507 1.00 . A A . 4 PRO HA 1 1 15 7876 1 1 4 PRO HB2 H -10.589 -7.647 -6.564 1.00 . A A . 4 PRO HB2 1 1 15 7877 1 1 4 PRO HB3 H -11.341 -6.498 -5.416 1.00 . A A . 4 PRO HB3 1 1 15 7878 1 1 4 PRO HD2 H -9.714 -3.737 -7.538 1.00 . A A . 4 PRO HD2 1 1 15 7879 1 1 4 PRO HD3 H -10.827 -3.774 -6.136 1.00 . A A . 4 PRO HD3 1 1 15 7880 1 1 4 PRO HG2 H -10.259 -5.918 -8.188 1.00 . A A . 4 PRO HG2 1 1 15 7881 1 1 4 PRO HG3 H -11.837 -5.430 -7.490 1.00 . A A . 4 PRO HG3 1 1 15 7882 1 1 4 PRO N N -9.043 -4.823 -5.849 1.00 . A A . 4 PRO N 1 1 15 7883 1 1 4 PRO O O -7.725 -6.937 -7.361 1.00 . A A . 4 PRO O 1 1 15 7884 1 1 5 GLY C C -4.984 -8.283 -5.256 1.00 . A A . 5 GLY C 1 1 15 7885 1 1 5 GLY CA C -6.342 -8.813 -5.733 1.00 . A A . 5 GLY CA 1 1 15 7886 1 1 5 GLY H H -7.820 -8.048 -4.424 1.00 . A A . 5 GLY H 1 1 15 7887 1 1 5 GLY HA2 H -6.487 -9.803 -5.300 1.00 . A A . 5 GLY HA2 1 1 15 7888 1 1 5 GLY HA3 H -6.296 -8.925 -6.818 1.00 . A A . 5 GLY HA3 1 1 15 7889 1 1 5 GLY N N -7.480 -7.965 -5.371 1.00 . A A . 5 GLY N 1 1 15 7890 1 1 5 GLY O O -4.008 -9.029 -5.317 1.00 . A A . 5 GLY O 1 1 15 7891 1 1 6 TRP C C -3.655 -6.710 -2.650 1.00 . A A . 6 TRP C 1 1 15 7892 1 1 6 TRP CA C -3.711 -6.451 -4.171 1.00 . A A . 6 TRP CA 1 1 15 7893 1 1 6 TRP CB C -3.656 -4.953 -4.499 1.00 . A A . 6 TRP CB 1 1 15 7894 1 1 6 TRP CD1 C -1.928 -4.001 -6.079 1.00 . A A . 6 TRP CD1 1 1 15 7895 1 1 6 TRP CD2 C -3.804 -4.590 -7.153 1.00 . A A . 6 TRP CD2 1 1 15 7896 1 1 6 TRP CE2 C -2.931 -4.012 -8.123 1.00 . A A . 6 TRP CE2 1 1 15 7897 1 1 6 TRP CE3 C -5.067 -5.019 -7.611 1.00 . A A . 6 TRP CE3 1 1 15 7898 1 1 6 TRP CG C -3.140 -4.555 -5.852 1.00 . A A . 6 TRP CG 1 1 15 7899 1 1 6 TRP CH2 C -4.551 -4.328 -9.896 1.00 . A A . 6 TRP CH2 1 1 15 7900 1 1 6 TRP CZ2 C -3.282 -3.894 -9.477 1.00 . A A . 6 TRP CZ2 1 1 15 7901 1 1 6 TRP CZ3 C -5.443 -4.886 -8.961 1.00 . A A . 6 TRP CZ3 1 1 15 7902 1 1 6 TRP H H -5.746 -6.461 -4.722 1.00 . A A . 6 TRP H 1 1 15 7903 1 1 6 TRP HA H -2.837 -6.914 -4.610 1.00 . A A . 6 TRP HA 1 1 15 7904 1 1 6 TRP HB2 H -4.644 -4.518 -4.364 1.00 . A A . 6 TRP HB2 1 1 15 7905 1 1 6 TRP HB3 H -3.005 -4.481 -3.777 1.00 . A A . 6 TRP HB3 1 1 15 7906 1 1 6 TRP HD1 H -1.187 -3.805 -5.319 1.00 . A A . 6 TRP HD1 1 1 15 7907 1 1 6 TRP HE1 H -0.938 -3.322 -7.810 1.00 . A A . 6 TRP HE1 1 1 15 7908 1 1 6 TRP HE3 H -5.765 -5.429 -6.899 1.00 . A A . 6 TRP HE3 1 1 15 7909 1 1 6 TRP HH2 H -4.848 -4.228 -10.931 1.00 . A A . 6 TRP HH2 1 1 15 7910 1 1 6 TRP HZ2 H -2.589 -3.462 -10.184 1.00 . A A . 6 TRP HZ2 1 1 15 7911 1 1 6 TRP HZ3 H -6.426 -5.212 -9.273 1.00 . A A . 6 TRP HZ3 1 1 15 7912 1 1 6 TRP N N -4.913 -7.035 -4.770 1.00 . A A . 6 TRP N 1 1 15 7913 1 1 6 TRP NE1 N -1.788 -3.702 -7.418 1.00 . A A . 6 TRP NE1 1 1 15 7914 1 1 6 TRP O O -4.650 -6.551 -1.947 1.00 . A A . 6 TRP O 1 1 15 7915 1 1 7 GLU C C -1.017 -6.895 -0.132 1.00 . A A . 7 GLU C 1 1 15 7916 1 1 7 GLU CA C -2.246 -7.583 -0.775 1.00 . A A . 7 GLU CA 1 1 15 7917 1 1 7 GLU CB C -2.129 -9.114 -0.897 1.00 . A A . 7 GLU CB 1 1 15 7918 1 1 7 GLU CD C -0.619 -10.027 0.987 1.00 . A A . 7 GLU CD 1 1 15 7919 1 1 7 GLU CG C -2.037 -9.887 0.425 1.00 . A A . 7 GLU CG 1 1 15 7920 1 1 7 GLU H H -1.719 -7.288 -2.790 1.00 . A A . 7 GLU H 1 1 15 7921 1 1 7 GLU HA H -3.122 -7.360 -0.163 1.00 . A A . 7 GLU HA 1 1 15 7922 1 1 7 GLU HB2 H -3.037 -9.462 -1.394 1.00 . A A . 7 GLU HB2 1 1 15 7923 1 1 7 GLU HB3 H -1.296 -9.373 -1.551 1.00 . A A . 7 GLU HB3 1 1 15 7924 1 1 7 GLU HG2 H -2.685 -9.405 1.160 1.00 . A A . 7 GLU HG2 1 1 15 7925 1 1 7 GLU HG3 H -2.425 -10.893 0.254 1.00 . A A . 7 GLU HG3 1 1 15 7926 1 1 7 GLU N N -2.477 -7.087 -2.140 1.00 . A A . 7 GLU N 1 1 15 7927 1 1 7 GLU O O -0.007 -6.687 -0.801 1.00 . A A . 7 GLU O 1 1 15 7928 1 1 7 GLU OE1 O 0.359 -10.046 0.201 1.00 . A A . 7 GLU OE1 1 1 15 7929 1 1 7 GLU OE2 O -0.507 -10.127 2.227 1.00 . A A . 7 GLU OE2 1 1 15 7930 1 1 8 LYS C C 1.340 -6.177 1.859 1.00 . A A . 8 LYS C 1 1 15 7931 1 1 8 LYS CA C -0.102 -5.630 1.820 1.00 . A A . 8 LYS CA 1 1 15 7932 1 1 8 LYS CB C -0.593 -5.202 3.225 1.00 . A A . 8 LYS CB 1 1 15 7933 1 1 8 LYS CD C -0.935 -7.467 4.443 1.00 . A A . 8 LYS CD 1 1 15 7934 1 1 8 LYS CE C -0.065 -8.525 5.130 1.00 . A A . 8 LYS CE 1 1 15 7935 1 1 8 LYS CG C -0.220 -6.105 4.416 1.00 . A A . 8 LYS CG 1 1 15 7936 1 1 8 LYS H H -1.941 -6.702 1.667 1.00 . A A . 8 LYS H 1 1 15 7937 1 1 8 LYS HA H -0.061 -4.715 1.226 1.00 . A A . 8 LYS HA 1 1 15 7938 1 1 8 LYS HB2 H -0.158 -4.221 3.429 1.00 . A A . 8 LYS HB2 1 1 15 7939 1 1 8 LYS HB3 H -1.675 -5.073 3.214 1.00 . A A . 8 LYS HB3 1 1 15 7940 1 1 8 LYS HD2 H -1.871 -7.357 4.993 1.00 . A A . 8 LYS HD2 1 1 15 7941 1 1 8 LYS HD3 H -1.177 -7.806 3.437 1.00 . A A . 8 LYS HD3 1 1 15 7942 1 1 8 LYS HE2 H 0.443 -8.072 5.985 1.00 . A A . 8 LYS HE2 1 1 15 7943 1 1 8 LYS HE3 H -0.710 -9.329 5.493 1.00 . A A . 8 LYS HE3 1 1 15 7944 1 1 8 LYS HG2 H 0.861 -6.243 4.437 1.00 . A A . 8 LYS HG2 1 1 15 7945 1 1 8 LYS HG3 H -0.477 -5.578 5.336 1.00 . A A . 8 LYS HG3 1 1 15 7946 1 1 8 LYS HZ1 H 1.362 -8.358 3.619 1.00 . A A . 8 LYS HZ1 1 1 15 7947 1 1 8 LYS HZ2 H 1.593 -9.692 4.611 1.00 . A A . 8 LYS HZ2 1 1 15 7948 1 1 8 LYS HZ3 H 0.403 -9.629 3.460 1.00 . A A . 8 LYS HZ3 1 1 15 7949 1 1 8 LYS N N -1.102 -6.490 1.148 1.00 . A A . 8 LYS N 1 1 15 7950 1 1 8 LYS NZ N 0.915 -9.090 4.173 1.00 . A A . 8 LYS NZ 1 1 15 7951 1 1 8 LYS O O 1.566 -7.349 2.171 1.00 . A A . 8 LYS O 1 1 15 7952 1 1 9 ARG C C 4.541 -4.343 2.293 1.00 . A A . 9 ARG C 1 1 15 7953 1 1 9 ARG CA C 3.776 -5.538 1.701 1.00 . A A . 9 ARG CA 1 1 15 7954 1 1 9 ARG CB C 4.302 -5.764 0.272 1.00 . A A . 9 ARG CB 1 1 15 7955 1 1 9 ARG CD C 3.849 -8.262 0.088 1.00 . A A . 9 ARG CD 1 1 15 7956 1 1 9 ARG CG C 3.684 -6.888 -0.563 1.00 . A A . 9 ARG CG 1 1 15 7957 1 1 9 ARG CZ C 2.968 -10.010 -1.496 1.00 . A A . 9 ARG CZ 1 1 15 7958 1 1 9 ARG H H 2.056 -4.331 1.433 1.00 . A A . 9 ARG H 1 1 15 7959 1 1 9 ARG HA H 3.987 -6.407 2.324 1.00 . A A . 9 ARG HA 1 1 15 7960 1 1 9 ARG HB2 H 4.132 -4.834 -0.263 1.00 . A A . 9 ARG HB2 1 1 15 7961 1 1 9 ARG HB3 H 5.376 -5.950 0.312 1.00 . A A . 9 ARG HB3 1 1 15 7962 1 1 9 ARG HD2 H 4.869 -8.619 -0.062 1.00 . A A . 9 ARG HD2 1 1 15 7963 1 1 9 ARG HD3 H 3.695 -8.161 1.154 1.00 . A A . 9 ARG HD3 1 1 15 7964 1 1 9 ARG HE H 1.963 -9.310 0.037 1.00 . A A . 9 ARG HE 1 1 15 7965 1 1 9 ARG HG2 H 2.637 -6.651 -0.743 1.00 . A A . 9 ARG HG2 1 1 15 7966 1 1 9 ARG HG3 H 4.186 -6.918 -1.528 1.00 . A A . 9 ARG HG3 1 1 15 7967 1 1 9 ARG HH11 H 4.807 -9.450 -2.029 1.00 . A A . 9 ARG HH11 1 1 15 7968 1 1 9 ARG HH12 H 4.012 -10.546 -3.132 1.00 . A A . 9 ARG HH12 1 1 15 7969 1 1 9 ARG HH21 H 1.154 -10.655 -1.124 1.00 . A A . 9 ARG HH21 1 1 15 7970 1 1 9 ARG HH22 H 1.920 -11.410 -2.551 1.00 . A A . 9 ARG HH22 1 1 15 7971 1 1 9 ARG N N 2.323 -5.290 1.661 1.00 . A A . 9 ARG N 1 1 15 7972 1 1 9 ARG NE N 2.874 -9.229 -0.433 1.00 . A A . 9 ARG NE 1 1 15 7973 1 1 9 ARG NH1 N 4.034 -10.044 -2.262 1.00 . A A . 9 ARG NH1 1 1 15 7974 1 1 9 ARG NH2 N 1.942 -10.764 -1.788 1.00 . A A . 9 ARG NH2 1 1 15 7975 1 1 9 ARG O O 3.970 -3.279 2.530 1.00 . A A . 9 ARG O 1 1 15 7976 1 1 10 MET C C 8.185 -3.740 2.468 1.00 . A A . 10 MET C 1 1 15 7977 1 1 10 MET CA C 6.769 -3.508 3.014 1.00 . A A . 10 MET CA 1 1 15 7978 1 1 10 MET CB C 6.725 -3.627 4.546 1.00 . A A . 10 MET CB 1 1 15 7979 1 1 10 MET CE C 7.456 -0.849 7.592 1.00 . A A . 10 MET CE 1 1 15 7980 1 1 10 MET CG C 7.371 -2.449 5.279 1.00 . A A . 10 MET CG 1 1 15 7981 1 1 10 MET H H 6.284 -5.387 2.200 1.00 . A A . 10 MET H 1 1 15 7982 1 1 10 MET HA H 6.426 -2.518 2.730 1.00 . A A . 10 MET HA 1 1 15 7983 1 1 10 MET HB2 H 5.681 -3.671 4.860 1.00 . A A . 10 MET HB2 1 1 15 7984 1 1 10 MET HB3 H 7.206 -4.555 4.861 1.00 . A A . 10 MET HB3 1 1 15 7985 1 1 10 MET HE1 H 6.893 -0.121 7.007 1.00 . A A . 10 MET HE1 1 1 15 7986 1 1 10 MET HE2 H 7.205 -0.731 8.646 1.00 . A A . 10 MET HE2 1 1 15 7987 1 1 10 MET HE3 H 8.522 -0.679 7.462 1.00 . A A . 10 MET HE3 1 1 15 7988 1 1 10 MET HG2 H 8.449 -2.454 5.113 1.00 . A A . 10 MET HG2 1 1 15 7989 1 1 10 MET HG3 H 6.961 -1.521 4.883 1.00 . A A . 10 MET HG3 1 1 15 7990 1 1 10 MET N N 5.860 -4.503 2.443 1.00 . A A . 10 MET N 1 1 15 7991 1 1 10 MET O O 8.717 -4.845 2.558 1.00 . A A . 10 MET O 1 1 15 7992 1 1 10 MET SD S 7.031 -2.526 7.061 1.00 . A A . 10 MET SD 1 1 15 7993 1 1 11 PHE C C 11.169 -2.721 2.404 1.00 . A A . 11 PHE C 1 1 15 7994 1 1 11 PHE CA C 10.119 -2.730 1.281 1.00 . A A . 11 PHE CA 1 1 15 7995 1 1 11 PHE CB C 10.311 -1.515 0.365 1.00 . A A . 11 PHE CB 1 1 15 7996 1 1 11 PHE CD1 C 10.047 -2.532 -1.941 1.00 . A A . 11 PHE CD1 1 1 15 7997 1 1 11 PHE CD2 C 8.566 -0.708 -1.304 1.00 . A A . 11 PHE CD2 1 1 15 7998 1 1 11 PHE CE1 C 9.462 -2.560 -3.220 1.00 . A A . 11 PHE CE1 1 1 15 7999 1 1 11 PHE CE2 C 7.994 -0.729 -2.587 1.00 . A A . 11 PHE CE2 1 1 15 8000 1 1 11 PHE CG C 9.605 -1.602 -0.977 1.00 . A A . 11 PHE CG 1 1 15 8001 1 1 11 PHE CZ C 8.441 -1.651 -3.544 1.00 . A A . 11 PHE CZ 1 1 15 8002 1 1 11 PHE H H 8.242 -1.846 1.751 1.00 . A A . 11 PHE H 1 1 15 8003 1 1 11 PHE HA H 10.257 -3.618 0.671 1.00 . A A . 11 PHE HA 1 1 15 8004 1 1 11 PHE HB2 H 9.984 -0.626 0.897 1.00 . A A . 11 PHE HB2 1 1 15 8005 1 1 11 PHE HB3 H 11.375 -1.391 0.159 1.00 . A A . 11 PHE HB3 1 1 15 8006 1 1 11 PHE HD1 H 10.863 -3.205 -1.723 1.00 . A A . 11 PHE HD1 1 1 15 8007 1 1 11 PHE HD2 H 8.189 -0.001 -0.583 1.00 . A A . 11 PHE HD2 1 1 15 8008 1 1 11 PHE HE1 H 9.808 -3.264 -3.964 1.00 . A A . 11 PHE HE1 1 1 15 8009 1 1 11 PHE HE2 H 7.201 -0.045 -2.849 1.00 . A A . 11 PHE HE2 1 1 15 8010 1 1 11 PHE HZ H 7.998 -1.645 -4.529 1.00 . A A . 11 PHE HZ 1 1 15 8011 1 1 11 PHE N N 8.759 -2.718 1.824 1.00 . A A . 11 PHE N 1 1 15 8012 1 1 11 PHE O O 10.903 -2.254 3.510 1.00 . A A . 11 PHE O 1 1 15 8013 1 1 12 ALA C C 13.944 -1.864 3.650 1.00 . A A . 12 ALA C 1 1 15 8014 1 1 12 ALA CA C 13.507 -3.224 3.061 1.00 . A A . 12 ALA CA 1 1 15 8015 1 1 12 ALA CB C 14.687 -3.927 2.381 1.00 . A A . 12 ALA CB 1 1 15 8016 1 1 12 ALA H H 12.587 -3.523 1.178 1.00 . A A . 12 ALA H 1 1 15 8017 1 1 12 ALA HA H 13.183 -3.842 3.900 1.00 . A A . 12 ALA HA 1 1 15 8018 1 1 12 ALA HB1 H 14.381 -4.915 2.030 1.00 . A A . 12 ALA HB1 1 1 15 8019 1 1 12 ALA HB2 H 15.043 -3.336 1.536 1.00 . A A . 12 ALA HB2 1 1 15 8020 1 1 12 ALA HB3 H 15.501 -4.050 3.097 1.00 . A A . 12 ALA HB3 1 1 15 8021 1 1 12 ALA N N 12.401 -3.150 2.097 1.00 . A A . 12 ALA N 1 1 15 8022 1 1 12 ALA O O 14.608 -1.833 4.682 1.00 . A A . 12 ALA O 1 1 15 8023 1 1 13 ASN C C 12.556 1.041 4.508 1.00 . A A . 13 ASN C 1 1 15 8024 1 1 13 ASN CA C 13.713 0.611 3.570 1.00 . A A . 13 ASN CA 1 1 15 8025 1 1 13 ASN CB C 13.896 1.591 2.389 1.00 . A A . 13 ASN CB 1 1 15 8026 1 1 13 ASN CG C 12.703 1.636 1.439 1.00 . A A . 13 ASN CG 1 1 15 8027 1 1 13 ASN H H 12.991 -0.836 2.195 1.00 . A A . 13 ASN H 1 1 15 8028 1 1 13 ASN HA H 14.623 0.638 4.173 1.00 . A A . 13 ASN HA 1 1 15 8029 1 1 13 ASN HB2 H 14.065 2.597 2.776 1.00 . A A . 13 ASN HB2 1 1 15 8030 1 1 13 ASN HB3 H 14.784 1.296 1.828 1.00 . A A . 13 ASN HB3 1 1 15 8031 1 1 13 ASN HD21 H 13.819 2.401 -0.080 1.00 . A A . 13 ASN HD21 1 1 15 8032 1 1 13 ASN N N 13.550 -0.745 3.030 1.00 . A A . 13 ASN N 1 1 15 8033 1 1 13 ASN ND2 N 12.915 2.060 0.196 1.00 . A A . 13 ASN ND2 1 1 15 8034 1 1 13 ASN O O 12.576 2.159 5.016 1.00 . A A . 13 ASN O 1 1 15 8035 1 1 13 ASN OD1 O 11.599 1.239 1.810 1.00 . A A . 13 ASN OD1 1 1 15 8036 1 1 14 GLY C C 9.136 0.977 4.779 1.00 . A A . 14 GLY C 1 1 15 8037 1 1 14 GLY CA C 10.363 0.445 5.536 1.00 . A A . 14 GLY CA 1 1 15 8038 1 1 14 GLY H H 11.568 -0.731 4.267 1.00 . A A . 14 GLY H 1 1 15 8039 1 1 14 GLY HA2 H 10.082 -0.495 6.005 1.00 . A A . 14 GLY HA2 1 1 15 8040 1 1 14 GLY HA3 H 10.616 1.158 6.321 1.00 . A A . 14 GLY HA3 1 1 15 8041 1 1 14 GLY N N 11.542 0.185 4.709 1.00 . A A . 14 GLY N 1 1 15 8042 1 1 14 GLY O O 8.216 1.480 5.419 1.00 . A A . 14 GLY O 1 1 15 8043 1 1 15 THR C C 6.923 0.604 2.346 1.00 . A A . 15 THR C 1 1 15 8044 1 1 15 THR CA C 8.059 1.573 2.636 1.00 . A A . 15 THR CA 1 1 15 8045 1 1 15 THR CB C 8.661 2.115 1.331 1.00 . A A . 15 THR CB 1 1 15 8046 1 1 15 THR CG2 C 7.695 2.891 0.437 1.00 . A A . 15 THR CG2 1 1 15 8047 1 1 15 THR H H 9.807 0.383 2.936 1.00 . A A . 15 THR H 1 1 15 8048 1 1 15 THR HA H 7.664 2.426 3.184 1.00 . A A . 15 THR HA 1 1 15 8049 1 1 15 THR HB H 9.066 1.290 0.757 1.00 . A A . 15 THR HB 1 1 15 8050 1 1 15 THR HG1 H 10.472 2.353 1.880 1.00 . A A . 15 THR HG1 1 1 15 8051 1 1 15 THR HG21 H 6.815 2.287 0.218 1.00 . A A . 15 THR HG21 1 1 15 8052 1 1 15 THR HG22 H 7.387 3.813 0.931 1.00 . A A . 15 THR HG22 1 1 15 8053 1 1 15 THR HG23 H 8.190 3.127 -0.507 1.00 . A A . 15 THR HG23 1 1 15 8054 1 1 15 THR N N 9.094 0.899 3.441 1.00 . A A . 15 THR N 1 1 15 8055 1 1 15 THR O O 7.159 -0.444 1.748 1.00 . A A . 15 THR O 1 1 15 8056 1 1 15 THR OG1 O 9.732 2.964 1.651 1.00 . A A . 15 THR OG1 1 1 15 8057 1 1 16 VAL C C 3.806 0.238 1.325 1.00 . A A . 16 VAL C 1 1 15 8058 1 1 16 VAL CA C 4.545 0.027 2.641 1.00 . A A . 16 VAL CA 1 1 15 8059 1 1 16 VAL CB C 3.599 0.219 3.849 1.00 . A A . 16 VAL CB 1 1 15 8060 1 1 16 VAL CG1 C 2.194 -0.381 3.665 1.00 . A A . 16 VAL CG1 1 1 15 8061 1 1 16 VAL CG2 C 4.219 -0.451 5.080 1.00 . A A . 16 VAL CG2 1 1 15 8062 1 1 16 VAL H H 5.526 1.844 3.162 1.00 . A A . 16 VAL H 1 1 15 8063 1 1 16 VAL HA H 4.907 -0.998 2.663 1.00 . A A . 16 VAL HA 1 1 15 8064 1 1 16 VAL HB H 3.485 1.286 4.048 1.00 . A A . 16 VAL HB 1 1 15 8065 1 1 16 VAL HG11 H 1.658 0.147 2.878 1.00 . A A . 16 VAL HG11 1 1 15 8066 1 1 16 VAL HG12 H 2.264 -1.440 3.412 1.00 . A A . 16 VAL HG12 1 1 15 8067 1 1 16 VAL HG13 H 1.625 -0.274 4.589 1.00 . A A . 16 VAL HG13 1 1 15 8068 1 1 16 VAL HG21 H 4.305 -1.526 4.906 1.00 . A A . 16 VAL HG21 1 1 15 8069 1 1 16 VAL HG22 H 5.205 -0.031 5.276 1.00 . A A . 16 VAL HG22 1 1 15 8070 1 1 16 VAL HG23 H 3.591 -0.282 5.954 1.00 . A A . 16 VAL HG23 1 1 15 8071 1 1 16 VAL N N 5.687 0.951 2.719 1.00 . A A . 16 VAL N 1 1 15 8072 1 1 16 VAL O O 3.568 1.363 0.893 1.00 . A A . 16 VAL O 1 1 15 8073 1 1 17 TYR C C 1.736 -2.132 -0.527 1.00 . A A . 17 TYR C 1 1 15 8074 1 1 17 TYR CA C 2.693 -0.940 -0.552 1.00 . A A . 17 TYR CA 1 1 15 8075 1 1 17 TYR CB C 3.676 -1.051 -1.738 1.00 . A A . 17 TYR CB 1 1 15 8076 1 1 17 TYR CD1 C 5.729 -2.282 -0.949 1.00 . A A . 17 TYR CD1 1 1 15 8077 1 1 17 TYR CD2 C 4.294 -3.398 -2.573 1.00 . A A . 17 TYR CD2 1 1 15 8078 1 1 17 TYR CE1 C 6.624 -3.365 -0.982 1.00 . A A . 17 TYR CE1 1 1 15 8079 1 1 17 TYR CE2 C 5.188 -4.489 -2.616 1.00 . A A . 17 TYR CE2 1 1 15 8080 1 1 17 TYR CG C 4.574 -2.280 -1.752 1.00 . A A . 17 TYR CG 1 1 15 8081 1 1 17 TYR CZ C 6.367 -4.460 -1.836 1.00 . A A . 17 TYR CZ 1 1 15 8082 1 1 17 TYR H H 3.600 -1.777 1.157 1.00 . A A . 17 TYR H 1 1 15 8083 1 1 17 TYR HA H 2.103 -0.031 -0.669 1.00 . A A . 17 TYR HA 1 1 15 8084 1 1 17 TYR HB2 H 3.117 -1.013 -2.675 1.00 . A A . 17 TYR HB2 1 1 15 8085 1 1 17 TYR HB3 H 4.319 -0.172 -1.728 1.00 . A A . 17 TYR HB3 1 1 15 8086 1 1 17 TYR HD1 H 5.942 -1.428 -0.323 1.00 . A A . 17 TYR HD1 1 1 15 8087 1 1 17 TYR HD2 H 3.392 -3.432 -3.167 1.00 . A A . 17 TYR HD2 1 1 15 8088 1 1 17 TYR HE1 H 7.507 -3.324 -0.360 1.00 . A A . 17 TYR HE1 1 1 15 8089 1 1 17 TYR HE2 H 4.973 -5.376 -3.203 1.00 . A A . 17 TYR HE2 1 1 15 8090 1 1 17 TYR HH H 8.030 -5.336 -1.385 1.00 . A A . 17 TYR HH 1 1 15 8091 1 1 17 TYR N N 3.445 -0.883 0.697 1.00 . A A . 17 TYR N 1 1 15 8092 1 1 17 TYR O O 1.720 -2.915 0.420 1.00 . A A . 17 TYR O 1 1 15 8093 1 1 17 TYR OH O 7.218 -5.522 -1.861 1.00 . A A . 17 TYR OH 1 1 15 8094 1 1 18 TYR C C 0.526 -4.099 -3.181 1.00 . A A . 18 TYR C 1 1 15 8095 1 1 18 TYR CA C 0.124 -3.452 -1.855 1.00 . A A . 18 TYR CA 1 1 15 8096 1 1 18 TYR CB C -1.352 -3.044 -1.781 1.00 . A A . 18 TYR CB 1 1 15 8097 1 1 18 TYR CD1 C -1.227 -1.469 0.189 1.00 . A A . 18 TYR CD1 1 1 15 8098 1 1 18 TYR CD2 C -2.607 -3.453 0.388 1.00 . A A . 18 TYR CD2 1 1 15 8099 1 1 18 TYR CE1 C -1.362 -1.222 1.558 1.00 . A A . 18 TYR CE1 1 1 15 8100 1 1 18 TYR CE2 C -2.864 -3.138 1.728 1.00 . A A . 18 TYR CE2 1 1 15 8101 1 1 18 TYR CG C -1.761 -2.634 -0.381 1.00 . A A . 18 TYR CG 1 1 15 8102 1 1 18 TYR CZ C -2.176 -2.068 2.345 1.00 . A A . 18 TYR CZ 1 1 15 8103 1 1 18 TYR H H 0.885 -1.530 -2.259 1.00 . A A . 18 TYR H 1 1 15 8104 1 1 18 TYR HA H 0.279 -4.186 -1.065 1.00 . A A . 18 TYR HA 1 1 15 8105 1 1 18 TYR HB2 H -1.557 -2.234 -2.484 1.00 . A A . 18 TYR HB2 1 1 15 8106 1 1 18 TYR HB3 H -1.941 -3.911 -2.058 1.00 . A A . 18 TYR HB3 1 1 15 8107 1 1 18 TYR HD1 H -0.640 -0.794 -0.410 1.00 . A A . 18 TYR HD1 1 1 15 8108 1 1 18 TYR HD2 H -3.092 -4.316 -0.033 1.00 . A A . 18 TYR HD2 1 1 15 8109 1 1 18 TYR HE1 H -0.824 -0.376 1.945 1.00 . A A . 18 TYR HE1 1 1 15 8110 1 1 18 TYR HE2 H -3.595 -3.737 2.250 1.00 . A A . 18 TYR HE2 1 1 15 8111 1 1 18 TYR HH H -1.706 -1.193 4.012 1.00 . A A . 18 TYR HH 1 1 15 8112 1 1 18 TYR N N 0.978 -2.301 -1.605 1.00 . A A . 18 TYR N 1 1 15 8113 1 1 18 TYR O O 0.906 -3.432 -4.143 1.00 . A A . 18 TYR O 1 1 15 8114 1 1 18 TYR OH O -2.336 -1.834 3.675 1.00 . A A . 18 TYR OH 1 1 15 8115 1 1 19 PHE C C -0.122 -7.161 -4.846 1.00 . A A . 19 PHE C 1 1 15 8116 1 1 19 PHE CA C 0.976 -6.272 -4.280 1.00 . A A . 19 PHE CA 1 1 15 8117 1 1 19 PHE CB C 2.093 -7.101 -3.652 1.00 . A A . 19 PHE CB 1 1 15 8118 1 1 19 PHE CD1 C 2.234 -9.375 -4.757 1.00 . A A . 19 PHE CD1 1 1 15 8119 1 1 19 PHE CD2 C 4.002 -7.747 -5.157 1.00 . A A . 19 PHE CD2 1 1 15 8120 1 1 19 PHE CE1 C 2.935 -10.331 -5.511 1.00 . A A . 19 PHE CE1 1 1 15 8121 1 1 19 PHE CE2 C 4.701 -8.696 -5.913 1.00 . A A . 19 PHE CE2 1 1 15 8122 1 1 19 PHE CG C 2.776 -8.089 -4.566 1.00 . A A . 19 PHE CG 1 1 15 8123 1 1 19 PHE CZ C 4.170 -9.989 -6.091 1.00 . A A . 19 PHE CZ 1 1 15 8124 1 1 19 PHE H H 0.184 -5.911 -2.369 1.00 . A A . 19 PHE H 1 1 15 8125 1 1 19 PHE HA H 1.407 -5.670 -5.080 1.00 . A A . 19 PHE HA 1 1 15 8126 1 1 19 PHE HB2 H 2.841 -6.407 -3.274 1.00 . A A . 19 PHE HB2 1 1 15 8127 1 1 19 PHE HB3 H 1.691 -7.649 -2.798 1.00 . A A . 19 PHE HB3 1 1 15 8128 1 1 19 PHE HD1 H 1.286 -9.635 -4.306 1.00 . A A . 19 PHE HD1 1 1 15 8129 1 1 19 PHE HD2 H 4.420 -6.758 -5.029 1.00 . A A . 19 PHE HD2 1 1 15 8130 1 1 19 PHE HE1 H 2.521 -11.322 -5.652 1.00 . A A . 19 PHE HE1 1 1 15 8131 1 1 19 PHE HE2 H 5.642 -8.398 -6.351 1.00 . A A . 19 PHE HE2 1 1 15 8132 1 1 19 PHE HZ H 4.689 -10.713 -6.703 1.00 . A A . 19 PHE HZ 1 1 15 8133 1 1 19 PHE N N 0.453 -5.423 -3.220 1.00 . A A . 19 PHE N 1 1 15 8134 1 1 19 PHE O O -0.704 -7.960 -4.115 1.00 . A A . 19 PHE O 1 1 15 8135 1 1 20 ASN C C -0.715 -9.330 -6.898 1.00 . A A . 20 ASN C 1 1 15 8136 1 1 20 ASN CA C -1.304 -7.916 -6.856 1.00 . A A . 20 ASN CA 1 1 15 8137 1 1 20 ASN CB C -1.581 -7.361 -8.254 1.00 . A A . 20 ASN CB 1 1 15 8138 1 1 20 ASN CG C -2.700 -8.134 -8.925 1.00 . A A . 20 ASN CG 1 1 15 8139 1 1 20 ASN H H 0.092 -6.342 -6.700 1.00 . A A . 20 ASN H 1 1 15 8140 1 1 20 ASN HA H -2.247 -7.950 -6.327 1.00 . A A . 20 ASN HA 1 1 15 8141 1 1 20 ASN HB2 H -1.858 -6.320 -8.178 1.00 . A A . 20 ASN HB2 1 1 15 8142 1 1 20 ASN HB3 H -0.683 -7.423 -8.866 1.00 . A A . 20 ASN HB3 1 1 15 8143 1 1 20 ASN HD21 H -3.947 -6.509 -9.119 1.00 . A A . 20 ASN HD21 1 1 15 8144 1 1 20 ASN HD22 H -4.513 -8.063 -9.697 1.00 . A A . 20 ASN HD22 1 1 15 8145 1 1 20 ASN N N -0.408 -7.026 -6.139 1.00 . A A . 20 ASN N 1 1 15 8146 1 1 20 ASN ND2 N -3.791 -7.495 -9.291 1.00 . A A . 20 ASN ND2 1 1 15 8147 1 1 20 ASN O O 0.176 -9.603 -7.700 1.00 . A A . 20 ASN O 1 1 15 8148 1 1 20 ASN OD1 O -2.617 -9.340 -9.093 1.00 . A A . 20 ASN OD1 1 1 15 8149 1 1 21 HIS C C -1.115 -12.495 -7.186 1.00 . A A . 21 HIS C 1 1 15 8150 1 1 21 HIS CA C -0.660 -11.608 -6.012 1.00 . A A . 21 HIS CA 1 1 15 8151 1 1 21 HIS CB C -0.935 -12.233 -4.642 1.00 . A A . 21 HIS CB 1 1 15 8152 1 1 21 HIS CD2 C -3.207 -13.386 -4.915 1.00 . A A . 21 HIS CD2 1 1 15 8153 1 1 21 HIS CE1 C -4.408 -12.109 -3.577 1.00 . A A . 21 HIS CE1 1 1 15 8154 1 1 21 HIS CG C -2.400 -12.439 -4.352 1.00 . A A . 21 HIS CG 1 1 15 8155 1 1 21 HIS H H -1.943 -9.994 -5.405 1.00 . A A . 21 HIS H 1 1 15 8156 1 1 21 HIS HA H 0.419 -11.541 -6.119 1.00 . A A . 21 HIS HA 1 1 15 8157 1 1 21 HIS HB2 H -0.399 -13.180 -4.579 1.00 . A A . 21 HIS HB2 1 1 15 8158 1 1 21 HIS HB3 H -0.524 -11.578 -3.872 1.00 . A A . 21 HIS HB3 1 1 15 8159 1 1 21 HIS HD2 H -2.902 -14.142 -5.627 1.00 . A A . 21 HIS HD2 1 1 15 8160 1 1 21 HIS HE1 H -5.245 -11.693 -3.032 1.00 . A A . 21 HIS HE1 1 1 15 8161 1 1 21 HIS HE2 H -5.306 -13.681 -4.641 1.00 . A A . 21 HIS HE2 1 1 15 8162 1 1 21 HIS N N -1.196 -10.242 -6.051 1.00 . A A . 21 HIS N 1 1 15 8163 1 1 21 HIS ND1 N -3.158 -11.636 -3.505 1.00 . A A . 21 HIS ND1 1 1 15 8164 1 1 21 HIS NE2 N -4.472 -13.160 -4.417 1.00 . A A . 21 HIS NE2 1 1 15 8165 1 1 21 HIS O O -0.769 -13.674 -7.219 1.00 . A A . 21 HIS O 1 1 15 8166 1 1 22 ILE C C -1.355 -12.223 -10.546 1.00 . A A . 22 ILE C 1 1 15 8167 1 1 22 ILE CA C -2.295 -12.608 -9.382 1.00 . A A . 22 ILE CA 1 1 15 8168 1 1 22 ILE CB C -3.779 -12.267 -9.706 1.00 . A A . 22 ILE CB 1 1 15 8169 1 1 22 ILE CD1 C -6.137 -11.820 -8.702 1.00 . A A . 22 ILE CD1 1 1 15 8170 1 1 22 ILE CG1 C -4.690 -12.263 -8.447 1.00 . A A . 22 ILE CG1 1 1 15 8171 1 1 22 ILE CG2 C -4.313 -13.257 -10.759 1.00 . A A . 22 ILE CG2 1 1 15 8172 1 1 22 ILE H H -2.137 -10.967 -8.061 1.00 . A A . 22 ILE H 1 1 15 8173 1 1 22 ILE HA H -2.219 -13.686 -9.242 1.00 . A A . 22 ILE HA 1 1 15 8174 1 1 22 ILE HB H -3.818 -11.272 -10.147 1.00 . A A . 22 ILE HB 1 1 15 8175 1 1 22 ILE HD11 H -6.650 -11.705 -7.745 1.00 . A A . 22 ILE HD11 1 1 15 8176 1 1 22 ILE HD12 H -6.146 -10.861 -9.218 1.00 . A A . 22 ILE HD12 1 1 15 8177 1 1 22 ILE HD13 H -6.669 -12.564 -9.294 1.00 . A A . 22 ILE HD13 1 1 15 8178 1 1 22 ILE HG12 H -4.696 -13.258 -7.999 1.00 . A A . 22 ILE HG12 1 1 15 8179 1 1 22 ILE HG13 H -4.294 -11.565 -7.711 1.00 . A A . 22 ILE HG13 1 1 15 8180 1 1 22 ILE HG21 H -4.342 -14.265 -10.345 1.00 . A A . 22 ILE HG21 1 1 15 8181 1 1 22 ILE HG22 H -5.314 -12.971 -11.079 1.00 . A A . 22 ILE HG22 1 1 15 8182 1 1 22 ILE HG23 H -3.675 -13.255 -11.642 1.00 . A A . 22 ILE HG23 1 1 15 8183 1 1 22 ILE N N -1.869 -11.943 -8.145 1.00 . A A . 22 ILE N 1 1 15 8184 1 1 22 ILE O O -1.099 -13.051 -11.417 1.00 . A A . 22 ILE O 1 1 15 8185 1 1 23 THR C C 1.461 -10.079 -11.231 1.00 . A A . 23 THR C 1 1 15 8186 1 1 23 THR CA C 0.034 -10.459 -11.640 1.00 . A A . 23 THR CA 1 1 15 8187 1 1 23 THR CB C -0.607 -9.219 -12.287 1.00 . A A . 23 THR CB 1 1 15 8188 1 1 23 THR CG2 C -2.052 -9.441 -12.739 1.00 . A A . 23 THR CG2 1 1 15 8189 1 1 23 THR H H -1.152 -10.330 -9.861 1.00 . A A . 23 THR H 1 1 15 8190 1 1 23 THR HA H 0.128 -11.215 -12.420 1.00 . A A . 23 THR HA 1 1 15 8191 1 1 23 THR HB H -0.019 -8.947 -13.164 1.00 . A A . 23 THR HB 1 1 15 8192 1 1 23 THR HG1 H -1.157 -7.453 -11.763 1.00 . A A . 23 THR HG1 1 1 15 8193 1 1 23 THR HG21 H -2.705 -9.583 -11.879 1.00 . A A . 23 THR HG21 1 1 15 8194 1 1 23 THR HG22 H -2.395 -8.579 -13.311 1.00 . A A . 23 THR HG22 1 1 15 8195 1 1 23 THR HG23 H -2.103 -10.326 -13.376 1.00 . A A . 23 THR HG23 1 1 15 8196 1 1 23 THR N N -0.810 -10.994 -10.551 1.00 . A A . 23 THR N 1 1 15 8197 1 1 23 THR O O 2.319 -9.970 -12.106 1.00 . A A . 23 THR O 1 1 15 8198 1 1 23 THR OG1 O -0.588 -8.131 -11.388 1.00 . A A . 23 THR OG1 1 1 15 8199 1 1 24 ASN C C 3.014 -7.804 -9.306 1.00 . A A . 24 ASN C 1 1 15 8200 1 1 24 ASN CA C 2.935 -9.348 -9.296 1.00 . A A . 24 ASN CA 1 1 15 8201 1 1 24 ASN CB C 4.239 -10.000 -9.807 1.00 . A A . 24 ASN CB 1 1 15 8202 1 1 24 ASN CG C 4.200 -11.520 -9.811 1.00 . A A . 24 ASN CG 1 1 15 8203 1 1 24 ASN H H 0.983 -10.046 -9.254 1.00 . A A . 24 ASN H 1 1 15 8204 1 1 24 ASN HA H 2.845 -9.611 -8.245 1.00 . A A . 24 ASN HA 1 1 15 8205 1 1 24 ASN HB2 H 4.465 -9.640 -10.810 1.00 . A A . 24 ASN HB2 1 1 15 8206 1 1 24 ASN HB3 H 5.062 -9.692 -9.163 1.00 . A A . 24 ASN HB3 1 1 15 8207 1 1 24 ASN HD21 H 3.479 -11.533 -11.688 1.00 . A A . 24 ASN HD21 1 1 15 8208 1 1 24 ASN HD22 H 3.785 -13.115 -10.939 1.00 . A A . 24 ASN HD22 1 1 15 8209 1 1 24 ASN N N 1.728 -9.898 -9.930 1.00 . A A . 24 ASN N 1 1 15 8210 1 1 24 ASN ND2 N 3.817 -12.112 -10.924 1.00 . A A . 24 ASN ND2 1 1 15 8211 1 1 24 ASN O O 4.001 -7.255 -8.817 1.00 . A A . 24 ASN O 1 1 15 8212 1 1 24 ASN OD1 O 4.515 -12.174 -8.829 1.00 . A A . 24 ASN OD1 1 1 15 8213 1 1 25 ALA C C 1.977 -4.992 -8.471 1.00 . A A . 25 ALA C 1 1 15 8214 1 1 25 ALA CA C 2.065 -5.618 -9.881 1.00 . A A . 25 ALA CA 1 1 15 8215 1 1 25 ALA CB C 0.923 -5.115 -10.773 1.00 . A A . 25 ALA CB 1 1 15 8216 1 1 25 ALA H H 1.208 -7.549 -10.244 1.00 . A A . 25 ALA H 1 1 15 8217 1 1 25 ALA HA H 3.010 -5.319 -10.336 1.00 . A A . 25 ALA HA 1 1 15 8218 1 1 25 ALA HB1 H 0.974 -4.029 -10.857 1.00 . A A . 25 ALA HB1 1 1 15 8219 1 1 25 ALA HB2 H 1.015 -5.550 -11.769 1.00 . A A . 25 ALA HB2 1 1 15 8220 1 1 25 ALA HB3 H -0.039 -5.394 -10.343 1.00 . A A . 25 ALA HB3 1 1 15 8221 1 1 25 ALA N N 2.013 -7.084 -9.840 1.00 . A A . 25 ALA N 1 1 15 8222 1 1 25 ALA O O 1.044 -5.263 -7.718 1.00 . A A . 25 ALA O 1 1 15 8223 1 1 26 SER C C 2.696 -1.971 -6.851 1.00 . A A . 26 SER C 1 1 15 8224 1 1 26 SER CA C 3.038 -3.462 -6.815 1.00 . A A . 26 SER CA 1 1 15 8225 1 1 26 SER CB C 4.481 -3.636 -6.330 1.00 . A A . 26 SER CB 1 1 15 8226 1 1 26 SER H H 3.657 -3.883 -8.780 1.00 . A A . 26 SER H 1 1 15 8227 1 1 26 SER HA H 2.382 -3.959 -6.104 1.00 . A A . 26 SER HA 1 1 15 8228 1 1 26 SER HB2 H 4.591 -3.190 -5.343 1.00 . A A . 26 SER HB2 1 1 15 8229 1 1 26 SER HB3 H 4.724 -4.696 -6.260 1.00 . A A . 26 SER HB3 1 1 15 8230 1 1 26 SER HG H 4.945 -2.148 -7.486 1.00 . A A . 26 SER HG 1 1 15 8231 1 1 26 SER N N 2.899 -4.080 -8.142 1.00 . A A . 26 SER N 1 1 15 8232 1 1 26 SER O O 3.324 -1.233 -7.613 1.00 . A A . 26 SER O 1 1 15 8233 1 1 26 SER OG O 5.358 -2.996 -7.240 1.00 . A A . 26 SER OG 1 1 15 8234 1 1 27 GLN C C 1.048 0.341 -4.522 1.00 . A A . 27 GLN C 1 1 15 8235 1 1 27 GLN CA C 1.315 -0.125 -5.964 1.00 . A A . 27 GLN CA 1 1 15 8236 1 1 27 GLN CB C 0.078 0.026 -6.876 1.00 . A A . 27 GLN CB 1 1 15 8237 1 1 27 GLN CD C 0.669 2.425 -7.530 1.00 . A A . 27 GLN CD 1 1 15 8238 1 1 27 GLN CG C -0.429 1.465 -7.077 1.00 . A A . 27 GLN CG 1 1 15 8239 1 1 27 GLN H H 1.321 -2.159 -5.345 1.00 . A A . 27 GLN H 1 1 15 8240 1 1 27 GLN HA H 2.119 0.496 -6.361 1.00 . A A . 27 GLN HA 1 1 15 8241 1 1 27 GLN HB2 H 0.328 -0.375 -7.860 1.00 . A A . 27 GLN HB2 1 1 15 8242 1 1 27 GLN HB3 H -0.738 -0.576 -6.470 1.00 . A A . 27 GLN HB3 1 1 15 8243 1 1 27 GLN HE21 H 0.299 2.185 -9.530 1.00 . A A . 27 GLN HE21 1 1 15 8244 1 1 27 GLN HE22 H 1.601 3.262 -9.051 1.00 . A A . 27 GLN HE22 1 1 15 8245 1 1 27 GLN HG2 H -1.226 1.454 -7.821 1.00 . A A . 27 GLN HG2 1 1 15 8246 1 1 27 GLN HG3 H -0.856 1.837 -6.150 1.00 . A A . 27 GLN HG3 1 1 15 8247 1 1 27 GLN N N 1.750 -1.522 -6.016 1.00 . A A . 27 GLN N 1 1 15 8248 1 1 27 GLN NE2 N 0.855 2.628 -8.819 1.00 . A A . 27 GLN NE2 1 1 15 8249 1 1 27 GLN O O 0.632 -0.428 -3.658 1.00 . A A . 27 GLN O 1 1 15 8250 1 1 27 GLN OE1 O 1.388 2.989 -6.718 1.00 . A A . 27 GLN OE1 1 1 15 8251 1 1 28 PHE C C -0.388 2.602 -2.614 1.00 . A A . 28 PHE C 1 1 15 8252 1 1 28 PHE CA C 1.083 2.310 -2.980 1.00 . A A . 28 PHE CA 1 1 15 8253 1 1 28 PHE CB C 1.941 3.582 -2.991 1.00 . A A . 28 PHE CB 1 1 15 8254 1 1 28 PHE CD1 C 4.196 2.614 -2.390 1.00 . A A . 28 PHE CD1 1 1 15 8255 1 1 28 PHE CD2 C 3.938 3.689 -4.558 1.00 . A A . 28 PHE CD2 1 1 15 8256 1 1 28 PHE CE1 C 5.530 2.307 -2.700 1.00 . A A . 28 PHE CE1 1 1 15 8257 1 1 28 PHE CE2 C 5.279 3.391 -4.863 1.00 . A A . 28 PHE CE2 1 1 15 8258 1 1 28 PHE CG C 3.396 3.308 -3.316 1.00 . A A . 28 PHE CG 1 1 15 8259 1 1 28 PHE CZ C 6.078 2.702 -3.932 1.00 . A A . 28 PHE CZ 1 1 15 8260 1 1 28 PHE H H 1.549 2.230 -5.046 1.00 . A A . 28 PHE H 1 1 15 8261 1 1 28 PHE HA H 1.484 1.654 -2.207 1.00 . A A . 28 PHE HA 1 1 15 8262 1 1 28 PHE HB2 H 1.530 4.288 -3.714 1.00 . A A . 28 PHE HB2 1 1 15 8263 1 1 28 PHE HB3 H 1.906 4.046 -2.005 1.00 . A A . 28 PHE HB3 1 1 15 8264 1 1 28 PHE HD1 H 3.783 2.299 -1.442 1.00 . A A . 28 PHE HD1 1 1 15 8265 1 1 28 PHE HD2 H 3.322 4.201 -5.284 1.00 . A A . 28 PHE HD2 1 1 15 8266 1 1 28 PHE HE1 H 6.122 1.759 -1.987 1.00 . A A . 28 PHE HE1 1 1 15 8267 1 1 28 PHE HE2 H 5.695 3.686 -5.813 1.00 . A A . 28 PHE HE2 1 1 15 8268 1 1 28 PHE HZ H 7.109 2.476 -4.165 1.00 . A A . 28 PHE HZ 1 1 15 8269 1 1 28 PHE N N 1.249 1.635 -4.273 1.00 . A A . 28 PHE N 1 1 15 8270 1 1 28 PHE O O -0.663 3.301 -1.633 1.00 . A A . 28 PHE O 1 1 15 8271 1 1 29 GLU C C -3.253 1.396 -2.038 1.00 . A A . 29 GLU C 1 1 15 8272 1 1 29 GLU CA C -2.773 2.325 -3.164 1.00 . A A . 29 GLU CA 1 1 15 8273 1 1 29 GLU CB C -3.581 2.241 -4.468 1.00 . A A . 29 GLU CB 1 1 15 8274 1 1 29 GLU CD C -5.145 4.276 -3.936 1.00 . A A . 29 GLU CD 1 1 15 8275 1 1 29 GLU CG C -5.015 2.787 -4.323 1.00 . A A . 29 GLU CG 1 1 15 8276 1 1 29 GLU H H -1.076 1.539 -4.190 1.00 . A A . 29 GLU H 1 1 15 8277 1 1 29 GLU HA H -2.886 3.330 -2.811 1.00 . A A . 29 GLU HA 1 1 15 8278 1 1 29 GLU HB2 H -3.074 2.821 -5.242 1.00 . A A . 29 GLU HB2 1 1 15 8279 1 1 29 GLU HB3 H -3.625 1.203 -4.801 1.00 . A A . 29 GLU HB3 1 1 15 8280 1 1 29 GLU HG2 H -5.538 2.626 -5.266 1.00 . A A . 29 GLU HG2 1 1 15 8281 1 1 29 GLU HG3 H -5.515 2.193 -3.557 1.00 . A A . 29 GLU HG3 1 1 15 8282 1 1 29 GLU N N -1.348 2.133 -3.423 1.00 . A A . 29 GLU N 1 1 15 8283 1 1 29 GLU O O -3.356 0.183 -2.212 1.00 . A A . 29 GLU O 1 1 15 8284 1 1 29 GLU OE1 O -4.139 5.018 -3.837 1.00 . A A . 29 GLU OE1 1 1 15 8285 1 1 29 GLU OE2 O -6.274 4.685 -3.575 1.00 . A A . 29 GLU OE2 1 1 15 8286 1 1 30 ARG C C -5.307 1.403 0.846 1.00 . A A . 30 ARG C 1 1 15 8287 1 1 30 ARG CA C -3.834 1.324 0.395 1.00 . A A . 30 ARG CA 1 1 15 8288 1 1 30 ARG CB C -2.826 1.809 1.459 1.00 . A A . 30 ARG CB 1 1 15 8289 1 1 30 ARG CD C -2.517 4.385 1.207 1.00 . A A . 30 ARG CD 1 1 15 8290 1 1 30 ARG CG C -2.999 3.209 2.075 1.00 . A A . 30 ARG CG 1 1 15 8291 1 1 30 ARG CZ C -3.617 5.421 -0.817 1.00 . A A . 30 ARG CZ 1 1 15 8292 1 1 30 ARG H H -3.474 3.002 -0.821 1.00 . A A . 30 ARG H 1 1 15 8293 1 1 30 ARG HA H -3.619 0.268 0.229 1.00 . A A . 30 ARG HA 1 1 15 8294 1 1 30 ARG HB2 H -2.862 1.106 2.289 1.00 . A A . 30 ARG HB2 1 1 15 8295 1 1 30 ARG HB3 H -1.819 1.735 1.044 1.00 . A A . 30 ARG HB3 1 1 15 8296 1 1 30 ARG HD2 H -2.117 5.154 1.870 1.00 . A A . 30 ARG HD2 1 1 15 8297 1 1 30 ARG HD3 H -1.707 4.052 0.558 1.00 . A A . 30 ARG HD3 1 1 15 8298 1 1 30 ARG HE H -4.525 5.129 0.889 1.00 . A A . 30 ARG HE 1 1 15 8299 1 1 30 ARG HG2 H -4.033 3.365 2.388 1.00 . A A . 30 ARG HG2 1 1 15 8300 1 1 30 ARG HG3 H -2.386 3.217 2.977 1.00 . A A . 30 ARG HG3 1 1 15 8301 1 1 30 ARG HH11 H -1.750 4.828 -1.396 1.00 . A A . 30 ARG HH11 1 1 15 8302 1 1 30 ARG HH12 H -2.885 5.436 -2.622 1.00 . A A . 30 ARG HH12 1 1 15 8303 1 1 30 ARG HH21 H -5.538 5.919 -0.681 1.00 . A A . 30 ARG HH21 1 1 15 8304 1 1 30 ARG HH22 H -4.816 5.875 -2.340 1.00 . A A . 30 ARG HH22 1 1 15 8305 1 1 30 ARG N N -3.563 1.998 -0.880 1.00 . A A . 30 ARG N 1 1 15 8306 1 1 30 ARG NE N -3.612 4.994 0.434 1.00 . A A . 30 ARG NE 1 1 15 8307 1 1 30 ARG NH1 N -2.604 5.329 -1.637 1.00 . A A . 30 ARG NH1 1 1 15 8308 1 1 30 ARG NH2 N -4.728 5.881 -1.319 1.00 . A A . 30 ARG NH2 1 1 15 8309 1 1 30 ARG O O -6.054 2.219 0.308 1.00 . A A . 30 ARG O 1 1 15 8310 1 1 31 PRO C C -7.532 1.896 2.958 1.00 . A A . 31 PRO C 1 1 15 8311 1 1 31 PRO CA C -7.122 0.551 2.338 1.00 . A A . 31 PRO CA 1 1 15 8312 1 1 31 PRO CB C -7.135 -0.554 3.404 1.00 . A A . 31 PRO CB 1 1 15 8313 1 1 31 PRO CD C -5.052 -0.620 2.274 1.00 . A A . 31 PRO CD 1 1 15 8314 1 1 31 PRO CG C -6.094 -1.541 2.889 1.00 . A A . 31 PRO CG 1 1 15 8315 1 1 31 PRO HA H -7.837 0.290 1.557 1.00 . A A . 31 PRO HA 1 1 15 8316 1 1 31 PRO HB2 H -6.807 -0.156 4.366 1.00 . A A . 31 PRO HB2 1 1 15 8317 1 1 31 PRO HB3 H -8.117 -1.018 3.497 1.00 . A A . 31 PRO HB3 1 1 15 8318 1 1 31 PRO HD2 H -4.365 -0.291 3.053 1.00 . A A . 31 PRO HD2 1 1 15 8319 1 1 31 PRO HD3 H -4.528 -1.146 1.479 1.00 . A A . 31 PRO HD3 1 1 15 8320 1 1 31 PRO HG2 H -5.666 -2.160 3.674 1.00 . A A . 31 PRO HG2 1 1 15 8321 1 1 31 PRO HG3 H -6.535 -2.163 2.114 1.00 . A A . 31 PRO HG3 1 1 15 8322 1 1 31 PRO N N -5.776 0.523 1.756 1.00 . A A . 31 PRO N 1 1 15 8323 1 1 31 PRO O O -6.713 2.789 3.161 1.00 . A A . 31 PRO O 1 1 15 8324 1 1 32 SER C C -9.525 4.479 3.261 1.00 . A A . 32 SER C 1 1 15 8325 1 1 32 SER CA C -9.497 3.121 3.983 1.00 . A A . 32 SER CA 1 1 15 8326 1 1 32 SER CB C -8.963 3.282 5.412 1.00 . A A . 32 SER CB 1 1 15 8327 1 1 32 SER H H -9.390 1.178 3.174 1.00 . A A . 32 SER H 1 1 15 8328 1 1 32 SER HA H -10.542 2.835 4.081 1.00 . A A . 32 SER HA 1 1 15 8329 1 1 32 SER HB2 H -7.913 3.579 5.383 1.00 . A A . 32 SER HB2 1 1 15 8330 1 1 32 SER HB3 H -9.534 4.058 5.925 1.00 . A A . 32 SER HB3 1 1 15 8331 1 1 32 SER HG H -8.762 2.189 7.014 1.00 . A A . 32 SER HG 1 1 15 8332 1 1 32 SER N N -8.822 2.002 3.294 1.00 . A A . 32 SER N 1 1 15 8333 1 1 32 SER O O -10.501 5.209 3.413 1.00 . A A . 32 SER O 1 1 15 8334 1 1 32 SER OG O -9.093 2.064 6.120 1.00 . A A . 32 SER OG 1 1 15 8335 1 1 33 GLY C C -7.373 5.922 0.576 1.00 . A A . 33 GLY C 1 1 15 8336 1 1 33 GLY CA C -8.404 6.046 1.681 1.00 . A A . 33 GLY CA 1 1 15 8337 1 1 33 GLY H H -7.698 4.189 2.463 1.00 . A A . 33 GLY H 1 1 15 8338 1 1 33 GLY HA2 H -9.368 6.289 1.234 1.00 . A A . 33 GLY HA2 1 1 15 8339 1 1 33 GLY HA3 H -8.103 6.862 2.336 1.00 . A A . 33 GLY HA3 1 1 15 8340 1 1 33 GLY N N -8.507 4.807 2.459 1.00 . A A . 33 GLY N 1 1 15 8341 1 1 33 GLY O O -7.728 6.084 -0.610 1.00 . A A . 33 GLY O 1 1 15 8342 1 1 33 GLY OXT O -6.216 5.573 0.874 1.00 . A A . 33 GLY OXT 1 1 15 8343 2 2 1 NAG C1 C 11.991 1.724 -0.878 1.00 . B A . 101 NAG C1 1 1 15 8344 2 2 1 NAG C2 C 11.441 2.938 -1.661 1.00 . B A . 101 NAG C2 1 1 15 8345 2 2 1 NAG C3 C 10.456 2.351 -2.687 1.00 . B A . 101 NAG C3 1 1 15 8346 2 2 1 NAG C4 C 11.247 1.478 -3.654 1.00 . B A . 101 NAG C4 1 1 15 8347 2 2 1 NAG C5 C 11.925 0.319 -2.913 1.00 . B A . 101 NAG C5 1 1 15 8348 2 2 1 NAG C6 C 12.813 -0.560 -3.793 1.00 . B A . 101 NAG C6 1 1 15 8349 2 2 1 NAG C7 C 10.511 5.159 -1.163 1.00 . B A . 101 NAG C7 1 1 15 8350 2 2 1 NAG C8 C 9.951 6.096 -0.082 1.00 . B A . 101 NAG C8 1 1 15 8351 2 2 1 NAG H1 H 11.157 1.152 -0.471 1.00 . B A . 101 NAG H1 1 1 15 8352 2 2 1 NAG H2 H 12.259 3.439 -2.183 1.00 . B A . 101 NAG H2 1 1 15 8353 2 2 1 NAG H3 H 9.706 1.740 -2.172 1.00 . B A . 101 NAG H3 1 1 15 8354 2 2 1 NAG H4 H 11.978 2.096 -4.167 1.00 . B A . 101 NAG H4 1 1 15 8355 2 2 1 NAG H5 H 11.147 -0.302 -2.491 1.00 . B A . 101 NAG H5 1 1 15 8356 2 2 1 NAG H61 H 13.050 -1.482 -3.262 1.00 . B A . 101 NAG H61 1 1 15 8357 2 2 1 NAG H62 H 12.315 -0.822 -4.726 1.00 . B A . 101 NAG H62 1 1 15 8358 2 2 1 NAG H81 H 10.535 5.997 0.833 1.00 . B A . 101 NAG H81 1 1 15 8359 2 2 1 NAG H82 H 8.912 5.838 0.122 1.00 . B A . 101 NAG H82 1 1 15 8360 2 2 1 NAG H83 H 10.002 7.130 -0.427 1.00 . B A . 101 NAG H83 1 1 15 8361 2 2 1 NAG HN2 H 10.521 3.615 0.148 1.00 . B A . 101 NAG HN2 1 1 15 8362 2 2 1 NAG HO3 H 10.080 4.268 -3.147 1.00 . B A . 101 NAG HO3 1 1 15 8363 2 2 1 NAG HO4 H 9.725 1.724 -4.793 1.00 . B A . 101 NAG HO4 1 1 15 8364 2 2 1 NAG HO6 H 14.336 0.510 -3.214 1.00 . B A . 101 NAG HO6 1 1 15 8365 2 2 1 NAG N2 N 10.801 3.917 -0.781 1.00 . B A . 101 NAG N2 1 1 15 8366 2 2 1 NAG O3 O 9.804 3.377 -3.478 1.00 . B A . 101 NAG O3 1 1 15 8367 2 2 1 NAG O4 O 10.298 0.970 -4.596 1.00 . B A . 101 NAG O4 1 1 15 8368 2 2 1 NAG O5 O 12.744 0.863 -1.796 1.00 . B A . 101 NAG O5 1 1 15 8369 2 2 1 NAG O6 O 14.029 0.153 -4.054 1.00 . B A . 101 NAG O6 1 1 15 8370 2 2 1 NAG O7 O 10.660 5.513 -2.331 1.00 . B A . 101 NAG O7 1 1 16 8371 1 1 1 LYS C C -9.427 -6.802 2.184 1.00 . A A . 1 LYS C 1 1 16 8372 1 1 1 LYS CA C -10.263 -7.000 3.470 1.00 . A A . 1 LYS CA 1 1 16 8373 1 1 1 LYS CB C -11.062 -8.328 3.475 1.00 . A A . 1 LYS CB 1 1 16 8374 1 1 1 LYS CD C -12.366 -8.213 1.175 1.00 . A A . 1 LYS CD 1 1 16 8375 1 1 1 LYS CE C -11.788 -9.439 0.448 1.00 . A A . 1 LYS CE 1 1 16 8376 1 1 1 LYS CG C -12.401 -8.358 2.707 1.00 . A A . 1 LYS CG 1 1 16 8377 1 1 1 LYS H1 H -11.829 -5.710 3.057 1.00 . A A . 1 LYS H1 1 1 16 8378 1 1 1 LYS H2 H -10.653 -4.979 3.849 1.00 . A A . 1 LYS H2 1 1 16 8379 1 1 1 LYS H3 H -11.646 -6.019 4.677 1.00 . A A . 1 LYS H3 1 1 16 8380 1 1 1 LYS HA H -9.524 -7.084 4.267 1.00 . A A . 1 LYS HA 1 1 16 8381 1 1 1 LYS HB2 H -10.433 -9.150 3.131 1.00 . A A . 1 LYS HB2 1 1 16 8382 1 1 1 LYS HB3 H -11.298 -8.549 4.517 1.00 . A A . 1 LYS HB3 1 1 16 8383 1 1 1 LYS HD2 H -13.401 -8.102 0.844 1.00 . A A . 1 LYS HD2 1 1 16 8384 1 1 1 LYS HD3 H -11.851 -7.297 0.887 1.00 . A A . 1 LYS HD3 1 1 16 8385 1 1 1 LYS HE2 H -11.815 -10.303 1.118 1.00 . A A . 1 LYS HE2 1 1 16 8386 1 1 1 LYS HE3 H -12.438 -9.659 -0.403 1.00 . A A . 1 LYS HE3 1 1 16 8387 1 1 1 LYS HG2 H -12.895 -9.303 2.938 1.00 . A A . 1 LYS HG2 1 1 16 8388 1 1 1 LYS HG3 H -13.048 -7.572 3.102 1.00 . A A . 1 LYS HG3 1 1 16 8389 1 1 1 LYS HZ1 H -10.059 -9.991 -0.579 1.00 . A A . 1 LYS HZ1 1 1 16 8390 1 1 1 LYS HZ2 H -10.383 -8.358 -0.620 1.00 . A A . 1 LYS HZ2 1 1 16 8391 1 1 1 LYS HZ3 H -9.770 -8.987 0.711 1.00 . A A . 1 LYS HZ3 1 1 16 8392 1 1 1 LYS N N -11.154 -5.863 3.809 1.00 . A A . 1 LYS N 1 1 16 8393 1 1 1 LYS NZ N -10.414 -9.208 -0.051 1.00 . A A . 1 LYS NZ 1 1 16 8394 1 1 1 LYS O O -8.929 -7.799 1.666 1.00 . A A . 1 LYS O 1 1 16 8395 1 1 2 LEU C C -9.370 -5.621 -0.854 1.00 . A A . 2 LEU C 1 1 16 8396 1 1 2 LEU CA C -8.635 -5.134 0.426 1.00 . A A . 2 LEU CA 1 1 16 8397 1 1 2 LEU CB C -7.130 -5.481 0.371 1.00 . A A . 2 LEU CB 1 1 16 8398 1 1 2 LEU CD1 C -6.140 -3.137 0.474 1.00 . A A . 2 LEU CD1 1 1 16 8399 1 1 2 LEU CD2 C -6.299 -4.450 2.582 1.00 . A A . 2 LEU CD2 1 1 16 8400 1 1 2 LEU CG C -6.122 -4.545 1.068 1.00 . A A . 2 LEU CG 1 1 16 8401 1 1 2 LEU H H -9.697 -4.779 2.170 1.00 . A A . 2 LEU H 1 1 16 8402 1 1 2 LEU HA H -8.722 -4.051 0.431 1.00 . A A . 2 LEU HA 1 1 16 8403 1 1 2 LEU HB2 H -6.975 -6.490 0.749 1.00 . A A . 2 LEU HB2 1 1 16 8404 1 1 2 LEU HB3 H -6.838 -5.510 -0.677 1.00 . A A . 2 LEU HB3 1 1 16 8405 1 1 2 LEU HD11 H -7.074 -2.628 0.705 1.00 . A A . 2 LEU HD11 1 1 16 8406 1 1 2 LEU HD12 H -5.315 -2.557 0.890 1.00 . A A . 2 LEU HD12 1 1 16 8407 1 1 2 LEU HD13 H -6.013 -3.204 -0.605 1.00 . A A . 2 LEU HD13 1 1 16 8408 1 1 2 LEU HD21 H -5.466 -3.880 2.999 1.00 . A A . 2 LEU HD21 1 1 16 8409 1 1 2 LEU HD22 H -7.235 -3.950 2.825 1.00 . A A . 2 LEU HD22 1 1 16 8410 1 1 2 LEU HD23 H -6.291 -5.451 3.014 1.00 . A A . 2 LEU HD23 1 1 16 8411 1 1 2 LEU HG H -5.128 -4.955 0.885 1.00 . A A . 2 LEU HG 1 1 16 8412 1 1 2 LEU N N -9.243 -5.563 1.700 1.00 . A A . 2 LEU N 1 1 16 8413 1 1 2 LEU O O -10.021 -6.669 -0.839 1.00 . A A . 2 LEU O 1 1 16 8414 1 1 3 PRO C C -9.145 -6.673 -3.790 1.00 . A A . 3 PRO C 1 1 16 8415 1 1 3 PRO CA C -9.778 -5.348 -3.289 1.00 . A A . 3 PRO CA 1 1 16 8416 1 1 3 PRO CB C -9.519 -4.191 -4.268 1.00 . A A . 3 PRO CB 1 1 16 8417 1 1 3 PRO CD C -8.689 -3.563 -2.124 1.00 . A A . 3 PRO CD 1 1 16 8418 1 1 3 PRO CG C -9.327 -2.972 -3.375 1.00 . A A . 3 PRO CG 1 1 16 8419 1 1 3 PRO HA H -10.854 -5.482 -3.180 1.00 . A A . 3 PRO HA 1 1 16 8420 1 1 3 PRO HB2 H -8.601 -4.362 -4.827 1.00 . A A . 3 PRO HB2 1 1 16 8421 1 1 3 PRO HB3 H -10.354 -4.048 -4.953 1.00 . A A . 3 PRO HB3 1 1 16 8422 1 1 3 PRO HD2 H -7.610 -3.639 -2.265 1.00 . A A . 3 PRO HD2 1 1 16 8423 1 1 3 PRO HD3 H -8.917 -2.927 -1.271 1.00 . A A . 3 PRO HD3 1 1 16 8424 1 1 3 PRO HG2 H -8.689 -2.220 -3.841 1.00 . A A . 3 PRO HG2 1 1 16 8425 1 1 3 PRO HG3 H -10.302 -2.551 -3.126 1.00 . A A . 3 PRO HG3 1 1 16 8426 1 1 3 PRO N N -9.259 -4.897 -1.992 1.00 . A A . 3 PRO N 1 1 16 8427 1 1 3 PRO O O -8.100 -7.083 -3.279 1.00 . A A . 3 PRO O 1 1 16 8428 1 1 4 PRO C C -7.817 -8.888 -5.496 1.00 . A A . 4 PRO C 1 1 16 8429 1 1 4 PRO CA C -9.329 -8.656 -5.321 1.00 . A A . 4 PRO CA 1 1 16 8430 1 1 4 PRO CB C -10.110 -8.850 -6.625 1.00 . A A . 4 PRO CB 1 1 16 8431 1 1 4 PRO CD C -10.931 -6.900 -5.522 1.00 . A A . 4 PRO CD 1 1 16 8432 1 1 4 PRO CG C -11.405 -8.094 -6.348 1.00 . A A . 4 PRO CG 1 1 16 8433 1 1 4 PRO HA H -9.700 -9.396 -4.612 1.00 . A A . 4 PRO HA 1 1 16 8434 1 1 4 PRO HB2 H -9.591 -8.376 -7.461 1.00 . A A . 4 PRO HB2 1 1 16 8435 1 1 4 PRO HB3 H -10.293 -9.905 -6.835 1.00 . A A . 4 PRO HB3 1 1 16 8436 1 1 4 PRO HD2 H -10.672 -6.079 -6.192 1.00 . A A . 4 PRO HD2 1 1 16 8437 1 1 4 PRO HD3 H -11.721 -6.593 -4.837 1.00 . A A . 4 PRO HD3 1 1 16 8438 1 1 4 PRO HG2 H -11.897 -7.780 -7.269 1.00 . A A . 4 PRO HG2 1 1 16 8439 1 1 4 PRO HG3 H -12.071 -8.715 -5.749 1.00 . A A . 4 PRO HG3 1 1 16 8440 1 1 4 PRO N N -9.733 -7.337 -4.811 1.00 . A A . 4 PRO N 1 1 16 8441 1 1 4 PRO O O -7.206 -8.444 -6.469 1.00 . A A . 4 PRO O 1 1 16 8442 1 1 5 GLY C C -4.824 -9.007 -3.950 1.00 . A A . 5 GLY C 1 1 16 8443 1 1 5 GLY CA C -5.810 -10.014 -4.549 1.00 . A A . 5 GLY CA 1 1 16 8444 1 1 5 GLY H H -7.767 -9.889 -3.741 1.00 . A A . 5 GLY H 1 1 16 8445 1 1 5 GLY HA2 H -5.711 -10.947 -3.995 1.00 . A A . 5 GLY HA2 1 1 16 8446 1 1 5 GLY HA3 H -5.502 -10.196 -5.578 1.00 . A A . 5 GLY HA3 1 1 16 8447 1 1 5 GLY N N -7.217 -9.605 -4.538 1.00 . A A . 5 GLY N 1 1 16 8448 1 1 5 GLY O O -3.646 -9.338 -3.838 1.00 . A A . 5 GLY O 1 1 16 8449 1 1 6 TRP C C -4.162 -6.994 -1.509 1.00 . A A . 6 TRP C 1 1 16 8450 1 1 6 TRP CA C -4.424 -6.762 -3.001 1.00 . A A . 6 TRP CA 1 1 16 8451 1 1 6 TRP CB C -5.076 -5.397 -3.228 1.00 . A A . 6 TRP CB 1 1 16 8452 1 1 6 TRP CD1 C -5.985 -5.078 -5.574 1.00 . A A . 6 TRP CD1 1 1 16 8453 1 1 6 TRP CD2 C -3.923 -4.229 -5.317 1.00 . A A . 6 TRP CD2 1 1 16 8454 1 1 6 TRP CE2 C -4.313 -3.971 -6.665 1.00 . A A . 6 TRP CE2 1 1 16 8455 1 1 6 TRP CE3 C -2.622 -3.840 -4.935 1.00 . A A . 6 TRP CE3 1 1 16 8456 1 1 6 TRP CG C -5.020 -4.915 -4.642 1.00 . A A . 6 TRP CG 1 1 16 8457 1 1 6 TRP CH2 C -2.174 -2.965 -7.174 1.00 . A A . 6 TRP CH2 1 1 16 8458 1 1 6 TRP CZ2 C -3.462 -3.344 -7.587 1.00 . A A . 6 TRP CZ2 1 1 16 8459 1 1 6 TRP CZ3 C -1.755 -3.225 -5.858 1.00 . A A . 6 TRP CZ3 1 1 16 8460 1 1 6 TRP H H -6.268 -7.589 -3.610 1.00 . A A . 6 TRP H 1 1 16 8461 1 1 6 TRP HA H -3.466 -6.761 -3.512 1.00 . A A . 6 TRP HA 1 1 16 8462 1 1 6 TRP HB2 H -6.113 -5.425 -2.898 1.00 . A A . 6 TRP HB2 1 1 16 8463 1 1 6 TRP HB3 H -4.562 -4.663 -2.609 1.00 . A A . 6 TRP HB3 1 1 16 8464 1 1 6 TRP HD1 H -6.920 -5.597 -5.407 1.00 . A A . 6 TRP HD1 1 1 16 8465 1 1 6 TRP HE1 H -6.150 -4.472 -7.600 1.00 . A A . 6 TRP HE1 1 1 16 8466 1 1 6 TRP HE3 H -2.290 -4.033 -3.927 1.00 . A A . 6 TRP HE3 1 1 16 8467 1 1 6 TRP HH2 H -1.509 -2.464 -7.864 1.00 . A A . 6 TRP HH2 1 1 16 8468 1 1 6 TRP HZ2 H -3.791 -3.152 -8.597 1.00 . A A . 6 TRP HZ2 1 1 16 8469 1 1 6 TRP HZ3 H -0.764 -2.936 -5.550 1.00 . A A . 6 TRP HZ3 1 1 16 8470 1 1 6 TRP N N -5.275 -7.801 -3.578 1.00 . A A . 6 TRP N 1 1 16 8471 1 1 6 TRP NE1 N -5.583 -4.499 -6.762 1.00 . A A . 6 TRP NE1 1 1 16 8472 1 1 6 TRP O O -5.051 -7.418 -0.772 1.00 . A A . 6 TRP O 1 1 16 8473 1 1 7 GLU C C -1.332 -5.871 0.638 1.00 . A A . 7 GLU C 1 1 16 8474 1 1 7 GLU CA C -2.538 -6.800 0.349 1.00 . A A . 7 GLU CA 1 1 16 8475 1 1 7 GLU CB C -2.234 -8.289 0.602 1.00 . A A . 7 GLU CB 1 1 16 8476 1 1 7 GLU CD C -1.368 -8.381 2.993 1.00 . A A . 7 GLU CD 1 1 16 8477 1 1 7 GLU CG C -2.477 -8.792 2.033 1.00 . A A . 7 GLU CG 1 1 16 8478 1 1 7 GLU H H -2.202 -6.462 -1.717 1.00 . A A . 7 GLU H 1 1 16 8479 1 1 7 GLU HA H -3.371 -6.498 0.984 1.00 . A A . 7 GLU HA 1 1 16 8480 1 1 7 GLU HB2 H -2.884 -8.895 -0.030 1.00 . A A . 7 GLU HB2 1 1 16 8481 1 1 7 GLU HB3 H -1.219 -8.492 0.286 1.00 . A A . 7 GLU HB3 1 1 16 8482 1 1 7 GLU HG2 H -3.442 -8.424 2.385 1.00 . A A . 7 GLU HG2 1 1 16 8483 1 1 7 GLU HG3 H -2.528 -9.883 2.013 1.00 . A A . 7 GLU HG3 1 1 16 8484 1 1 7 GLU N N -2.946 -6.682 -1.053 1.00 . A A . 7 GLU N 1 1 16 8485 1 1 7 GLU O O -0.638 -5.440 -0.286 1.00 . A A . 7 GLU O 1 1 16 8486 1 1 7 GLU OE1 O -0.244 -8.924 2.870 1.00 . A A . 7 GLU OE1 1 1 16 8487 1 1 7 GLU OE2 O -1.605 -7.459 3.807 1.00 . A A . 7 GLU OE2 1 1 16 8488 1 1 8 LYS C C 1.390 -5.323 2.224 1.00 . A A . 8 LYS C 1 1 16 8489 1 1 8 LYS CA C 0.010 -4.671 2.388 1.00 . A A . 8 LYS CA 1 1 16 8490 1 1 8 LYS CB C -0.315 -4.296 3.855 1.00 . A A . 8 LYS CB 1 1 16 8491 1 1 8 LYS CD C 1.784 -4.901 5.355 1.00 . A A . 8 LYS CD 1 1 16 8492 1 1 8 LYS CE C 1.152 -6.154 5.995 1.00 . A A . 8 LYS CE 1 1 16 8493 1 1 8 LYS CG C 0.824 -3.833 4.782 1.00 . A A . 8 LYS CG 1 1 16 8494 1 1 8 LYS H H -1.582 -6.040 2.649 1.00 . A A . 8 LYS H 1 1 16 8495 1 1 8 LYS HA H 0.014 -3.754 1.793 1.00 . A A . 8 LYS HA 1 1 16 8496 1 1 8 LYS HB2 H -1.043 -3.487 3.814 1.00 . A A . 8 LYS HB2 1 1 16 8497 1 1 8 LYS HB3 H -0.829 -5.118 4.347 1.00 . A A . 8 LYS HB3 1 1 16 8498 1 1 8 LYS HD2 H 2.509 -5.208 4.605 1.00 . A A . 8 LYS HD2 1 1 16 8499 1 1 8 LYS HD3 H 2.364 -4.405 6.134 1.00 . A A . 8 LYS HD3 1 1 16 8500 1 1 8 LYS HE2 H 1.908 -6.593 6.651 1.00 . A A . 8 LYS HE2 1 1 16 8501 1 1 8 LYS HE3 H 0.303 -5.861 6.618 1.00 . A A . 8 LYS HE3 1 1 16 8502 1 1 8 LYS HG2 H 1.411 -3.071 4.266 1.00 . A A . 8 LYS HG2 1 1 16 8503 1 1 8 LYS HG3 H 0.353 -3.344 5.636 1.00 . A A . 8 LYS HG3 1 1 16 8504 1 1 8 LYS HZ1 H -0.233 -7.072 4.685 1.00 . A A . 8 LYS HZ1 1 1 16 8505 1 1 8 LYS HZ2 H 1.274 -7.148 4.143 1.00 . A A . 8 LYS HZ2 1 1 16 8506 1 1 8 LYS HZ3 H 0.779 -8.125 5.377 1.00 . A A . 8 LYS HZ3 1 1 16 8507 1 1 8 LYS N N -1.076 -5.544 1.912 1.00 . A A . 8 LYS N 1 1 16 8508 1 1 8 LYS NZ N 0.738 -7.186 5.010 1.00 . A A . 8 LYS NZ 1 1 16 8509 1 1 8 LYS O O 1.558 -6.515 2.493 1.00 . A A . 8 LYS O 1 1 16 8510 1 1 9 ARG C C 4.738 -3.813 2.440 1.00 . A A . 9 ARG C 1 1 16 8511 1 1 9 ARG CA C 3.831 -4.913 1.872 1.00 . A A . 9 ARG CA 1 1 16 8512 1 1 9 ARG CB C 4.269 -5.182 0.426 1.00 . A A . 9 ARG CB 1 1 16 8513 1 1 9 ARG CD C 3.706 -7.698 0.228 1.00 . A A . 9 ARG CD 1 1 16 8514 1 1 9 ARG CG C 3.572 -6.286 -0.369 1.00 . A A . 9 ARG CG 1 1 16 8515 1 1 9 ARG CZ C 1.800 -9.341 0.029 1.00 . A A . 9 ARG CZ 1 1 16 8516 1 1 9 ARG H H 2.208 -3.534 1.713 1.00 . A A . 9 ARG H 1 1 16 8517 1 1 9 ARG HA H 3.983 -5.811 2.471 1.00 . A A . 9 ARG HA 1 1 16 8518 1 1 9 ARG HB2 H 4.124 -4.251 -0.117 1.00 . A A . 9 ARG HB2 1 1 16 8519 1 1 9 ARG HB3 H 5.333 -5.419 0.419 1.00 . A A . 9 ARG HB3 1 1 16 8520 1 1 9 ARG HD2 H 4.227 -8.331 -0.492 1.00 . A A . 9 ARG HD2 1 1 16 8521 1 1 9 ARG HD3 H 4.336 -7.655 1.117 1.00 . A A . 9 ARG HD3 1 1 16 8522 1 1 9 ARG HE H 1.961 -7.921 1.423 1.00 . A A . 9 ARG HE 1 1 16 8523 1 1 9 ARG HG2 H 2.542 -5.987 -0.551 1.00 . A A . 9 ARG HG2 1 1 16 8524 1 1 9 ARG HG3 H 4.062 -6.316 -1.338 1.00 . A A . 9 ARG HG3 1 1 16 8525 1 1 9 ARG HH11 H 2.916 -9.423 -1.638 1.00 . A A . 9 ARG HH11 1 1 16 8526 1 1 9 ARG HH12 H 1.619 -10.604 -1.503 1.00 . A A . 9 ARG HH12 1 1 16 8527 1 1 9 ARG HH21 H 0.452 -9.570 1.532 1.00 . A A . 9 ARG HH21 1 1 16 8528 1 1 9 ARG HH22 H 0.235 -10.585 0.092 1.00 . A A . 9 ARG HH22 1 1 16 8529 1 1 9 ARG N N 2.411 -4.518 1.907 1.00 . A A . 9 ARG N 1 1 16 8530 1 1 9 ARG NE N 2.417 -8.312 0.598 1.00 . A A . 9 ARG NE 1 1 16 8531 1 1 9 ARG NH1 N 2.152 -9.835 -1.134 1.00 . A A . 9 ARG NH1 1 1 16 8532 1 1 9 ARG NH2 N 0.789 -9.919 0.617 1.00 . A A . 9 ARG NH2 1 1 16 8533 1 1 9 ARG O O 4.297 -2.691 2.688 1.00 . A A . 9 ARG O 1 1 16 8534 1 1 10 MET C C 8.435 -3.687 2.552 1.00 . A A . 10 MET C 1 1 16 8535 1 1 10 MET CA C 7.071 -3.265 3.117 1.00 . A A . 10 MET CA 1 1 16 8536 1 1 10 MET CB C 7.038 -3.361 4.650 1.00 . A A . 10 MET CB 1 1 16 8537 1 1 10 MET CE C 8.749 -0.945 7.626 1.00 . A A . 10 MET CE 1 1 16 8538 1 1 10 MET CG C 7.947 -2.344 5.344 1.00 . A A . 10 MET CG 1 1 16 8539 1 1 10 MET H H 6.332 -5.066 2.329 1.00 . A A . 10 MET H 1 1 16 8540 1 1 10 MET HA H 6.862 -2.237 2.829 1.00 . A A . 10 MET HA 1 1 16 8541 1 1 10 MET HB2 H 6.017 -3.178 4.987 1.00 . A A . 10 MET HB2 1 1 16 8542 1 1 10 MET HB3 H 7.319 -4.366 4.967 1.00 . A A . 10 MET HB3 1 1 16 8543 1 1 10 MET HE1 H 8.588 -0.712 8.679 1.00 . A A . 10 MET HE1 1 1 16 8544 1 1 10 MET HE2 H 9.775 -1.283 7.489 1.00 . A A . 10 MET HE2 1 1 16 8545 1 1 10 MET HE3 H 8.567 -0.051 7.030 1.00 . A A . 10 MET HE3 1 1 16 8546 1 1 10 MET HG2 H 8.991 -2.620 5.186 1.00 . A A . 10 MET HG2 1 1 16 8547 1 1 10 MET HG3 H 7.778 -1.358 4.910 1.00 . A A . 10 MET HG3 1 1 16 8548 1 1 10 MET N N 6.030 -4.135 2.574 1.00 . A A . 10 MET N 1 1 16 8549 1 1 10 MET O O 8.864 -4.823 2.738 1.00 . A A . 10 MET O 1 1 16 8550 1 1 10 MET SD S 7.611 -2.259 7.124 1.00 . A A . 10 MET SD 1 1 16 8551 1 1 11 PHE C C 11.492 -3.022 2.350 1.00 . A A . 11 PHE C 1 1 16 8552 1 1 11 PHE CA C 10.423 -2.984 1.244 1.00 . A A . 11 PHE CA 1 1 16 8553 1 1 11 PHE CB C 10.727 -1.856 0.252 1.00 . A A . 11 PHE CB 1 1 16 8554 1 1 11 PHE CD1 C 10.339 -2.997 -1.969 1.00 . A A . 11 PHE CD1 1 1 16 8555 1 1 11 PHE CD2 C 9.034 -1.003 -1.453 1.00 . A A . 11 PHE CD2 1 1 16 8556 1 1 11 PHE CE1 C 9.730 -3.072 -3.234 1.00 . A A . 11 PHE CE1 1 1 16 8557 1 1 11 PHE CE2 C 8.435 -1.079 -2.723 1.00 . A A . 11 PHE CE2 1 1 16 8558 1 1 11 PHE CG C 9.998 -1.960 -1.075 1.00 . A A . 11 PHE CG 1 1 16 8559 1 1 11 PHE CZ C 8.783 -2.107 -3.613 1.00 . A A . 11 PHE CZ 1 1 16 8560 1 1 11 PHE H H 8.658 -1.877 1.666 1.00 . A A . 11 PHE H 1 1 16 8561 1 1 11 PHE HA H 10.453 -3.918 0.690 1.00 . A A . 11 PHE HA 1 1 16 8562 1 1 11 PHE HB2 H 10.498 -0.908 0.729 1.00 . A A . 11 PHE HB2 1 1 16 8563 1 1 11 PHE HB3 H 11.795 -1.855 0.033 1.00 . A A . 11 PHE HB3 1 1 16 8564 1 1 11 PHE HD1 H 11.098 -3.719 -1.708 1.00 . A A . 11 PHE HD1 1 1 16 8565 1 1 11 PHE HD2 H 8.722 -0.217 -0.778 1.00 . A A . 11 PHE HD2 1 1 16 8566 1 1 11 PHE HE1 H 10.000 -3.859 -3.926 1.00 . A A . 11 PHE HE1 1 1 16 8567 1 1 11 PHE HE2 H 7.686 -0.364 -3.024 1.00 . A A . 11 PHE HE2 1 1 16 8568 1 1 11 PHE HZ H 8.318 -2.147 -4.587 1.00 . A A . 11 PHE HZ 1 1 16 8569 1 1 11 PHE N N 9.083 -2.791 1.801 1.00 . A A . 11 PHE N 1 1 16 8570 1 1 11 PHE O O 11.318 -2.426 3.413 1.00 . A A . 11 PHE O 1 1 16 8571 1 1 12 ALA C C 14.390 -2.465 3.486 1.00 . A A . 12 ALA C 1 1 16 8572 1 1 12 ALA CA C 13.753 -3.793 3.020 1.00 . A A . 12 ALA CA 1 1 16 8573 1 1 12 ALA CB C 14.806 -4.709 2.385 1.00 . A A . 12 ALA CB 1 1 16 8574 1 1 12 ALA H H 12.753 -4.116 1.183 1.00 . A A . 12 ALA H 1 1 16 8575 1 1 12 ALA HA H 13.367 -4.288 3.912 1.00 . A A . 12 ALA HA 1 1 16 8576 1 1 12 ALA HB1 H 15.614 -4.885 3.097 1.00 . A A . 12 ALA HB1 1 1 16 8577 1 1 12 ALA HB2 H 14.357 -5.668 2.123 1.00 . A A . 12 ALA HB2 1 1 16 8578 1 1 12 ALA HB3 H 15.220 -4.244 1.489 1.00 . A A . 12 ALA HB3 1 1 16 8579 1 1 12 ALA N N 12.644 -3.644 2.067 1.00 . A A . 12 ALA N 1 1 16 8580 1 1 12 ALA O O 15.077 -2.443 4.502 1.00 . A A . 12 ALA O 1 1 16 8581 1 1 13 ASN C C 13.452 0.658 4.130 1.00 . A A . 13 ASN C 1 1 16 8582 1 1 13 ASN CA C 14.502 0.004 3.196 1.00 . A A . 13 ASN CA 1 1 16 8583 1 1 13 ASN CB C 14.760 0.854 1.931 1.00 . A A . 13 ASN CB 1 1 16 8584 1 1 13 ASN CG C 13.542 0.989 1.022 1.00 . A A . 13 ASN CG 1 1 16 8585 1 1 13 ASN H H 13.551 -1.437 1.962 1.00 . A A . 13 ASN H 1 1 16 8586 1 1 13 ASN HA H 15.432 -0.045 3.766 1.00 . A A . 13 ASN HA 1 1 16 8587 1 1 13 ASN HB2 H 15.078 1.854 2.230 1.00 . A A . 13 ASN HB2 1 1 16 8588 1 1 13 ASN HB3 H 15.574 0.400 1.366 1.00 . A A . 13 ASN HB3 1 1 16 8589 1 1 13 ASN HD21 H 14.676 1.568 -0.564 1.00 . A A . 13 ASN HD21 1 1 16 8590 1 1 13 ASN N N 14.139 -1.356 2.776 1.00 . A A . 13 ASN N 1 1 16 8591 1 1 13 ASN ND2 N 13.751 1.339 -0.246 1.00 . A A . 13 ASN ND2 1 1 16 8592 1 1 13 ASN O O 13.644 1.798 4.545 1.00 . A A . 13 ASN O 1 1 16 8593 1 1 13 ASN OD1 O 12.417 0.731 1.446 1.00 . A A . 13 ASN OD1 1 1 16 8594 1 1 14 GLY C C 10.057 1.062 4.503 1.00 . A A . 14 GLY C 1 1 16 8595 1 1 14 GLY CA C 11.242 0.455 5.267 1.00 . A A . 14 GLY CA 1 1 16 8596 1 1 14 GLY H H 12.222 -0.972 4.060 1.00 . A A . 14 GLY H 1 1 16 8597 1 1 14 GLY HA2 H 10.867 -0.391 5.839 1.00 . A A . 14 GLY HA2 1 1 16 8598 1 1 14 GLY HA3 H 11.617 1.201 5.968 1.00 . A A . 14 GLY HA3 1 1 16 8599 1 1 14 GLY N N 12.341 -0.033 4.431 1.00 . A A . 14 GLY N 1 1 16 8600 1 1 14 GLY O O 9.225 1.719 5.124 1.00 . A A . 14 GLY O 1 1 16 8601 1 1 15 THR C C 7.716 0.762 2.180 1.00 . A A . 15 THR C 1 1 16 8602 1 1 15 THR CA C 8.976 1.599 2.348 1.00 . A A . 15 THR CA 1 1 16 8603 1 1 15 THR CB C 9.583 1.966 0.986 1.00 . A A . 15 THR CB 1 1 16 8604 1 1 15 THR CG2 C 8.699 2.838 0.099 1.00 . A A . 15 THR CG2 1 1 16 8605 1 1 15 THR H H 10.587 0.243 2.701 1.00 . A A . 15 THR H 1 1 16 8606 1 1 15 THR HA H 8.706 2.534 2.828 1.00 . A A . 15 THR HA 1 1 16 8607 1 1 15 THR HB H 9.822 1.061 0.442 1.00 . A A . 15 THR HB 1 1 16 8608 1 1 15 THR HG1 H 11.438 1.963 1.446 1.00 . A A . 15 THR HG1 1 1 16 8609 1 1 15 THR HG21 H 8.598 3.832 0.534 1.00 . A A . 15 THR HG21 1 1 16 8610 1 1 15 THR HG22 H 9.155 2.916 -0.892 1.00 . A A . 15 THR HG22 1 1 16 8611 1 1 15 THR HG23 H 7.712 2.392 -0.006 1.00 . A A . 15 THR HG23 1 1 16 8612 1 1 15 THR N N 9.953 0.873 3.179 1.00 . A A . 15 THR N 1 1 16 8613 1 1 15 THR O O 7.783 -0.333 1.627 1.00 . A A . 15 THR O 1 1 16 8614 1 1 15 THR OG1 O 10.782 2.660 1.206 1.00 . A A . 15 THR OG1 1 1 16 8615 1 1 16 VAL C C 4.500 0.808 1.390 1.00 . A A . 16 VAL C 1 1 16 8616 1 1 16 VAL CA C 5.304 0.520 2.655 1.00 . A A . 16 VAL CA 1 1 16 8617 1 1 16 VAL CB C 4.497 0.849 3.932 1.00 . A A . 16 VAL CB 1 1 16 8618 1 1 16 VAL CG1 C 3.011 0.452 3.877 1.00 . A A . 16 VAL CG1 1 1 16 8619 1 1 16 VAL CG2 C 5.117 0.099 5.117 1.00 . A A . 16 VAL CG2 1 1 16 8620 1 1 16 VAL H H 6.555 2.196 3.042 1.00 . A A . 16 VAL H 1 1 16 8621 1 1 16 VAL HA H 5.524 -0.545 2.669 1.00 . A A . 16 VAL HA 1 1 16 8622 1 1 16 VAL HB H 4.552 1.922 4.123 1.00 . A A . 16 VAL HB 1 1 16 8623 1 1 16 VAL HG11 H 2.540 0.651 4.839 1.00 . A A . 16 VAL HG11 1 1 16 8624 1 1 16 VAL HG12 H 2.489 1.040 3.122 1.00 . A A . 16 VAL HG12 1 1 16 8625 1 1 16 VAL HG13 H 2.910 -0.609 3.646 1.00 . A A . 16 VAL HG13 1 1 16 8626 1 1 16 VAL HG21 H 5.017 -0.977 4.957 1.00 . A A . 16 VAL HG21 1 1 16 8627 1 1 16 VAL HG22 H 6.169 0.361 5.221 1.00 . A A . 16 VAL HG22 1 1 16 8628 1 1 16 VAL HG23 H 4.601 0.369 6.039 1.00 . A A . 16 VAL HG23 1 1 16 8629 1 1 16 VAL N N 6.565 1.274 2.629 1.00 . A A . 16 VAL N 1 1 16 8630 1 1 16 VAL O O 4.458 1.930 0.888 1.00 . A A . 16 VAL O 1 1 16 8631 1 1 17 TYR C C 2.004 -1.327 -0.274 1.00 . A A . 17 TYR C 1 1 16 8632 1 1 17 TYR CA C 3.089 -0.250 -0.354 1.00 . A A . 17 TYR CA 1 1 16 8633 1 1 17 TYR CB C 4.020 -0.477 -1.566 1.00 . A A . 17 TYR CB 1 1 16 8634 1 1 17 TYR CD1 C 5.927 -1.952 -0.840 1.00 . A A . 17 TYR CD1 1 1 16 8635 1 1 17 TYR CD2 C 4.347 -2.856 -2.462 1.00 . A A . 17 TYR CD2 1 1 16 8636 1 1 17 TYR CE1 C 6.711 -3.113 -0.934 1.00 . A A . 17 TYR CE1 1 1 16 8637 1 1 17 TYR CE2 C 5.131 -4.020 -2.564 1.00 . A A . 17 TYR CE2 1 1 16 8638 1 1 17 TYR CG C 4.762 -1.804 -1.615 1.00 . A A . 17 TYR CG 1 1 16 8639 1 1 17 TYR CZ C 6.329 -4.140 -1.825 1.00 . A A . 17 TYR CZ 1 1 16 8640 1 1 17 TYR H H 3.906 -1.137 1.374 1.00 . A A . 17 TYR H 1 1 16 8641 1 1 17 TYR HA H 2.598 0.717 -0.469 1.00 . A A . 17 TYR HA 1 1 16 8642 1 1 17 TYR HB2 H 3.450 -0.356 -2.487 1.00 . A A . 17 TYR HB2 1 1 16 8643 1 1 17 TYR HB3 H 4.776 0.309 -1.564 1.00 . A A . 17 TYR HB3 1 1 16 8644 1 1 17 TYR HD1 H 6.244 -1.150 -0.191 1.00 . A A . 17 TYR HD1 1 1 16 8645 1 1 17 TYR HD2 H 3.437 -2.799 -3.045 1.00 . A A . 17 TYR HD2 1 1 16 8646 1 1 17 TYR HE1 H 7.615 -3.177 -0.344 1.00 . A A . 17 TYR HE1 1 1 16 8647 1 1 17 TYR HE2 H 4.809 -4.841 -3.185 1.00 . A A . 17 TYR HE2 1 1 16 8648 1 1 17 TYR HH H 7.954 -5.141 -1.559 1.00 . A A . 17 TYR HH 1 1 16 8649 1 1 17 TYR N N 3.881 -0.251 0.871 1.00 . A A . 17 TYR N 1 1 16 8650 1 1 17 TYR O O 1.929 -2.081 0.698 1.00 . A A . 17 TYR O 1 1 16 8651 1 1 17 TYR OH O 7.082 -5.266 -1.935 1.00 . A A . 17 TYR OH 1 1 16 8652 1 1 18 TYR C C 0.585 -3.282 -2.795 1.00 . A A . 18 TYR C 1 1 16 8653 1 1 18 TYR CA C 0.250 -2.528 -1.518 1.00 . A A . 18 TYR CA 1 1 16 8654 1 1 18 TYR CB C -1.183 -1.987 -1.508 1.00 . A A . 18 TYR CB 1 1 16 8655 1 1 18 TYR CD1 C -1.053 0.071 -0.068 1.00 . A A . 18 TYR CD1 1 1 16 8656 1 1 18 TYR CD2 C -2.019 -1.960 0.885 1.00 . A A . 18 TYR CD2 1 1 16 8657 1 1 18 TYR CE1 C -1.160 0.708 1.176 1.00 . A A . 18 TYR CE1 1 1 16 8658 1 1 18 TYR CE2 C -2.125 -1.321 2.133 1.00 . A A . 18 TYR CE2 1 1 16 8659 1 1 18 TYR CG C -1.470 -1.266 -0.210 1.00 . A A . 18 TYR CG 1 1 16 8660 1 1 18 TYR CZ C -1.701 0.019 2.281 1.00 . A A . 18 TYR CZ 1 1 16 8661 1 1 18 TYR H H 1.224 -0.720 -2.053 1.00 . A A . 18 TYR H 1 1 16 8662 1 1 18 TYR HA H 0.341 -3.226 -0.686 1.00 . A A . 18 TYR HA 1 1 16 8663 1 1 18 TYR HB2 H -1.321 -1.301 -2.345 1.00 . A A . 18 TYR HB2 1 1 16 8664 1 1 18 TYR HB3 H -1.883 -2.815 -1.624 1.00 . A A . 18 TYR HB3 1 1 16 8665 1 1 18 TYR HD1 H -0.616 0.600 -0.905 1.00 . A A . 18 TYR HD1 1 1 16 8666 1 1 18 TYR HD2 H -2.331 -2.991 0.787 1.00 . A A . 18 TYR HD2 1 1 16 8667 1 1 18 TYR HE1 H -0.825 1.726 1.284 1.00 . A A . 18 TYR HE1 1 1 16 8668 1 1 18 TYR HE2 H -2.503 -1.873 2.975 1.00 . A A . 18 TYR HE2 1 1 16 8669 1 1 18 TYR HH H -2.221 0.104 4.146 1.00 . A A . 18 TYR HH 1 1 16 8670 1 1 18 TYR N N 1.201 -1.437 -1.330 1.00 . A A . 18 TYR N 1 1 16 8671 1 1 18 TYR O O 1.014 -2.690 -3.786 1.00 . A A . 18 TYR O 1 1 16 8672 1 1 18 TYR OH O -1.809 0.653 3.478 1.00 . A A . 18 TYR OH 1 1 16 8673 1 1 19 PHE C C -0.399 -6.466 -4.091 1.00 . A A . 19 PHE C 1 1 16 8674 1 1 19 PHE CA C 0.773 -5.544 -3.794 1.00 . A A . 19 PHE CA 1 1 16 8675 1 1 19 PHE CB C 1.965 -6.356 -3.299 1.00 . A A . 19 PHE CB 1 1 16 8676 1 1 19 PHE CD1 C 3.600 -6.918 -5.141 1.00 . A A . 19 PHE CD1 1 1 16 8677 1 1 19 PHE CD2 C 2.143 -8.679 -4.304 1.00 . A A . 19 PHE CD2 1 1 16 8678 1 1 19 PHE CE1 C 4.226 -7.840 -5.995 1.00 . A A . 19 PHE CE1 1 1 16 8679 1 1 19 PHE CE2 C 2.782 -9.604 -5.149 1.00 . A A . 19 PHE CE2 1 1 16 8680 1 1 19 PHE CG C 2.565 -7.336 -4.286 1.00 . A A . 19 PHE CG 1 1 16 8681 1 1 19 PHE CZ C 3.825 -9.186 -5.991 1.00 . A A . 19 PHE CZ 1 1 16 8682 1 1 19 PHE H H 0.025 -5.010 -1.896 1.00 . A A . 19 PHE H 1 1 16 8683 1 1 19 PHE HA H 1.066 -5.012 -4.698 1.00 . A A . 19 PHE HA 1 1 16 8684 1 1 19 PHE HB2 H 2.738 -5.648 -3.011 1.00 . A A . 19 PHE HB2 1 1 16 8685 1 1 19 PHE HB3 H 1.658 -6.911 -2.411 1.00 . A A . 19 PHE HB3 1 1 16 8686 1 1 19 PHE HD1 H 3.931 -5.891 -5.137 1.00 . A A . 19 PHE HD1 1 1 16 8687 1 1 19 PHE HD2 H 1.335 -9.006 -3.665 1.00 . A A . 19 PHE HD2 1 1 16 8688 1 1 19 PHE HE1 H 5.025 -7.511 -6.642 1.00 . A A . 19 PHE HE1 1 1 16 8689 1 1 19 PHE HE2 H 2.488 -10.643 -5.153 1.00 . A A . 19 PHE HE2 1 1 16 8690 1 1 19 PHE HZ H 4.316 -9.903 -6.634 1.00 . A A . 19 PHE HZ 1 1 16 8691 1 1 19 PHE N N 0.397 -4.599 -2.752 1.00 . A A . 19 PHE N 1 1 16 8692 1 1 19 PHE O O -1.086 -6.916 -3.175 1.00 . A A . 19 PHE O 1 1 16 8693 1 1 20 ASN C C -1.020 -9.063 -6.080 1.00 . A A . 20 ASN C 1 1 16 8694 1 1 20 ASN CA C -1.625 -7.679 -5.825 1.00 . A A . 20 ASN CA 1 1 16 8695 1 1 20 ASN CB C -2.298 -7.083 -7.056 1.00 . A A . 20 ASN CB 1 1 16 8696 1 1 20 ASN CG C -3.510 -7.912 -7.421 1.00 . A A . 20 ASN CG 1 1 16 8697 1 1 20 ASN H H 0.009 -6.361 -6.075 1.00 . A A . 20 ASN H 1 1 16 8698 1 1 20 ASN HA H -2.383 -7.772 -5.053 1.00 . A A . 20 ASN HA 1 1 16 8699 1 1 20 ASN HB2 H -2.597 -6.060 -6.857 1.00 . A A . 20 ASN HB2 1 1 16 8700 1 1 20 ASN HB3 H -1.594 -7.069 -7.883 1.00 . A A . 20 ASN HB3 1 1 16 8701 1 1 20 ASN HD21 H -4.760 -6.619 -6.486 1.00 . A A . 20 ASN HD21 1 1 16 8702 1 1 20 ASN HD22 H -5.527 -8.047 -7.113 1.00 . A A . 20 ASN HD22 1 1 16 8703 1 1 20 ASN N N -0.601 -6.766 -5.368 1.00 . A A . 20 ASN N 1 1 16 8704 1 1 20 ASN ND2 N -4.678 -7.494 -6.987 1.00 . A A . 20 ASN ND2 1 1 16 8705 1 1 20 ASN O O -0.510 -9.337 -7.167 1.00 . A A . 20 ASN O 1 1 16 8706 1 1 20 ASN OD1 O -3.382 -8.949 -8.059 1.00 . A A . 20 ASN OD1 1 1 16 8707 1 1 21 HIS C C -1.333 -12.274 -6.112 1.00 . A A . 21 HIS C 1 1 16 8708 1 1 21 HIS CA C -0.522 -11.311 -5.216 1.00 . A A . 21 HIS CA 1 1 16 8709 1 1 21 HIS CB C -0.092 -11.860 -3.840 1.00 . A A . 21 HIS CB 1 1 16 8710 1 1 21 HIS CD2 C -2.403 -12.198 -2.802 1.00 . A A . 21 HIS CD2 1 1 16 8711 1 1 21 HIS CE1 C -1.967 -11.536 -0.744 1.00 . A A . 21 HIS CE1 1 1 16 8712 1 1 21 HIS CG C -1.100 -11.803 -2.722 1.00 . A A . 21 HIS CG 1 1 16 8713 1 1 21 HIS H H -1.627 -9.734 -4.257 1.00 . A A . 21 HIS H 1 1 16 8714 1 1 21 HIS HA H 0.405 -11.201 -5.777 1.00 . A A . 21 HIS HA 1 1 16 8715 1 1 21 HIS HB2 H 0.250 -12.888 -3.949 1.00 . A A . 21 HIS HB2 1 1 16 8716 1 1 21 HIS HB3 H 0.773 -11.287 -3.515 1.00 . A A . 21 HIS HB3 1 1 16 8717 1 1 21 HIS HD2 H -2.902 -12.592 -3.675 1.00 . A A . 21 HIS HD2 1 1 16 8718 1 1 21 HIS HE1 H -2.104 -11.314 0.305 1.00 . A A . 21 HIS HE1 1 1 16 8719 1 1 21 HIS HE2 H -3.887 -12.202 -1.265 1.00 . A A . 21 HIS HE2 1 1 16 8720 1 1 21 HIS N N -1.094 -9.963 -5.094 1.00 . A A . 21 HIS N 1 1 16 8721 1 1 21 HIS ND1 N -0.813 -11.384 -1.417 1.00 . A A . 21 HIS ND1 1 1 16 8722 1 1 21 HIS NE2 N -2.936 -12.011 -1.546 1.00 . A A . 21 HIS NE2 1 1 16 8723 1 1 21 HIS O O -1.164 -13.486 -6.021 1.00 . A A . 21 HIS O 1 1 16 8724 1 1 22 ILE C C -2.354 -12.003 -9.455 1.00 . A A . 22 ILE C 1 1 16 8725 1 1 22 ILE CA C -2.881 -12.465 -8.072 1.00 . A A . 22 ILE CA 1 1 16 8726 1 1 22 ILE CB C -4.421 -12.339 -7.902 1.00 . A A . 22 ILE CB 1 1 16 8727 1 1 22 ILE CD1 C -6.353 -12.984 -6.273 1.00 . A A . 22 ILE CD1 1 1 16 8728 1 1 22 ILE CG1 C -4.844 -12.981 -6.557 1.00 . A A . 22 ILE CG1 1 1 16 8729 1 1 22 ILE CG2 C -5.194 -12.977 -9.074 1.00 . A A . 22 ILE CG2 1 1 16 8730 1 1 22 ILE H H -2.336 -10.732 -6.981 1.00 . A A . 22 ILE H 1 1 16 8731 1 1 22 ILE HA H -2.631 -13.524 -7.998 1.00 . A A . 22 ILE HA 1 1 16 8732 1 1 22 ILE HB H -4.683 -11.280 -7.873 1.00 . A A . 22 ILE HB 1 1 16 8733 1 1 22 ILE HD11 H -6.855 -13.723 -6.898 1.00 . A A . 22 ILE HD11 1 1 16 8734 1 1 22 ILE HD12 H -6.524 -13.246 -5.229 1.00 . A A . 22 ILE HD12 1 1 16 8735 1 1 22 ILE HD13 H -6.776 -11.998 -6.467 1.00 . A A . 22 ILE HD13 1 1 16 8736 1 1 22 ILE HG12 H -4.489 -14.012 -6.522 1.00 . A A . 22 ILE HG12 1 1 16 8737 1 1 22 ILE HG13 H -4.367 -12.438 -5.741 1.00 . A A . 22 ILE HG13 1 1 16 8738 1 1 22 ILE HG21 H -4.936 -14.033 -9.163 1.00 . A A . 22 ILE HG21 1 1 16 8739 1 1 22 ILE HG22 H -6.269 -12.875 -8.930 1.00 . A A . 22 ILE HG22 1 1 16 8740 1 1 22 ILE HG23 H -4.959 -12.468 -10.008 1.00 . A A . 22 ILE HG23 1 1 16 8741 1 1 22 ILE N N -2.190 -11.735 -6.995 1.00 . A A . 22 ILE N 1 1 16 8742 1 1 22 ILE O O -2.501 -12.724 -10.438 1.00 . A A . 22 ILE O 1 1 16 8743 1 1 23 THR C C 0.222 -9.688 -10.753 1.00 . A A . 23 THR C 1 1 16 8744 1 1 23 THR CA C -1.212 -10.225 -10.799 1.00 . A A . 23 THR CA 1 1 16 8745 1 1 23 THR CB C -2.104 -9.040 -11.193 1.00 . A A . 23 THR CB 1 1 16 8746 1 1 23 THR CG2 C -3.567 -9.419 -11.436 1.00 . A A . 23 THR CG2 1 1 16 8747 1 1 23 THR H H -1.609 -10.277 -8.700 1.00 . A A . 23 THR H 1 1 16 8748 1 1 23 THR HA H -1.248 -10.962 -11.602 1.00 . A A . 23 THR HA 1 1 16 8749 1 1 23 THR HB H -1.716 -8.592 -12.109 1.00 . A A . 23 THR HB 1 1 16 8750 1 1 23 THR HG1 H -2.596 -8.440 -9.433 1.00 . A A . 23 THR HG1 1 1 16 8751 1 1 23 THR HG21 H -4.118 -8.537 -11.760 1.00 . A A . 23 THR HG21 1 1 16 8752 1 1 23 THR HG22 H -3.620 -10.178 -12.216 1.00 . A A . 23 THR HG22 1 1 16 8753 1 1 23 THR HG23 H -4.023 -9.811 -10.527 1.00 . A A . 23 THR HG23 1 1 16 8754 1 1 23 THR N N -1.684 -10.841 -9.538 1.00 . A A . 23 THR N 1 1 16 8755 1 1 23 THR O O 0.757 -9.327 -11.799 1.00 . A A . 23 THR O 1 1 16 8756 1 1 23 THR OG1 O -2.047 -8.080 -10.163 1.00 . A A . 23 THR OG1 1 1 16 8757 1 1 24 ASN C C 2.045 -7.381 -9.477 1.00 . A A . 24 ASN C 1 1 16 8758 1 1 24 ASN CA C 2.109 -8.922 -9.304 1.00 . A A . 24 ASN CA 1 1 16 8759 1 1 24 ASN CB C 3.237 -9.627 -10.097 1.00 . A A . 24 ASN CB 1 1 16 8760 1 1 24 ASN CG C 4.608 -9.581 -9.435 1.00 . A A . 24 ASN CG 1 1 16 8761 1 1 24 ASN H H 0.321 -9.851 -8.728 1.00 . A A . 24 ASN H 1 1 16 8762 1 1 24 ASN HA H 2.310 -9.083 -8.246 1.00 . A A . 24 ASN HA 1 1 16 8763 1 1 24 ASN HB2 H 2.985 -10.680 -10.224 1.00 . A A . 24 ASN HB2 1 1 16 8764 1 1 24 ASN HB3 H 3.314 -9.182 -11.090 1.00 . A A . 24 ASN HB3 1 1 16 8765 1 1 24 ASN HD21 H 4.661 -7.567 -9.488 1.00 . A A . 24 ASN HD21 1 1 16 8766 1 1 24 ASN HD22 H 6.118 -8.397 -8.889 1.00 . A A . 24 ASN HD22 1 1 16 8767 1 1 24 ASN N N 0.836 -9.596 -9.566 1.00 . A A . 24 ASN N 1 1 16 8768 1 1 24 ASN ND2 N 5.193 -8.414 -9.278 1.00 . A A . 24 ASN ND2 1 1 16 8769 1 1 24 ASN O O 3.095 -6.735 -9.481 1.00 . A A . 24 ASN O 1 1 16 8770 1 1 24 ASN OD1 O 5.162 -10.595 -9.046 1.00 . A A . 24 ASN OD1 1 1 16 8771 1 1 25 ALA C C 1.174 -4.742 -8.168 1.00 . A A . 25 ALA C 1 1 16 8772 1 1 25 ALA CA C 0.765 -5.298 -9.554 1.00 . A A . 25 ALA CA 1 1 16 8773 1 1 25 ALA CB C -0.655 -4.867 -9.940 1.00 . A A . 25 ALA CB 1 1 16 8774 1 1 25 ALA H H -0.011 -7.292 -9.656 1.00 . A A . 25 ALA H 1 1 16 8775 1 1 25 ALA HA H 1.452 -4.888 -10.296 1.00 . A A . 25 ALA HA 1 1 16 8776 1 1 25 ALA HB1 H -0.703 -3.780 -10.014 1.00 . A A . 25 ALA HB1 1 1 16 8777 1 1 25 ALA HB2 H -0.921 -5.296 -10.908 1.00 . A A . 25 ALA HB2 1 1 16 8778 1 1 25 ALA HB3 H -1.371 -5.202 -9.192 1.00 . A A . 25 ALA HB3 1 1 16 8779 1 1 25 ALA N N 0.855 -6.764 -9.604 1.00 . A A . 25 ALA N 1 1 16 8780 1 1 25 ALA O O 1.063 -5.436 -7.157 1.00 . A A . 25 ALA O 1 1 16 8781 1 1 26 SER C C 1.792 -1.305 -6.904 1.00 . A A . 26 SER C 1 1 16 8782 1 1 26 SER CA C 2.030 -2.813 -6.854 1.00 . A A . 26 SER CA 1 1 16 8783 1 1 26 SER CB C 3.522 -3.037 -6.585 1.00 . A A . 26 SER CB 1 1 16 8784 1 1 26 SER H H 1.702 -2.928 -8.944 1.00 . A A . 26 SER H 1 1 16 8785 1 1 26 SER HA H 1.473 -3.234 -6.022 1.00 . A A . 26 SER HA 1 1 16 8786 1 1 26 SER HB2 H 3.810 -2.486 -5.688 1.00 . A A . 26 SER HB2 1 1 16 8787 1 1 26 SER HB3 H 3.713 -4.093 -6.407 1.00 . A A . 26 SER HB3 1 1 16 8788 1 1 26 SER HG H 3.902 -1.752 -7.998 1.00 . A A . 26 SER HG 1 1 16 8789 1 1 26 SER N N 1.614 -3.478 -8.102 1.00 . A A . 26 SER N 1 1 16 8790 1 1 26 SER O O 2.104 -0.687 -7.923 1.00 . A A . 26 SER O 1 1 16 8791 1 1 26 SER OG O 4.294 -2.578 -7.679 1.00 . A A . 26 SER OG 1 1 16 8792 1 1 27 GLN C C 1.442 1.266 -4.260 1.00 . A A . 27 GLN C 1 1 16 8793 1 1 27 GLN CA C 1.125 0.735 -5.669 1.00 . A A . 27 GLN CA 1 1 16 8794 1 1 27 GLN CB C -0.312 1.091 -6.098 1.00 . A A . 27 GLN CB 1 1 16 8795 1 1 27 GLN CD C -2.805 0.751 -5.805 1.00 . A A . 27 GLN CD 1 1 16 8796 1 1 27 GLN CG C -1.420 0.469 -5.229 1.00 . A A . 27 GLN CG 1 1 16 8797 1 1 27 GLN H H 1.149 -1.281 -4.968 1.00 . A A . 27 GLN H 1 1 16 8798 1 1 27 GLN HA H 1.802 1.236 -6.363 1.00 . A A . 27 GLN HA 1 1 16 8799 1 1 27 GLN HB2 H -0.425 2.176 -6.079 1.00 . A A . 27 GLN HB2 1 1 16 8800 1 1 27 GLN HB3 H -0.453 0.762 -7.129 1.00 . A A . 27 GLN HB3 1 1 16 8801 1 1 27 GLN HE21 H -3.227 2.170 -4.396 1.00 . A A . 27 GLN HE21 1 1 16 8802 1 1 27 GLN HE22 H -4.463 1.817 -5.623 1.00 . A A . 27 GLN HE22 1 1 16 8803 1 1 27 GLN HG2 H -1.289 -0.608 -5.173 1.00 . A A . 27 GLN HG2 1 1 16 8804 1 1 27 GLN HG3 H -1.361 0.867 -4.216 1.00 . A A . 27 GLN HG3 1 1 16 8805 1 1 27 GLN N N 1.339 -0.711 -5.793 1.00 . A A . 27 GLN N 1 1 16 8806 1 1 27 GLN NE2 N -3.568 1.642 -5.206 1.00 . A A . 27 GLN NE2 1 1 16 8807 1 1 27 GLN O O 1.101 0.643 -3.252 1.00 . A A . 27 GLN O 1 1 16 8808 1 1 27 GLN OE1 O -3.216 0.185 -6.805 1.00 . A A . 27 GLN OE1 1 1 16 8809 1 1 28 PHE C C 1.013 3.948 -2.506 1.00 . A A . 28 PHE C 1 1 16 8810 1 1 28 PHE CA C 2.282 3.210 -2.964 1.00 . A A . 28 PHE CA 1 1 16 8811 1 1 28 PHE CB C 3.414 4.222 -3.184 1.00 . A A . 28 PHE CB 1 1 16 8812 1 1 28 PHE CD1 C 5.426 2.845 -2.546 1.00 . A A . 28 PHE CD1 1 1 16 8813 1 1 28 PHE CD2 C 5.280 3.692 -4.826 1.00 . A A . 28 PHE CD2 1 1 16 8814 1 1 28 PHE CE1 C 6.638 2.213 -2.859 1.00 . A A . 28 PHE CE1 1 1 16 8815 1 1 28 PHE CE2 C 6.502 3.066 -5.133 1.00 . A A . 28 PHE CE2 1 1 16 8816 1 1 28 PHE CG C 4.740 3.580 -3.529 1.00 . A A . 28 PHE CG 1 1 16 8817 1 1 28 PHE CZ C 7.182 2.327 -4.150 1.00 . A A . 28 PHE CZ 1 1 16 8818 1 1 28 PHE H H 2.398 2.875 -5.053 1.00 . A A . 28 PHE H 1 1 16 8819 1 1 28 PHE HA H 2.585 2.528 -2.167 1.00 . A A . 28 PHE HA 1 1 16 8820 1 1 28 PHE HB2 H 3.129 4.922 -3.971 1.00 . A A . 28 PHE HB2 1 1 16 8821 1 1 28 PHE HB3 H 3.554 4.794 -2.265 1.00 . A A . 28 PHE HB3 1 1 16 8822 1 1 28 PHE HD1 H 5.017 2.755 -1.549 1.00 . A A . 28 PHE HD1 1 1 16 8823 1 1 28 PHE HD2 H 4.764 4.258 -5.587 1.00 . A A . 28 PHE HD2 1 1 16 8824 1 1 28 PHE HE1 H 7.143 1.639 -2.102 1.00 . A A . 28 PHE HE1 1 1 16 8825 1 1 28 PHE HE2 H 6.920 3.155 -6.125 1.00 . A A . 28 PHE HE2 1 1 16 8826 1 1 28 PHE HZ H 8.123 1.850 -4.385 1.00 . A A . 28 PHE HZ 1 1 16 8827 1 1 28 PHE N N 2.068 2.449 -4.201 1.00 . A A . 28 PHE N 1 1 16 8828 1 1 28 PHE O O 0.774 4.082 -1.308 1.00 . A A . 28 PHE O 1 1 16 8829 1 1 29 GLU C C -2.034 3.993 -2.506 1.00 . A A . 29 GLU C 1 1 16 8830 1 1 29 GLU CA C -1.119 5.016 -3.189 1.00 . A A . 29 GLU CA 1 1 16 8831 1 1 29 GLU CB C -1.737 5.493 -4.520 1.00 . A A . 29 GLU CB 1 1 16 8832 1 1 29 GLU CD C -2.084 7.908 -3.939 1.00 . A A . 29 GLU CD 1 1 16 8833 1 1 29 GLU CG C -1.360 6.939 -4.876 1.00 . A A . 29 GLU CG 1 1 16 8834 1 1 29 GLU H H 0.434 4.275 -4.422 1.00 . A A . 29 GLU H 1 1 16 8835 1 1 29 GLU HA H -0.990 5.867 -2.518 1.00 . A A . 29 GLU HA 1 1 16 8836 1 1 29 GLU HB2 H -1.423 4.830 -5.328 1.00 . A A . 29 GLU HB2 1 1 16 8837 1 1 29 GLU HB3 H -2.826 5.433 -4.457 1.00 . A A . 29 GLU HB3 1 1 16 8838 1 1 29 GLU HG2 H -0.278 7.065 -4.806 1.00 . A A . 29 GLU HG2 1 1 16 8839 1 1 29 GLU HG3 H -1.662 7.139 -5.906 1.00 . A A . 29 GLU HG3 1 1 16 8840 1 1 29 GLU N N 0.188 4.410 -3.456 1.00 . A A . 29 GLU N 1 1 16 8841 1 1 29 GLU O O -2.461 3.025 -3.139 1.00 . A A . 29 GLU O 1 1 16 8842 1 1 29 GLU OE1 O -3.315 8.068 -4.091 1.00 . A A . 29 GLU OE1 1 1 16 8843 1 1 29 GLU OE2 O -1.482 8.342 -2.934 1.00 . A A . 29 GLU OE2 1 1 16 8844 1 1 30 ARG C C -4.514 2.965 -0.955 1.00 . A A . 30 ARG C 1 1 16 8845 1 1 30 ARG CA C -3.081 3.207 -0.426 1.00 . A A . 30 ARG CA 1 1 16 8846 1 1 30 ARG CB C -2.970 3.463 1.090 1.00 . A A . 30 ARG CB 1 1 16 8847 1 1 30 ARG CD C -3.656 5.959 1.387 1.00 . A A . 30 ARG CD 1 1 16 8848 1 1 30 ARG CG C -3.839 4.498 1.818 1.00 . A A . 30 ARG CG 1 1 16 8849 1 1 30 ARG CZ C -3.910 6.960 -0.904 1.00 . A A . 30 ARG CZ 1 1 16 8850 1 1 30 ARG H H -1.913 4.970 -0.731 1.00 . A A . 30 ARG H 1 1 16 8851 1 1 30 ARG HA H -2.522 2.291 -0.576 1.00 . A A . 30 ARG HA 1 1 16 8852 1 1 30 ARG HB2 H -3.191 2.513 1.578 1.00 . A A . 30 ARG HB2 1 1 16 8853 1 1 30 ARG HB3 H -1.929 3.700 1.316 1.00 . A A . 30 ARG HB3 1 1 16 8854 1 1 30 ARG HD2 H -4.112 6.606 2.139 1.00 . A A . 30 ARG HD2 1 1 16 8855 1 1 30 ARG HD3 H -2.590 6.183 1.332 1.00 . A A . 30 ARG HD3 1 1 16 8856 1 1 30 ARG HE H -4.991 5.493 -0.182 1.00 . A A . 30 ARG HE 1 1 16 8857 1 1 30 ARG HG2 H -4.891 4.218 1.740 1.00 . A A . 30 ARG HG2 1 1 16 8858 1 1 30 ARG HG3 H -3.546 4.415 2.863 1.00 . A A . 30 ARG HG3 1 1 16 8859 1 1 30 ARG HH11 H -2.523 7.993 0.121 1.00 . A A . 30 ARG HH11 1 1 16 8860 1 1 30 ARG HH12 H -2.481 8.208 -1.628 1.00 . A A . 30 ARG HH12 1 1 16 8861 1 1 30 ARG HH21 H -5.163 6.083 -2.215 1.00 . A A . 30 ARG HH21 1 1 16 8862 1 1 30 ARG HH22 H -4.137 7.372 -2.870 1.00 . A A . 30 ARG HH22 1 1 16 8863 1 1 30 ARG N N -2.336 4.193 -1.216 1.00 . A A . 30 ARG N 1 1 16 8864 1 1 30 ARG NE N -4.314 6.200 0.098 1.00 . A A . 30 ARG NE 1 1 16 8865 1 1 30 ARG NH1 N -2.931 7.822 -0.776 1.00 . A A . 30 ARG NH1 1 1 16 8866 1 1 30 ARG NH2 N -4.470 6.797 -2.074 1.00 . A A . 30 ARG NH2 1 1 16 8867 1 1 30 ARG O O -5.312 3.910 -0.983 1.00 . A A . 30 ARG O 1 1 16 8868 1 1 31 PRO C C -7.026 1.063 -0.489 1.00 . A A . 31 PRO C 1 1 16 8869 1 1 31 PRO CA C -6.204 1.341 -1.762 1.00 . A A . 31 PRO CA 1 1 16 8870 1 1 31 PRO CB C -6.015 0.091 -2.632 1.00 . A A . 31 PRO CB 1 1 16 8871 1 1 31 PRO CD C -3.979 0.568 -1.434 1.00 . A A . 31 PRO CD 1 1 16 8872 1 1 31 PRO CG C -4.790 -0.584 -2.019 1.00 . A A . 31 PRO CG 1 1 16 8873 1 1 31 PRO HA H -6.698 2.119 -2.344 1.00 . A A . 31 PRO HA 1 1 16 8874 1 1 31 PRO HB2 H -6.883 -0.567 -2.628 1.00 . A A . 31 PRO HB2 1 1 16 8875 1 1 31 PRO HB3 H -5.782 0.397 -3.654 1.00 . A A . 31 PRO HB3 1 1 16 8876 1 1 31 PRO HD2 H -3.686 0.313 -0.415 1.00 . A A . 31 PRO HD2 1 1 16 8877 1 1 31 PRO HD3 H -3.094 0.757 -2.042 1.00 . A A . 31 PRO HD3 1 1 16 8878 1 1 31 PRO HG2 H -5.102 -1.237 -1.209 1.00 . A A . 31 PRO HG2 1 1 16 8879 1 1 31 PRO HG3 H -4.216 -1.141 -2.759 1.00 . A A . 31 PRO HG3 1 1 16 8880 1 1 31 PRO N N -4.846 1.738 -1.407 1.00 . A A . 31 PRO N 1 1 16 8881 1 1 31 PRO O O -6.548 1.237 0.636 1.00 . A A . 31 PRO O 1 1 16 8882 1 1 32 SER C C -10.235 -0.741 0.012 1.00 . A A . 32 SER C 1 1 16 8883 1 1 32 SER CA C -9.102 0.166 0.494 1.00 . A A . 32 SER CA 1 1 16 8884 1 1 32 SER CB C -9.661 1.362 1.279 1.00 . A A . 32 SER CB 1 1 16 8885 1 1 32 SER H H -8.698 0.512 -1.547 1.00 . A A . 32 SER H 1 1 16 8886 1 1 32 SER HA H -8.479 -0.424 1.169 1.00 . A A . 32 SER HA 1 1 16 8887 1 1 32 SER HB2 H -10.110 2.079 0.591 1.00 . A A . 32 SER HB2 1 1 16 8888 1 1 32 SER HB3 H -10.417 1.025 1.988 1.00 . A A . 32 SER HB3 1 1 16 8889 1 1 32 SER HG H -7.761 1.751 1.538 1.00 . A A . 32 SER HG 1 1 16 8890 1 1 32 SER N N -8.285 0.637 -0.631 1.00 . A A . 32 SER N 1 1 16 8891 1 1 32 SER O O -10.572 -0.745 -1.172 1.00 . A A . 32 SER O 1 1 16 8892 1 1 32 SER OG O -8.607 1.971 1.998 1.00 . A A . 32 SER OG 1 1 16 8893 1 1 33 GLY C C -11.631 -3.656 1.781 1.00 . A A . 33 GLY C 1 1 16 8894 1 1 33 GLY CA C -11.796 -2.566 0.732 1.00 . A A . 33 GLY CA 1 1 16 8895 1 1 33 GLY H H -10.438 -1.523 1.891 1.00 . A A . 33 GLY H 1 1 16 8896 1 1 33 GLY HA2 H -12.799 -2.151 0.819 1.00 . A A . 33 GLY HA2 1 1 16 8897 1 1 33 GLY HA3 H -11.679 -3.015 -0.254 1.00 . A A . 33 GLY HA3 1 1 16 8898 1 1 33 GLY N N -10.796 -1.517 0.943 1.00 . A A . 33 GLY N 1 1 16 8899 1 1 33 GLY O O -12.286 -4.713 1.671 1.00 . A A . 33 GLY O 1 1 16 8900 1 1 33 GLY OXT O -10.767 -3.497 2.679 1.00 . A A . 33 GLY OXT 1 1 16 8901 2 2 1 NAG C1 C 12.759 1.056 -1.273 1.00 . B A . 101 NAG C1 1 1 16 8902 2 2 1 NAG C2 C 12.333 2.277 -2.119 1.00 . B A . 101 NAG C2 1 1 16 8903 2 2 1 NAG C3 C 11.249 1.751 -3.076 1.00 . B A . 101 NAG C3 1 1 16 8904 2 2 1 NAG C4 C 11.896 0.731 -4.005 1.00 . B A . 101 NAG C4 1 1 16 8905 2 2 1 NAG C5 C 12.463 -0.452 -3.214 1.00 . B A . 101 NAG C5 1 1 16 8906 2 2 1 NAG C6 C 13.219 -1.476 -4.059 1.00 . B A . 101 NAG C6 1 1 16 8907 2 2 1 NAG C7 C 11.694 4.626 -1.751 1.00 . B A . 101 NAG C7 1 1 16 8908 2 2 1 NAG C8 C 11.286 5.690 -0.724 1.00 . B A . 101 NAG C8 1 1 16 8909 2 2 1 NAG H1 H 11.876 0.616 -0.811 1.00 . B A . 101 NAG H1 1 1 16 8910 2 2 1 NAG H2 H 13.185 2.639 -2.698 1.00 . B A . 101 NAG H2 1 1 16 8911 2 2 1 NAG H3 H 10.449 1.268 -2.501 1.00 . B A . 101 NAG H3 1 1 16 8912 2 2 1 NAG H4 H 12.676 1.228 -4.576 1.00 . B A . 101 NAG H4 1 1 16 8913 2 2 1 NAG H5 H 11.634 -0.954 -2.733 1.00 . B A . 101 NAG H5 1 1 16 8914 2 2 1 NAG H61 H 13.395 -2.376 -3.471 1.00 . B A . 101 NAG H61 1 1 16 8915 2 2 1 NAG H62 H 12.653 -1.753 -4.948 1.00 . B A . 101 NAG H62 1 1 16 8916 2 2 1 NAG H81 H 10.218 5.610 -0.519 1.00 . B A . 101 NAG H81 1 1 16 8917 2 2 1 NAG H82 H 11.502 6.684 -1.117 1.00 . B A . 101 NAG H82 1 1 16 8918 2 2 1 NAG H83 H 11.843 5.546 0.204 1.00 . B A . 101 NAG H83 1 1 16 8919 2 2 1 NAG HN2 H 11.571 3.177 -0.337 1.00 . B A . 101 NAG HN2 1 1 16 8920 2 2 1 NAG HO3 H 11.089 3.666 -3.653 1.00 . B A . 101 NAG HO3 1 1 16 8921 2 2 1 NAG HO4 H 10.393 1.093 -5.137 1.00 . B A . 101 NAG HO4 1 1 16 8922 2 2 1 NAG HO6 H 14.878 -0.543 -3.628 1.00 . B A . 101 NAG HO6 1 1 16 8923 2 2 1 NAG N2 N 11.849 3.385 -1.293 1.00 . B A . 101 NAG N2 1 1 16 8924 2 2 1 NAG O3 O 10.695 2.797 -3.916 1.00 . B A . 101 NAG O3 1 1 16 8925 2 2 1 NAG O4 O 10.864 0.284 -4.889 1.00 . B A . 101 NAG O4 1 1 16 8926 2 2 1 NAG O5 O 13.373 0.057 -2.154 1.00 . B A . 101 NAG O5 1 1 16 8927 2 2 1 NAG O6 O 14.484 -0.907 -4.427 1.00 . B A . 101 NAG O6 1 1 16 8928 2 2 1 NAG O7 O 11.841 4.882 -2.944 1.00 . B A . 101 NAG O7 1 1 17 8929 1 1 1 LYS C C -6.554 -6.101 3.530 1.00 . A A . 1 LYS C 1 1 17 8930 1 1 1 LYS CA C -6.301 -6.925 4.797 1.00 . A A . 1 LYS CA 1 1 17 8931 1 1 1 LYS CB C -6.668 -6.119 6.067 1.00 . A A . 1 LYS CB 1 1 17 8932 1 1 1 LYS CD C -8.233 -4.192 6.863 1.00 . A A . 1 LYS CD 1 1 17 8933 1 1 1 LYS CE C -7.207 -3.079 6.569 1.00 . A A . 1 LYS CE 1 1 17 8934 1 1 1 LYS CG C -8.087 -5.496 6.054 1.00 . A A . 1 LYS CG 1 1 17 8935 1 1 1 LYS H1 H -4.667 -7.904 4.027 1.00 . A A . 1 LYS H1 1 1 17 8936 1 1 1 LYS H2 H -4.725 -7.942 5.672 1.00 . A A . 1 LYS H2 1 1 17 8937 1 1 1 LYS H3 H -4.263 -6.571 4.860 1.00 . A A . 1 LYS H3 1 1 17 8938 1 1 1 LYS HA H -6.941 -7.807 4.744 1.00 . A A . 1 LYS HA 1 1 17 8939 1 1 1 LYS HB2 H -6.583 -6.769 6.940 1.00 . A A . 1 LYS HB2 1 1 17 8940 1 1 1 LYS HB3 H -5.923 -5.333 6.181 1.00 . A A . 1 LYS HB3 1 1 17 8941 1 1 1 LYS HD2 H -9.235 -3.794 6.688 1.00 . A A . 1 LYS HD2 1 1 17 8942 1 1 1 LYS HD3 H -8.165 -4.437 7.925 1.00 . A A . 1 LYS HD3 1 1 17 8943 1 1 1 LYS HE2 H -7.492 -2.183 7.128 1.00 . A A . 1 LYS HE2 1 1 17 8944 1 1 1 LYS HE3 H -6.235 -3.399 6.952 1.00 . A A . 1 LYS HE3 1 1 17 8945 1 1 1 LYS HG2 H -8.414 -5.278 5.040 1.00 . A A . 1 LYS HG2 1 1 17 8946 1 1 1 LYS HG3 H -8.789 -6.233 6.448 1.00 . A A . 1 LYS HG3 1 1 17 8947 1 1 1 LYS HZ1 H -7.876 -2.261 4.737 1.00 . A A . 1 LYS HZ1 1 1 17 8948 1 1 1 LYS HZ2 H -6.274 -2.100 4.991 1.00 . A A . 1 LYS HZ2 1 1 17 8949 1 1 1 LYS HZ3 H -6.863 -3.559 4.559 1.00 . A A . 1 LYS HZ3 1 1 17 8950 1 1 1 LYS N N -4.892 -7.362 4.863 1.00 . A A . 1 LYS N 1 1 17 8951 1 1 1 LYS NZ N -7.066 -2.740 5.131 1.00 . A A . 1 LYS NZ 1 1 17 8952 1 1 1 LYS O O -6.375 -4.885 3.586 1.00 . A A . 1 LYS O 1 1 17 8953 1 1 2 LEU C C -8.424 -7.009 0.415 1.00 . A A . 2 LEU C 1 1 17 8954 1 1 2 LEU CA C -7.499 -6.063 1.216 1.00 . A A . 2 LEU CA 1 1 17 8955 1 1 2 LEU CB C -6.333 -5.583 0.329 1.00 . A A . 2 LEU CB 1 1 17 8956 1 1 2 LEU CD1 C -4.891 -3.764 -0.563 1.00 . A A . 2 LEU CD1 1 1 17 8957 1 1 2 LEU CD2 C -6.680 -3.085 0.980 1.00 . A A . 2 LEU CD2 1 1 17 8958 1 1 2 LEU CG C -5.695 -4.217 0.656 1.00 . A A . 2 LEU CG 1 1 17 8959 1 1 2 LEU H H -6.988 -7.740 2.381 1.00 . A A . 2 LEU H 1 1 17 8960 1 1 2 LEU HA H -8.117 -5.219 1.512 1.00 . A A . 2 LEU HA 1 1 17 8961 1 1 2 LEU HB2 H -5.558 -6.340 0.368 1.00 . A A . 2 LEU HB2 1 1 17 8962 1 1 2 LEU HB3 H -6.674 -5.552 -0.705 1.00 . A A . 2 LEU HB3 1 1 17 8963 1 1 2 LEU HD11 H -4.097 -4.478 -0.776 1.00 . A A . 2 LEU HD11 1 1 17 8964 1 1 2 LEU HD12 H -5.543 -3.675 -1.433 1.00 . A A . 2 LEU HD12 1 1 17 8965 1 1 2 LEU HD13 H -4.465 -2.787 -0.367 1.00 . A A . 2 LEU HD13 1 1 17 8966 1 1 2 LEU HD21 H -6.121 -2.187 1.238 1.00 . A A . 2 LEU HD21 1 1 17 8967 1 1 2 LEU HD22 H -7.328 -2.890 0.125 1.00 . A A . 2 LEU HD22 1 1 17 8968 1 1 2 LEU HD23 H -7.285 -3.330 1.846 1.00 . A A . 2 LEU HD23 1 1 17 8969 1 1 2 LEU HG H -5.006 -4.334 1.492 1.00 . A A . 2 LEU HG 1 1 17 8970 1 1 2 LEU N N -7.000 -6.723 2.435 1.00 . A A . 2 LEU N 1 1 17 8971 1 1 2 LEU O O -8.445 -8.208 0.701 1.00 . A A . 2 LEU O 1 1 17 8972 1 1 3 PRO C C -9.281 -8.461 -2.136 1.00 . A A . 3 PRO C 1 1 17 8973 1 1 3 PRO CA C -10.045 -7.309 -1.442 1.00 . A A . 3 PRO CA 1 1 17 8974 1 1 3 PRO CB C -10.626 -6.337 -2.474 1.00 . A A . 3 PRO CB 1 1 17 8975 1 1 3 PRO CD C -9.414 -5.079 -0.854 1.00 . A A . 3 PRO CD 1 1 17 8976 1 1 3 PRO CG C -10.668 -5.011 -1.720 1.00 . A A . 3 PRO CG 1 1 17 8977 1 1 3 PRO HA H -10.861 -7.689 -0.831 1.00 . A A . 3 PRO HA 1 1 17 8978 1 1 3 PRO HB2 H -9.951 -6.243 -3.327 1.00 . A A . 3 PRO HB2 1 1 17 8979 1 1 3 PRO HB3 H -11.618 -6.645 -2.805 1.00 . A A . 3 PRO HB3 1 1 17 8980 1 1 3 PRO HD2 H -8.567 -4.694 -1.423 1.00 . A A . 3 PRO HD2 1 1 17 8981 1 1 3 PRO HD3 H -9.560 -4.491 0.052 1.00 . A A . 3 PRO HD3 1 1 17 8982 1 1 3 PRO HG2 H -10.648 -4.157 -2.398 1.00 . A A . 3 PRO HG2 1 1 17 8983 1 1 3 PRO HG3 H -11.554 -4.977 -1.083 1.00 . A A . 3 PRO HG3 1 1 17 8984 1 1 3 PRO N N -9.210 -6.493 -0.558 1.00 . A A . 3 PRO N 1 1 17 8985 1 1 3 PRO O O -8.157 -8.240 -2.599 1.00 . A A . 3 PRO O 1 1 17 8986 1 1 4 PRO C C -8.463 -10.668 -4.109 1.00 . A A . 4 PRO C 1 1 17 8987 1 1 4 PRO CA C -9.281 -10.872 -2.825 1.00 . A A . 4 PRO CA 1 1 17 8988 1 1 4 PRO CB C -10.430 -11.869 -3.017 1.00 . A A . 4 PRO CB 1 1 17 8989 1 1 4 PRO CD C -11.226 -9.994 -1.770 1.00 . A A . 4 PRO CD 1 1 17 8990 1 1 4 PRO CG C -11.370 -11.512 -1.873 1.00 . A A . 4 PRO CG 1 1 17 8991 1 1 4 PRO HA H -8.619 -11.279 -2.060 1.00 . A A . 4 PRO HA 1 1 17 8992 1 1 4 PRO HB2 H -10.941 -11.694 -3.966 1.00 . A A . 4 PRO HB2 1 1 17 8993 1 1 4 PRO HB3 H -10.086 -12.902 -2.950 1.00 . A A . 4 PRO HB3 1 1 17 8994 1 1 4 PRO HD2 H -11.974 -9.509 -2.401 1.00 . A A . 4 PRO HD2 1 1 17 8995 1 1 4 PRO HD3 H -11.356 -9.696 -0.730 1.00 . A A . 4 PRO HD3 1 1 17 8996 1 1 4 PRO HG2 H -12.398 -11.807 -2.084 1.00 . A A . 4 PRO HG2 1 1 17 8997 1 1 4 PRO HG3 H -11.017 -11.975 -0.950 1.00 . A A . 4 PRO HG3 1 1 17 8998 1 1 4 PRO N N -9.891 -9.664 -2.262 1.00 . A A . 4 PRO N 1 1 17 8999 1 1 4 PRO O O -9.010 -10.528 -5.201 1.00 . A A . 4 PRO O 1 1 17 9000 1 1 5 GLY C C -5.103 -9.471 -4.727 1.00 . A A . 5 GLY C 1 1 17 9001 1 1 5 GLY CA C -6.162 -10.525 -5.039 1.00 . A A . 5 GLY CA 1 1 17 9002 1 1 5 GLY H H -6.776 -10.703 -3.014 1.00 . A A . 5 GLY H 1 1 17 9003 1 1 5 GLY HA2 H -5.664 -11.478 -5.214 1.00 . A A . 5 GLY HA2 1 1 17 9004 1 1 5 GLY HA3 H -6.670 -10.228 -5.957 1.00 . A A . 5 GLY HA3 1 1 17 9005 1 1 5 GLY N N -7.135 -10.681 -3.957 1.00 . A A . 5 GLY N 1 1 17 9006 1 1 5 GLY O O -3.936 -9.686 -5.039 1.00 . A A . 5 GLY O 1 1 17 9007 1 1 6 TRP C C -4.233 -7.598 -2.121 1.00 . A A . 6 TRP C 1 1 17 9008 1 1 6 TRP CA C -4.555 -7.346 -3.602 1.00 . A A . 6 TRP CA 1 1 17 9009 1 1 6 TRP CB C -5.078 -5.922 -3.856 1.00 . A A . 6 TRP CB 1 1 17 9010 1 1 6 TRP CD1 C -3.007 -4.542 -4.305 1.00 . A A . 6 TRP CD1 1 1 17 9011 1 1 6 TRP CD2 C -4.292 -4.761 -6.132 1.00 . A A . 6 TRP CD2 1 1 17 9012 1 1 6 TRP CE2 C -3.134 -4.023 -6.523 1.00 . A A . 6 TRP CE2 1 1 17 9013 1 1 6 TRP CE3 C -5.254 -5.024 -7.134 1.00 . A A . 6 TRP CE3 1 1 17 9014 1 1 6 TRP CG C -4.171 -5.093 -4.714 1.00 . A A . 6 TRP CG 1 1 17 9015 1 1 6 TRP CH2 C -3.903 -3.875 -8.815 1.00 . A A . 6 TRP CH2 1 1 17 9016 1 1 6 TRP CZ2 C -2.926 -3.597 -7.844 1.00 . A A . 6 TRP CZ2 1 1 17 9017 1 1 6 TRP CZ3 C -5.069 -4.577 -8.457 1.00 . A A . 6 TRP CZ3 1 1 17 9018 1 1 6 TRP H H -6.462 -8.243 -3.841 1.00 . A A . 6 TRP H 1 1 17 9019 1 1 6 TRP HA H -3.612 -7.441 -4.134 1.00 . A A . 6 TRP HA 1 1 17 9020 1 1 6 TRP HB2 H -6.059 -5.963 -4.332 1.00 . A A . 6 TRP HB2 1 1 17 9021 1 1 6 TRP HB3 H -5.215 -5.414 -2.904 1.00 . A A . 6 TRP HB3 1 1 17 9022 1 1 6 TRP HD1 H -2.613 -4.626 -3.300 1.00 . A A . 6 TRP HD1 1 1 17 9023 1 1 6 TRP HE1 H -1.474 -3.459 -5.300 1.00 . A A . 6 TRP HE1 1 1 17 9024 1 1 6 TRP HE3 H -6.151 -5.564 -6.865 1.00 . A A . 6 TRP HE3 1 1 17 9025 1 1 6 TRP HH2 H -3.764 -3.538 -9.832 1.00 . A A . 6 TRP HH2 1 1 17 9026 1 1 6 TRP HZ2 H -2.024 -3.067 -8.111 1.00 . A A . 6 TRP HZ2 1 1 17 9027 1 1 6 TRP HZ3 H -5.829 -4.763 -9.203 1.00 . A A . 6 TRP HZ3 1 1 17 9028 1 1 6 TRP N N -5.495 -8.332 -4.147 1.00 . A A . 6 TRP N 1 1 17 9029 1 1 6 TRP NE1 N -2.388 -3.910 -5.369 1.00 . A A . 6 TRP NE1 1 1 17 9030 1 1 6 TRP O O -5.090 -8.078 -1.383 1.00 . A A . 6 TRP O 1 1 17 9031 1 1 7 GLU C C -1.658 -6.086 0.118 1.00 . A A . 7 GLU C 1 1 17 9032 1 1 7 GLU CA C -2.675 -7.184 -0.239 1.00 . A A . 7 GLU CA 1 1 17 9033 1 1 7 GLU CB C -2.169 -8.561 0.240 1.00 . A A . 7 GLU CB 1 1 17 9034 1 1 7 GLU CD C -3.825 -8.560 2.214 1.00 . A A . 7 GLU CD 1 1 17 9035 1 1 7 GLU CG C -3.219 -9.352 1.043 1.00 . A A . 7 GLU CG 1 1 17 9036 1 1 7 GLU H H -2.301 -6.970 -2.325 1.00 . A A . 7 GLU H 1 1 17 9037 1 1 7 GLU HA H -3.571 -6.930 0.317 1.00 . A A . 7 GLU HA 1 1 17 9038 1 1 7 GLU HB2 H -1.833 -9.155 -0.610 1.00 . A A . 7 GLU HB2 1 1 17 9039 1 1 7 GLU HB3 H -1.304 -8.418 0.884 1.00 . A A . 7 GLU HB3 1 1 17 9040 1 1 7 GLU HG2 H -4.015 -9.672 0.371 1.00 . A A . 7 GLU HG2 1 1 17 9041 1 1 7 GLU HG3 H -2.740 -10.250 1.437 1.00 . A A . 7 GLU HG3 1 1 17 9042 1 1 7 GLU N N -3.036 -7.209 -1.662 1.00 . A A . 7 GLU N 1 1 17 9043 1 1 7 GLU O O -0.928 -5.587 -0.738 1.00 . A A . 7 GLU O 1 1 17 9044 1 1 7 GLU OE1 O -3.189 -7.604 2.722 1.00 . A A . 7 GLU OE1 1 1 17 9045 1 1 7 GLU OE2 O -4.952 -8.878 2.655 1.00 . A A . 7 GLU OE2 1 1 17 9046 1 1 8 LYS C C 0.736 -5.484 2.169 1.00 . A A . 8 LYS C 1 1 17 9047 1 1 8 LYS CA C -0.615 -4.790 1.979 1.00 . A A . 8 LYS CA 1 1 17 9048 1 1 8 LYS CB C -1.138 -4.264 3.327 1.00 . A A . 8 LYS CB 1 1 17 9049 1 1 8 LYS CD C -0.602 -2.802 5.368 1.00 . A A . 8 LYS CD 1 1 17 9050 1 1 8 LYS CE C -2.059 -2.380 5.583 1.00 . A A . 8 LYS CE 1 1 17 9051 1 1 8 LYS CG C -0.263 -3.131 3.906 1.00 . A A . 8 LYS CG 1 1 17 9052 1 1 8 LYS H H -2.180 -6.273 2.059 1.00 . A A . 8 LYS H 1 1 17 9053 1 1 8 LYS HA H -0.488 -3.952 1.292 1.00 . A A . 8 LYS HA 1 1 17 9054 1 1 8 LYS HB2 H -2.153 -3.892 3.185 1.00 . A A . 8 LYS HB2 1 1 17 9055 1 1 8 LYS HB3 H -1.174 -5.092 4.038 1.00 . A A . 8 LYS HB3 1 1 17 9056 1 1 8 LYS HD2 H -0.412 -3.692 5.969 1.00 . A A . 8 LYS HD2 1 1 17 9057 1 1 8 LYS HD3 H 0.066 -2.016 5.725 1.00 . A A . 8 LYS HD3 1 1 17 9058 1 1 8 LYS HE2 H -2.712 -3.075 5.051 1.00 . A A . 8 LYS HE2 1 1 17 9059 1 1 8 LYS HE3 H -2.296 -2.453 6.648 1.00 . A A . 8 LYS HE3 1 1 17 9060 1 1 8 LYS HG2 H 0.787 -3.426 3.879 1.00 . A A . 8 LYS HG2 1 1 17 9061 1 1 8 LYS HG3 H -0.372 -2.237 3.292 1.00 . A A . 8 LYS HG3 1 1 17 9062 1 1 8 LYS HZ1 H -3.335 -0.873 4.978 1.00 . A A . 8 LYS HZ1 1 1 17 9063 1 1 8 LYS HZ2 H -2.006 -0.314 5.790 1.00 . A A . 8 LYS HZ2 1 1 17 9064 1 1 8 LYS HZ3 H -1.885 -0.794 4.230 1.00 . A A . 8 LYS HZ3 1 1 17 9065 1 1 8 LYS N N -1.594 -5.733 1.412 1.00 . A A . 8 LYS N 1 1 17 9066 1 1 8 LYS NZ N -2.323 -1.000 5.122 1.00 . A A . 8 LYS NZ 1 1 17 9067 1 1 8 LYS O O 0.793 -6.583 2.728 1.00 . A A . 8 LYS O 1 1 17 9068 1 1 9 ARG C C 4.062 -4.141 2.513 1.00 . A A . 9 ARG C 1 1 17 9069 1 1 9 ARG CA C 3.229 -5.277 1.902 1.00 . A A . 9 ARG CA 1 1 17 9070 1 1 9 ARG CB C 3.858 -5.621 0.535 1.00 . A A . 9 ARG CB 1 1 17 9071 1 1 9 ARG CD C 3.112 -8.076 0.013 1.00 . A A . 9 ARG CD 1 1 17 9072 1 1 9 ARG CG C 3.175 -6.605 -0.419 1.00 . A A . 9 ARG CG 1 1 17 9073 1 1 9 ARG CZ C 1.520 -9.401 1.460 1.00 . A A . 9 ARG CZ 1 1 17 9074 1 1 9 ARG H H 1.704 -3.907 1.352 1.00 . A A . 9 ARG H 1 1 17 9075 1 1 9 ARG HA H 3.295 -6.137 2.569 1.00 . A A . 9 ARG HA 1 1 17 9076 1 1 9 ARG HB2 H 3.925 -4.679 -0.006 1.00 . A A . 9 ARG HB2 1 1 17 9077 1 1 9 ARG HB3 H 4.875 -5.982 0.691 1.00 . A A . 9 ARG HB3 1 1 17 9078 1 1 9 ARG HD2 H 2.825 -8.661 -0.862 1.00 . A A . 9 ARG HD2 1 1 17 9079 1 1 9 ARG HD3 H 4.102 -8.399 0.339 1.00 . A A . 9 ARG HD3 1 1 17 9080 1 1 9 ARG HE H 1.851 -7.482 1.622 1.00 . A A . 9 ARG HE 1 1 17 9081 1 1 9 ARG HG2 H 2.189 -6.223 -0.671 1.00 . A A . 9 ARG HG2 1 1 17 9082 1 1 9 ARG HG3 H 3.765 -6.597 -1.333 1.00 . A A . 9 ARG HG3 1 1 17 9083 1 1 9 ARG HH11 H 2.384 -10.596 0.120 1.00 . A A . 9 ARG HH11 1 1 17 9084 1 1 9 ARG HH12 H 1.236 -11.381 1.177 1.00 . A A . 9 ARG HH12 1 1 17 9085 1 1 9 ARG HH21 H 0.493 -8.394 2.829 1.00 . A A . 9 ARG HH21 1 1 17 9086 1 1 9 ARG HH22 H 0.141 -10.121 2.768 1.00 . A A . 9 ARG HH22 1 1 17 9087 1 1 9 ARG N N 1.829 -4.843 1.742 1.00 . A A . 9 ARG N 1 1 17 9088 1 1 9 ARG NE N 2.138 -8.294 1.088 1.00 . A A . 9 ARG NE 1 1 17 9089 1 1 9 ARG NH1 N 1.729 -10.559 0.879 1.00 . A A . 9 ARG NH1 1 1 17 9090 1 1 9 ARG NH2 N 0.663 -9.327 2.448 1.00 . A A . 9 ARG NH2 1 1 17 9091 1 1 9 ARG O O 3.584 -3.013 2.650 1.00 . A A . 9 ARG O 1 1 17 9092 1 1 10 MET C C 7.747 -3.846 2.744 1.00 . A A . 10 MET C 1 1 17 9093 1 1 10 MET CA C 6.333 -3.416 3.143 1.00 . A A . 10 MET CA 1 1 17 9094 1 1 10 MET CB C 6.252 -3.132 4.654 1.00 . A A . 10 MET CB 1 1 17 9095 1 1 10 MET CE C 6.959 -5.569 7.993 1.00 . A A . 10 MET CE 1 1 17 9096 1 1 10 MET CG C 6.624 -4.319 5.550 1.00 . A A . 10 MET CG 1 1 17 9097 1 1 10 MET H H 5.709 -5.347 2.591 1.00 . A A . 10 MET H 1 1 17 9098 1 1 10 MET HA H 6.094 -2.499 2.611 1.00 . A A . 10 MET HA 1 1 17 9099 1 1 10 MET HB2 H 6.915 -2.298 4.889 1.00 . A A . 10 MET HB2 1 1 17 9100 1 1 10 MET HB3 H 5.235 -2.830 4.899 1.00 . A A . 10 MET HB3 1 1 17 9101 1 1 10 MET HE1 H 7.998 -5.734 7.709 1.00 . A A . 10 MET HE1 1 1 17 9102 1 1 10 MET HE2 H 6.882 -5.545 9.080 1.00 . A A . 10 MET HE2 1 1 17 9103 1 1 10 MET HE3 H 6.342 -6.379 7.606 1.00 . A A . 10 MET HE3 1 1 17 9104 1 1 10 MET HG2 H 6.011 -5.179 5.278 1.00 . A A . 10 MET HG2 1 1 17 9105 1 1 10 MET HG3 H 7.672 -4.575 5.389 1.00 . A A . 10 MET HG3 1 1 17 9106 1 1 10 MET N N 5.348 -4.418 2.752 1.00 . A A . 10 MET N 1 1 17 9107 1 1 10 MET O O 8.126 -5.010 2.868 1.00 . A A . 10 MET O 1 1 17 9108 1 1 10 MET SD S 6.387 -3.989 7.315 1.00 . A A . 10 MET SD 1 1 17 9109 1 1 11 PHE C C 10.782 -2.957 3.180 1.00 . A A . 11 PHE C 1 1 17 9110 1 1 11 PHE CA C 9.927 -3.004 1.911 1.00 . A A . 11 PHE CA 1 1 17 9111 1 1 11 PHE CB C 10.321 -1.841 0.989 1.00 . A A . 11 PHE CB 1 1 17 9112 1 1 11 PHE CD1 C 10.272 -2.968 -1.267 1.00 . A A . 11 PHE CD1 1 1 17 9113 1 1 11 PHE CD2 C 8.805 -1.056 -0.897 1.00 . A A . 11 PHE CD2 1 1 17 9114 1 1 11 PHE CE1 C 9.787 -3.097 -2.579 1.00 . A A . 11 PHE CE1 1 1 17 9115 1 1 11 PHE CE2 C 8.328 -1.187 -2.215 1.00 . A A . 11 PHE CE2 1 1 17 9116 1 1 11 PHE CG C 9.775 -1.959 -0.419 1.00 . A A . 11 PHE CG 1 1 17 9117 1 1 11 PHE CZ C 8.811 -2.206 -3.053 1.00 . A A . 11 PHE CZ 1 1 17 9118 1 1 11 PHE H H 8.111 -1.953 2.151 1.00 . A A . 11 PHE H 1 1 17 9119 1 1 11 PHE HA H 10.102 -3.937 1.382 1.00 . A A . 11 PHE HA 1 1 17 9120 1 1 11 PHE HB2 H 10.001 -0.896 1.431 1.00 . A A . 11 PHE HB2 1 1 17 9121 1 1 11 PHE HB3 H 11.405 -1.807 0.912 1.00 . A A . 11 PHE HB3 1 1 17 9122 1 1 11 PHE HD1 H 11.037 -3.643 -0.917 1.00 . A A . 11 PHE HD1 1 1 17 9123 1 1 11 PHE HD2 H 8.423 -0.266 -0.262 1.00 . A A . 11 PHE HD2 1 1 17 9124 1 1 11 PHE HE1 H 10.161 -3.880 -3.224 1.00 . A A . 11 PHE HE1 1 1 17 9125 1 1 11 PHE HE2 H 7.580 -0.514 -2.599 1.00 . A A . 11 PHE HE2 1 1 17 9126 1 1 11 PHE HZ H 8.431 -2.302 -4.060 1.00 . A A . 11 PHE HZ 1 1 17 9127 1 1 11 PHE N N 8.514 -2.881 2.240 1.00 . A A . 11 PHE N 1 1 17 9128 1 1 11 PHE O O 10.580 -2.079 4.021 1.00 . A A . 11 PHE O 1 1 17 9129 1 1 12 ALA C C 13.586 -2.378 4.274 1.00 . A A . 12 ALA C 1 1 17 9130 1 1 12 ALA CA C 12.827 -3.722 4.329 1.00 . A A . 12 ALA CA 1 1 17 9131 1 1 12 ALA CB C 13.784 -4.911 4.198 1.00 . A A . 12 ALA CB 1 1 17 9132 1 1 12 ALA H H 11.915 -4.557 2.596 1.00 . A A . 12 ALA H 1 1 17 9133 1 1 12 ALA HA H 12.332 -3.781 5.300 1.00 . A A . 12 ALA HA 1 1 17 9134 1 1 12 ALA HB1 H 13.229 -5.847 4.283 1.00 . A A . 12 ALA HB1 1 1 17 9135 1 1 12 ALA HB2 H 14.297 -4.880 3.235 1.00 . A A . 12 ALA HB2 1 1 17 9136 1 1 12 ALA HB3 H 14.526 -4.870 4.997 1.00 . A A . 12 ALA HB3 1 1 17 9137 1 1 12 ALA N N 11.807 -3.816 3.273 1.00 . A A . 12 ALA N 1 1 17 9138 1 1 12 ALA O O 14.073 -1.891 5.289 1.00 . A A . 12 ALA O 1 1 17 9139 1 1 13 ASN C C 13.132 0.701 3.401 1.00 . A A . 13 ASN C 1 1 17 9140 1 1 13 ASN CA C 14.077 -0.390 2.820 1.00 . A A . 13 ASN CA 1 1 17 9141 1 1 13 ASN CB C 14.255 -0.308 1.291 1.00 . A A . 13 ASN CB 1 1 17 9142 1 1 13 ASN CG C 14.696 1.071 0.800 1.00 . A A . 13 ASN CG 1 1 17 9143 1 1 13 ASN H H 13.230 -2.251 2.305 1.00 . A A . 13 ASN H 1 1 17 9144 1 1 13 ASN HA H 15.051 -0.247 3.293 1.00 . A A . 13 ASN HA 1 1 17 9145 1 1 13 ASN HB2 H 15.026 -1.016 0.990 1.00 . A A . 13 ASN HB2 1 1 17 9146 1 1 13 ASN HB3 H 13.336 -0.612 0.803 1.00 . A A . 13 ASN HB3 1 1 17 9147 1 1 13 ASN HD21 H 14.236 2.732 -0.154 1.00 . A A . 13 ASN HD21 1 1 17 9148 1 1 13 ASN N N 13.615 -1.753 3.090 1.00 . A A . 13 ASN N 1 1 17 9149 1 1 13 ASN ND2 N 13.961 1.752 -0.070 1.00 . A A . 13 ASN ND2 1 1 17 9150 1 1 13 ASN O O 13.397 1.890 3.253 1.00 . A A . 13 ASN O 1 1 17 9151 1 1 13 ASN OD1 O 15.746 1.548 1.203 1.00 . A A . 13 ASN OD1 1 1 17 9152 1 1 14 GLY C C 10.106 1.901 3.998 1.00 . A A . 14 GLY C 1 1 17 9153 1 1 14 GLY CA C 11.177 1.214 4.842 1.00 . A A . 14 GLY CA 1 1 17 9154 1 1 14 GLY H H 11.815 -0.671 4.140 1.00 . A A . 14 GLY H 1 1 17 9155 1 1 14 GLY HA2 H 10.681 0.635 5.621 1.00 . A A . 14 GLY HA2 1 1 17 9156 1 1 14 GLY HA3 H 11.787 1.980 5.322 1.00 . A A . 14 GLY HA3 1 1 17 9157 1 1 14 GLY N N 12.035 0.318 4.069 1.00 . A A . 14 GLY N 1 1 17 9158 1 1 14 GLY O O 10.089 3.127 3.894 1.00 . A A . 14 GLY O 1 1 17 9159 1 1 15 THR C C 6.930 0.696 2.527 1.00 . A A . 15 THR C 1 1 17 9160 1 1 15 THR CA C 8.053 1.721 2.646 1.00 . A A . 15 THR CA 1 1 17 9161 1 1 15 THR CB C 8.496 2.244 1.270 1.00 . A A . 15 THR CB 1 1 17 9162 1 1 15 THR CG2 C 7.349 2.639 0.339 1.00 . A A . 15 THR CG2 1 1 17 9163 1 1 15 THR H H 9.263 0.130 3.396 1.00 . A A . 15 THR H 1 1 17 9164 1 1 15 THR HA H 7.664 2.564 3.205 1.00 . A A . 15 THR HA 1 1 17 9165 1 1 15 THR HB H 9.119 1.492 0.784 1.00 . A A . 15 THR HB 1 1 17 9166 1 1 15 THR HG1 H 9.610 3.386 2.391 1.00 . A A . 15 THR HG1 1 1 17 9167 1 1 15 THR HG21 H 7.758 3.077 -0.572 1.00 . A A . 15 THR HG21 1 1 17 9168 1 1 15 THR HG22 H 6.759 1.765 0.071 1.00 . A A . 15 THR HG22 1 1 17 9169 1 1 15 THR HG23 H 6.708 3.373 0.826 1.00 . A A . 15 THR HG23 1 1 17 9170 1 1 15 THR N N 9.206 1.142 3.359 1.00 . A A . 15 THR N 1 1 17 9171 1 1 15 THR O O 7.190 -0.443 2.151 1.00 . A A . 15 THR O 1 1 17 9172 1 1 15 THR OG1 O 9.261 3.410 1.467 1.00 . A A . 15 THR OG1 1 1 17 9173 1 1 16 VAL C C 3.867 0.456 1.305 1.00 . A A . 16 VAL C 1 1 17 9174 1 1 16 VAL CA C 4.488 0.260 2.683 1.00 . A A . 16 VAL CA 1 1 17 9175 1 1 16 VAL CB C 3.473 0.605 3.800 1.00 . A A . 16 VAL CB 1 1 17 9176 1 1 16 VAL CG1 C 2.022 0.175 3.521 1.00 . A A . 16 VAL CG1 1 1 17 9177 1 1 16 VAL CG2 C 3.893 -0.095 5.097 1.00 . A A . 16 VAL CG2 1 1 17 9178 1 1 16 VAL H H 5.516 2.079 3.018 1.00 . A A . 16 VAL H 1 1 17 9179 1 1 16 VAL HA H 4.766 -0.787 2.786 1.00 . A A . 16 VAL HA 1 1 17 9180 1 1 16 VAL HB H 3.477 1.684 3.964 1.00 . A A . 16 VAL HB 1 1 17 9181 1 1 16 VAL HG11 H 1.978 -0.890 3.294 1.00 . A A . 16 VAL HG11 1 1 17 9182 1 1 16 VAL HG12 H 1.401 0.379 4.394 1.00 . A A . 16 VAL HG12 1 1 17 9183 1 1 16 VAL HG13 H 1.611 0.741 2.684 1.00 . A A . 16 VAL HG13 1 1 17 9184 1 1 16 VAL HG21 H 3.746 -1.170 4.988 1.00 . A A . 16 VAL HG21 1 1 17 9185 1 1 16 VAL HG22 H 4.941 0.112 5.317 1.00 . A A . 16 VAL HG22 1 1 17 9186 1 1 16 VAL HG23 H 3.283 0.263 5.926 1.00 . A A . 16 VAL HG23 1 1 17 9187 1 1 16 VAL N N 5.683 1.110 2.787 1.00 . A A . 16 VAL N 1 1 17 9188 1 1 16 VAL O O 3.847 1.565 0.768 1.00 . A A . 16 VAL O 1 1 17 9189 1 1 17 TYR C C 1.641 -1.717 -0.659 1.00 . A A . 17 TYR C 1 1 17 9190 1 1 17 TYR CA C 2.720 -0.632 -0.573 1.00 . A A . 17 TYR CA 1 1 17 9191 1 1 17 TYR CB C 3.806 -0.807 -1.655 1.00 . A A . 17 TYR CB 1 1 17 9192 1 1 17 TYR CD1 C 5.669 -2.244 -0.776 1.00 . A A . 17 TYR CD1 1 1 17 9193 1 1 17 TYR CD2 C 4.188 -3.198 -2.467 1.00 . A A . 17 TYR CD2 1 1 17 9194 1 1 17 TYR CE1 C 6.435 -3.421 -0.773 1.00 . A A . 17 TYR CE1 1 1 17 9195 1 1 17 TYR CE2 C 4.965 -4.374 -2.486 1.00 . A A . 17 TYR CE2 1 1 17 9196 1 1 17 TYR CG C 4.557 -2.125 -1.627 1.00 . A A . 17 TYR CG 1 1 17 9197 1 1 17 TYR CZ C 6.099 -4.480 -1.644 1.00 . A A . 17 TYR CZ 1 1 17 9198 1 1 17 TYR H H 3.362 -1.523 1.241 1.00 . A A . 17 TYR H 1 1 17 9199 1 1 17 TYR HA H 2.232 0.332 -0.732 1.00 . A A . 17 TYR HA 1 1 17 9200 1 1 17 TYR HB2 H 3.367 -0.677 -2.643 1.00 . A A . 17 TYR HB2 1 1 17 9201 1 1 17 TYR HB3 H 4.550 -0.015 -1.533 1.00 . A A . 17 TYR HB3 1 1 17 9202 1 1 17 TYR HD1 H 5.948 -1.404 -0.152 1.00 . A A . 17 TYR HD1 1 1 17 9203 1 1 17 TYR HD2 H 3.315 -3.123 -3.105 1.00 . A A . 17 TYR HD2 1 1 17 9204 1 1 17 TYR HE1 H 7.305 -3.497 -0.136 1.00 . A A . 17 TYR HE1 1 1 17 9205 1 1 17 TYR HE2 H 4.678 -5.201 -3.122 1.00 . A A . 17 TYR HE2 1 1 17 9206 1 1 17 TYR HH H 6.645 -6.195 -2.374 1.00 . A A . 17 TYR HH 1 1 17 9207 1 1 17 TYR N N 3.367 -0.640 0.734 1.00 . A A . 17 TYR N 1 1 17 9208 1 1 17 TYR O O 1.438 -2.504 0.268 1.00 . A A . 17 TYR O 1 1 17 9209 1 1 17 TYR OH O 6.847 -5.617 -1.638 1.00 . A A . 17 TYR OH 1 1 17 9210 1 1 18 TYR C C 0.086 -3.470 -3.350 1.00 . A A . 18 TYR C 1 1 17 9211 1 1 18 TYR CA C -0.163 -2.623 -2.108 1.00 . A A . 18 TYR CA 1 1 17 9212 1 1 18 TYR CB C -1.406 -1.735 -2.203 1.00 . A A . 18 TYR CB 1 1 17 9213 1 1 18 TYR CD1 C -2.122 -1.768 0.202 1.00 . A A . 18 TYR CD1 1 1 17 9214 1 1 18 TYR CD2 C -1.206 0.302 -0.704 1.00 . A A . 18 TYR CD2 1 1 17 9215 1 1 18 TYR CE1 C -2.272 -1.166 1.459 1.00 . A A . 18 TYR CE1 1 1 17 9216 1 1 18 TYR CE2 C -1.259 0.874 0.575 1.00 . A A . 18 TYR CE2 1 1 17 9217 1 1 18 TYR CG C -1.632 -1.028 -0.888 1.00 . A A . 18 TYR CG 1 1 17 9218 1 1 18 TYR CZ C -1.824 0.157 1.653 1.00 . A A . 18 TYR CZ 1 1 17 9219 1 1 18 TYR H H 1.116 -0.990 -2.442 1.00 . A A . 18 TYR H 1 1 17 9220 1 1 18 TYR HA H -0.306 -3.300 -1.269 1.00 . A A . 18 TYR HA 1 1 17 9221 1 1 18 TYR HB2 H -1.283 -1.005 -3.004 1.00 . A A . 18 TYR HB2 1 1 17 9222 1 1 18 TYR HB3 H -2.277 -2.351 -2.430 1.00 . A A . 18 TYR HB3 1 1 17 9223 1 1 18 TYR HD1 H -2.363 -2.812 0.075 1.00 . A A . 18 TYR HD1 1 1 17 9224 1 1 18 TYR HD2 H -0.805 0.884 -1.525 1.00 . A A . 18 TYR HD2 1 1 17 9225 1 1 18 TYR HE1 H -2.697 -1.727 2.272 1.00 . A A . 18 TYR HE1 1 1 17 9226 1 1 18 TYR HE2 H -0.868 1.868 0.705 1.00 . A A . 18 TYR HE2 1 1 17 9227 1 1 18 TYR HH H -2.932 0.738 3.168 1.00 . A A . 18 TYR HH 1 1 17 9228 1 1 18 TYR N N 0.987 -1.779 -1.816 1.00 . A A . 18 TYR N 1 1 17 9229 1 1 18 TYR O O 0.151 -2.965 -4.473 1.00 . A A . 18 TYR O 1 1 17 9230 1 1 18 TYR OH O -1.947 0.721 2.883 1.00 . A A . 18 TYR OH 1 1 17 9231 1 1 19 PHE C C -0.466 -6.696 -4.524 1.00 . A A . 19 PHE C 1 1 17 9232 1 1 19 PHE CA C 0.668 -5.767 -4.101 1.00 . A A . 19 PHE CA 1 1 17 9233 1 1 19 PHE CB C 1.777 -6.578 -3.437 1.00 . A A . 19 PHE CB 1 1 17 9234 1 1 19 PHE CD1 C 3.463 -7.204 -5.204 1.00 . A A . 19 PHE CD1 1 1 17 9235 1 1 19 PHE CD2 C 2.124 -8.971 -4.195 1.00 . A A . 19 PHE CD2 1 1 17 9236 1 1 19 PHE CE1 C 4.150 -8.159 -5.969 1.00 . A A . 19 PHE CE1 1 1 17 9237 1 1 19 PHE CE2 C 2.813 -9.927 -4.963 1.00 . A A . 19 PHE CE2 1 1 17 9238 1 1 19 PHE CG C 2.456 -7.607 -4.311 1.00 . A A . 19 PHE CG 1 1 17 9239 1 1 19 PHE CZ C 3.824 -9.522 -5.850 1.00 . A A . 19 PHE CZ 1 1 17 9240 1 1 19 PHE H H 0.025 -5.129 -2.195 1.00 . A A . 19 PHE H 1 1 17 9241 1 1 19 PHE HA H 1.089 -5.271 -4.974 1.00 . A A . 19 PHE HA 1 1 17 9242 1 1 19 PHE HB2 H 2.531 -5.877 -3.093 1.00 . A A . 19 PHE HB2 1 1 17 9243 1 1 19 PHE HB3 H 1.358 -7.087 -2.568 1.00 . A A . 19 PHE HB3 1 1 17 9244 1 1 19 PHE HD1 H 3.717 -6.161 -5.302 1.00 . A A . 19 PHE HD1 1 1 17 9245 1 1 19 PHE HD2 H 1.346 -9.285 -3.515 1.00 . A A . 19 PHE HD2 1 1 17 9246 1 1 19 PHE HE1 H 4.923 -7.832 -6.650 1.00 . A A . 19 PHE HE1 1 1 17 9247 1 1 19 PHE HE2 H 2.572 -10.977 -4.872 1.00 . A A . 19 PHE HE2 1 1 17 9248 1 1 19 PHE HZ H 4.340 -10.258 -6.452 1.00 . A A . 19 PHE HZ 1 1 17 9249 1 1 19 PHE N N 0.223 -4.777 -3.131 1.00 . A A . 19 PHE N 1 1 17 9250 1 1 19 PHE O O -1.113 -7.320 -3.683 1.00 . A A . 19 PHE O 1 1 17 9251 1 1 20 ASN C C -0.865 -9.145 -6.455 1.00 . A A . 20 ASN C 1 1 17 9252 1 1 20 ASN CA C -1.578 -7.785 -6.421 1.00 . A A . 20 ASN CA 1 1 17 9253 1 1 20 ASN CB C -1.988 -7.297 -7.814 1.00 . A A . 20 ASN CB 1 1 17 9254 1 1 20 ASN CG C -3.074 -8.175 -8.404 1.00 . A A . 20 ASN CG 1 1 17 9255 1 1 20 ASN H H -0.156 -6.222 -6.470 1.00 . A A . 20 ASN H 1 1 17 9256 1 1 20 ASN HA H -2.476 -7.871 -5.814 1.00 . A A . 20 ASN HA 1 1 17 9257 1 1 20 ASN HB2 H -2.353 -6.277 -7.745 1.00 . A A . 20 ASN HB2 1 1 17 9258 1 1 20 ASN HB3 H -1.126 -7.300 -8.475 1.00 . A A . 20 ASN HB3 1 1 17 9259 1 1 20 ASN HD21 H -4.383 -6.627 -8.593 1.00 . A A . 20 ASN HD21 1 1 17 9260 1 1 20 ASN HD22 H -4.924 -8.225 -9.105 1.00 . A A . 20 ASN HD22 1 1 17 9261 1 1 20 ASN N N -0.694 -6.799 -5.829 1.00 . A A . 20 ASN N 1 1 17 9262 1 1 20 ASN ND2 N -4.214 -7.613 -8.744 1.00 . A A . 20 ASN ND2 1 1 17 9263 1 1 20 ASN O O -0.006 -9.374 -7.305 1.00 . A A . 20 ASN O 1 1 17 9264 1 1 20 ASN OD1 O -2.913 -9.377 -8.545 1.00 . A A . 20 ASN OD1 1 1 17 9265 1 1 21 HIS C C -1.111 -12.377 -6.553 1.00 . A A . 21 HIS C 1 1 17 9266 1 1 21 HIS CA C -0.613 -11.397 -5.472 1.00 . A A . 21 HIS CA 1 1 17 9267 1 1 21 HIS CB C -0.726 -11.937 -4.037 1.00 . A A . 21 HIS CB 1 1 17 9268 1 1 21 HIS CD2 C -3.091 -12.888 -3.798 1.00 . A A . 21 HIS CD2 1 1 17 9269 1 1 21 HIS CE1 C -3.856 -11.528 -2.234 1.00 . A A . 21 HIS CE1 1 1 17 9270 1 1 21 HIS CG C -2.121 -11.987 -3.469 1.00 . A A . 21 HIS CG 1 1 17 9271 1 1 21 HIS H H -2.002 -9.868 -4.931 1.00 . A A . 21 HIS H 1 1 17 9272 1 1 21 HIS HA H 0.450 -11.286 -5.682 1.00 . A A . 21 HIS HA 1 1 17 9273 1 1 21 HIS HB2 H -0.285 -12.932 -3.986 1.00 . A A . 21 HIS HB2 1 1 17 9274 1 1 21 HIS HB3 H -0.130 -11.294 -3.388 1.00 . A A . 21 HIS HB3 1 1 17 9275 1 1 21 HIS HD2 H -2.999 -13.683 -4.525 1.00 . A A . 21 HIS HD2 1 1 17 9276 1 1 21 HIS HE1 H -4.506 -11.055 -1.507 1.00 . A A . 21 HIS HE1 1 1 17 9277 1 1 21 HIS HE2 H -5.058 -13.079 -2.989 1.00 . A A . 21 HIS HE2 1 1 17 9278 1 1 21 HIS N N -1.213 -10.059 -5.547 1.00 . A A . 21 HIS N 1 1 17 9279 1 1 21 HIS ND1 N -2.601 -11.133 -2.480 1.00 . A A . 21 HIS ND1 1 1 17 9280 1 1 21 HIS NE2 N -4.178 -12.585 -3.005 1.00 . A A . 21 HIS NE2 1 1 17 9281 1 1 21 HIS O O -0.879 -13.579 -6.434 1.00 . A A . 21 HIS O 1 1 17 9282 1 1 22 ILE C C -1.311 -12.125 -10.031 1.00 . A A . 22 ILE C 1 1 17 9283 1 1 22 ILE CA C -2.118 -12.638 -8.820 1.00 . A A . 22 ILE CA 1 1 17 9284 1 1 22 ILE CB C -3.650 -12.605 -9.063 1.00 . A A . 22 ILE CB 1 1 17 9285 1 1 22 ILE CD1 C -5.960 -12.969 -7.931 1.00 . A A . 22 ILE CD1 1 1 17 9286 1 1 22 ILE CG1 C -4.433 -13.049 -7.801 1.00 . A A . 22 ILE CG1 1 1 17 9287 1 1 22 ILE CG2 C -4.014 -13.489 -10.272 1.00 . A A . 22 ILE CG2 1 1 17 9288 1 1 22 ILE H H -2.000 -10.891 -7.622 1.00 . A A . 22 ILE H 1 1 17 9289 1 1 22 ILE HA H -1.834 -13.682 -8.677 1.00 . A A . 22 ILE HA 1 1 17 9290 1 1 22 ILE HB H -3.944 -11.582 -9.301 1.00 . A A . 22 ILE HB 1 1 17 9291 1 1 22 ILE HD11 H -6.254 -11.971 -8.257 1.00 . A A . 22 ILE HD11 1 1 17 9292 1 1 22 ILE HD12 H -6.325 -13.711 -8.640 1.00 . A A . 22 ILE HD12 1 1 17 9293 1 1 22 ILE HD13 H -6.414 -13.172 -6.960 1.00 . A A . 22 ILE HD13 1 1 17 9294 1 1 22 ILE HG12 H -4.154 -14.073 -7.544 1.00 . A A . 22 ILE HG12 1 1 17 9295 1 1 22 ILE HG13 H -4.162 -12.408 -6.963 1.00 . A A . 22 ILE HG13 1 1 17 9296 1 1 22 ILE HG21 H -3.762 -14.530 -10.062 1.00 . A A . 22 ILE HG21 1 1 17 9297 1 1 22 ILE HG22 H -5.077 -13.414 -10.494 1.00 . A A . 22 ILE HG22 1 1 17 9298 1 1 22 ILE HG23 H -3.477 -13.166 -11.163 1.00 . A A . 22 ILE HG23 1 1 17 9299 1 1 22 ILE N N -1.765 -11.878 -7.612 1.00 . A A . 22 ILE N 1 1 17 9300 1 1 22 ILE O O -0.836 -12.934 -10.826 1.00 . A A . 22 ILE O 1 1 17 9301 1 1 23 THR C C 1.012 -9.695 -10.989 1.00 . A A . 23 THR C 1 1 17 9302 1 1 23 THR CA C -0.403 -10.189 -11.307 1.00 . A A . 23 THR CA 1 1 17 9303 1 1 23 THR CB C -1.184 -9.002 -11.896 1.00 . A A . 23 THR CB 1 1 17 9304 1 1 23 THR CG2 C -2.636 -9.340 -12.240 1.00 . A A . 23 THR CG2 1 1 17 9305 1 1 23 THR H H -1.591 -10.176 -9.524 1.00 . A A . 23 THR H 1 1 17 9306 1 1 23 THR HA H -0.303 -10.929 -12.101 1.00 . A A . 23 THR HA 1 1 17 9307 1 1 23 THR HB H -0.685 -8.686 -12.813 1.00 . A A . 23 THR HB 1 1 17 9308 1 1 23 THR HG1 H -1.771 -7.246 -11.367 1.00 . A A . 23 THR HG1 1 1 17 9309 1 1 23 THR HG21 H -2.661 -10.215 -12.889 1.00 . A A . 23 THR HG21 1 1 17 9310 1 1 23 THR HG22 H -3.206 -9.549 -11.335 1.00 . A A . 23 THR HG22 1 1 17 9311 1 1 23 THR HG23 H -3.094 -8.502 -12.766 1.00 . A A . 23 THR HG23 1 1 17 9312 1 1 23 THR N N -1.113 -10.804 -10.167 1.00 . A A . 23 THR N 1 1 17 9313 1 1 23 THR O O 1.805 -9.543 -11.917 1.00 . A A . 23 THR O 1 1 17 9314 1 1 23 THR OG1 O -1.183 -7.911 -10.999 1.00 . A A . 23 THR OG1 1 1 17 9315 1 1 24 ASN C C 2.542 -7.292 -9.223 1.00 . A A . 24 ASN C 1 1 17 9316 1 1 24 ASN CA C 2.551 -8.836 -9.163 1.00 . A A . 24 ASN CA 1 1 17 9317 1 1 24 ASN CB C 3.857 -9.433 -9.735 1.00 . A A . 24 ASN CB 1 1 17 9318 1 1 24 ASN CG C 3.903 -10.953 -9.713 1.00 . A A . 24 ASN CG 1 1 17 9319 1 1 24 ASN H H 0.646 -9.663 -8.991 1.00 . A A . 24 ASN H 1 1 17 9320 1 1 24 ASN HA H 2.542 -9.073 -8.101 1.00 . A A . 24 ASN HA 1 1 17 9321 1 1 24 ASN HB2 H 4.007 -9.082 -10.756 1.00 . A A . 24 ASN HB2 1 1 17 9322 1 1 24 ASN HB3 H 4.697 -9.068 -9.144 1.00 . A A . 24 ASN HB3 1 1 17 9323 1 1 24 ASN HD21 H 3.052 -11.042 -11.533 1.00 . A A . 24 ASN HD21 1 1 17 9324 1 1 24 ASN HD22 H 3.484 -12.590 -10.775 1.00 . A A . 24 ASN HD22 1 1 17 9325 1 1 24 ASN N N 1.340 -9.471 -9.708 1.00 . A A . 24 ASN N 1 1 17 9326 1 1 24 ASN ND2 N 3.474 -11.586 -10.785 1.00 . A A . 24 ASN ND2 1 1 17 9327 1 1 24 ASN O O 3.530 -6.673 -8.831 1.00 . A A . 24 ASN O 1 1 17 9328 1 1 24 ASN OD1 O 4.327 -11.569 -8.748 1.00 . A A . 24 ASN OD1 1 1 17 9329 1 1 25 ALA C C 1.460 -4.582 -8.297 1.00 . A A . 25 ALA C 1 1 17 9330 1 1 25 ALA CA C 1.354 -5.186 -9.712 1.00 . A A . 25 ALA CA 1 1 17 9331 1 1 25 ALA CB C 0.036 -4.787 -10.384 1.00 . A A . 25 ALA CB 1 1 17 9332 1 1 25 ALA H H 0.661 -7.185 -10.021 1.00 . A A . 25 ALA H 1 1 17 9333 1 1 25 ALA HA H 2.176 -4.796 -10.315 1.00 . A A . 25 ALA HA 1 1 17 9334 1 1 25 ALA HB1 H -0.808 -5.166 -9.808 1.00 . A A . 25 ALA HB1 1 1 17 9335 1 1 25 ALA HB2 H -0.032 -3.699 -10.435 1.00 . A A . 25 ALA HB2 1 1 17 9336 1 1 25 ALA HB3 H -0.001 -5.191 -11.397 1.00 . A A . 25 ALA HB3 1 1 17 9337 1 1 25 ALA N N 1.457 -6.652 -9.692 1.00 . A A . 25 ALA N 1 1 17 9338 1 1 25 ALA O O 0.751 -5.012 -7.388 1.00 . A A . 25 ALA O 1 1 17 9339 1 1 26 SER C C 2.387 -1.455 -6.829 1.00 . A A . 26 SER C 1 1 17 9340 1 1 26 SER CA C 2.636 -2.964 -6.809 1.00 . A A . 26 SER CA 1 1 17 9341 1 1 26 SER CB C 4.100 -3.222 -6.435 1.00 . A A . 26 SER CB 1 1 17 9342 1 1 26 SER H H 2.874 -3.241 -8.886 1.00 . A A . 26 SER H 1 1 17 9343 1 1 26 SER HA H 2.014 -3.411 -6.036 1.00 . A A . 26 SER HA 1 1 17 9344 1 1 26 SER HB2 H 4.305 -2.775 -5.461 1.00 . A A . 26 SER HB2 1 1 17 9345 1 1 26 SER HB3 H 4.289 -4.292 -6.373 1.00 . A A . 26 SER HB3 1 1 17 9346 1 1 26 SER HG H 4.550 -1.768 -7.623 1.00 . A A . 26 SER HG 1 1 17 9347 1 1 26 SER N N 2.325 -3.577 -8.108 1.00 . A A . 26 SER N 1 1 17 9348 1 1 26 SER O O 3.077 -0.743 -7.564 1.00 . A A . 26 SER O 1 1 17 9349 1 1 26 SER OG O 4.950 -2.632 -7.401 1.00 . A A . 26 SER OG 1 1 17 9350 1 1 27 GLN C C 1.365 1.042 -4.555 1.00 . A A . 27 GLN C 1 1 17 9351 1 1 27 GLN CA C 1.067 0.433 -5.924 1.00 . A A . 27 GLN CA 1 1 17 9352 1 1 27 GLN CB C -0.444 0.552 -6.186 1.00 . A A . 27 GLN CB 1 1 17 9353 1 1 27 GLN CD C -0.104 -0.010 -8.693 1.00 . A A . 27 GLN CD 1 1 17 9354 1 1 27 GLN CG C -0.972 -0.147 -7.443 1.00 . A A . 27 GLN CG 1 1 17 9355 1 1 27 GLN H H 0.981 -1.615 -5.362 1.00 . A A . 27 GLN H 1 1 17 9356 1 1 27 GLN HA H 1.597 1.009 -6.685 1.00 . A A . 27 GLN HA 1 1 17 9357 1 1 27 GLN HB2 H -0.984 0.143 -5.330 1.00 . A A . 27 GLN HB2 1 1 17 9358 1 1 27 GLN HB3 H -0.701 1.606 -6.243 1.00 . A A . 27 GLN HB3 1 1 17 9359 1 1 27 GLN HE21 H -0.202 2.068 -8.748 1.00 . A A . 27 GLN HE21 1 1 17 9360 1 1 27 GLN HE22 H 0.751 1.229 -9.976 1.00 . A A . 27 GLN HE22 1 1 17 9361 1 1 27 GLN HG2 H -1.071 -1.205 -7.213 1.00 . A A . 27 GLN HG2 1 1 17 9362 1 1 27 GLN HG3 H -1.958 0.259 -7.658 1.00 . A A . 27 GLN HG3 1 1 17 9363 1 1 27 GLN N N 1.480 -0.972 -5.975 1.00 . A A . 27 GLN N 1 1 17 9364 1 1 27 GLN NE2 N 0.160 1.190 -9.169 1.00 . A A . 27 GLN NE2 1 1 17 9365 1 1 27 GLN O O 1.215 0.386 -3.525 1.00 . A A . 27 GLN O 1 1 17 9366 1 1 27 GLN OE1 O 0.335 -0.999 -9.264 1.00 . A A . 27 GLN OE1 1 1 17 9367 1 1 28 PHE C C 0.544 3.817 -2.975 1.00 . A A . 28 PHE C 1 1 17 9368 1 1 28 PHE CA C 1.865 3.105 -3.301 1.00 . A A . 28 PHE CA 1 1 17 9369 1 1 28 PHE CB C 3.021 4.099 -3.434 1.00 . A A . 28 PHE CB 1 1 17 9370 1 1 28 PHE CD1 C 4.973 2.654 -2.730 1.00 . A A . 28 PHE CD1 1 1 17 9371 1 1 28 PHE CD2 C 4.895 3.483 -5.022 1.00 . A A . 28 PHE CD2 1 1 17 9372 1 1 28 PHE CE1 C 6.166 1.978 -3.022 1.00 . A A . 28 PHE CE1 1 1 17 9373 1 1 28 PHE CE2 C 6.085 2.793 -5.312 1.00 . A A . 28 PHE CE2 1 1 17 9374 1 1 28 PHE CG C 4.339 3.415 -3.730 1.00 . A A . 28 PHE CG 1 1 17 9375 1 1 28 PHE CZ C 6.721 2.038 -4.312 1.00 . A A . 28 PHE CZ 1 1 17 9376 1 1 28 PHE H H 1.678 2.821 -5.428 1.00 . A A . 28 PHE H 1 1 17 9377 1 1 28 PHE HA H 2.100 2.441 -2.469 1.00 . A A . 28 PHE HA 1 1 17 9378 1 1 28 PHE HB2 H 2.792 4.817 -4.223 1.00 . A A . 28 PHE HB2 1 1 17 9379 1 1 28 PHE HB3 H 3.128 4.646 -2.498 1.00 . A A . 28 PHE HB3 1 1 17 9380 1 1 28 PHE HD1 H 4.550 2.558 -1.738 1.00 . A A . 28 PHE HD1 1 1 17 9381 1 1 28 PHE HD2 H 4.399 4.047 -5.798 1.00 . A A . 28 PHE HD2 1 1 17 9382 1 1 28 PHE HE1 H 6.634 1.406 -2.242 1.00 . A A . 28 PHE HE1 1 1 17 9383 1 1 28 PHE HE2 H 6.501 2.837 -6.307 1.00 . A A . 28 PHE HE2 1 1 17 9384 1 1 28 PHE HZ H 7.624 1.495 -4.542 1.00 . A A . 28 PHE HZ 1 1 17 9385 1 1 28 PHE N N 1.748 2.316 -4.538 1.00 . A A . 28 PHE N 1 1 17 9386 1 1 28 PHE O O 0.258 4.125 -1.820 1.00 . A A . 28 PHE O 1 1 17 9387 1 1 29 GLU C C -2.462 3.600 -3.018 1.00 . A A . 29 GLU C 1 1 17 9388 1 1 29 GLU CA C -1.656 4.491 -3.977 1.00 . A A . 29 GLU CA 1 1 17 9389 1 1 29 GLU CB C -2.250 4.477 -5.405 1.00 . A A . 29 GLU CB 1 1 17 9390 1 1 29 GLU CD C -0.391 4.107 -7.130 1.00 . A A . 29 GLU CD 1 1 17 9391 1 1 29 GLU CG C -1.369 5.116 -6.499 1.00 . A A . 29 GLU CG 1 1 17 9392 1 1 29 GLU H H 0.109 3.824 -4.932 1.00 . A A . 29 GLU H 1 1 17 9393 1 1 29 GLU HA H -1.667 5.517 -3.612 1.00 . A A . 29 GLU HA 1 1 17 9394 1 1 29 GLU HB2 H -2.479 3.453 -5.703 1.00 . A A . 29 GLU HB2 1 1 17 9395 1 1 29 GLU HB3 H -3.195 5.023 -5.367 1.00 . A A . 29 GLU HB3 1 1 17 9396 1 1 29 GLU HG2 H -2.025 5.500 -7.283 1.00 . A A . 29 GLU HG2 1 1 17 9397 1 1 29 GLU HG3 H -0.825 5.967 -6.085 1.00 . A A . 29 GLU HG3 1 1 17 9398 1 1 29 GLU N N -0.275 4.029 -4.009 1.00 . A A . 29 GLU N 1 1 17 9399 1 1 29 GLU O O -2.690 2.422 -3.291 1.00 . A A . 29 GLU O 1 1 17 9400 1 1 29 GLU OE1 O 0.694 3.878 -6.542 1.00 . A A . 29 GLU OE1 1 1 17 9401 1 1 29 GLU OE2 O -0.753 3.498 -8.159 1.00 . A A . 29 GLU OE2 1 1 17 9402 1 1 30 ARG C C -4.958 3.206 -0.908 1.00 . A A . 30 ARG C 1 1 17 9403 1 1 30 ARG CA C -3.439 3.427 -0.744 1.00 . A A . 30 ARG CA 1 1 17 9404 1 1 30 ARG CB C -3.061 4.174 0.545 1.00 . A A . 30 ARG CB 1 1 17 9405 1 1 30 ARG CD C -4.309 4.182 2.795 1.00 . A A . 30 ARG CD 1 1 17 9406 1 1 30 ARG CG C -3.389 3.412 1.842 1.00 . A A . 30 ARG CG 1 1 17 9407 1 1 30 ARG CZ C -6.561 5.245 2.373 1.00 . A A . 30 ARG CZ 1 1 17 9408 1 1 30 ARG H H -2.617 5.128 -1.699 1.00 . A A . 30 ARG H 1 1 17 9409 1 1 30 ARG HA H -2.941 2.462 -0.708 1.00 . A A . 30 ARG HA 1 1 17 9410 1 1 30 ARG HB2 H -1.978 4.316 0.519 1.00 . A A . 30 ARG HB2 1 1 17 9411 1 1 30 ARG HB3 H -3.531 5.159 0.549 1.00 . A A . 30 ARG HB3 1 1 17 9412 1 1 30 ARG HD2 H -4.345 3.646 3.745 1.00 . A A . 30 ARG HD2 1 1 17 9413 1 1 30 ARG HD3 H -3.887 5.173 2.967 1.00 . A A . 30 ARG HD3 1 1 17 9414 1 1 30 ARG HE H -5.986 3.518 1.653 1.00 . A A . 30 ARG HE 1 1 17 9415 1 1 30 ARG HG2 H -3.836 2.445 1.612 1.00 . A A . 30 ARG HG2 1 1 17 9416 1 1 30 ARG HG3 H -2.451 3.236 2.368 1.00 . A A . 30 ARG HG3 1 1 17 9417 1 1 30 ARG HH11 H -5.467 6.400 3.571 1.00 . A A . 30 ARG HH11 1 1 17 9418 1 1 30 ARG HH12 H -7.045 7.038 3.166 1.00 . A A . 30 ARG HH12 1 1 17 9419 1 1 30 ARG HH21 H -7.810 4.253 1.208 1.00 . A A . 30 ARG HH21 1 1 17 9420 1 1 30 ARG HH22 H -8.416 5.815 1.767 1.00 . A A . 30 ARG HH22 1 1 17 9421 1 1 30 ARG N N -2.857 4.162 -1.869 1.00 . A A . 30 ARG N 1 1 17 9422 1 1 30 ARG NE N -5.670 4.276 2.251 1.00 . A A . 30 ARG NE 1 1 17 9423 1 1 30 ARG NH1 N -6.347 6.321 3.094 1.00 . A A . 30 ARG NH1 1 1 17 9424 1 1 30 ARG NH2 N -7.704 5.109 1.752 1.00 . A A . 30 ARG NH2 1 1 17 9425 1 1 30 ARG O O -5.710 4.178 -0.824 1.00 . A A . 30 ARG O 1 1 17 9426 1 1 31 PRO C C -7.544 1.582 0.125 1.00 . A A . 31 PRO C 1 1 17 9427 1 1 31 PRO CA C -6.850 1.615 -1.254 1.00 . A A . 31 PRO CA 1 1 17 9428 1 1 31 PRO CB C -6.825 0.290 -2.030 1.00 . A A . 31 PRO CB 1 1 17 9429 1 1 31 PRO CD C -4.632 0.739 -1.185 1.00 . A A . 31 PRO CD 1 1 17 9430 1 1 31 PRO CG C -5.603 -0.407 -1.450 1.00 . A A . 31 PRO CG 1 1 17 9431 1 1 31 PRO HA H -7.383 2.345 -1.858 1.00 . A A . 31 PRO HA 1 1 17 9432 1 1 31 PRO HB2 H -7.731 -0.307 -1.930 1.00 . A A . 31 PRO HB2 1 1 17 9433 1 1 31 PRO HB3 H -6.646 0.500 -3.087 1.00 . A A . 31 PRO HB3 1 1 17 9434 1 1 31 PRO HD2 H -4.108 0.564 -0.245 1.00 . A A . 31 PRO HD2 1 1 17 9435 1 1 31 PRO HD3 H -3.917 0.799 -2.002 1.00 . A A . 31 PRO HD3 1 1 17 9436 1 1 31 PRO HG2 H -5.871 -0.868 -0.505 1.00 . A A . 31 PRO HG2 1 1 17 9437 1 1 31 PRO HG3 H -5.186 -1.139 -2.143 1.00 . A A . 31 PRO HG3 1 1 17 9438 1 1 31 PRO N N -5.432 1.958 -1.112 1.00 . A A . 31 PRO N 1 1 17 9439 1 1 31 PRO O O -7.333 2.472 0.953 1.00 . A A . 31 PRO O 1 1 17 9440 1 1 32 SER C C -8.255 -0.033 2.827 1.00 . A A . 32 SER C 1 1 17 9441 1 1 32 SER CA C -9.147 0.395 1.636 1.00 . A A . 32 SER CA 1 1 17 9442 1 1 32 SER CB C -10.294 -0.599 1.393 1.00 . A A . 32 SER CB 1 1 17 9443 1 1 32 SER H H -8.573 -0.075 -0.358 1.00 . A A . 32 SER H 1 1 17 9444 1 1 32 SER HA H -9.603 1.347 1.907 1.00 . A A . 32 SER HA 1 1 17 9445 1 1 32 SER HB2 H -10.927 -0.650 2.281 1.00 . A A . 32 SER HB2 1 1 17 9446 1 1 32 SER HB3 H -10.900 -0.264 0.549 1.00 . A A . 32 SER HB3 1 1 17 9447 1 1 32 SER HG H -9.225 -2.102 1.890 1.00 . A A . 32 SER HG 1 1 17 9448 1 1 32 SER N N -8.408 0.594 0.380 1.00 . A A . 32 SER N 1 1 17 9449 1 1 32 SER O O -8.415 -1.127 3.384 1.00 . A A . 32 SER O 1 1 17 9450 1 1 32 SER OG O -9.769 -1.880 1.119 1.00 . A A . 32 SER OG 1 1 17 9451 1 1 33 GLY C C -5.153 0.059 4.209 1.00 . A A . 33 GLY C 1 1 17 9452 1 1 33 GLY CA C -6.481 0.772 4.419 1.00 . A A . 33 GLY CA 1 1 17 9453 1 1 33 GLY H H -7.222 1.672 2.635 1.00 . A A . 33 GLY H 1 1 17 9454 1 1 33 GLY HA2 H -6.253 1.784 4.754 1.00 . A A . 33 GLY HA2 1 1 17 9455 1 1 33 GLY HA3 H -7.020 0.269 5.220 1.00 . A A . 33 GLY HA3 1 1 17 9456 1 1 33 GLY N N -7.324 0.848 3.219 1.00 . A A . 33 GLY N 1 1 17 9457 1 1 33 GLY O O -4.220 0.661 3.638 1.00 . A A . 33 GLY O 1 1 17 9458 1 1 33 GLY OXT O -5.007 -1.076 4.716 1.00 . A A . 33 GLY OXT 1 1 17 9459 2 2 1 NAG C1 C 12.692 1.374 -0.676 1.00 . B A . 101 NAG C1 1 1 17 9460 2 2 1 NAG C2 C 11.941 2.604 -1.233 1.00 . B A . 101 NAG C2 1 1 17 9461 2 2 1 NAG C3 C 10.700 2.100 -1.976 1.00 . B A . 101 NAG C3 1 1 17 9462 2 2 1 NAG C4 C 11.172 1.246 -3.155 1.00 . B A . 101 NAG C4 1 1 17 9463 2 2 1 NAG C5 C 11.908 0.013 -2.611 1.00 . B A . 101 NAG C5 1 1 17 9464 2 2 1 NAG C6 C 12.449 -0.938 -3.676 1.00 . B A . 101 NAG C6 1 1 17 9465 2 2 1 NAG C7 C 12.451 4.432 0.308 1.00 . B A . 101 NAG C7 1 1 17 9466 2 2 1 NAG C8 C 11.923 5.351 1.411 1.00 . B A . 101 NAG C8 1 1 17 9467 2 2 1 NAG H1 H 12.053 0.834 0.032 1.00 . B A . 101 NAG H1 1 1 17 9468 2 2 1 NAG H2 H 12.589 3.126 -1.939 1.00 . B A . 101 NAG H2 1 1 17 9469 2 2 1 NAG H3 H 10.086 1.506 -1.293 1.00 . B A . 101 NAG H3 1 1 17 9470 2 2 1 NAG H4 H 11.829 1.831 -3.800 1.00 . B A . 101 NAG H4 1 1 17 9471 2 2 1 NAG H5 H 11.232 -0.541 -1.971 1.00 . B A . 101 NAG H5 1 1 17 9472 2 2 1 NAG H61 H 12.926 -1.795 -3.202 1.00 . B A . 101 NAG H61 1 1 17 9473 2 2 1 NAG H62 H 11.645 -1.302 -4.315 1.00 . B A . 101 NAG H62 1 1 17 9474 2 2 1 NAG H81 H 11.803 4.781 2.332 1.00 . B A . 101 NAG H81 1 1 17 9475 2 2 1 NAG H82 H 10.961 5.773 1.115 1.00 . B A . 101 NAG H82 1 1 17 9476 2 2 1 NAG H83 H 12.629 6.164 1.583 1.00 . B A . 101 NAG H83 1 1 17 9477 2 2 1 NAG HN2 H 10.641 3.500 0.212 1.00 . B A . 101 NAG HN2 1 1 17 9478 2 2 1 NAG HO3 H 9.342 2.813 -3.182 1.00 . B A . 101 NAG HO3 1 1 17 9479 2 2 1 NAG HO4 H 10.302 0.448 -4.740 1.00 . B A . 101 NAG HO4 1 1 17 9480 2 2 1 NAG HO6 H 14.089 0.115 -3.860 1.00 . B A . 101 NAG HO6 1 1 17 9481 2 2 1 NAG N2 N 11.588 3.532 -0.162 1.00 . B A . 101 NAG N2 1 1 17 9482 2 2 1 NAG O3 O 9.918 3.190 -2.502 1.00 . B A . 101 NAG O3 1 1 17 9483 2 2 1 NAG O4 O 10.014 0.847 -3.912 1.00 . B A . 101 NAG O4 1 1 17 9484 2 2 1 NAG O5 O 13.045 0.476 -1.787 1.00 . B A . 101 NAG O5 1 1 17 9485 2 2 1 NAG O6 O 13.419 -0.231 -4.460 1.00 . B A . 101 NAG O6 1 1 17 9486 2 2 1 NAG O7 O 13.608 4.497 -0.105 1.00 . B A . 101 NAG O7 1 1 18 9487 1 1 1 LYS C C -10.070 -0.027 -4.255 1.00 . A A . 1 LYS C 1 1 18 9488 1 1 1 LYS CA C -11.009 1.142 -3.960 1.00 . A A . 1 LYS CA 1 1 18 9489 1 1 1 LYS CB C -10.250 2.407 -3.507 1.00 . A A . 1 LYS CB 1 1 18 9490 1 1 1 LYS CD C -9.269 3.004 -5.839 1.00 . A A . 1 LYS CD 1 1 18 9491 1 1 1 LYS CE C -7.949 3.073 -6.622 1.00 . A A . 1 LYS CE 1 1 18 9492 1 1 1 LYS CG C -9.004 2.761 -4.341 1.00 . A A . 1 LYS CG 1 1 18 9493 1 1 1 LYS H1 H -12.577 -0.053 -3.302 1.00 . A A . 1 LYS H1 1 1 18 9494 1 1 1 LYS H2 H -12.709 1.527 -2.836 1.00 . A A . 1 LYS H2 1 1 18 9495 1 1 1 LYS H3 H -11.655 0.507 -2.094 1.00 . A A . 1 LYS H3 1 1 18 9496 1 1 1 LYS HA H -11.488 1.373 -4.911 1.00 . A A . 1 LYS HA 1 1 18 9497 1 1 1 LYS HB2 H -10.939 3.254 -3.532 1.00 . A A . 1 LYS HB2 1 1 18 9498 1 1 1 LYS HB3 H -9.924 2.281 -2.474 1.00 . A A . 1 LYS HB3 1 1 18 9499 1 1 1 LYS HD2 H -9.852 2.181 -6.253 1.00 . A A . 1 LYS HD2 1 1 18 9500 1 1 1 LYS HD3 H -9.835 3.927 -5.974 1.00 . A A . 1 LYS HD3 1 1 18 9501 1 1 1 LYS HE2 H -7.362 2.183 -6.377 1.00 . A A . 1 LYS HE2 1 1 18 9502 1 1 1 LYS HE3 H -8.162 3.052 -7.694 1.00 . A A . 1 LYS HE3 1 1 18 9503 1 1 1 LYS HG2 H -8.568 3.665 -3.915 1.00 . A A . 1 LYS HG2 1 1 18 9504 1 1 1 LYS HG3 H -8.268 1.964 -4.233 1.00 . A A . 1 LYS HG3 1 1 18 9505 1 1 1 LYS HZ1 H -7.529 5.125 -6.705 1.00 . A A . 1 LYS HZ1 1 1 18 9506 1 1 1 LYS HZ2 H -7.093 4.411 -5.270 1.00 . A A . 1 LYS HZ2 1 1 18 9507 1 1 1 LYS HZ3 H -6.167 4.169 -6.484 1.00 . A A . 1 LYS HZ3 1 1 18 9508 1 1 1 LYS N N -12.068 0.764 -2.995 1.00 . A A . 1 LYS N 1 1 18 9509 1 1 1 LYS NZ N -7.167 4.283 -6.290 1.00 . A A . 1 LYS NZ 1 1 18 9510 1 1 1 LYS O O -9.850 -0.308 -5.428 1.00 . A A . 1 LYS O 1 1 18 9511 1 1 2 LEU C C -9.188 -2.939 -4.199 1.00 . A A . 2 LEU C 1 1 18 9512 1 1 2 LEU CA C -8.569 -1.788 -3.363 1.00 . A A . 2 LEU CA 1 1 18 9513 1 1 2 LEU CB C -8.222 -2.229 -1.927 1.00 . A A . 2 LEU CB 1 1 18 9514 1 1 2 LEU CD1 C -5.796 -2.830 -2.424 1.00 . A A . 2 LEU CD1 1 1 18 9515 1 1 2 LEU CD2 C -6.878 -3.588 -0.317 1.00 . A A . 2 LEU CD2 1 1 18 9516 1 1 2 LEU CG C -7.115 -3.289 -1.799 1.00 . A A . 2 LEU CG 1 1 18 9517 1 1 2 LEU H H -9.720 -0.378 -2.275 1.00 . A A . 2 LEU H 1 1 18 9518 1 1 2 LEU HA H -7.666 -1.408 -3.831 1.00 . A A . 2 LEU HA 1 1 18 9519 1 1 2 LEU HB2 H -7.918 -1.349 -1.360 1.00 . A A . 2 LEU HB2 1 1 18 9520 1 1 2 LEU HB3 H -9.127 -2.621 -1.457 1.00 . A A . 2 LEU HB3 1 1 18 9521 1 1 2 LEU HD11 H -5.053 -3.604 -2.265 1.00 . A A . 2 LEU HD11 1 1 18 9522 1 1 2 LEU HD12 H -5.909 -2.688 -3.497 1.00 . A A . 2 LEU HD12 1 1 18 9523 1 1 2 LEU HD13 H -5.456 -1.905 -1.966 1.00 . A A . 2 LEU HD13 1 1 18 9524 1 1 2 LEU HD21 H -7.800 -3.959 0.133 1.00 . A A . 2 LEU HD21 1 1 18 9525 1 1 2 LEU HD22 H -6.113 -4.357 -0.216 1.00 . A A . 2 LEU HD22 1 1 18 9526 1 1 2 LEU HD23 H -6.564 -2.684 0.205 1.00 . A A . 2 LEU HD23 1 1 18 9527 1 1 2 LEU HG H -7.430 -4.209 -2.284 1.00 . A A . 2 LEU HG 1 1 18 9528 1 1 2 LEU N N -9.507 -0.674 -3.231 1.00 . A A . 2 LEU N 1 1 18 9529 1 1 2 LEU O O -10.214 -3.484 -3.786 1.00 . A A . 2 LEU O 1 1 18 9530 1 1 3 PRO C C -8.819 -5.818 -5.631 1.00 . A A . 3 PRO C 1 1 18 9531 1 1 3 PRO CA C -9.151 -4.412 -6.183 1.00 . A A . 3 PRO CA 1 1 18 9532 1 1 3 PRO CB C -8.567 -4.195 -7.591 1.00 . A A . 3 PRO CB 1 1 18 9533 1 1 3 PRO CD C -7.526 -2.662 -6.059 1.00 . A A . 3 PRO CD 1 1 18 9534 1 1 3 PRO CG C -7.839 -2.854 -7.536 1.00 . A A . 3 PRO CG 1 1 18 9535 1 1 3 PRO HA H -10.235 -4.298 -6.233 1.00 . A A . 3 PRO HA 1 1 18 9536 1 1 3 PRO HB2 H -7.869 -4.988 -7.846 1.00 . A A . 3 PRO HB2 1 1 18 9537 1 1 3 PRO HB3 H -9.360 -4.159 -8.338 1.00 . A A . 3 PRO HB3 1 1 18 9538 1 1 3 PRO HD2 H -6.576 -3.138 -5.814 1.00 . A A . 3 PRO HD2 1 1 18 9539 1 1 3 PRO HD3 H -7.481 -1.595 -5.847 1.00 . A A . 3 PRO HD3 1 1 18 9540 1 1 3 PRO HG2 H -6.934 -2.855 -8.145 1.00 . A A . 3 PRO HG2 1 1 18 9541 1 1 3 PRO HG3 H -8.515 -2.062 -7.864 1.00 . A A . 3 PRO HG3 1 1 18 9542 1 1 3 PRO N N -8.604 -3.335 -5.351 1.00 . A A . 3 PRO N 1 1 18 9543 1 1 3 PRO O O -7.952 -5.955 -4.764 1.00 . A A . 3 PRO O 1 1 18 9544 1 1 4 PRO C C -7.728 -8.713 -5.936 1.00 . A A . 4 PRO C 1 1 18 9545 1 1 4 PRO CA C -9.178 -8.260 -5.690 1.00 . A A . 4 PRO CA 1 1 18 9546 1 1 4 PRO CB C -10.199 -9.149 -6.407 1.00 . A A . 4 PRO CB 1 1 18 9547 1 1 4 PRO CD C -10.442 -6.907 -7.209 1.00 . A A . 4 PRO CD 1 1 18 9548 1 1 4 PRO CG C -10.545 -8.360 -7.668 1.00 . A A . 4 PRO CG 1 1 18 9549 1 1 4 PRO HA H -9.377 -8.303 -4.617 1.00 . A A . 4 PRO HA 1 1 18 9550 1 1 4 PRO HB2 H -9.797 -10.135 -6.645 1.00 . A A . 4 PRO HB2 1 1 18 9551 1 1 4 PRO HB3 H -11.091 -9.246 -5.787 1.00 . A A . 4 PRO HB3 1 1 18 9552 1 1 4 PRO HD2 H -10.162 -6.280 -8.054 1.00 . A A . 4 PRO HD2 1 1 18 9553 1 1 4 PRO HD3 H -11.397 -6.580 -6.796 1.00 . A A . 4 PRO HD3 1 1 18 9554 1 1 4 PRO HG2 H -9.795 -8.552 -8.436 1.00 . A A . 4 PRO HG2 1 1 18 9555 1 1 4 PRO HG3 H -11.543 -8.599 -8.037 1.00 . A A . 4 PRO HG3 1 1 18 9556 1 1 4 PRO N N -9.432 -6.897 -6.159 1.00 . A A . 4 PRO N 1 1 18 9557 1 1 4 PRO O O -7.125 -8.427 -6.972 1.00 . A A . 4 PRO O 1 1 18 9558 1 1 5 GLY C C -4.717 -8.976 -4.528 1.00 . A A . 5 GLY C 1 1 18 9559 1 1 5 GLY CA C -5.804 -9.959 -4.980 1.00 . A A . 5 GLY CA 1 1 18 9560 1 1 5 GLY H H -7.711 -9.611 -4.121 1.00 . A A . 5 GLY H 1 1 18 9561 1 1 5 GLY HA2 H -5.754 -10.837 -4.335 1.00 . A A . 5 GLY HA2 1 1 18 9562 1 1 5 GLY HA3 H -5.565 -10.271 -5.997 1.00 . A A . 5 GLY HA3 1 1 18 9563 1 1 5 GLY N N -7.169 -9.425 -4.953 1.00 . A A . 5 GLY N 1 1 18 9564 1 1 5 GLY O O -3.597 -9.419 -4.273 1.00 . A A . 5 GLY O 1 1 18 9565 1 1 6 TRP C C -4.211 -6.559 -2.378 1.00 . A A . 6 TRP C 1 1 18 9566 1 1 6 TRP CA C -4.147 -6.636 -3.908 1.00 . A A . 6 TRP CA 1 1 18 9567 1 1 6 TRP CB C -4.559 -5.282 -4.492 1.00 . A A . 6 TRP CB 1 1 18 9568 1 1 6 TRP CD1 C -5.380 -5.505 -6.875 1.00 . A A . 6 TRP CD1 1 1 18 9569 1 1 6 TRP CD2 C -3.442 -4.387 -6.736 1.00 . A A . 6 TRP CD2 1 1 18 9570 1 1 6 TRP CE2 C -3.829 -4.383 -8.110 1.00 . A A . 6 TRP CE2 1 1 18 9571 1 1 6 TRP CE3 C -2.219 -3.764 -6.411 1.00 . A A . 6 TRP CE3 1 1 18 9572 1 1 6 TRP CG C -4.463 -5.096 -5.973 1.00 . A A . 6 TRP CG 1 1 18 9573 1 1 6 TRP CH2 C -1.865 -3.125 -8.745 1.00 . A A . 6 TRP CH2 1 1 18 9574 1 1 6 TRP CZ2 C -3.066 -3.756 -9.107 1.00 . A A . 6 TRP CZ2 1 1 18 9575 1 1 6 TRP CZ3 C -1.439 -3.149 -7.407 1.00 . A A . 6 TRP CZ3 1 1 18 9576 1 1 6 TRP H H -5.977 -7.364 -4.606 1.00 . A A . 6 TRP H 1 1 18 9577 1 1 6 TRP HA H -3.126 -6.839 -4.210 1.00 . A A . 6 TRP HA 1 1 18 9578 1 1 6 TRP HB2 H -5.585 -5.071 -4.194 1.00 . A A . 6 TRP HB2 1 1 18 9579 1 1 6 TRP HB3 H -3.927 -4.528 -4.035 1.00 . A A . 6 TRP HB3 1 1 18 9580 1 1 6 TRP HD1 H -6.279 -6.053 -6.621 1.00 . A A . 6 TRP HD1 1 1 18 9581 1 1 6 TRP HE1 H -5.563 -5.253 -8.971 1.00 . A A . 6 TRP HE1 1 1 18 9582 1 1 6 TRP HE3 H -1.877 -3.760 -5.387 1.00 . A A . 6 TRP HE3 1 1 18 9583 1 1 6 TRP HH2 H -1.264 -2.628 -9.494 1.00 . A A . 6 TRP HH2 1 1 18 9584 1 1 6 TRP HZ2 H -3.398 -3.760 -10.134 1.00 . A A . 6 TRP HZ2 1 1 18 9585 1 1 6 TRP HZ3 H -0.507 -2.685 -7.135 1.00 . A A . 6 TRP HZ3 1 1 18 9586 1 1 6 TRP N N -5.033 -7.678 -4.420 1.00 . A A . 6 TRP N 1 1 18 9587 1 1 6 TRP NE1 N -5.008 -5.096 -8.140 1.00 . A A . 6 TRP NE1 1 1 18 9588 1 1 6 TRP O O -5.294 -6.427 -1.811 1.00 . A A . 6 TRP O 1 1 18 9589 1 1 7 GLU C C -1.709 -5.722 0.225 1.00 . A A . 7 GLU C 1 1 18 9590 1 1 7 GLU CA C -2.976 -6.461 -0.245 1.00 . A A . 7 GLU CA 1 1 18 9591 1 1 7 GLU CB C -3.117 -7.847 0.411 1.00 . A A . 7 GLU CB 1 1 18 9592 1 1 7 GLU CD C -2.293 -10.220 0.619 1.00 . A A . 7 GLU CD 1 1 18 9593 1 1 7 GLU CG C -2.254 -8.946 -0.225 1.00 . A A . 7 GLU CG 1 1 18 9594 1 1 7 GLU H H -2.186 -6.776 -2.206 1.00 . A A . 7 GLU H 1 1 18 9595 1 1 7 GLU HA H -3.822 -5.864 0.095 1.00 . A A . 7 GLU HA 1 1 18 9596 1 1 7 GLU HB2 H -2.866 -7.763 1.470 1.00 . A A . 7 GLU HB2 1 1 18 9597 1 1 7 GLU HB3 H -4.162 -8.153 0.344 1.00 . A A . 7 GLU HB3 1 1 18 9598 1 1 7 GLU HG2 H -2.620 -9.174 -1.229 1.00 . A A . 7 GLU HG2 1 1 18 9599 1 1 7 GLU HG3 H -1.227 -8.588 -0.314 1.00 . A A . 7 GLU HG3 1 1 18 9600 1 1 7 GLU N N -3.056 -6.586 -1.707 1.00 . A A . 7 GLU N 1 1 18 9601 1 1 7 GLU O O -0.723 -5.617 -0.508 1.00 . A A . 7 GLU O 1 1 18 9602 1 1 7 GLU OE1 O -3.370 -10.852 0.683 1.00 . A A . 7 GLU OE1 1 1 18 9603 1 1 7 GLU OE2 O -1.228 -10.545 1.205 1.00 . A A . 7 GLU OE2 1 1 18 9604 1 1 8 LYS C C 0.627 -5.018 2.186 1.00 . A A . 8 LYS C 1 1 18 9605 1 1 8 LYS CA C -0.710 -4.293 2.002 1.00 . A A . 8 LYS CA 1 1 18 9606 1 1 8 LYS CB C -1.181 -3.684 3.334 1.00 . A A . 8 LYS CB 1 1 18 9607 1 1 8 LYS CD C 0.185 -2.605 5.228 1.00 . A A . 8 LYS CD 1 1 18 9608 1 1 8 LYS CE C 1.266 -3.682 5.412 1.00 . A A . 8 LYS CE 1 1 18 9609 1 1 8 LYS CG C -0.315 -2.484 3.780 1.00 . A A . 8 LYS CG 1 1 18 9610 1 1 8 LYS H H -2.568 -5.329 2.025 1.00 . A A . 8 LYS H 1 1 18 9611 1 1 8 LYS HA H -0.568 -3.479 1.288 1.00 . A A . 8 LYS HA 1 1 18 9612 1 1 8 LYS HB2 H -2.208 -3.335 3.223 1.00 . A A . 8 LYS HB2 1 1 18 9613 1 1 8 LYS HB3 H -1.186 -4.463 4.099 1.00 . A A . 8 LYS HB3 1 1 18 9614 1 1 8 LYS HD2 H 0.576 -1.639 5.554 1.00 . A A . 8 LYS HD2 1 1 18 9615 1 1 8 LYS HD3 H -0.666 -2.848 5.867 1.00 . A A . 8 LYS HD3 1 1 18 9616 1 1 8 LYS HE2 H 1.292 -3.956 6.471 1.00 . A A . 8 LYS HE2 1 1 18 9617 1 1 8 LYS HE3 H 0.987 -4.577 4.847 1.00 . A A . 8 LYS HE3 1 1 18 9618 1 1 8 LYS HG2 H 0.538 -2.347 3.117 1.00 . A A . 8 LYS HG2 1 1 18 9619 1 1 8 LYS HG3 H -0.922 -1.582 3.706 1.00 . A A . 8 LYS HG3 1 1 18 9620 1 1 8 LYS HZ1 H 3.305 -3.932 5.183 1.00 . A A . 8 LYS HZ1 1 1 18 9621 1 1 8 LYS HZ2 H 2.666 -2.983 4.012 1.00 . A A . 8 LYS HZ2 1 1 18 9622 1 1 8 LYS HZ3 H 2.872 -2.385 5.527 1.00 . A A . 8 LYS HZ3 1 1 18 9623 1 1 8 LYS N N -1.747 -5.181 1.456 1.00 . A A . 8 LYS N 1 1 18 9624 1 1 8 LYS NZ N 2.613 -3.211 5.006 1.00 . A A . 8 LYS NZ 1 1 18 9625 1 1 8 LYS O O 0.699 -6.104 2.766 1.00 . A A . 8 LYS O 1 1 18 9626 1 1 9 ARG C C 4.093 -3.900 2.083 1.00 . A A . 9 ARG C 1 1 18 9627 1 1 9 ARG CA C 3.056 -4.925 1.600 1.00 . A A . 9 ARG CA 1 1 18 9628 1 1 9 ARG CB C 3.180 -5.247 0.101 1.00 . A A . 9 ARG CB 1 1 18 9629 1 1 9 ARG CD C 3.368 -7.851 -0.089 1.00 . A A . 9 ARG CD 1 1 18 9630 1 1 9 ARG CG C 4.041 -6.464 -0.224 1.00 . A A . 9 ARG CG 1 1 18 9631 1 1 9 ARG CZ C 1.359 -8.841 1.080 1.00 . A A . 9 ARG CZ 1 1 18 9632 1 1 9 ARG H H 1.600 -3.516 1.230 1.00 . A A . 9 ARG H 1 1 18 9633 1 1 9 ARG HA H 3.179 -5.819 2.211 1.00 . A A . 9 ARG HA 1 1 18 9634 1 1 9 ARG HB2 H 2.198 -5.419 -0.346 1.00 . A A . 9 ARG HB2 1 1 18 9635 1 1 9 ARG HB3 H 3.592 -4.370 -0.394 1.00 . A A . 9 ARG HB3 1 1 18 9636 1 1 9 ARG HD2 H 2.950 -8.123 -1.057 1.00 . A A . 9 ARG HD2 1 1 18 9637 1 1 9 ARG HD3 H 4.135 -8.589 0.154 1.00 . A A . 9 ARG HD3 1 1 18 9638 1 1 9 ARG HE H 2.126 -7.105 1.500 1.00 . A A . 9 ARG HE 1 1 18 9639 1 1 9 ARG HG2 H 4.304 -6.325 -1.267 1.00 . A A . 9 ARG HG2 1 1 18 9640 1 1 9 ARG HG3 H 4.958 -6.422 0.360 1.00 . A A . 9 ARG HG3 1 1 18 9641 1 1 9 ARG HH11 H 1.893 -10.175 -0.364 1.00 . A A . 9 ARG HH11 1 1 18 9642 1 1 9 ARG HH12 H 0.391 -10.473 0.544 1.00 . A A . 9 ARG HH12 1 1 18 9643 1 1 9 ARG HH21 H 0.385 -7.805 2.520 1.00 . A A . 9 ARG HH21 1 1 18 9644 1 1 9 ARG HH22 H -0.305 -9.382 1.984 1.00 . A A . 9 ARG HH22 1 1 18 9645 1 1 9 ARG N N 1.709 -4.389 1.737 1.00 . A A . 9 ARG N 1 1 18 9646 1 1 9 ARG NE N 2.290 -7.912 0.918 1.00 . A A . 9 ARG NE 1 1 18 9647 1 1 9 ARG NH1 N 1.254 -9.934 0.368 1.00 . A A . 9 ARG NH1 1 1 18 9648 1 1 9 ARG NH2 N 0.447 -8.676 1.996 1.00 . A A . 9 ARG NH2 1 1 18 9649 1 1 9 ARG O O 3.724 -2.794 2.493 1.00 . A A . 9 ARG O 1 1 18 9650 1 1 10 MET C C 7.808 -3.892 2.021 1.00 . A A . 10 MET C 1 1 18 9651 1 1 10 MET CA C 6.467 -3.463 2.629 1.00 . A A . 10 MET CA 1 1 18 9652 1 1 10 MET CB C 6.538 -3.487 4.171 1.00 . A A . 10 MET CB 1 1 18 9653 1 1 10 MET CE C 5.274 -7.181 5.753 1.00 . A A . 10 MET CE 1 1 18 9654 1 1 10 MET CG C 6.494 -4.877 4.823 1.00 . A A . 10 MET CG 1 1 18 9655 1 1 10 MET H H 5.632 -5.212 1.807 1.00 . A A . 10 MET H 1 1 18 9656 1 1 10 MET HA H 6.282 -2.436 2.325 1.00 . A A . 10 MET HA 1 1 18 9657 1 1 10 MET HB2 H 7.465 -2.995 4.474 1.00 . A A . 10 MET HB2 1 1 18 9658 1 1 10 MET HB3 H 5.717 -2.896 4.574 1.00 . A A . 10 MET HB3 1 1 18 9659 1 1 10 MET HE1 H 4.370 -7.763 5.936 1.00 . A A . 10 MET HE1 1 1 18 9660 1 1 10 MET HE2 H 5.929 -7.735 5.080 1.00 . A A . 10 MET HE2 1 1 18 9661 1 1 10 MET HE3 H 5.789 -7.010 6.698 1.00 . A A . 10 MET HE3 1 1 18 9662 1 1 10 MET HG2 H 7.122 -5.563 4.255 1.00 . A A . 10 MET HG2 1 1 18 9663 1 1 10 MET HG3 H 6.922 -4.790 5.822 1.00 . A A . 10 MET HG3 1 1 18 9664 1 1 10 MET N N 5.368 -4.291 2.127 1.00 . A A . 10 MET N 1 1 18 9665 1 1 10 MET O O 8.062 -5.082 1.838 1.00 . A A . 10 MET O 1 1 18 9666 1 1 10 MET SD S 4.831 -5.592 5.004 1.00 . A A . 10 MET SD 1 1 18 9667 1 1 11 PHE C C 11.006 -3.055 2.389 1.00 . A A . 11 PHE C 1 1 18 9668 1 1 11 PHE CA C 10.017 -3.089 1.213 1.00 . A A . 11 PHE CA 1 1 18 9669 1 1 11 PHE CB C 10.343 -1.982 0.207 1.00 . A A . 11 PHE CB 1 1 18 9670 1 1 11 PHE CD1 C 10.077 -3.216 -1.975 1.00 . A A . 11 PHE CD1 1 1 18 9671 1 1 11 PHE CD2 C 8.709 -1.228 -1.608 1.00 . A A . 11 PHE CD2 1 1 18 9672 1 1 11 PHE CE1 C 9.529 -3.365 -3.260 1.00 . A A . 11 PHE CE1 1 1 18 9673 1 1 11 PHE CE2 C 8.167 -1.382 -2.898 1.00 . A A . 11 PHE CE2 1 1 18 9674 1 1 11 PHE CG C 9.677 -2.148 -1.146 1.00 . A A . 11 PHE CG 1 1 18 9675 1 1 11 PHE CZ C 8.578 -2.442 -3.723 1.00 . A A . 11 PHE CZ 1 1 18 9676 1 1 11 PHE H H 8.324 -1.948 1.783 1.00 . A A . 11 PHE H 1 1 18 9677 1 1 11 PHE HA H 10.110 -4.039 0.693 1.00 . A A . 11 PHE HA 1 1 18 9678 1 1 11 PHE HB2 H 10.070 -1.028 0.645 1.00 . A A . 11 PHE HB2 1 1 18 9679 1 1 11 PHE HB3 H 11.422 -1.965 0.038 1.00 . A A . 11 PHE HB3 1 1 18 9680 1 1 11 PHE HD1 H 10.834 -3.912 -1.647 1.00 . A A . 11 PHE HD1 1 1 18 9681 1 1 11 PHE HD2 H 8.339 -0.422 -0.981 1.00 . A A . 11 PHE HD2 1 1 18 9682 1 1 11 PHE HE1 H 9.845 -4.177 -3.899 1.00 . A A . 11 PHE HE1 1 1 18 9683 1 1 11 PHE HE2 H 7.407 -0.708 -3.259 1.00 . A A . 11 PHE HE2 1 1 18 9684 1 1 11 PHE HZ H 8.158 -2.552 -4.713 1.00 . A A . 11 PHE HZ 1 1 18 9685 1 1 11 PHE N N 8.646 -2.908 1.686 1.00 . A A . 11 PHE N 1 1 18 9686 1 1 11 PHE O O 10.755 -2.404 3.403 1.00 . A A . 11 PHE O 1 1 18 9687 1 1 12 ALA C C 13.808 -2.443 3.717 1.00 . A A . 12 ALA C 1 1 18 9688 1 1 12 ALA CA C 13.206 -3.792 3.266 1.00 . A A . 12 ALA CA 1 1 18 9689 1 1 12 ALA CB C 14.303 -4.736 2.761 1.00 . A A . 12 ALA CB 1 1 18 9690 1 1 12 ALA H H 12.347 -4.207 1.377 1.00 . A A . 12 ALA H 1 1 18 9691 1 1 12 ALA HA H 12.752 -4.244 4.150 1.00 . A A . 12 ALA HA 1 1 18 9692 1 1 12 ALA HB1 H 14.786 -4.314 1.878 1.00 . A A . 12 ALA HB1 1 1 18 9693 1 1 12 ALA HB2 H 15.052 -4.876 3.542 1.00 . A A . 12 ALA HB2 1 1 18 9694 1 1 12 ALA HB3 H 13.873 -5.707 2.511 1.00 . A A . 12 ALA HB3 1 1 18 9695 1 1 12 ALA N N 12.174 -3.691 2.225 1.00 . A A . 12 ALA N 1 1 18 9696 1 1 12 ALA O O 14.429 -2.374 4.772 1.00 . A A . 12 ALA O 1 1 18 9697 1 1 13 ASN C C 12.842 0.710 4.162 1.00 . A A . 13 ASN C 1 1 18 9698 1 1 13 ASN CA C 13.938 0.011 3.319 1.00 . A A . 13 ASN CA 1 1 18 9699 1 1 13 ASN CB C 14.268 0.798 2.030 1.00 . A A . 13 ASN CB 1 1 18 9700 1 1 13 ASN CG C 13.102 0.885 1.048 1.00 . A A . 13 ASN CG 1 1 18 9701 1 1 13 ASN H H 13.054 -1.485 2.107 1.00 . A A . 13 ASN H 1 1 18 9702 1 1 13 ASN HA H 14.837 -0.011 3.939 1.00 . A A . 13 ASN HA 1 1 18 9703 1 1 13 ASN HB2 H 14.571 1.811 2.293 1.00 . A A . 13 ASN HB2 1 1 18 9704 1 1 13 ASN HB3 H 15.110 0.316 1.533 1.00 . A A . 13 ASN HB3 1 1 18 9705 1 1 13 ASN HD21 H 14.316 1.427 -0.491 1.00 . A A . 13 ASN HD21 1 1 18 9706 1 1 13 ASN N N 13.597 -1.366 2.947 1.00 . A A . 13 ASN N 1 1 18 9707 1 1 13 ASN ND2 N 13.377 1.196 -0.217 1.00 . A A . 13 ASN ND2 1 1 18 9708 1 1 13 ASN O O 13.012 1.875 4.511 1.00 . A A . 13 ASN O 1 1 18 9709 1 1 13 ASN OD1 O 11.958 0.625 1.419 1.00 . A A . 13 ASN OD1 1 1 18 9710 1 1 14 GLY C C 9.452 1.157 4.343 1.00 . A A . 14 GLY C 1 1 18 9711 1 1 14 GLY CA C 10.588 0.592 5.208 1.00 . A A . 14 GLY CA 1 1 18 9712 1 1 14 GLY H H 11.609 -0.922 4.134 1.00 . A A . 14 GLY H 1 1 18 9713 1 1 14 GLY HA2 H 10.168 -0.200 5.828 1.00 . A A . 14 GLY HA2 1 1 18 9714 1 1 14 GLY HA3 H 10.938 1.386 5.869 1.00 . A A . 14 GLY HA3 1 1 18 9715 1 1 14 GLY N N 11.718 0.037 4.459 1.00 . A A . 14 GLY N 1 1 18 9716 1 1 14 GLY O O 8.583 1.847 4.871 1.00 . A A . 14 GLY O 1 1 18 9717 1 1 15 THR C C 7.252 0.684 1.928 1.00 . A A . 15 THR C 1 1 18 9718 1 1 15 THR CA C 8.493 1.548 2.100 1.00 . A A . 15 THR CA 1 1 18 9719 1 1 15 THR CB C 9.163 1.833 0.749 1.00 . A A . 15 THR CB 1 1 18 9720 1 1 15 THR CG2 C 8.321 2.655 -0.226 1.00 . A A . 15 THR CG2 1 1 18 9721 1 1 15 THR H H 10.117 0.260 2.632 1.00 . A A . 15 THR H 1 1 18 9722 1 1 15 THR HA H 8.192 2.509 2.501 1.00 . A A . 15 THR HA 1 1 18 9723 1 1 15 THR HB H 9.420 0.900 0.265 1.00 . A A . 15 THR HB 1 1 18 9724 1 1 15 THR HG1 H 10.994 1.854 1.288 1.00 . A A . 15 THR HG1 1 1 18 9725 1 1 15 THR HG21 H 7.352 2.182 -0.379 1.00 . A A . 15 THR HG21 1 1 18 9726 1 1 15 THR HG22 H 8.175 3.662 0.164 1.00 . A A . 15 THR HG22 1 1 18 9727 1 1 15 THR HG23 H 8.840 2.706 -1.186 1.00 . A A . 15 THR HG23 1 1 18 9728 1 1 15 THR N N 9.425 0.883 3.030 1.00 . A A . 15 THR N 1 1 18 9729 1 1 15 THR O O 7.356 -0.451 1.468 1.00 . A A . 15 THR O 1 1 18 9730 1 1 15 THR OG1 O 10.352 2.540 0.982 1.00 . A A . 15 THR OG1 1 1 18 9731 1 1 16 VAL C C 4.075 0.795 0.959 1.00 . A A . 16 VAL C 1 1 18 9732 1 1 16 VAL CA C 4.804 0.495 2.265 1.00 . A A . 16 VAL CA 1 1 18 9733 1 1 16 VAL CB C 3.943 0.849 3.499 1.00 . A A . 16 VAL CB 1 1 18 9734 1 1 16 VAL CG1 C 2.451 0.492 3.371 1.00 . A A . 16 VAL CG1 1 1 18 9735 1 1 16 VAL CG2 C 4.483 0.078 4.709 1.00 . A A . 16 VAL CG2 1 1 18 9736 1 1 16 VAL H H 6.063 2.162 2.655 1.00 . A A . 16 VAL H 1 1 18 9737 1 1 16 VAL HA H 4.999 -0.577 2.291 1.00 . A A . 16 VAL HA 1 1 18 9738 1 1 16 VAL HB H 4.018 1.920 3.696 1.00 . A A . 16 VAL HB 1 1 18 9739 1 1 16 VAL HG11 H 1.939 0.692 4.313 1.00 . A A . 16 VAL HG11 1 1 18 9740 1 1 16 VAL HG12 H 1.984 1.107 2.602 1.00 . A A . 16 VAL HG12 1 1 18 9741 1 1 16 VAL HG13 H 2.332 -0.558 3.112 1.00 . A A . 16 VAL HG13 1 1 18 9742 1 1 16 VAL HG21 H 5.535 0.320 4.867 1.00 . A A . 16 VAL HG21 1 1 18 9743 1 1 16 VAL HG22 H 3.927 0.354 5.606 1.00 . A A . 16 VAL HG22 1 1 18 9744 1 1 16 VAL HG23 H 4.382 -0.991 4.528 1.00 . A A . 16 VAL HG23 1 1 18 9745 1 1 16 VAL N N 6.084 1.215 2.305 1.00 . A A . 16 VAL N 1 1 18 9746 1 1 16 VAL O O 4.118 1.905 0.433 1.00 . A A . 16 VAL O 1 1 18 9747 1 1 17 TYR C C 1.606 -1.360 -0.735 1.00 . A A . 17 TYR C 1 1 18 9748 1 1 17 TYR CA C 2.670 -0.256 -0.809 1.00 . A A . 17 TYR CA 1 1 18 9749 1 1 17 TYR CB C 3.672 -0.520 -1.957 1.00 . A A . 17 TYR CB 1 1 18 9750 1 1 17 TYR CD1 C 5.528 -1.956 -1.037 1.00 . A A . 17 TYR CD1 1 1 18 9751 1 1 17 TYR CD2 C 4.102 -2.922 -2.754 1.00 . A A . 17 TYR CD2 1 1 18 9752 1 1 17 TYR CE1 C 6.310 -3.121 -1.018 1.00 . A A . 17 TYR CE1 1 1 18 9753 1 1 17 TYR CE2 C 4.914 -4.073 -2.769 1.00 . A A . 17 TYR CE2 1 1 18 9754 1 1 17 TYR CG C 4.427 -1.842 -1.903 1.00 . A A . 17 TYR CG 1 1 18 9755 1 1 17 TYR CZ C 6.023 -4.174 -1.904 1.00 . A A . 17 TYR CZ 1 1 18 9756 1 1 17 TYR H H 3.394 -1.120 0.951 1.00 . A A . 17 TYR H 1 1 18 9757 1 1 17 TYR HA H 2.181 0.707 -0.966 1.00 . A A . 17 TYR HA 1 1 18 9758 1 1 17 TYR HB2 H 3.162 -0.435 -2.916 1.00 . A A . 17 TYR HB2 1 1 18 9759 1 1 17 TYR HB3 H 4.432 0.265 -1.936 1.00 . A A . 17 TYR HB3 1 1 18 9760 1 1 17 TYR HD1 H 5.806 -1.123 -0.410 1.00 . A A . 17 TYR HD1 1 1 18 9761 1 1 17 TYR HD2 H 3.248 -2.878 -3.410 1.00 . A A . 17 TYR HD2 1 1 18 9762 1 1 17 TYR HE1 H 7.169 -3.170 -0.377 1.00 . A A . 17 TYR HE1 1 1 18 9763 1 1 17 TYR HE2 H 4.709 -4.897 -3.432 1.00 . A A . 17 TYR HE2 1 1 18 9764 1 1 17 TYR HH H 7.605 -5.168 -1.402 1.00 . A A . 17 TYR HH 1 1 18 9765 1 1 17 TYR N N 3.422 -0.243 0.441 1.00 . A A . 17 TYR N 1 1 18 9766 1 1 17 TYR O O 1.546 -2.096 0.248 1.00 . A A . 17 TYR O 1 1 18 9767 1 1 17 TYR OH O 6.801 -5.290 -1.910 1.00 . A A . 17 TYR OH 1 1 18 9768 1 1 18 TYR C C 0.339 -3.483 -3.175 1.00 . A A . 18 TYR C 1 1 18 9769 1 1 18 TYR CA C -0.112 -2.649 -1.983 1.00 . A A . 18 TYR CA 1 1 18 9770 1 1 18 TYR CB C -1.556 -2.160 -2.155 1.00 . A A . 18 TYR CB 1 1 18 9771 1 1 18 TYR CD1 C -1.591 -0.592 -0.196 1.00 . A A . 18 TYR CD1 1 1 18 9772 1 1 18 TYR CD2 C -3.159 -2.447 -0.201 1.00 . A A . 18 TYR CD2 1 1 18 9773 1 1 18 TYR CE1 C -1.969 -0.272 1.104 1.00 . A A . 18 TYR CE1 1 1 18 9774 1 1 18 TYR CE2 C -3.663 -2.024 1.044 1.00 . A A . 18 TYR CE2 1 1 18 9775 1 1 18 TYR CG C -2.142 -1.710 -0.837 1.00 . A A . 18 TYR CG 1 1 18 9776 1 1 18 TYR CZ C -3.060 -0.933 1.710 1.00 . A A . 18 TYR CZ 1 1 18 9777 1 1 18 TYR H H 0.716 -0.747 -2.427 1.00 . A A . 18 TYR H 1 1 18 9778 1 1 18 TYR HA H -0.081 -3.292 -1.105 1.00 . A A . 18 TYR HA 1 1 18 9779 1 1 18 TYR HB2 H -1.588 -1.338 -2.871 1.00 . A A . 18 TYR HB2 1 1 18 9780 1 1 18 TYR HB3 H -2.163 -2.976 -2.549 1.00 . A A . 18 TYR HB3 1 1 18 9781 1 1 18 TYR HD1 H -0.871 0.047 -0.684 1.00 . A A . 18 TYR HD1 1 1 18 9782 1 1 18 TYR HD2 H -3.573 -3.321 -0.677 1.00 . A A . 18 TYR HD2 1 1 18 9783 1 1 18 TYR HE1 H -1.422 0.533 1.548 1.00 . A A . 18 TYR HE1 1 1 18 9784 1 1 18 TYR HE2 H -4.498 -2.542 1.488 1.00 . A A . 18 TYR HE2 1 1 18 9785 1 1 18 TYR HH H -4.452 -0.047 2.704 1.00 . A A . 18 TYR HH 1 1 18 9786 1 1 18 TYR N N 0.805 -1.526 -1.785 1.00 . A A . 18 TYR N 1 1 18 9787 1 1 18 TYR O O 0.736 -2.949 -4.211 1.00 . A A . 18 TYR O 1 1 18 9788 1 1 18 TYR OH O -3.577 -0.469 2.880 1.00 . A A . 18 TYR OH 1 1 18 9789 1 1 19 PHE C C -0.263 -6.780 -4.344 1.00 . A A . 19 PHE C 1 1 18 9790 1 1 19 PHE CA C 0.814 -5.780 -3.948 1.00 . A A . 19 PHE CA 1 1 18 9791 1 1 19 PHE CB C 1.983 -6.490 -3.271 1.00 . A A . 19 PHE CB 1 1 18 9792 1 1 19 PHE CD1 C 3.532 -7.084 -5.186 1.00 . A A . 19 PHE CD1 1 1 18 9793 1 1 19 PHE CD2 C 2.529 -8.886 -3.893 1.00 . A A . 19 PHE CD2 1 1 18 9794 1 1 19 PHE CE1 C 4.217 -8.029 -5.969 1.00 . A A . 19 PHE CE1 1 1 18 9795 1 1 19 PHE CE2 C 3.217 -9.832 -4.675 1.00 . A A . 19 PHE CE2 1 1 18 9796 1 1 19 PHE CG C 2.694 -7.510 -4.138 1.00 . A A . 19 PHE CG 1 1 18 9797 1 1 19 PHE CZ C 4.062 -9.403 -5.712 1.00 . A A . 19 PHE CZ 1 1 18 9798 1 1 19 PHE H H -0.076 -5.179 -2.133 1.00 . A A . 19 PHE H 1 1 18 9799 1 1 19 PHE HA H 1.182 -5.278 -4.843 1.00 . A A . 19 PHE HA 1 1 18 9800 1 1 19 PHE HB2 H 2.703 -5.739 -2.956 1.00 . A A . 19 PHE HB2 1 1 18 9801 1 1 19 PHE HB3 H 1.608 -6.980 -2.372 1.00 . A A . 19 PHE HB3 1 1 18 9802 1 1 19 PHE HD1 H 3.649 -6.031 -5.399 1.00 . A A . 19 PHE HD1 1 1 18 9803 1 1 19 PHE HD2 H 1.871 -9.220 -3.103 1.00 . A A . 19 PHE HD2 1 1 18 9804 1 1 19 PHE HE1 H 4.860 -7.698 -6.772 1.00 . A A . 19 PHE HE1 1 1 18 9805 1 1 19 PHE HE2 H 3.104 -10.889 -4.482 1.00 . A A . 19 PHE HE2 1 1 18 9806 1 1 19 PHE HZ H 4.586 -10.130 -6.319 1.00 . A A . 19 PHE HZ 1 1 18 9807 1 1 19 PHE N N 0.274 -4.804 -3.015 1.00 . A A . 19 PHE N 1 1 18 9808 1 1 19 PHE O O -0.900 -7.380 -3.475 1.00 . A A . 19 PHE O 1 1 18 9809 1 1 20 ASN C C -0.523 -9.324 -6.258 1.00 . A A . 20 ASN C 1 1 18 9810 1 1 20 ASN CA C -1.304 -8.011 -6.178 1.00 . A A . 20 ASN CA 1 1 18 9811 1 1 20 ASN CB C -1.888 -7.604 -7.532 1.00 . A A . 20 ASN CB 1 1 18 9812 1 1 20 ASN CG C -3.002 -8.566 -7.910 1.00 . A A . 20 ASN CG 1 1 18 9813 1 1 20 ASN H H 0.122 -6.452 -6.315 1.00 . A A . 20 ASN H 1 1 18 9814 1 1 20 ASN HA H -2.134 -8.153 -5.499 1.00 . A A . 20 ASN HA 1 1 18 9815 1 1 20 ASN HB2 H -2.278 -6.595 -7.474 1.00 . A A . 20 ASN HB2 1 1 18 9816 1 1 20 ASN HB3 H -1.114 -7.618 -8.294 1.00 . A A . 20 ASN HB3 1 1 18 9817 1 1 20 ASN HD21 H -4.425 -7.137 -7.709 1.00 . A A . 20 ASN HD21 1 1 18 9818 1 1 20 ASN HD22 H -5.004 -8.739 -8.080 1.00 . A A . 20 ASN HD22 1 1 18 9819 1 1 20 ASN N N -0.460 -6.958 -5.649 1.00 . A A . 20 ASN N 1 1 18 9820 1 1 20 ASN ND2 N -4.234 -8.104 -7.932 1.00 . A A . 20 ASN ND2 1 1 18 9821 1 1 20 ASN O O 0.225 -9.536 -7.211 1.00 . A A . 20 ASN O 1 1 18 9822 1 1 20 ASN OD1 O -2.775 -9.747 -8.116 1.00 . A A . 20 ASN OD1 1 1 18 9823 1 1 21 HIS C C -0.555 -12.543 -6.324 1.00 . A A . 21 HIS C 1 1 18 9824 1 1 21 HIS CA C 0.008 -11.517 -5.323 1.00 . A A . 21 HIS CA 1 1 18 9825 1 1 21 HIS CB C 0.248 -12.075 -3.911 1.00 . A A . 21 HIS CB 1 1 18 9826 1 1 21 HIS CD2 C -2.261 -12.185 -3.301 1.00 . A A . 21 HIS CD2 1 1 18 9827 1 1 21 HIS CE1 C -2.030 -12.775 -1.185 1.00 . A A . 21 HIS CE1 1 1 18 9828 1 1 21 HIS CG C -0.934 -12.337 -3.016 1.00 . A A . 21 HIS CG 1 1 18 9829 1 1 21 HIS H H -1.357 -10.025 -4.536 1.00 . A A . 21 HIS H 1 1 18 9830 1 1 21 HIS HA H 1.006 -11.313 -5.713 1.00 . A A . 21 HIS HA 1 1 18 9831 1 1 21 HIS HB2 H 0.816 -13.002 -3.992 1.00 . A A . 21 HIS HB2 1 1 18 9832 1 1 21 HIS HB3 H 0.886 -11.368 -3.382 1.00 . A A . 21 HIS HB3 1 1 18 9833 1 1 21 HIS HD2 H -2.696 -11.873 -4.240 1.00 . A A . 21 HIS HD2 1 1 18 9834 1 1 21 HIS HE1 H -2.265 -12.987 -0.150 1.00 . A A . 21 HIS HE1 1 1 18 9835 1 1 21 HIS HE2 H -3.920 -12.336 -1.939 1.00 . A A . 21 HIS HE2 1 1 18 9836 1 1 21 HIS N N -0.701 -10.226 -5.288 1.00 . A A . 21 HIS N 1 1 18 9837 1 1 21 HIS ND1 N -0.789 -12.709 -1.683 1.00 . A A . 21 HIS ND1 1 1 18 9838 1 1 21 HIS NE2 N -2.933 -12.450 -2.126 1.00 . A A . 21 HIS NE2 1 1 18 9839 1 1 21 HIS O O -0.071 -13.671 -6.361 1.00 . A A . 21 HIS O 1 1 18 9840 1 1 22 ILE C C -1.248 -12.566 -9.575 1.00 . A A . 22 ILE C 1 1 18 9841 1 1 22 ILE CA C -2.000 -12.976 -8.292 1.00 . A A . 22 ILE CA 1 1 18 9842 1 1 22 ILE CB C -3.538 -12.877 -8.480 1.00 . A A . 22 ILE CB 1 1 18 9843 1 1 22 ILE CD1 C -5.827 -12.907 -7.251 1.00 . A A . 22 ILE CD1 1 1 18 9844 1 1 22 ILE CG1 C -4.300 -13.024 -7.138 1.00 . A A . 22 ILE CG1 1 1 18 9845 1 1 22 ILE CG2 C -4.003 -13.942 -9.492 1.00 . A A . 22 ILE CG2 1 1 18 9846 1 1 22 ILE H H -1.905 -11.219 -7.107 1.00 . A A . 22 ILE H 1 1 18 9847 1 1 22 ILE HA H -1.761 -14.021 -8.093 1.00 . A A . 22 ILE HA 1 1 18 9848 1 1 22 ILE HB H -3.781 -11.901 -8.898 1.00 . A A . 22 ILE HB 1 1 18 9849 1 1 22 ILE HD11 H -6.091 -11.991 -7.781 1.00 . A A . 22 ILE HD11 1 1 18 9850 1 1 22 ILE HD12 H -6.239 -13.768 -7.777 1.00 . A A . 22 ILE HD12 1 1 18 9851 1 1 22 ILE HD13 H -6.260 -12.877 -6.251 1.00 . A A . 22 ILE HD13 1 1 18 9852 1 1 22 ILE HG12 H -4.054 -13.986 -6.684 1.00 . A A . 22 ILE HG12 1 1 18 9853 1 1 22 ILE HG13 H -3.980 -12.237 -6.455 1.00 . A A . 22 ILE HG13 1 1 18 9854 1 1 22 ILE HG21 H -3.460 -13.843 -10.431 1.00 . A A . 22 ILE HG21 1 1 18 9855 1 1 22 ILE HG22 H -3.834 -14.942 -9.089 1.00 . A A . 22 ILE HG22 1 1 18 9856 1 1 22 ILE HG23 H -5.062 -13.819 -9.718 1.00 . A A . 22 ILE HG23 1 1 18 9857 1 1 22 ILE N N -1.535 -12.164 -7.158 1.00 . A A . 22 ILE N 1 1 18 9858 1 1 22 ILE O O -0.864 -13.430 -10.358 1.00 . A A . 22 ILE O 1 1 18 9859 1 1 23 THR C C 1.079 -10.270 -10.827 1.00 . A A . 23 THR C 1 1 18 9860 1 1 23 THR CA C -0.373 -10.724 -11.008 1.00 . A A . 23 THR CA 1 1 18 9861 1 1 23 THR CB C -1.165 -9.541 -11.587 1.00 . A A . 23 THR CB 1 1 18 9862 1 1 23 THR CG2 C -2.643 -9.859 -11.825 1.00 . A A . 23 THR CG2 1 1 18 9863 1 1 23 THR H H -1.417 -10.587 -9.140 1.00 . A A . 23 THR H 1 1 18 9864 1 1 23 THR HA H -0.360 -11.503 -11.770 1.00 . A A . 23 THR HA 1 1 18 9865 1 1 23 THR HB H -0.720 -9.267 -12.545 1.00 . A A . 23 THR HB 1 1 18 9866 1 1 23 THR HG1 H -1.662 -7.749 -11.101 1.00 . A A . 23 THR HG1 1 1 18 9867 1 1 23 THR HG21 H -3.157 -10.019 -10.877 1.00 . A A . 23 THR HG21 1 1 18 9868 1 1 23 THR HG22 H -3.118 -9.031 -12.352 1.00 . A A . 23 THR HG22 1 1 18 9869 1 1 23 THR HG23 H -2.729 -10.758 -12.435 1.00 . A A . 23 THR HG23 1 1 18 9870 1 1 23 THR N N -1.010 -11.260 -9.787 1.00 . A A . 23 THR N 1 1 18 9871 1 1 23 THR O O 1.805 -10.198 -11.819 1.00 . A A . 23 THR O 1 1 18 9872 1 1 23 THR OG1 O -1.089 -8.424 -10.729 1.00 . A A . 23 THR OG1 1 1 18 9873 1 1 24 ASN C C 2.766 -7.816 -9.288 1.00 . A A . 24 ASN C 1 1 18 9874 1 1 24 ASN CA C 2.767 -9.356 -9.161 1.00 . A A . 24 ASN CA 1 1 18 9875 1 1 24 ASN CB C 4.017 -9.992 -9.806 1.00 . A A . 24 ASN CB 1 1 18 9876 1 1 24 ASN CG C 4.059 -11.508 -9.704 1.00 . A A . 24 ASN CG 1 1 18 9877 1 1 24 ASN H H 0.840 -10.089 -8.828 1.00 . A A . 24 ASN H 1 1 18 9878 1 1 24 ASN HA H 2.837 -9.549 -8.091 1.00 . A A . 24 ASN HA 1 1 18 9879 1 1 24 ASN HB2 H 4.087 -9.697 -10.852 1.00 . A A . 24 ASN HB2 1 1 18 9880 1 1 24 ASN HB3 H 4.905 -9.605 -9.304 1.00 . A A . 24 ASN HB3 1 1 18 9881 1 1 24 ASN HD21 H 3.056 -11.690 -11.439 1.00 . A A . 24 ASN HD21 1 1 18 9882 1 1 24 ASN HD22 H 3.546 -13.197 -10.634 1.00 . A A . 24 ASN HD22 1 1 18 9883 1 1 24 ASN N N 1.509 -9.989 -9.590 1.00 . A A . 24 ASN N 1 1 18 9884 1 1 24 ASN ND2 N 3.538 -12.195 -10.700 1.00 . A A . 24 ASN ND2 1 1 18 9885 1 1 24 ASN O O 3.808 -7.194 -9.087 1.00 . A A . 24 ASN O 1 1 18 9886 1 1 24 ASN OD1 O 4.562 -12.074 -8.746 1.00 . A A . 24 ASN OD1 1 1 18 9887 1 1 25 ALA C C 1.701 -5.041 -8.317 1.00 . A A . 25 ALA C 1 1 18 9888 1 1 25 ALA CA C 1.555 -5.718 -9.700 1.00 . A A . 25 ALA CA 1 1 18 9889 1 1 25 ALA CB C 0.235 -5.335 -10.377 1.00 . A A . 25 ALA CB 1 1 18 9890 1 1 25 ALA H H 0.787 -7.712 -9.800 1.00 . A A . 25 ALA H 1 1 18 9891 1 1 25 ALA HA H 2.372 -5.368 -10.332 1.00 . A A . 25 ALA HA 1 1 18 9892 1 1 25 ALA HB1 H 0.204 -4.257 -10.536 1.00 . A A . 25 ALA HB1 1 1 18 9893 1 1 25 ALA HB2 H 0.158 -5.831 -11.345 1.00 . A A . 25 ALA HB2 1 1 18 9894 1 1 25 ALA HB3 H -0.607 -5.630 -9.748 1.00 . A A . 25 ALA HB3 1 1 18 9895 1 1 25 ALA N N 1.633 -7.181 -9.626 1.00 . A A . 25 ALA N 1 1 18 9896 1 1 25 ALA O O 1.376 -5.631 -7.287 1.00 . A A . 25 ALA O 1 1 18 9897 1 1 26 SER C C 2.013 -1.545 -7.189 1.00 . A A . 26 SER C 1 1 18 9898 1 1 26 SER CA C 2.443 -3.013 -7.071 1.00 . A A . 26 SER CA 1 1 18 9899 1 1 26 SER CB C 3.946 -3.057 -6.777 1.00 . A A . 26 SER CB 1 1 18 9900 1 1 26 SER H H 2.404 -3.325 -9.161 1.00 . A A . 26 SER H 1 1 18 9901 1 1 26 SER HA H 1.921 -3.468 -6.233 1.00 . A A . 26 SER HA 1 1 18 9902 1 1 26 SER HB2 H 4.148 -2.513 -5.854 1.00 . A A . 26 SER HB2 1 1 18 9903 1 1 26 SER HB3 H 4.268 -4.089 -6.642 1.00 . A A . 26 SER HB3 1 1 18 9904 1 1 26 SER HG H 4.151 -1.689 -8.146 1.00 . A A . 26 SER HG 1 1 18 9905 1 1 26 SER N N 2.150 -3.778 -8.295 1.00 . A A . 26 SER N 1 1 18 9906 1 1 26 SER O O 2.351 -0.900 -8.180 1.00 . A A . 26 SER O 1 1 18 9907 1 1 26 SER OG O 4.660 -2.458 -7.844 1.00 . A A . 26 SER OG 1 1 18 9908 1 1 27 GLN C C 1.109 1.007 -4.781 1.00 . A A . 27 GLN C 1 1 18 9909 1 1 27 GLN CA C 0.746 0.323 -6.110 1.00 . A A . 27 GLN CA 1 1 18 9910 1 1 27 GLN CB C -0.780 0.187 -6.319 1.00 . A A . 27 GLN CB 1 1 18 9911 1 1 27 GLN CD C -1.368 2.687 -6.713 1.00 . A A . 27 GLN CD 1 1 18 9912 1 1 27 GLN CG C -1.653 1.398 -5.936 1.00 . A A . 27 GLN CG 1 1 18 9913 1 1 27 GLN H H 1.117 -1.621 -5.369 1.00 . A A . 27 GLN H 1 1 18 9914 1 1 27 GLN HA H 1.154 0.924 -6.925 1.00 . A A . 27 GLN HA 1 1 18 9915 1 1 27 GLN HB2 H -0.966 -0.060 -7.366 1.00 . A A . 27 GLN HB2 1 1 18 9916 1 1 27 GLN HB3 H -1.133 -0.651 -5.715 1.00 . A A . 27 GLN HB3 1 1 18 9917 1 1 27 GLN HE21 H -3.249 3.571 -6.400 1.00 . A A . 27 GLN HE21 1 1 18 9918 1 1 27 GLN HE22 H -2.061 4.381 -7.409 1.00 . A A . 27 GLN HE22 1 1 18 9919 1 1 27 GLN HG2 H -2.696 1.125 -6.101 1.00 . A A . 27 GLN HG2 1 1 18 9920 1 1 27 GLN HG3 H -1.536 1.584 -4.871 1.00 . A A . 27 GLN HG3 1 1 18 9921 1 1 27 GLN N N 1.332 -1.020 -6.164 1.00 . A A . 27 GLN N 1 1 18 9922 1 1 27 GLN NE2 N -2.335 3.571 -6.884 1.00 . A A . 27 GLN NE2 1 1 18 9923 1 1 27 GLN O O 0.819 0.471 -3.714 1.00 . A A . 27 GLN O 1 1 18 9924 1 1 27 GLN OE1 O -0.254 2.949 -7.142 1.00 . A A . 27 GLN OE1 1 1 18 9925 1 1 28 PHE C C 1.100 3.646 -2.860 1.00 . A A . 28 PHE C 1 1 18 9926 1 1 28 PHE CA C 2.206 2.903 -3.628 1.00 . A A . 28 PHE CA 1 1 18 9927 1 1 28 PHE CB C 3.346 3.858 -4.005 1.00 . A A . 28 PHE CB 1 1 18 9928 1 1 28 PHE CD1 C 5.362 2.571 -3.202 1.00 . A A . 28 PHE CD1 1 1 18 9929 1 1 28 PHE CD2 C 5.159 3.034 -5.585 1.00 . A A . 28 PHE CD2 1 1 18 9930 1 1 28 PHE CE1 C 6.576 1.906 -3.433 1.00 . A A . 28 PHE CE1 1 1 18 9931 1 1 28 PHE CE2 C 6.376 2.369 -5.815 1.00 . A A . 28 PHE CE2 1 1 18 9932 1 1 28 PHE CG C 4.652 3.141 -4.276 1.00 . A A . 28 PHE CG 1 1 18 9933 1 1 28 PHE CZ C 7.087 1.808 -4.739 1.00 . A A . 28 PHE CZ 1 1 18 9934 1 1 28 PHE H H 1.927 2.605 -5.732 1.00 . A A . 28 PHE H 1 1 18 9935 1 1 28 PHE HA H 2.605 2.173 -2.926 1.00 . A A . 28 PHE HA 1 1 18 9936 1 1 28 PHE HB2 H 3.057 4.453 -4.872 1.00 . A A . 28 PHE HB2 1 1 18 9937 1 1 28 PHE HB3 H 3.521 4.547 -3.176 1.00 . A A . 28 PHE HB3 1 1 18 9938 1 1 28 PHE HD1 H 4.969 2.638 -2.196 1.00 . A A . 28 PHE HD1 1 1 18 9939 1 1 28 PHE HD2 H 4.618 3.466 -6.415 1.00 . A A . 28 PHE HD2 1 1 18 9940 1 1 28 PHE HE1 H 7.112 1.468 -2.604 1.00 . A A . 28 PHE HE1 1 1 18 9941 1 1 28 PHE HE2 H 6.767 2.294 -6.819 1.00 . A A . 28 PHE HE2 1 1 18 9942 1 1 28 PHE HZ H 8.026 1.302 -4.915 1.00 . A A . 28 PHE HZ 1 1 18 9943 1 1 28 PHE N N 1.745 2.184 -4.830 1.00 . A A . 28 PHE N 1 1 18 9944 1 1 28 PHE O O 1.313 4.045 -1.716 1.00 . A A . 28 PHE O 1 1 18 9945 1 1 29 GLU C C -1.631 3.381 -1.593 1.00 . A A . 29 GLU C 1 1 18 9946 1 1 29 GLU CA C -1.275 4.312 -2.763 1.00 . A A . 29 GLU CA 1 1 18 9947 1 1 29 GLU CB C -2.420 4.347 -3.782 1.00 . A A . 29 GLU CB 1 1 18 9948 1 1 29 GLU CD C -4.902 4.505 -4.303 1.00 . A A . 29 GLU CD 1 1 18 9949 1 1 29 GLU CG C -3.794 4.806 -3.281 1.00 . A A . 29 GLU CG 1 1 18 9950 1 1 29 GLU H H -0.188 3.482 -4.401 1.00 . A A . 29 GLU H 1 1 18 9951 1 1 29 GLU HA H -1.088 5.319 -2.388 1.00 . A A . 29 GLU HA 1 1 18 9952 1 1 29 GLU HB2 H -2.124 4.996 -4.607 1.00 . A A . 29 GLU HB2 1 1 18 9953 1 1 29 GLU HB3 H -2.548 3.335 -4.150 1.00 . A A . 29 GLU HB3 1 1 18 9954 1 1 29 GLU HG2 H -4.039 4.286 -2.355 1.00 . A A . 29 GLU HG2 1 1 18 9955 1 1 29 GLU HG3 H -3.758 5.878 -3.075 1.00 . A A . 29 GLU HG3 1 1 18 9956 1 1 29 GLU N N -0.081 3.821 -3.458 1.00 . A A . 29 GLU N 1 1 18 9957 1 1 29 GLU O O -1.541 2.160 -1.722 1.00 . A A . 29 GLU O 1 1 18 9958 1 1 29 GLU OE1 O -4.617 4.131 -5.474 1.00 . A A . 29 GLU OE1 1 1 18 9959 1 1 29 GLU OE2 O -6.090 4.637 -3.932 1.00 . A A . 29 GLU OE2 1 1 18 9960 1 1 30 ARG C C -4.081 3.384 0.898 1.00 . A A . 30 ARG C 1 1 18 9961 1 1 30 ARG CA C -2.564 3.218 0.704 1.00 . A A . 30 ARG CA 1 1 18 9962 1 1 30 ARG CB C -1.723 3.633 1.928 1.00 . A A . 30 ARG CB 1 1 18 9963 1 1 30 ARG CD C -1.224 3.302 4.392 1.00 . A A . 30 ARG CD 1 1 18 9964 1 1 30 ARG CG C -2.158 2.945 3.233 1.00 . A A . 30 ARG CG 1 1 18 9965 1 1 30 ARG CZ C -1.237 2.885 6.864 1.00 . A A . 30 ARG CZ 1 1 18 9966 1 1 30 ARG H H -2.140 4.956 -0.427 1.00 . A A . 30 ARG H 1 1 18 9967 1 1 30 ARG HA H -2.381 2.164 0.538 1.00 . A A . 30 ARG HA 1 1 18 9968 1 1 30 ARG HB2 H -0.682 3.373 1.724 1.00 . A A . 30 ARG HB2 1 1 18 9969 1 1 30 ARG HB3 H -1.789 4.714 2.060 1.00 . A A . 30 ARG HB3 1 1 18 9970 1 1 30 ARG HD2 H -0.210 2.979 4.147 1.00 . A A . 30 ARG HD2 1 1 18 9971 1 1 30 ARG HD3 H -1.233 4.386 4.526 1.00 . A A . 30 ARG HD3 1 1 18 9972 1 1 30 ARG HE H -2.397 1.956 5.533 1.00 . A A . 30 ARG HE 1 1 18 9973 1 1 30 ARG HG2 H -3.168 3.257 3.500 1.00 . A A . 30 ARG HG2 1 1 18 9974 1 1 30 ARG HG3 H -2.155 1.867 3.103 1.00 . A A . 30 ARG HG3 1 1 18 9975 1 1 30 ARG HH11 H 0.126 4.231 6.320 1.00 . A A . 30 ARG HH11 1 1 18 9976 1 1 30 ARG HH12 H 0.040 3.938 8.037 1.00 . A A . 30 ARG HH12 1 1 18 9977 1 1 30 ARG HH21 H -2.507 1.589 7.745 1.00 . A A . 30 ARG HH21 1 1 18 9978 1 1 30 ARG HH22 H -1.451 2.452 8.819 1.00 . A A . 30 ARG HH22 1 1 18 9979 1 1 30 ARG N N -2.100 3.953 -0.475 1.00 . A A . 30 ARG N 1 1 18 9980 1 1 30 ARG NE N -1.666 2.641 5.633 1.00 . A A . 30 ARG NE 1 1 18 9981 1 1 30 ARG NH1 N -0.280 3.753 7.104 1.00 . A A . 30 ARG NH1 1 1 18 9982 1 1 30 ARG NH2 N -1.764 2.252 7.886 1.00 . A A . 30 ARG NH2 1 1 18 9983 1 1 30 ARG O O -4.503 4.308 1.592 1.00 . A A . 30 ARG O 1 1 18 9984 1 1 31 PRO C C -6.607 1.569 1.841 1.00 . A A . 31 PRO C 1 1 18 9985 1 1 31 PRO CA C -6.335 2.434 0.593 1.00 . A A . 31 PRO CA 1 1 18 9986 1 1 31 PRO CB C -6.934 1.812 -0.672 1.00 . A A . 31 PRO CB 1 1 18 9987 1 1 31 PRO CD C -4.552 1.448 -0.640 1.00 . A A . 31 PRO CD 1 1 18 9988 1 1 31 PRO CG C -5.863 0.810 -1.097 1.00 . A A . 31 PRO CG 1 1 18 9989 1 1 31 PRO HA H -6.751 3.431 0.743 1.00 . A A . 31 PRO HA 1 1 18 9990 1 1 31 PRO HB2 H -7.893 1.328 -0.488 1.00 . A A . 31 PRO HB2 1 1 18 9991 1 1 31 PRO HB3 H -7.039 2.580 -1.441 1.00 . A A . 31 PRO HB3 1 1 18 9992 1 1 31 PRO HD2 H -3.954 0.690 -0.151 1.00 . A A . 31 PRO HD2 1 1 18 9993 1 1 31 PRO HD3 H -3.992 1.846 -1.483 1.00 . A A . 31 PRO HD3 1 1 18 9994 1 1 31 PRO HG2 H -6.011 -0.124 -0.555 1.00 . A A . 31 PRO HG2 1 1 18 9995 1 1 31 PRO HG3 H -5.875 0.637 -2.174 1.00 . A A . 31 PRO HG3 1 1 18 9996 1 1 31 PRO N N -4.908 2.500 0.307 1.00 . A A . 31 PRO N 1 1 18 9997 1 1 31 PRO O O -5.754 0.794 2.292 1.00 . A A . 31 PRO O 1 1 18 9998 1 1 32 SER C C -9.361 -0.231 2.978 1.00 . A A . 32 SER C 1 1 18 9999 1 1 32 SER CA C -8.370 0.846 3.454 1.00 . A A . 32 SER CA 1 1 18 10000 1 1 32 SER CB C -9.056 1.765 4.471 1.00 . A A . 32 SER CB 1 1 18 10001 1 1 32 SER H H -8.476 2.376 2.027 1.00 . A A . 32 SER H 1 1 18 10002 1 1 32 SER HA H -7.554 0.331 3.962 1.00 . A A . 32 SER HA 1 1 18 10003 1 1 32 SER HB2 H -9.548 1.164 5.237 1.00 . A A . 32 SER HB2 1 1 18 10004 1 1 32 SER HB3 H -8.305 2.398 4.945 1.00 . A A . 32 SER HB3 1 1 18 10005 1 1 32 SER HG H -10.495 3.085 4.479 1.00 . A A . 32 SER HG 1 1 18 10006 1 1 32 SER N N -7.832 1.672 2.364 1.00 . A A . 32 SER N 1 1 18 10007 1 1 32 SER O O -9.782 -1.063 3.780 1.00 . A A . 32 SER O 1 1 18 10008 1 1 32 SER OG O -10.007 2.587 3.817 1.00 . A A . 32 SER OG 1 1 18 10009 1 1 33 GLY C C -11.091 -0.502 -0.320 1.00 . A A . 33 GLY C 1 1 18 10010 1 1 33 GLY CA C -10.717 -1.075 1.040 1.00 . A A . 33 GLY CA 1 1 18 10011 1 1 33 GLY H H -9.355 0.489 1.067 1.00 . A A . 33 GLY H 1 1 18 10012 1 1 33 GLY HA2 H -10.314 -2.076 0.896 1.00 . A A . 33 GLY HA2 1 1 18 10013 1 1 33 GLY HA3 H -11.618 -1.133 1.648 1.00 . A A . 33 GLY HA3 1 1 18 10014 1 1 33 GLY N N -9.723 -0.219 1.689 1.00 . A A . 33 GLY N 1 1 18 10015 1 1 33 GLY O O -10.344 0.359 -0.840 1.00 . A A . 33 GLY O 1 1 18 10016 1 1 33 GLY OXT O -12.122 -0.903 -0.892 1.00 . A A . 33 GLY OXT 1 1 18 10017 2 2 1 NAG C1 C 12.446 0.872 -1.290 1.00 . B A . 101 NAG C1 1 1 18 10018 2 2 1 NAG C2 C 12.080 2.055 -2.216 1.00 . B A . 101 NAG C2 1 1 18 10019 2 2 1 NAG C3 C 11.052 1.489 -3.212 1.00 . B A . 101 NAG C3 1 1 18 10020 2 2 1 NAG C4 C 11.746 0.426 -4.054 1.00 . B A . 101 NAG C4 1 1 18 10021 2 2 1 NAG C5 C 12.260 -0.721 -3.180 1.00 . B A . 101 NAG C5 1 1 18 10022 2 2 1 NAG C6 C 13.064 -1.779 -3.936 1.00 . B A . 101 NAG C6 1 1 18 10023 2 2 1 NAG C7 C 11.426 4.418 -1.990 1.00 . B A . 101 NAG C7 1 1 18 10024 2 2 1 NAG C8 C 10.956 5.525 -1.036 1.00 . B A . 101 NAG C8 1 1 18 10025 2 2 1 NAG H1 H 11.534 0.455 -0.863 1.00 . B A . 101 NAG H1 1 1 18 10026 2 2 1 NAG H2 H 12.968 2.388 -2.756 1.00 . B A . 101 NAG H2 1 1 18 10027 2 2 1 NAG H3 H 10.216 1.037 -2.667 1.00 . B A . 101 NAG H3 1 1 18 10028 2 2 1 NAG H4 H 12.558 0.892 -4.605 1.00 . B A . 101 NAG H4 1 1 18 10029 2 2 1 NAG H5 H 11.402 -1.202 -2.731 1.00 . B A . 101 NAG H5 1 1 18 10030 2 2 1 NAG H61 H 13.173 -2.666 -3.314 1.00 . B A . 101 NAG H61 1 1 18 10031 2 2 1 NAG H62 H 12.568 -2.069 -4.862 1.00 . B A . 101 NAG H62 1 1 18 10032 2 2 1 NAG H81 H 9.887 5.416 -0.851 1.00 . B A . 101 NAG H81 1 1 18 10033 2 2 1 NAG H82 H 11.145 6.502 -1.483 1.00 . B A . 101 NAG H82 1 1 18 10034 2 2 1 NAG H83 H 11.495 5.455 -0.091 1.00 . B A . 101 NAG H83 1 1 18 10035 2 2 1 NAG HN2 H 11.215 3.031 -0.524 1.00 . B A . 101 NAG HN2 1 1 18 10036 2 2 1 NAG HO3 H 10.935 3.378 -3.881 1.00 . B A . 101 NAG HO3 1 1 18 10037 2 2 1 NAG HO4 H 10.309 0.739 -5.281 1.00 . B A . 101 NAG HO4 1 1 18 10038 2 2 1 NAG HO6 H 14.683 -0.838 -3.395 1.00 . B A . 101 NAG HO6 1 1 18 10039 2 2 1 NAG N2 N 11.551 3.198 -1.469 1.00 . B A . 101 NAG N2 1 1 18 10040 2 2 1 NAG O3 O 10.558 2.498 -4.131 1.00 . B A . 101 NAG O3 1 1 18 10041 2 2 1 NAG O4 O 10.759 -0.059 -4.970 1.00 . B A . 101 NAG O4 1 1 18 10042 2 2 1 NAG O5 O 13.107 -0.168 -2.088 1.00 . B A . 101 NAG O5 1 1 18 10043 2 2 1 NAG O6 O 14.364 -1.239 -4.211 1.00 . B A . 101 NAG O6 1 1 18 10044 2 2 1 NAG O7 O 11.649 4.623 -3.181 1.00 . B A . 101 NAG O7 1 1 19 10045 1 1 1 LYS C C -8.261 1.159 -4.013 1.00 . A A . 1 LYS C 1 1 19 10046 1 1 1 LYS CA C -8.279 2.346 -3.065 1.00 . A A . 1 LYS CA 1 1 19 10047 1 1 1 LYS CB C -9.423 3.339 -3.347 1.00 . A A . 1 LYS CB 1 1 19 10048 1 1 1 LYS CD C -9.139 4.620 -1.105 1.00 . A A . 1 LYS CD 1 1 19 10049 1 1 1 LYS CE C -8.384 5.820 -0.514 1.00 . A A . 1 LYS CE 1 1 19 10050 1 1 1 LYS CG C -9.253 4.700 -2.638 1.00 . A A . 1 LYS CG 1 1 19 10051 1 1 1 LYS H1 H -6.289 2.507 -2.619 1.00 . A A . 1 LYS H1 1 1 19 10052 1 1 1 LYS H2 H -6.948 3.960 -2.996 1.00 . A A . 1 LYS H2 1 1 19 10053 1 1 1 LYS H3 H -6.660 2.883 -4.198 1.00 . A A . 1 LYS H3 1 1 19 10054 1 1 1 LYS HA H -8.373 1.984 -2.041 1.00 . A A . 1 LYS HA 1 1 19 10055 1 1 1 LYS HB2 H -9.482 3.524 -4.421 1.00 . A A . 1 LYS HB2 1 1 19 10056 1 1 1 LYS HB3 H -10.365 2.886 -3.030 1.00 . A A . 1 LYS HB3 1 1 19 10057 1 1 1 LYS HD2 H -10.148 4.594 -0.689 1.00 . A A . 1 LYS HD2 1 1 19 10058 1 1 1 LYS HD3 H -8.635 3.706 -0.793 1.00 . A A . 1 LYS HD3 1 1 19 10059 1 1 1 LYS HE2 H -8.642 6.729 -1.061 1.00 . A A . 1 LYS HE2 1 1 19 10060 1 1 1 LYS HE3 H -8.704 5.942 0.524 1.00 . A A . 1 LYS HE3 1 1 19 10061 1 1 1 LYS HG2 H -8.375 5.199 -3.046 1.00 . A A . 1 LYS HG2 1 1 19 10062 1 1 1 LYS HG3 H -10.109 5.329 -2.887 1.00 . A A . 1 LYS HG3 1 1 19 10063 1 1 1 LYS HZ1 H -6.491 5.599 -1.456 1.00 . A A . 1 LYS HZ1 1 1 19 10064 1 1 1 LYS HZ2 H -6.418 6.278 0.066 1.00 . A A . 1 LYS HZ2 1 1 19 10065 1 1 1 LYS HZ3 H -6.686 4.717 -0.063 1.00 . A A . 1 LYS HZ3 1 1 19 10066 1 1 1 LYS N N -6.952 2.971 -3.233 1.00 . A A . 1 LYS N 1 1 19 10067 1 1 1 LYS NZ N -6.918 5.601 -0.522 1.00 . A A . 1 LYS NZ 1 1 19 10068 1 1 1 LYS O O -7.933 1.380 -5.176 1.00 . A A . 1 LYS O 1 1 19 10069 1 1 2 LEU C C -9.164 -2.458 -4.077 1.00 . A A . 2 LEU C 1 1 19 10070 1 1 2 LEU CA C -8.236 -1.260 -4.378 1.00 . A A . 2 LEU CA 1 1 19 10071 1 1 2 LEU CB C -6.732 -1.611 -4.291 1.00 . A A . 2 LEU CB 1 1 19 10072 1 1 2 LEU CD1 C -6.660 -3.274 -2.343 1.00 . A A . 2 LEU CD1 1 1 19 10073 1 1 2 LEU CD2 C -4.617 -2.004 -3.056 1.00 . A A . 2 LEU CD2 1 1 19 10074 1 1 2 LEU CG C -6.132 -1.956 -2.907 1.00 . A A . 2 LEU CG 1 1 19 10075 1 1 2 LEU H H -8.796 -0.245 -2.595 1.00 . A A . 2 LEU H 1 1 19 10076 1 1 2 LEU HA H -8.435 -0.969 -5.410 1.00 . A A . 2 LEU HA 1 1 19 10077 1 1 2 LEU HB2 H -6.525 -2.443 -4.963 1.00 . A A . 2 LEU HB2 1 1 19 10078 1 1 2 LEU HB3 H -6.182 -0.757 -4.690 1.00 . A A . 2 LEU HB3 1 1 19 10079 1 1 2 LEU HD11 H -6.923 -3.951 -3.150 1.00 . A A . 2 LEU HD11 1 1 19 10080 1 1 2 LEU HD12 H -5.917 -3.748 -1.703 1.00 . A A . 2 LEU HD12 1 1 19 10081 1 1 2 LEU HD13 H -7.556 -3.086 -1.754 1.00 . A A . 2 LEU HD13 1 1 19 10082 1 1 2 LEU HD21 H -4.237 -1.031 -3.367 1.00 . A A . 2 LEU HD21 1 1 19 10083 1 1 2 LEU HD22 H -4.186 -2.238 -2.090 1.00 . A A . 2 LEU HD22 1 1 19 10084 1 1 2 LEU HD23 H -4.326 -2.751 -3.789 1.00 . A A . 2 LEU HD23 1 1 19 10085 1 1 2 LEU HG H -6.324 -1.183 -2.168 1.00 . A A . 2 LEU HG 1 1 19 10086 1 1 2 LEU N N -8.472 -0.076 -3.538 1.00 . A A . 2 LEU N 1 1 19 10087 1 1 2 LEU O O -9.701 -2.536 -2.970 1.00 . A A . 2 LEU O 1 1 19 10088 1 1 3 PRO C C -9.441 -5.817 -4.368 1.00 . A A . 3 PRO C 1 1 19 10089 1 1 3 PRO CA C -10.200 -4.574 -4.896 1.00 . A A . 3 PRO CA 1 1 19 10090 1 1 3 PRO CB C -10.704 -4.843 -6.321 1.00 . A A . 3 PRO CB 1 1 19 10091 1 1 3 PRO CD C -8.932 -3.258 -6.438 1.00 . A A . 3 PRO CD 1 1 19 10092 1 1 3 PRO CG C -9.497 -4.469 -7.178 1.00 . A A . 3 PRO CG 1 1 19 10093 1 1 3 PRO HA H -11.044 -4.352 -4.245 1.00 . A A . 3 PRO HA 1 1 19 10094 1 1 3 PRO HB2 H -10.998 -5.880 -6.482 1.00 . A A . 3 PRO HB2 1 1 19 10095 1 1 3 PRO HB3 H -11.535 -4.174 -6.547 1.00 . A A . 3 PRO HB3 1 1 19 10096 1 1 3 PRO HD2 H -7.847 -3.245 -6.525 1.00 . A A . 3 PRO HD2 1 1 19 10097 1 1 3 PRO HD3 H -9.355 -2.350 -6.870 1.00 . A A . 3 PRO HD3 1 1 19 10098 1 1 3 PRO HG2 H -8.770 -5.283 -7.171 1.00 . A A . 3 PRO HG2 1 1 19 10099 1 1 3 PRO HG3 H -9.787 -4.221 -8.199 1.00 . A A . 3 PRO HG3 1 1 19 10100 1 1 3 PRO N N -9.362 -3.381 -5.046 1.00 . A A . 3 PRO N 1 1 19 10101 1 1 3 PRO O O -8.205 -5.850 -4.368 1.00 . A A . 3 PRO O 1 1 19 10102 1 1 4 PRO C C -8.682 -8.715 -4.788 1.00 . A A . 4 PRO C 1 1 19 10103 1 1 4 PRO CA C -9.599 -8.196 -3.668 1.00 . A A . 4 PRO CA 1 1 19 10104 1 1 4 PRO CB C -10.791 -9.133 -3.451 1.00 . A A . 4 PRO CB 1 1 19 10105 1 1 4 PRO CD C -11.616 -6.919 -3.787 1.00 . A A . 4 PRO CD 1 1 19 10106 1 1 4 PRO CG C -11.900 -8.190 -2.990 1.00 . A A . 4 PRO CG 1 1 19 10107 1 1 4 PRO HA H -9.034 -8.111 -2.739 1.00 . A A . 4 PRO HA 1 1 19 10108 1 1 4 PRO HB2 H -11.086 -9.596 -4.395 1.00 . A A . 4 PRO HB2 1 1 19 10109 1 1 4 PRO HB3 H -10.575 -9.897 -2.703 1.00 . A A . 4 PRO HB3 1 1 19 10110 1 1 4 PRO HD2 H -12.112 -6.979 -4.756 1.00 . A A . 4 PRO HD2 1 1 19 10111 1 1 4 PRO HD3 H -11.970 -6.050 -3.231 1.00 . A A . 4 PRO HD3 1 1 19 10112 1 1 4 PRO HG2 H -12.892 -8.591 -3.206 1.00 . A A . 4 PRO HG2 1 1 19 10113 1 1 4 PRO HG3 H -11.789 -7.986 -1.924 1.00 . A A . 4 PRO HG3 1 1 19 10114 1 1 4 PRO N N -10.172 -6.886 -3.978 1.00 . A A . 4 PRO N 1 1 19 10115 1 1 4 PRO O O -8.968 -8.541 -5.971 1.00 . A A . 4 PRO O 1 1 19 10116 1 1 5 GLY C C -5.174 -8.993 -5.003 1.00 . A A . 5 GLY C 1 1 19 10117 1 1 5 GLY CA C -6.475 -9.741 -5.302 1.00 . A A . 5 GLY CA 1 1 19 10118 1 1 5 GLY H H -7.401 -9.460 -3.412 1.00 . A A . 5 GLY H 1 1 19 10119 1 1 5 GLY HA2 H -6.294 -10.809 -5.193 1.00 . A A . 5 GLY HA2 1 1 19 10120 1 1 5 GLY HA3 H -6.749 -9.540 -6.339 1.00 . A A . 5 GLY HA3 1 1 19 10121 1 1 5 GLY N N -7.563 -9.337 -4.401 1.00 . A A . 5 GLY N 1 1 19 10122 1 1 5 GLY O O -4.092 -9.492 -5.303 1.00 . A A . 5 GLY O 1 1 19 10123 1 1 6 TRP C C -3.959 -7.379 -2.392 1.00 . A A . 6 TRP C 1 1 19 10124 1 1 6 TRP CA C -4.157 -7.039 -3.877 1.00 . A A . 6 TRP CA 1 1 19 10125 1 1 6 TRP CB C -4.434 -5.552 -4.058 1.00 . A A . 6 TRP CB 1 1 19 10126 1 1 6 TRP CD1 C -5.551 -5.151 -6.306 1.00 . A A . 6 TRP CD1 1 1 19 10127 1 1 6 TRP CD2 C -3.479 -4.295 -6.208 1.00 . A A . 6 TRP CD2 1 1 19 10128 1 1 6 TRP CE2 C -3.998 -3.981 -7.499 1.00 . A A . 6 TRP CE2 1 1 19 10129 1 1 6 TRP CE3 C -2.170 -3.856 -5.919 1.00 . A A . 6 TRP CE3 1 1 19 10130 1 1 6 TRP CG C -4.494 -5.042 -5.469 1.00 . A A . 6 TRP CG 1 1 19 10131 1 1 6 TRP CH2 C -1.950 -2.859 -8.138 1.00 . A A . 6 TRP CH2 1 1 19 10132 1 1 6 TRP CZ2 C -3.256 -3.271 -8.456 1.00 . A A . 6 TRP CZ2 1 1 19 10133 1 1 6 TRP CZ3 C -1.412 -3.153 -6.873 1.00 . A A . 6 TRP CZ3 1 1 19 10134 1 1 6 TRP H H -6.189 -7.383 -4.250 1.00 . A A . 6 TRP H 1 1 19 10135 1 1 6 TRP HA H -3.243 -7.288 -4.400 1.00 . A A . 6 TRP HA 1 1 19 10136 1 1 6 TRP HB2 H -5.380 -5.339 -3.573 1.00 . A A . 6 TRP HB2 1 1 19 10137 1 1 6 TRP HB3 H -3.663 -5.003 -3.527 1.00 . A A . 6 TRP HB3 1 1 19 10138 1 1 6 TRP HD1 H -6.488 -5.632 -6.052 1.00 . A A . 6 TRP HD1 1 1 19 10139 1 1 6 TRP HE1 H -5.922 -4.444 -8.269 1.00 . A A . 6 TRP HE1 1 1 19 10140 1 1 6 TRP HE3 H -1.742 -4.077 -4.955 1.00 . A A . 6 TRP HE3 1 1 19 10141 1 1 6 TRP HH2 H -1.356 -2.320 -8.863 1.00 . A A . 6 TRP HH2 1 1 19 10142 1 1 6 TRP HZ2 H -3.677 -3.052 -9.425 1.00 . A A . 6 TRP HZ2 1 1 19 10143 1 1 6 TRP HZ3 H -0.404 -2.847 -6.631 1.00 . A A . 6 TRP HZ3 1 1 19 10144 1 1 6 TRP N N -5.278 -7.789 -4.431 1.00 . A A . 6 TRP N 1 1 19 10145 1 1 6 TRP NE1 N -5.263 -4.531 -7.507 1.00 . A A . 6 TRP NE1 1 1 19 10146 1 1 6 TRP O O -4.933 -7.572 -1.664 1.00 . A A . 6 TRP O 1 1 19 10147 1 1 7 GLU C C -1.216 -6.857 -0.010 1.00 . A A . 7 GLU C 1 1 19 10148 1 1 7 GLU CA C -2.333 -7.770 -0.561 1.00 . A A . 7 GLU CA 1 1 19 10149 1 1 7 GLU CB C -1.925 -9.257 -0.585 1.00 . A A . 7 GLU CB 1 1 19 10150 1 1 7 GLU CD C -2.002 -9.724 1.889 1.00 . A A . 7 GLU CD 1 1 19 10151 1 1 7 GLU CG C -2.579 -10.085 0.525 1.00 . A A . 7 GLU CG 1 1 19 10152 1 1 7 GLU H H -1.936 -7.330 -2.593 1.00 . A A . 7 GLU H 1 1 19 10153 1 1 7 GLU HA H -3.206 -7.654 0.083 1.00 . A A . 7 GLU HA 1 1 19 10154 1 1 7 GLU HB2 H -2.224 -9.707 -1.532 1.00 . A A . 7 GLU HB2 1 1 19 10155 1 1 7 GLU HB3 H -0.842 -9.339 -0.522 1.00 . A A . 7 GLU HB3 1 1 19 10156 1 1 7 GLU HG2 H -3.658 -9.925 0.517 1.00 . A A . 7 GLU HG2 1 1 19 10157 1 1 7 GLU HG3 H -2.393 -11.143 0.325 1.00 . A A . 7 GLU HG3 1 1 19 10158 1 1 7 GLU N N -2.705 -7.394 -1.930 1.00 . A A . 7 GLU N 1 1 19 10159 1 1 7 GLU O O -0.407 -6.335 -0.773 1.00 . A A . 7 GLU O 1 1 19 10160 1 1 7 GLU OE1 O -1.000 -10.369 2.274 1.00 . A A . 7 GLU OE1 1 1 19 10161 1 1 7 GLU OE2 O -2.498 -8.747 2.501 1.00 . A A . 7 GLU OE2 1 1 19 10162 1 1 8 LYS C C 1.167 -6.058 2.055 1.00 . A A . 8 LYS C 1 1 19 10163 1 1 8 LYS CA C -0.312 -5.640 1.977 1.00 . A A . 8 LYS CA 1 1 19 10164 1 1 8 LYS CB C -0.895 -5.333 3.370 1.00 . A A . 8 LYS CB 1 1 19 10165 1 1 8 LYS CD C -1.572 -6.324 5.646 1.00 . A A . 8 LYS CD 1 1 19 10166 1 1 8 LYS CE C -3.045 -6.655 5.357 1.00 . A A . 8 LYS CE 1 1 19 10167 1 1 8 LYS CG C -0.656 -6.438 4.417 1.00 . A A . 8 LYS CG 1 1 19 10168 1 1 8 LYS H H -1.777 -7.221 1.897 1.00 . A A . 8 LYS H 1 1 19 10169 1 1 8 LYS HA H -0.361 -4.722 1.386 1.00 . A A . 8 LYS HA 1 1 19 10170 1 1 8 LYS HB2 H -0.454 -4.406 3.740 1.00 . A A . 8 LYS HB2 1 1 19 10171 1 1 8 LYS HB3 H -1.966 -5.164 3.257 1.00 . A A . 8 LYS HB3 1 1 19 10172 1 1 8 LYS HD2 H -1.204 -7.001 6.418 1.00 . A A . 8 LYS HD2 1 1 19 10173 1 1 8 LYS HD3 H -1.509 -5.308 6.038 1.00 . A A . 8 LYS HD3 1 1 19 10174 1 1 8 LYS HE2 H -3.621 -6.459 6.265 1.00 . A A . 8 LYS HE2 1 1 19 10175 1 1 8 LYS HE3 H -3.416 -5.989 4.574 1.00 . A A . 8 LYS HE3 1 1 19 10176 1 1 8 LYS HG2 H -0.788 -7.421 3.966 1.00 . A A . 8 LYS HG2 1 1 19 10177 1 1 8 LYS HG3 H 0.377 -6.369 4.760 1.00 . A A . 8 LYS HG3 1 1 19 10178 1 1 8 LYS HZ1 H -4.216 -8.293 4.855 1.00 . A A . 8 LYS HZ1 1 1 19 10179 1 1 8 LYS HZ2 H -2.818 -8.248 4.025 1.00 . A A . 8 LYS HZ2 1 1 19 10180 1 1 8 LYS HZ3 H -2.801 -8.704 5.601 1.00 . A A . 8 LYS HZ3 1 1 19 10181 1 1 8 LYS N N -1.169 -6.642 1.312 1.00 . A A . 8 LYS N 1 1 19 10182 1 1 8 LYS NZ N -3.236 -8.069 4.949 1.00 . A A . 8 LYS NZ 1 1 19 10183 1 1 8 LYS O O 1.473 -7.200 2.399 1.00 . A A . 8 LYS O 1 1 19 10184 1 1 9 ARG C C 4.358 -4.211 2.328 1.00 . A A . 9 ARG C 1 1 19 10185 1 1 9 ARG CA C 3.558 -5.403 1.787 1.00 . A A . 9 ARG CA 1 1 19 10186 1 1 9 ARG CB C 4.038 -5.684 0.351 1.00 . A A . 9 ARG CB 1 1 19 10187 1 1 9 ARG CD C 3.661 -8.206 0.239 1.00 . A A . 9 ARG CD 1 1 19 10188 1 1 9 ARG CG C 3.429 -6.850 -0.436 1.00 . A A . 9 ARG CG 1 1 19 10189 1 1 9 ARG CZ C 1.861 -9.971 0.224 1.00 . A A . 9 ARG CZ 1 1 19 10190 1 1 9 ARG H H 1.817 -4.206 1.493 1.00 . A A . 9 ARG H 1 1 19 10191 1 1 9 ARG HA H 3.782 -6.257 2.428 1.00 . A A . 9 ARG HA 1 1 19 10192 1 1 9 ARG HB2 H 3.834 -4.776 -0.211 1.00 . A A . 9 ARG HB2 1 1 19 10193 1 1 9 ARG HB3 H 5.115 -5.846 0.363 1.00 . A A . 9 ARG HB3 1 1 19 10194 1 1 9 ARG HD2 H 4.717 -8.462 0.140 1.00 . A A . 9 ARG HD2 1 1 19 10195 1 1 9 ARG HD3 H 3.461 -8.108 1.298 1.00 . A A . 9 ARG HD3 1 1 19 10196 1 1 9 ARG HE H 3.116 -9.592 -1.277 1.00 . A A . 9 ARG HE 1 1 19 10197 1 1 9 ARG HG2 H 2.376 -6.640 -0.608 1.00 . A A . 9 ARG HG2 1 1 19 10198 1 1 9 ARG HG3 H 3.918 -6.891 -1.407 1.00 . A A . 9 ARG HG3 1 1 19 10199 1 1 9 ARG HH11 H 1.649 -8.781 1.830 1.00 . A A . 9 ARG HH11 1 1 19 10200 1 1 9 ARG HH12 H 0.532 -10.106 1.786 1.00 . A A . 9 ARG HH12 1 1 19 10201 1 1 9 ARG HH21 H 1.592 -11.294 -1.291 1.00 . A A . 9 ARG HH21 1 1 19 10202 1 1 9 ARG HH22 H 0.537 -11.438 0.097 1.00 . A A . 9 ARG HH22 1 1 19 10203 1 1 9 ARG N N 2.104 -5.143 1.782 1.00 . A A . 9 ARG N 1 1 19 10204 1 1 9 ARG NE N 2.851 -9.293 -0.354 1.00 . A A . 9 ARG NE 1 1 19 10205 1 1 9 ARG NH1 N 1.386 -9.669 1.403 1.00 . A A . 9 ARG NH1 1 1 19 10206 1 1 9 ARG NH2 N 1.297 -10.986 -0.384 1.00 . A A . 9 ARG NH2 1 1 19 10207 1 1 9 ARG O O 3.823 -3.121 2.536 1.00 . A A . 9 ARG O 1 1 19 10208 1 1 10 MET C C 8.037 -3.726 2.276 1.00 . A A . 10 MET C 1 1 19 10209 1 1 10 MET CA C 6.649 -3.398 2.840 1.00 . A A . 10 MET CA 1 1 19 10210 1 1 10 MET CB C 6.699 -3.252 4.376 1.00 . A A . 10 MET CB 1 1 19 10211 1 1 10 MET CE C 7.467 -7.037 6.072 1.00 . A A . 10 MET CE 1 1 19 10212 1 1 10 MET CG C 7.298 -4.434 5.154 1.00 . A A . 10 MET CG 1 1 19 10213 1 1 10 MET H H 6.063 -5.321 2.252 1.00 . A A . 10 MET H 1 1 19 10214 1 1 10 MET HA H 6.324 -2.450 2.423 1.00 . A A . 10 MET HA 1 1 19 10215 1 1 10 MET HB2 H 7.294 -2.367 4.607 1.00 . A A . 10 MET HB2 1 1 19 10216 1 1 10 MET HB3 H 5.692 -3.075 4.750 1.00 . A A . 10 MET HB3 1 1 19 10217 1 1 10 MET HE1 H 7.600 -6.622 7.072 1.00 . A A . 10 MET HE1 1 1 19 10218 1 1 10 MET HE2 H 7.042 -8.038 6.151 1.00 . A A . 10 MET HE2 1 1 19 10219 1 1 10 MET HE3 H 8.433 -7.095 5.570 1.00 . A A . 10 MET HE3 1 1 19 10220 1 1 10 MET HG2 H 8.306 -4.631 4.789 1.00 . A A . 10 MET HG2 1 1 19 10221 1 1 10 MET HG3 H 7.388 -4.132 6.198 1.00 . A A . 10 MET HG3 1 1 19 10222 1 1 10 MET N N 5.676 -4.406 2.438 1.00 . A A . 10 MET N 1 1 19 10223 1 1 10 MET O O 8.440 -4.886 2.200 1.00 . A A . 10 MET O 1 1 19 10224 1 1 10 MET SD S 6.348 -5.982 5.117 1.00 . A A . 10 MET SD 1 1 19 10225 1 1 11 PHE C C 11.119 -2.752 2.516 1.00 . A A . 11 PHE C 1 1 19 10226 1 1 11 PHE CA C 10.124 -2.766 1.345 1.00 . A A . 11 PHE CA 1 1 19 10227 1 1 11 PHE CB C 10.378 -1.592 0.396 1.00 . A A . 11 PHE CB 1 1 19 10228 1 1 11 PHE CD1 C 10.214 -2.705 -1.861 1.00 . A A . 11 PHE CD1 1 1 19 10229 1 1 11 PHE CD2 C 8.646 -0.905 -1.351 1.00 . A A . 11 PHE CD2 1 1 19 10230 1 1 11 PHE CE1 C 9.663 -2.828 -3.148 1.00 . A A . 11 PHE CE1 1 1 19 10231 1 1 11 PHE CE2 C 8.102 -1.032 -2.643 1.00 . A A . 11 PHE CE2 1 1 19 10232 1 1 11 PHE CG C 9.715 -1.741 -0.960 1.00 . A A . 11 PHE CG 1 1 19 10233 1 1 11 PHE CZ C 8.611 -1.986 -3.540 1.00 . A A . 11 PHE CZ 1 1 19 10234 1 1 11 PHE H H 8.314 -1.769 1.850 1.00 . A A . 11 PHE H 1 1 19 10235 1 1 11 PHE HA H 10.262 -3.680 0.773 1.00 . A A . 11 PHE HA 1 1 19 10236 1 1 11 PHE HB2 H 10.039 -0.679 0.876 1.00 . A A . 11 PHE HB2 1 1 19 10237 1 1 11 PHE HB3 H 11.450 -1.494 0.228 1.00 . A A . 11 PHE HB3 1 1 19 10238 1 1 11 PHE HD1 H 11.045 -3.336 -1.583 1.00 . A A . 11 PHE HD1 1 1 19 10239 1 1 11 PHE HD2 H 8.217 -0.179 -0.670 1.00 . A A . 11 PHE HD2 1 1 19 10240 1 1 11 PHE HE1 H 10.053 -3.558 -3.842 1.00 . A A . 11 PHE HE1 1 1 19 10241 1 1 11 PHE HE2 H 7.274 -0.417 -2.958 1.00 . A A . 11 PHE HE2 1 1 19 10242 1 1 11 PHE HZ H 8.192 -2.067 -4.532 1.00 . A A . 11 PHE HZ 1 1 19 10243 1 1 11 PHE N N 8.746 -2.689 1.827 1.00 . A A . 11 PHE N 1 1 19 10244 1 1 11 PHE O O 10.813 -2.247 3.597 1.00 . A A . 11 PHE O 1 1 19 10245 1 1 12 ALA C C 13.857 -1.951 3.873 1.00 . A A . 12 ALA C 1 1 19 10246 1 1 12 ALA CA C 13.404 -3.314 3.302 1.00 . A A . 12 ALA CA 1 1 19 10247 1 1 12 ALA CB C 14.590 -4.075 2.700 1.00 . A A . 12 ALA CB 1 1 19 10248 1 1 12 ALA H H 12.564 -3.636 1.385 1.00 . A A . 12 ALA H 1 1 19 10249 1 1 12 ALA HA H 13.019 -3.895 4.142 1.00 . A A . 12 ALA HA 1 1 19 10250 1 1 12 ALA HB1 H 15.005 -3.520 1.858 1.00 . A A . 12 ALA HB1 1 1 19 10251 1 1 12 ALA HB2 H 15.365 -4.202 3.457 1.00 . A A . 12 ALA HB2 1 1 19 10252 1 1 12 ALA HB3 H 14.268 -5.061 2.362 1.00 . A A . 12 ALA HB3 1 1 19 10253 1 1 12 ALA N N 12.347 -3.233 2.284 1.00 . A A . 12 ALA N 1 1 19 10254 1 1 12 ALA O O 14.493 -1.909 4.922 1.00 . A A . 12 ALA O 1 1 19 10255 1 1 13 ASN C C 12.506 1.029 4.579 1.00 . A A . 13 ASN C 1 1 19 10256 1 1 13 ASN CA C 13.687 0.529 3.706 1.00 . A A . 13 ASN CA 1 1 19 10257 1 1 13 ASN CB C 13.943 1.451 2.491 1.00 . A A . 13 ASN CB 1 1 19 10258 1 1 13 ASN CG C 12.789 1.481 1.493 1.00 . A A . 13 ASN CG 1 1 19 10259 1 1 13 ASN H H 12.962 -0.945 2.369 1.00 . A A . 13 ASN H 1 1 19 10260 1 1 13 ASN HA H 14.574 0.554 4.343 1.00 . A A . 13 ASN HA 1 1 19 10261 1 1 13 ASN HB2 H 14.123 2.467 2.841 1.00 . A A . 13 ASN HB2 1 1 19 10262 1 1 13 ASN HB3 H 14.843 1.109 1.979 1.00 . A A . 13 ASN HB3 1 1 19 10263 1 1 13 ASN HD21 H 13.959 2.235 0.008 1.00 . A A . 13 ASN HD21 1 1 19 10264 1 1 13 ASN N N 13.504 -0.841 3.213 1.00 . A A . 13 ASN N 1 1 19 10265 1 1 13 ASN ND2 N 13.045 1.895 0.253 1.00 . A A . 13 ASN ND2 1 1 19 10266 1 1 13 ASN O O 12.539 2.172 5.027 1.00 . A A . 13 ASN O 1 1 19 10267 1 1 13 ASN OD1 O 11.673 1.086 1.826 1.00 . A A . 13 ASN OD1 1 1 19 10268 1 1 14 GLY C C 9.088 1.096 4.720 1.00 . A A . 14 GLY C 1 1 19 10269 1 1 14 GLY CA C 10.263 0.563 5.557 1.00 . A A . 14 GLY CA 1 1 19 10270 1 1 14 GLY H H 11.472 -0.725 4.394 1.00 . A A . 14 GLY H 1 1 19 10271 1 1 14 GLY HA2 H 9.918 -0.330 6.077 1.00 . A A . 14 GLY HA2 1 1 19 10272 1 1 14 GLY HA3 H 10.515 1.316 6.306 1.00 . A A . 14 GLY HA3 1 1 19 10273 1 1 14 GLY N N 11.462 0.211 4.791 1.00 . A A . 14 GLY N 1 1 19 10274 1 1 14 GLY O O 8.162 1.666 5.291 1.00 . A A . 14 GLY O 1 1 19 10275 1 1 15 THR C C 6.962 0.657 2.233 1.00 . A A . 15 THR C 1 1 19 10276 1 1 15 THR CA C 8.120 1.603 2.505 1.00 . A A . 15 THR CA 1 1 19 10277 1 1 15 THR CB C 8.776 2.064 1.197 1.00 . A A . 15 THR CB 1 1 19 10278 1 1 15 THR CG2 C 7.871 2.885 0.283 1.00 . A A . 15 THR CG2 1 1 19 10279 1 1 15 THR H H 9.825 0.390 2.944 1.00 . A A . 15 THR H 1 1 19 10280 1 1 15 THR HA H 7.732 2.494 2.984 1.00 . A A . 15 THR HA 1 1 19 10281 1 1 15 THR HB H 9.128 1.202 0.643 1.00 . A A . 15 THR HB 1 1 19 10282 1 1 15 THR HG1 H 10.588 2.214 1.784 1.00 . A A . 15 THR HG1 1 1 19 10283 1 1 15 THR HG21 H 7.640 3.844 0.747 1.00 . A A . 15 THR HG21 1 1 19 10284 1 1 15 THR HG22 H 8.382 3.052 -0.669 1.00 . A A . 15 THR HG22 1 1 19 10285 1 1 15 THR HG23 H 6.944 2.349 0.089 1.00 . A A . 15 THR HG23 1 1 19 10286 1 1 15 THR N N 9.098 0.940 3.388 1.00 . A A . 15 THR N 1 1 19 10287 1 1 15 THR O O 7.174 -0.401 1.647 1.00 . A A . 15 THR O 1 1 19 10288 1 1 15 THR OG1 O 9.886 2.857 1.517 1.00 . A A . 15 THR OG1 1 1 19 10289 1 1 16 VAL C C 3.788 0.342 1.333 1.00 . A A . 16 VAL C 1 1 19 10290 1 1 16 VAL CA C 4.572 0.143 2.624 1.00 . A A . 16 VAL CA 1 1 19 10291 1 1 16 VAL CB C 3.688 0.408 3.866 1.00 . A A . 16 VAL CB 1 1 19 10292 1 1 16 VAL CG1 C 2.221 -0.035 3.729 1.00 . A A . 16 VAL CG1 1 1 19 10293 1 1 16 VAL CG2 C 4.273 -0.349 5.062 1.00 . A A . 16 VAL CG2 1 1 19 10294 1 1 16 VAL H H 5.627 1.931 3.082 1.00 . A A . 16 VAL H 1 1 19 10295 1 1 16 VAL HA H 4.901 -0.892 2.660 1.00 . A A . 16 VAL HA 1 1 19 10296 1 1 16 VAL HB H 3.694 1.476 4.086 1.00 . A A . 16 VAL HB 1 1 19 10297 1 1 16 VAL HG11 H 1.702 0.115 4.676 1.00 . A A . 16 VAL HG11 1 1 19 10298 1 1 16 VAL HG12 H 1.714 0.562 2.971 1.00 . A A . 16 VAL HG12 1 1 19 10299 1 1 16 VAL HG13 H 2.168 -1.091 3.458 1.00 . A A . 16 VAL HG13 1 1 19 10300 1 1 16 VAL HG21 H 5.329 -0.108 5.184 1.00 . A A . 16 VAL HG21 1 1 19 10301 1 1 16 VAL HG22 H 3.742 -0.070 5.972 1.00 . A A . 16 VAL HG22 1 1 19 10302 1 1 16 VAL HG23 H 4.156 -1.422 4.899 1.00 . A A . 16 VAL HG23 1 1 19 10303 1 1 16 VAL N N 5.744 1.032 2.637 1.00 . A A . 16 VAL N 1 1 19 10304 1 1 16 VAL O O 3.619 1.462 0.849 1.00 . A A . 16 VAL O 1 1 19 10305 1 1 17 TYR C C 1.570 -1.972 -0.489 1.00 . A A . 17 TYR C 1 1 19 10306 1 1 17 TYR CA C 2.555 -0.800 -0.470 1.00 . A A . 17 TYR CA 1 1 19 10307 1 1 17 TYR CB C 3.574 -0.931 -1.631 1.00 . A A . 17 TYR CB 1 1 19 10308 1 1 17 TYR CD1 C 5.625 -2.189 -0.879 1.00 . A A . 17 TYR CD1 1 1 19 10309 1 1 17 TYR CD2 C 4.126 -3.322 -2.428 1.00 . A A . 17 TYR CD2 1 1 19 10310 1 1 17 TYR CE1 C 6.503 -3.284 -0.912 1.00 . A A . 17 TYR CE1 1 1 19 10311 1 1 17 TYR CE2 C 5.004 -4.427 -2.468 1.00 . A A . 17 TYR CE2 1 1 19 10312 1 1 17 TYR CG C 4.443 -2.187 -1.643 1.00 . A A . 17 TYR CG 1 1 19 10313 1 1 17 TYR CZ C 6.204 -4.399 -1.723 1.00 . A A . 17 TYR CZ 1 1 19 10314 1 1 17 TYR H H 3.433 -1.669 1.250 1.00 . A A . 17 TYR H 1 1 19 10315 1 1 17 TYR HA H 1.994 0.128 -0.587 1.00 . A A . 17 TYR HA 1 1 19 10316 1 1 17 TYR HB2 H 3.061 -0.848 -2.585 1.00 . A A . 17 TYR HB2 1 1 19 10317 1 1 17 TYR HB3 H 4.256 -0.080 -1.583 1.00 . A A . 17 TYR HB3 1 1 19 10318 1 1 17 TYR HD1 H 5.874 -1.326 -0.280 1.00 . A A . 17 TYR HD1 1 1 19 10319 1 1 17 TYR HD2 H 3.206 -3.376 -2.991 1.00 . A A . 17 TYR HD2 1 1 19 10320 1 1 17 TYR HE1 H 7.410 -3.242 -0.331 1.00 . A A . 17 TYR HE1 1 1 19 10321 1 1 17 TYR HE2 H 4.758 -5.330 -3.014 1.00 . A A . 17 TYR HE2 1 1 19 10322 1 1 17 TYR HH H 7.838 -5.307 -1.236 1.00 . A A . 17 TYR HH 1 1 19 10323 1 1 17 TYR N N 3.317 -0.775 0.774 1.00 . A A . 17 TYR N 1 1 19 10324 1 1 17 TYR O O 1.551 -2.806 0.416 1.00 . A A . 17 TYR O 1 1 19 10325 1 1 17 TYR OH O 7.036 -5.473 -1.736 1.00 . A A . 17 TYR OH 1 1 19 10326 1 1 18 TYR C C 0.439 -3.893 -3.195 1.00 . A A . 18 TYR C 1 1 19 10327 1 1 18 TYR CA C -0.029 -3.224 -1.909 1.00 . A A . 18 TYR CA 1 1 19 10328 1 1 18 TYR CB C -1.496 -2.817 -1.998 1.00 . A A . 18 TYR CB 1 1 19 10329 1 1 18 TYR CD1 C -1.677 -1.637 0.204 1.00 . A A . 18 TYR CD1 1 1 19 10330 1 1 18 TYR CD2 C -2.936 -3.696 -0.110 1.00 . A A . 18 TYR CD2 1 1 19 10331 1 1 18 TYR CE1 C -1.998 -1.637 1.558 1.00 . A A . 18 TYR CE1 1 1 19 10332 1 1 18 TYR CE2 C -3.374 -3.624 1.223 1.00 . A A . 18 TYR CE2 1 1 19 10333 1 1 18 TYR CG C -2.085 -2.698 -0.616 1.00 . A A . 18 TYR CG 1 1 19 10334 1 1 18 TYR CZ C -2.864 -2.624 2.082 1.00 . A A . 18 TYR CZ 1 1 19 10335 1 1 18 TYR H H 0.645 -1.233 -2.105 1.00 . A A . 18 TYR H 1 1 19 10336 1 1 18 TYR HA H 0.059 -3.962 -1.111 1.00 . A A . 18 TYR HA 1 1 19 10337 1 1 18 TYR HB2 H -1.595 -1.874 -2.537 1.00 . A A . 18 TYR HB2 1 1 19 10338 1 1 18 TYR HB3 H -2.046 -3.581 -2.545 1.00 . A A . 18 TYR HB3 1 1 19 10339 1 1 18 TYR HD1 H -1.071 -0.829 -0.172 1.00 . A A . 18 TYR HD1 1 1 19 10340 1 1 18 TYR HD2 H -3.259 -4.516 -0.737 1.00 . A A . 18 TYR HD2 1 1 19 10341 1 1 18 TYR HE1 H -1.530 -0.860 2.122 1.00 . A A . 18 TYR HE1 1 1 19 10342 1 1 18 TYR HE2 H -4.102 -4.331 1.577 1.00 . A A . 18 TYR HE2 1 1 19 10343 1 1 18 TYR HH H -2.817 -1.870 3.862 1.00 . A A . 18 TYR HH 1 1 19 10344 1 1 18 TYR N N 0.811 -2.081 -1.577 1.00 . A A . 18 TYR N 1 1 19 10345 1 1 18 TYR O O 0.905 -3.251 -4.137 1.00 . A A . 18 TYR O 1 1 19 10346 1 1 18 TYR OH O -3.235 -2.593 3.390 1.00 . A A . 18 TYR OH 1 1 19 10347 1 1 19 PHE C C -0.303 -7.017 -4.740 1.00 . A A . 19 PHE C 1 1 19 10348 1 1 19 PHE CA C 0.814 -6.133 -4.198 1.00 . A A . 19 PHE CA 1 1 19 10349 1 1 19 PHE CB C 1.897 -6.957 -3.507 1.00 . A A . 19 PHE CB 1 1 19 10350 1 1 19 PHE CD1 C 2.133 -9.265 -4.530 1.00 . A A . 19 PHE CD1 1 1 19 10351 1 1 19 PHE CD2 C 3.774 -7.546 -5.075 1.00 . A A . 19 PHE CD2 1 1 19 10352 1 1 19 PHE CE1 C 2.829 -10.185 -5.333 1.00 . A A . 19 PHE CE1 1 1 19 10353 1 1 19 PHE CE2 C 4.474 -8.466 -5.868 1.00 . A A . 19 PHE CE2 1 1 19 10354 1 1 19 PHE CG C 2.610 -7.946 -4.397 1.00 . A A . 19 PHE CG 1 1 19 10355 1 1 19 PHE CZ C 4.004 -9.786 -5.998 1.00 . A A . 19 PHE CZ 1 1 19 10356 1 1 19 PHE H H -0.068 -5.647 -2.361 1.00 . A A . 19 PHE H 1 1 19 10357 1 1 19 PHE HA H 1.273 -5.582 -5.018 1.00 . A A . 19 PHE HA 1 1 19 10358 1 1 19 PHE HB2 H 2.633 -6.260 -3.114 1.00 . A A . 19 PHE HB2 1 1 19 10359 1 1 19 PHE HB3 H 1.460 -7.495 -2.665 1.00 . A A . 19 PHE HB3 1 1 19 10360 1 1 19 PHE HD1 H 1.229 -9.571 -4.021 1.00 . A A . 19 PHE HD1 1 1 19 10361 1 1 19 PHE HD2 H 4.140 -6.535 -4.989 1.00 . A A . 19 PHE HD2 1 1 19 10362 1 1 19 PHE HE1 H 2.466 -11.198 -5.441 1.00 . A A . 19 PHE HE1 1 1 19 10363 1 1 19 PHE HE2 H 5.370 -8.132 -6.368 1.00 . A A . 19 PHE HE2 1 1 19 10364 1 1 19 PHE HZ H 4.527 -10.490 -6.628 1.00 . A A . 19 PHE HZ 1 1 19 10365 1 1 19 PHE N N 0.283 -5.212 -3.211 1.00 . A A . 19 PHE N 1 1 19 10366 1 1 19 PHE O O -0.873 -7.828 -4.010 1.00 . A A . 19 PHE O 1 1 19 10367 1 1 20 ASN C C -0.969 -9.102 -6.927 1.00 . A A . 20 ASN C 1 1 19 10368 1 1 20 ASN CA C -1.556 -7.695 -6.743 1.00 . A A . 20 ASN CA 1 1 19 10369 1 1 20 ASN CB C -1.880 -7.028 -8.079 1.00 . A A . 20 ASN CB 1 1 19 10370 1 1 20 ASN CG C -2.986 -7.793 -8.767 1.00 . A A . 20 ASN CG 1 1 19 10371 1 1 20 ASN H H -0.128 -6.151 -6.566 1.00 . A A . 20 ASN H 1 1 19 10372 1 1 20 ASN HA H -2.481 -7.784 -6.182 1.00 . A A . 20 ASN HA 1 1 19 10373 1 1 20 ASN HB2 H -2.177 -5.996 -7.934 1.00 . A A . 20 ASN HB2 1 1 19 10374 1 1 20 ASN HB3 H -0.993 -7.024 -8.708 1.00 . A A . 20 ASN HB3 1 1 19 10375 1 1 20 ASN HD21 H -4.455 -6.640 -7.949 1.00 . A A . 20 ASN HD21 1 1 19 10376 1 1 20 ASN HD22 H -4.949 -7.960 -9.005 1.00 . A A . 20 ASN HD22 1 1 19 10377 1 1 20 ASN N N -0.631 -6.845 -6.017 1.00 . A A . 20 ASN N 1 1 19 10378 1 1 20 ASN ND2 N -4.232 -7.423 -8.549 1.00 . A A . 20 ASN ND2 1 1 19 10379 1 1 20 ASN O O -0.196 -9.340 -7.855 1.00 . A A . 20 ASN O 1 1 19 10380 1 1 20 ASN OD1 O -2.724 -8.758 -9.472 1.00 . A A . 20 ASN OD1 1 1 19 10381 1 1 21 HIS C C -1.362 -12.239 -7.347 1.00 . A A . 21 HIS C 1 1 19 10382 1 1 21 HIS CA C -0.822 -11.427 -6.154 1.00 . A A . 21 HIS CA 1 1 19 10383 1 1 21 HIS CB C -1.009 -12.138 -4.805 1.00 . A A . 21 HIS CB 1 1 19 10384 1 1 21 HIS CD2 C -3.359 -13.152 -4.980 1.00 . A A . 21 HIS CD2 1 1 19 10385 1 1 21 HIS CE1 C -4.279 -12.207 -3.211 1.00 . A A . 21 HIS CE1 1 1 19 10386 1 1 21 HIS CG C -2.441 -12.341 -4.375 1.00 . A A . 21 HIS CG 1 1 19 10387 1 1 21 HIS H H -2.052 -9.857 -5.367 1.00 . A A . 21 HIS H 1 1 19 10388 1 1 21 HIS HA H 0.252 -11.356 -6.325 1.00 . A A . 21 HIS HA 1 1 19 10389 1 1 21 HIS HB2 H -0.510 -13.105 -4.843 1.00 . A A . 21 HIS HB2 1 1 19 10390 1 1 21 HIS HB3 H -0.506 -11.550 -4.036 1.00 . A A . 21 HIS HB3 1 1 19 10391 1 1 21 HIS HD2 H -3.194 -13.760 -5.859 1.00 . A A . 21 HIS HD2 1 1 19 10392 1 1 21 HIS HE1 H -4.995 -11.937 -2.447 1.00 . A A . 21 HIS HE1 1 1 19 10393 1 1 21 HIS HE2 H -5.382 -13.535 -4.408 1.00 . A A . 21 HIS HE2 1 1 19 10394 1 1 21 HIS N N -1.346 -10.059 -6.075 1.00 . A A . 21 HIS N 1 1 19 10395 1 1 21 HIS ND1 N -3.020 -11.754 -3.253 1.00 . A A . 21 HIS ND1 1 1 19 10396 1 1 21 HIS NE2 N -4.514 -13.048 -4.235 1.00 . A A . 21 HIS NE2 1 1 19 10397 1 1 21 HIS O O -1.037 -13.417 -7.465 1.00 . A A . 21 HIS O 1 1 19 10398 1 1 22 ILE C C -1.695 -11.874 -10.656 1.00 . A A . 22 ILE C 1 1 19 10399 1 1 22 ILE CA C -2.635 -12.246 -9.484 1.00 . A A . 22 ILE CA 1 1 19 10400 1 1 22 ILE CB C -4.121 -11.854 -9.734 1.00 . A A . 22 ILE CB 1 1 19 10401 1 1 22 ILE CD1 C -6.464 -11.719 -8.601 1.00 . A A . 22 ILE CD1 1 1 19 10402 1 1 22 ILE CG1 C -4.997 -12.158 -8.488 1.00 . A A . 22 ILE CG1 1 1 19 10403 1 1 22 ILE CG2 C -4.688 -12.575 -10.973 1.00 . A A . 22 ILE CG2 1 1 19 10404 1 1 22 ILE H H -2.406 -10.656 -8.104 1.00 . A A . 22 ILE H 1 1 19 10405 1 1 22 ILE HA H -2.595 -13.331 -9.380 1.00 . A A . 22 ILE HA 1 1 19 10406 1 1 22 ILE HB H -4.171 -10.782 -9.925 1.00 . A A . 22 ILE HB 1 1 19 10407 1 1 22 ILE HD11 H -6.996 -12.333 -9.326 1.00 . A A . 22 ILE HD11 1 1 19 10408 1 1 22 ILE HD12 H -6.950 -11.840 -7.632 1.00 . A A . 22 ILE HD12 1 1 19 10409 1 1 22 ILE HD13 H -6.517 -10.670 -8.893 1.00 . A A . 22 ILE HD13 1 1 19 10410 1 1 22 ILE HG12 H -4.967 -13.228 -8.279 1.00 . A A . 22 ILE HG12 1 1 19 10411 1 1 22 ILE HG13 H -4.595 -11.636 -7.621 1.00 . A A . 22 ILE HG13 1 1 19 10412 1 1 22 ILE HG21 H -5.720 -12.277 -11.154 1.00 . A A . 22 ILE HG21 1 1 19 10413 1 1 22 ILE HG22 H -4.125 -12.303 -11.865 1.00 . A A . 22 ILE HG22 1 1 19 10414 1 1 22 ILE HG23 H -4.642 -13.655 -10.835 1.00 . A A . 22 ILE HG23 1 1 19 10415 1 1 22 ILE N N -2.163 -11.631 -8.235 1.00 . A A . 22 ILE N 1 1 19 10416 1 1 22 ILE O O -1.665 -12.572 -11.667 1.00 . A A . 22 ILE O 1 1 19 10417 1 1 23 THR C C 1.368 -9.860 -11.186 1.00 . A A . 23 THR C 1 1 19 10418 1 1 23 THR CA C -0.058 -10.240 -11.596 1.00 . A A . 23 THR CA 1 1 19 10419 1 1 23 THR CB C -0.700 -8.963 -12.164 1.00 . A A . 23 THR CB 1 1 19 10420 1 1 23 THR CG2 C -2.067 -9.196 -12.808 1.00 . A A . 23 THR CG2 1 1 19 10421 1 1 23 THR H H -0.990 -10.266 -9.662 1.00 . A A . 23 THR H 1 1 19 10422 1 1 23 THR HA H 0.027 -10.963 -12.408 1.00 . A A . 23 THR HA 1 1 19 10423 1 1 23 THR HB H -0.037 -8.545 -12.922 1.00 . A A . 23 THR HB 1 1 19 10424 1 1 23 THR HG1 H -1.592 -8.334 -10.567 1.00 . A A . 23 THR HG1 1 1 19 10425 1 1 23 THR HG21 H -1.973 -9.935 -13.602 1.00 . A A . 23 THR HG21 1 1 19 10426 1 1 23 THR HG22 H -2.788 -9.553 -12.072 1.00 . A A . 23 THR HG22 1 1 19 10427 1 1 23 THR HG23 H -2.428 -8.261 -13.236 1.00 . A A . 23 THR HG23 1 1 19 10428 1 1 23 THR N N -0.893 -10.806 -10.515 1.00 . A A . 23 THR N 1 1 19 10429 1 1 23 THR O O 2.230 -9.767 -12.060 1.00 . A A . 23 THR O 1 1 19 10430 1 1 23 THR OG1 O -0.844 -8.020 -11.124 1.00 . A A . 23 THR OG1 1 1 19 10431 1 1 24 ASN C C 2.879 -7.565 -9.286 1.00 . A A . 24 ASN C 1 1 19 10432 1 1 24 ASN CA C 2.825 -9.108 -9.251 1.00 . A A . 24 ASN CA 1 1 19 10433 1 1 24 ASN CB C 4.136 -9.754 -9.752 1.00 . A A . 24 ASN CB 1 1 19 10434 1 1 24 ASN CG C 4.117 -11.274 -9.754 1.00 . A A . 24 ASN CG 1 1 19 10435 1 1 24 ASN H H 0.869 -9.794 -9.220 1.00 . A A . 24 ASN H 1 1 19 10436 1 1 24 ASN HA H 2.734 -9.360 -8.196 1.00 . A A . 24 ASN HA 1 1 19 10437 1 1 24 ASN HB2 H 4.366 -9.394 -10.754 1.00 . A A . 24 ASN HB2 1 1 19 10438 1 1 24 ASN HB3 H 4.953 -9.435 -9.104 1.00 . A A . 24 ASN HB3 1 1 19 10439 1 1 24 ASN HD21 H 3.388 -11.294 -11.626 1.00 . A A . 24 ASN HD21 1 1 19 10440 1 1 24 ASN HD22 H 3.727 -12.874 -10.885 1.00 . A A . 24 ASN HD22 1 1 19 10441 1 1 24 ASN N N 1.625 -9.666 -9.886 1.00 . A A . 24 ASN N 1 1 19 10442 1 1 24 ASN ND2 N 3.738 -11.870 -10.866 1.00 . A A . 24 ASN ND2 1 1 19 10443 1 1 24 ASN O O 3.894 -6.994 -8.889 1.00 . A A . 24 ASN O 1 1 19 10444 1 1 24 ASN OD1 O 4.448 -11.925 -8.776 1.00 . A A . 24 ASN OD1 1 1 19 10445 1 1 25 ALA C C 1.848 -4.817 -8.339 1.00 . A A . 25 ALA C 1 1 19 10446 1 1 25 ALA CA C 1.823 -5.401 -9.766 1.00 . A A . 25 ALA CA 1 1 19 10447 1 1 25 ALA CB C 0.598 -4.911 -10.548 1.00 . A A . 25 ALA CB 1 1 19 10448 1 1 25 ALA H H 0.980 -7.335 -10.062 1.00 . A A . 25 ALA H 1 1 19 10449 1 1 25 ALA HA H 2.718 -5.066 -10.294 1.00 . A A . 25 ALA HA 1 1 19 10450 1 1 25 ALA HB1 H -0.319 -5.205 -10.038 1.00 . A A . 25 ALA HB1 1 1 19 10451 1 1 25 ALA HB2 H 0.625 -3.825 -10.629 1.00 . A A . 25 ALA HB2 1 1 19 10452 1 1 25 ALA HB3 H 0.603 -5.341 -11.551 1.00 . A A . 25 ALA HB3 1 1 19 10453 1 1 25 ALA N N 1.824 -6.867 -9.748 1.00 . A A . 25 ALA N 1 1 19 10454 1 1 25 ALA O O 1.029 -5.193 -7.504 1.00 . A A . 25 ALA O 1 1 19 10455 1 1 26 SER C C 2.668 -1.745 -6.798 1.00 . A A . 26 SER C 1 1 19 10456 1 1 26 SER CA C 2.940 -3.249 -6.743 1.00 . A A . 26 SER CA 1 1 19 10457 1 1 26 SER CB C 4.372 -3.468 -6.246 1.00 . A A . 26 SER CB 1 1 19 10458 1 1 26 SER H H 3.441 -3.618 -8.759 1.00 . A A . 26 SER H 1 1 19 10459 1 1 26 SER HA H 2.265 -3.708 -6.026 1.00 . A A . 26 SER HA 1 1 19 10460 1 1 26 SER HB2 H 4.492 -2.987 -5.275 1.00 . A A . 26 SER HB2 1 1 19 10461 1 1 26 SER HB3 H 4.568 -4.532 -6.130 1.00 . A A . 26 SER HB3 1 1 19 10462 1 1 26 SER HG H 4.902 -2.043 -7.452 1.00 . A A . 26 SER HG 1 1 19 10463 1 1 26 SER N N 2.759 -3.877 -8.061 1.00 . A A . 26 SER N 1 1 19 10464 1 1 26 SER O O 3.298 -1.058 -7.606 1.00 . A A . 26 SER O 1 1 19 10465 1 1 26 SER OG O 5.280 -2.894 -7.167 1.00 . A A . 26 SER OG 1 1 19 10466 1 1 27 GLN C C 1.315 0.689 -4.410 1.00 . A A . 27 GLN C 1 1 19 10467 1 1 27 GLN CA C 1.477 0.200 -5.859 1.00 . A A . 27 GLN CA 1 1 19 10468 1 1 27 GLN CB C 0.223 0.462 -6.717 1.00 . A A . 27 GLN CB 1 1 19 10469 1 1 27 GLN CD C 1.003 2.802 -7.401 1.00 . A A . 27 GLN CD 1 1 19 10470 1 1 27 GLN CG C -0.154 1.944 -6.888 1.00 . A A . 27 GLN CG 1 1 19 10471 1 1 27 GLN H H 1.351 -1.833 -5.231 1.00 . A A . 27 GLN H 1 1 19 10472 1 1 27 GLN HA H 2.313 0.750 -6.293 1.00 . A A . 27 GLN HA 1 1 19 10473 1 1 27 GLN HB2 H 0.391 0.046 -7.711 1.00 . A A . 27 GLN HB2 1 1 19 10474 1 1 27 GLN HB3 H -0.627 -0.063 -6.276 1.00 . A A . 27 GLN HB3 1 1 19 10475 1 1 27 GLN HE21 H 0.475 2.641 -9.374 1.00 . A A . 27 GLN HE21 1 1 19 10476 1 1 27 GLN HE22 H 1.902 3.582 -8.968 1.00 . A A . 27 GLN HE22 1 1 19 10477 1 1 27 GLN HG2 H -0.990 2.015 -7.583 1.00 . A A . 27 GLN HG2 1 1 19 10478 1 1 27 GLN HG3 H -0.489 2.348 -5.934 1.00 . A A . 27 GLN HG3 1 1 19 10479 1 1 27 GLN N N 1.797 -1.229 -5.923 1.00 . A A . 27 GLN N 1 1 19 10480 1 1 27 GLN NE2 N 1.117 3.015 -8.696 1.00 . A A . 27 GLN NE2 1 1 19 10481 1 1 27 GLN O O 0.838 -0.033 -3.536 1.00 . A A . 27 GLN O 1 1 19 10482 1 1 27 GLN OE1 O 1.828 3.277 -6.633 1.00 . A A . 27 GLN OE1 1 1 19 10483 1 1 28 PHE C C 0.373 3.064 -2.335 1.00 . A A . 28 PHE C 1 1 19 10484 1 1 28 PHE CA C 1.742 2.593 -2.856 1.00 . A A . 28 PHE CA 1 1 19 10485 1 1 28 PHE CB C 2.726 3.767 -2.934 1.00 . A A . 28 PHE CB 1 1 19 10486 1 1 28 PHE CD1 C 4.892 2.576 -2.441 1.00 . A A . 28 PHE CD1 1 1 19 10487 1 1 28 PHE CD2 C 4.645 3.681 -4.598 1.00 . A A . 28 PHE CD2 1 1 19 10488 1 1 28 PHE CE1 C 6.180 2.158 -2.804 1.00 . A A . 28 PHE CE1 1 1 19 10489 1 1 28 PHE CE2 C 5.936 3.259 -4.959 1.00 . A A . 28 PHE CE2 1 1 19 10490 1 1 28 PHE CG C 4.124 3.344 -3.334 1.00 . A A . 28 PHE CG 1 1 19 10491 1 1 28 PHE CZ C 6.708 2.501 -4.061 1.00 . A A . 28 PHE CZ 1 1 19 10492 1 1 28 PHE H H 2.038 2.502 -4.956 1.00 . A A . 28 PHE H 1 1 19 10493 1 1 28 PHE HA H 2.133 1.877 -2.132 1.00 . A A . 28 PHE HA 1 1 19 10494 1 1 28 PHE HB2 H 2.348 4.507 -3.641 1.00 . A A . 28 PHE HB2 1 1 19 10495 1 1 28 PHE HB3 H 2.794 4.243 -1.956 1.00 . A A . 28 PHE HB3 1 1 19 10496 1 1 28 PHE HD1 H 4.486 2.295 -1.479 1.00 . A A . 28 PHE HD1 1 1 19 10497 1 1 28 PHE HD2 H 4.054 4.257 -5.297 1.00 . A A . 28 PHE HD2 1 1 19 10498 1 1 28 PHE HE1 H 6.760 1.573 -2.111 1.00 . A A . 28 PHE HE1 1 1 19 10499 1 1 28 PHE HE2 H 6.338 3.519 -5.928 1.00 . A A . 28 PHE HE2 1 1 19 10500 1 1 28 PHE HZ H 7.702 2.182 -4.335 1.00 . A A . 28 PHE HZ 1 1 19 10501 1 1 28 PHE N N 1.702 1.944 -4.171 1.00 . A A . 28 PHE N 1 1 19 10502 1 1 28 PHE O O 0.298 3.632 -1.244 1.00 . A A . 28 PHE O 1 1 19 10503 1 1 29 GLU C C -2.586 1.860 -1.816 1.00 . A A . 29 GLU C 1 1 19 10504 1 1 29 GLU CA C -2.082 3.066 -2.631 1.00 . A A . 29 GLU CA 1 1 19 10505 1 1 29 GLU CB C -3.018 3.392 -3.817 1.00 . A A . 29 GLU CB 1 1 19 10506 1 1 29 GLU CD C -4.653 4.994 -2.677 1.00 . A A . 29 GLU CD 1 1 19 10507 1 1 29 GLU CG C -3.575 4.827 -3.757 1.00 . A A . 29 GLU CG 1 1 19 10508 1 1 29 GLU H H -0.585 2.343 -3.952 1.00 . A A . 29 GLU H 1 1 19 10509 1 1 29 GLU HA H -2.084 3.922 -1.959 1.00 . A A . 29 GLU HA 1 1 19 10510 1 1 29 GLU HB2 H -2.474 3.275 -4.755 1.00 . A A . 29 GLU HB2 1 1 19 10511 1 1 29 GLU HB3 H -3.855 2.692 -3.840 1.00 . A A . 29 GLU HB3 1 1 19 10512 1 1 29 GLU HG2 H -2.759 5.529 -3.576 1.00 . A A . 29 GLU HG2 1 1 19 10513 1 1 29 GLU HG3 H -4.010 5.062 -4.731 1.00 . A A . 29 GLU HG3 1 1 19 10514 1 1 29 GLU N N -0.708 2.860 -3.097 1.00 . A A . 29 GLU N 1 1 19 10515 1 1 29 GLU O O -2.082 0.745 -1.934 1.00 . A A . 29 GLU O 1 1 19 10516 1 1 29 GLU OE1 O -4.403 4.647 -1.507 1.00 . A A . 29 GLU OE1 1 1 19 10517 1 1 29 GLU OE2 O -5.808 5.355 -2.996 1.00 . A A . 29 GLU OE2 1 1 19 10518 1 1 30 ARG C C -5.636 0.946 -0.205 1.00 . A A . 30 ARG C 1 1 19 10519 1 1 30 ARG CA C -4.130 1.200 0.045 1.00 . A A . 30 ARG CA 1 1 19 10520 1 1 30 ARG CB C -3.886 1.773 1.458 1.00 . A A . 30 ARG CB 1 1 19 10521 1 1 30 ARG CD C -1.730 3.286 1.226 1.00 . A A . 30 ARG CD 1 1 19 10522 1 1 30 ARG CG C -2.455 2.126 1.914 1.00 . A A . 30 ARG CG 1 1 19 10523 1 1 30 ARG CZ C -2.196 5.642 0.536 1.00 . A A . 30 ARG CZ 1 1 19 10524 1 1 30 ARG H H -3.975 3.060 -0.976 1.00 . A A . 30 ARG H 1 1 19 10525 1 1 30 ARG HA H -3.610 0.246 -0.036 1.00 . A A . 30 ARG HA 1 1 19 10526 1 1 30 ARG HB2 H -4.516 2.649 1.595 1.00 . A A . 30 ARG HB2 1 1 19 10527 1 1 30 ARG HB3 H -4.216 1.008 2.155 1.00 . A A . 30 ARG HB3 1 1 19 10528 1 1 30 ARG HD2 H -0.791 3.465 1.752 1.00 . A A . 30 ARG HD2 1 1 19 10529 1 1 30 ARG HD3 H -1.484 2.983 0.216 1.00 . A A . 30 ARG HD3 1 1 19 10530 1 1 30 ARG HE H -3.337 4.622 1.800 1.00 . A A . 30 ARG HE 1 1 19 10531 1 1 30 ARG HG2 H -2.502 2.358 2.979 1.00 . A A . 30 ARG HG2 1 1 19 10532 1 1 30 ARG HG3 H -1.829 1.246 1.801 1.00 . A A . 30 ARG HG3 1 1 19 10533 1 1 30 ARG HH11 H -0.553 4.903 -0.387 1.00 . A A . 30 ARG HH11 1 1 19 10534 1 1 30 ARG HH12 H -0.907 6.589 -0.694 1.00 . A A . 30 ARG HH12 1 1 19 10535 1 1 30 ARG HH21 H -3.882 6.598 1.087 1.00 . A A . 30 ARG HH21 1 1 19 10536 1 1 30 ARG HH22 H -2.771 7.538 0.117 1.00 . A A . 30 ARG HH22 1 1 19 10537 1 1 30 ARG N N -3.594 2.108 -0.975 1.00 . A A . 30 ARG N 1 1 19 10538 1 1 30 ARG NE N -2.506 4.537 1.198 1.00 . A A . 30 ARG NE 1 1 19 10539 1 1 30 ARG NH1 N -1.124 5.736 -0.219 1.00 . A A . 30 ARG NH1 1 1 19 10540 1 1 30 ARG NH2 N -2.963 6.699 0.622 1.00 . A A . 30 ARG NH2 1 1 19 10541 1 1 30 ARG O O -6.250 1.709 -0.952 1.00 . A A . 30 ARG O 1 1 19 10542 1 1 31 PRO C C -8.549 0.821 0.665 1.00 . A A . 31 PRO C 1 1 19 10543 1 1 31 PRO CA C -7.701 -0.373 0.238 1.00 . A A . 31 PRO CA 1 1 19 10544 1 1 31 PRO CB C -7.991 -1.631 1.071 1.00 . A A . 31 PRO CB 1 1 19 10545 1 1 31 PRO CD C -5.611 -1.201 1.066 1.00 . A A . 31 PRO CD 1 1 19 10546 1 1 31 PRO CG C -6.636 -2.323 1.210 1.00 . A A . 31 PRO CG 1 1 19 10547 1 1 31 PRO HA H -7.939 -0.568 -0.782 1.00 . A A . 31 PRO HA 1 1 19 10548 1 1 31 PRO HB2 H -8.353 -1.367 2.065 1.00 . A A . 31 PRO HB2 1 1 19 10549 1 1 31 PRO HB3 H -8.715 -2.277 0.574 1.00 . A A . 31 PRO HB3 1 1 19 10550 1 1 31 PRO HD2 H -5.315 -0.858 2.057 1.00 . A A . 31 PRO HD2 1 1 19 10551 1 1 31 PRO HD3 H -4.750 -1.560 0.507 1.00 . A A . 31 PRO HD3 1 1 19 10552 1 1 31 PRO HG2 H -6.541 -2.825 2.174 1.00 . A A . 31 PRO HG2 1 1 19 10553 1 1 31 PRO HG3 H -6.505 -3.044 0.408 1.00 . A A . 31 PRO HG3 1 1 19 10554 1 1 31 PRO N N -6.255 -0.127 0.337 1.00 . A A . 31 PRO N 1 1 19 10555 1 1 31 PRO O O -9.403 1.313 -0.069 1.00 . A A . 31 PRO O 1 1 19 10556 1 1 32 SER C C -7.662 3.641 2.311 1.00 . A A . 32 SER C 1 1 19 10557 1 1 32 SER CA C -8.643 2.476 2.565 1.00 . A A . 32 SER CA 1 1 19 10558 1 1 32 SER CB C -8.803 2.133 4.055 1.00 . A A . 32 SER CB 1 1 19 10559 1 1 32 SER H H -7.432 0.715 2.180 1.00 . A A . 32 SER H 1 1 19 10560 1 1 32 SER HA H -9.622 2.774 2.184 1.00 . A A . 32 SER HA 1 1 19 10561 1 1 32 SER HB2 H -9.395 1.220 4.147 1.00 . A A . 32 SER HB2 1 1 19 10562 1 1 32 SER HB3 H -7.823 1.965 4.503 1.00 . A A . 32 SER HB3 1 1 19 10563 1 1 32 SER HG H -9.691 2.876 5.627 1.00 . A A . 32 SER HG 1 1 19 10564 1 1 32 SER N N -8.210 1.266 1.862 1.00 . A A . 32 SER N 1 1 19 10565 1 1 32 SER O O -6.919 3.607 1.330 1.00 . A A . 32 SER O 1 1 19 10566 1 1 32 SER OG O -9.473 3.175 4.738 1.00 . A A . 32 SER OG 1 1 19 10567 1 1 33 GLY C C -5.565 5.869 2.442 1.00 . A A . 33 GLY C 1 1 19 10568 1 1 33 GLY CA C -6.858 5.878 3.250 1.00 . A A . 33 GLY CA 1 1 19 10569 1 1 33 GLY H H -8.386 4.551 3.914 1.00 . A A . 33 GLY H 1 1 19 10570 1 1 33 GLY HA2 H -7.435 6.744 2.933 1.00 . A A . 33 GLY HA2 1 1 19 10571 1 1 33 GLY HA3 H -6.572 6.030 4.290 1.00 . A A . 33 GLY HA3 1 1 19 10572 1 1 33 GLY N N -7.708 4.674 3.166 1.00 . A A . 33 GLY N 1 1 19 10573 1 1 33 GLY O O -4.625 5.125 2.786 1.00 . A A . 33 GLY O 1 1 19 10574 1 1 33 GLY OXT O -5.503 6.639 1.457 1.00 . A A . 33 GLY OXT 1 1 19 10575 2 2 1 NAG C1 C 12.155 1.557 -0.851 1.00 . B A . 101 NAG C1 1 1 19 10576 2 2 1 NAG C2 C 11.675 2.762 -1.692 1.00 . B A . 101 NAG C2 1 1 19 10577 2 2 1 NAG C3 C 10.710 2.171 -2.737 1.00 . B A . 101 NAG C3 1 1 19 10578 2 2 1 NAG C4 C 11.509 1.245 -3.645 1.00 . B A . 101 NAG C4 1 1 19 10579 2 2 1 NAG C5 C 12.130 0.093 -2.849 1.00 . B A . 101 NAG C5 1 1 19 10580 2 2 1 NAG C6 C 13.031 -0.827 -3.671 1.00 . B A . 101 NAG C6 1 1 19 10581 2 2 1 NAG C7 C 10.790 5.025 -1.301 1.00 . B A . 101 NAG C7 1 1 19 10582 2 2 1 NAG C8 C 10.219 6.010 -0.271 1.00 . B A . 101 NAG C8 1 1 19 10583 2 2 1 NAG H1 H 11.287 1.023 -0.463 1.00 . B A . 101 NAG H1 1 1 19 10584 2 2 1 NAG H2 H 12.526 3.220 -2.199 1.00 . B A . 101 NAG H2 1 1 19 10585 2 2 1 NAG H3 H 9.923 1.601 -2.233 1.00 . B A . 101 NAG H3 1 1 19 10586 2 2 1 NAG H4 H 12.274 1.826 -4.154 1.00 . B A . 101 NAG H4 1 1 19 10587 2 2 1 NAG H5 H 11.319 -0.497 -2.444 1.00 . B A . 101 NAG H5 1 1 19 10588 2 2 1 NAG H61 H 13.199 -1.753 -3.122 1.00 . B A . 101 NAG H61 1 1 19 10589 2 2 1 NAG H62 H 12.581 -1.076 -4.631 1.00 . B A . 101 NAG H62 1 1 19 10590 2 2 1 NAG H81 H 9.155 5.817 -0.134 1.00 . B A . 101 NAG H81 1 1 19 10591 2 2 1 NAG H82 H 10.356 7.033 -0.624 1.00 . B A . 101 NAG H82 1 1 19 10592 2 2 1 NAG H83 H 10.734 5.890 0.683 1.00 . B A . 101 NAG H83 1 1 19 10593 2 2 1 NAG HN2 H 10.715 3.522 0.057 1.00 . B A . 101 NAG HN2 1 1 19 10594 2 2 1 NAG HO3 H 10.404 4.083 -3.268 1.00 . B A . 101 NAG HO3 1 1 19 10595 2 2 1 NAG HO4 H 10.038 1.492 -4.851 1.00 . B A . 101 NAG HO4 1 1 19 10596 2 2 1 NAG HO6 H 14.543 0.210 -3.012 1.00 . B A . 101 NAG HO6 1 1 19 10597 2 2 1 NAG N2 N 11.033 3.789 -0.871 1.00 . B A . 101 NAG N2 1 1 19 10598 2 2 1 NAG O3 O 10.120 3.189 -3.584 1.00 . B A . 101 NAG O3 1 1 19 10599 2 2 1 NAG O4 O 10.579 0.729 -4.602 1.00 . B A . 101 NAG O4 1 1 19 10600 2 2 1 NAG O5 O 12.917 0.647 -1.713 1.00 . B A . 101 NAG O5 1 1 19 10601 2 2 1 NAG O6 O 14.289 -0.164 -3.863 1.00 . B A . 101 NAG O6 1 1 19 10602 2 2 1 NAG O7 O 10.987 5.337 -2.474 1.00 . B A . 101 NAG O7 1 1 20 10603 1 1 1 LYS C C -10.205 0.019 -3.928 1.00 . A A . 1 LYS C 1 1 20 10604 1 1 1 LYS CA C -11.121 0.800 -2.996 1.00 . A A . 1 LYS CA 1 1 20 10605 1 1 1 LYS CB C -10.383 1.706 -1.998 1.00 . A A . 1 LYS CB 1 1 20 10606 1 1 1 LYS CD C -8.795 3.539 -1.515 1.00 . A A . 1 LYS CD 1 1 20 10607 1 1 1 LYS CE C -7.798 4.582 -2.011 1.00 . A A . 1 LYS CE 1 1 20 10608 1 1 1 LYS CG C -9.424 2.718 -2.642 1.00 . A A . 1 LYS CG 1 1 20 10609 1 1 1 LYS H1 H -12.461 -0.789 -2.932 1.00 . A A . 1 LYS H1 1 1 20 10610 1 1 1 LYS H2 H -12.791 0.428 -1.857 1.00 . A A . 1 LYS H2 1 1 20 10611 1 1 1 LYS H3 H -11.590 -0.580 -1.524 1.00 . A A . 1 LYS H3 1 1 20 10612 1 1 1 LYS HA H -11.718 1.444 -3.642 1.00 . A A . 1 LYS HA 1 1 20 10613 1 1 1 LYS HB2 H -11.130 2.273 -1.443 1.00 . A A . 1 LYS HB2 1 1 20 10614 1 1 1 LYS HB3 H -9.831 1.086 -1.290 1.00 . A A . 1 LYS HB3 1 1 20 10615 1 1 1 LYS HD2 H -9.590 4.044 -0.969 1.00 . A A . 1 LYS HD2 1 1 20 10616 1 1 1 LYS HD3 H -8.277 2.861 -0.838 1.00 . A A . 1 LYS HD3 1 1 20 10617 1 1 1 LYS HE2 H -7.071 4.102 -2.672 1.00 . A A . 1 LYS HE2 1 1 20 10618 1 1 1 LYS HE3 H -8.327 5.353 -2.576 1.00 . A A . 1 LYS HE3 1 1 20 10619 1 1 1 LYS HG2 H -8.638 2.204 -3.196 1.00 . A A . 1 LYS HG2 1 1 20 10620 1 1 1 LYS HG3 H -9.976 3.375 -3.316 1.00 . A A . 1 LYS HG3 1 1 20 10621 1 1 1 LYS HZ1 H -6.565 4.455 -0.368 1.00 . A A . 1 LYS HZ1 1 1 20 10622 1 1 1 LYS HZ2 H -6.392 5.865 -1.165 1.00 . A A . 1 LYS HZ2 1 1 20 10623 1 1 1 LYS HZ3 H -7.748 5.582 -0.189 1.00 . A A . 1 LYS HZ3 1 1 20 10624 1 1 1 LYS N N -12.050 -0.118 -2.299 1.00 . A A . 1 LYS N 1 1 20 10625 1 1 1 LYS NZ N -7.096 5.178 -0.857 1.00 . A A . 1 LYS NZ 1 1 20 10626 1 1 1 LYS O O -10.553 -0.096 -5.097 1.00 . A A . 1 LYS O 1 1 20 10627 1 1 2 LEU C C -9.056 -2.751 -4.574 1.00 . A A . 2 LEU C 1 1 20 10628 1 1 2 LEU CA C -8.281 -1.445 -4.270 1.00 . A A . 2 LEU CA 1 1 20 10629 1 1 2 LEU CB C -6.872 -1.651 -3.673 1.00 . A A . 2 LEU CB 1 1 20 10630 1 1 2 LEU CD1 C -7.231 -3.445 -1.845 1.00 . A A . 2 LEU CD1 1 1 20 10631 1 1 2 LEU CD2 C -5.222 -2.001 -1.839 1.00 . A A . 2 LEU CD2 1 1 20 10632 1 1 2 LEU CG C -6.708 -2.049 -2.188 1.00 . A A . 2 LEU CG 1 1 20 10633 1 1 2 LEU H H -8.825 -0.444 -2.476 1.00 . A A . 2 LEU H 1 1 20 10634 1 1 2 LEU HA H -8.129 -0.933 -5.220 1.00 . A A . 2 LEU HA 1 1 20 10635 1 1 2 LEU HB2 H -6.349 -2.388 -4.284 1.00 . A A . 2 LEU HB2 1 1 20 10636 1 1 2 LEU HB3 H -6.344 -0.706 -3.810 1.00 . A A . 2 LEU HB3 1 1 20 10637 1 1 2 LEU HD11 H -6.874 -3.747 -0.860 1.00 . A A . 2 LEU HD11 1 1 20 10638 1 1 2 LEU HD12 H -8.317 -3.448 -1.828 1.00 . A A . 2 LEU HD12 1 1 20 10639 1 1 2 LEU HD13 H -6.877 -4.172 -2.577 1.00 . A A . 2 LEU HD13 1 1 20 10640 1 1 2 LEU HD21 H -4.807 -1.016 -2.056 1.00 . A A . 2 LEU HD21 1 1 20 10641 1 1 2 LEU HD22 H -5.108 -2.196 -0.776 1.00 . A A . 2 LEU HD22 1 1 20 10642 1 1 2 LEU HD23 H -4.679 -2.758 -2.403 1.00 . A A . 2 LEU HD23 1 1 20 10643 1 1 2 LEU HG H -7.203 -1.326 -1.539 1.00 . A A . 2 LEU HG 1 1 20 10644 1 1 2 LEU N N -9.083 -0.538 -3.445 1.00 . A A . 2 LEU N 1 1 20 10645 1 1 2 LEU O O -9.867 -3.177 -3.747 1.00 . A A . 2 LEU O 1 1 20 10646 1 1 3 PRO C C -8.921 -5.851 -5.537 1.00 . A A . 3 PRO C 1 1 20 10647 1 1 3 PRO CA C -9.574 -4.586 -6.144 1.00 . A A . 3 PRO CA 1 1 20 10648 1 1 3 PRO CB C -9.556 -4.569 -7.678 1.00 . A A . 3 PRO CB 1 1 20 10649 1 1 3 PRO CD C -8.079 -2.854 -6.876 1.00 . A A . 3 PRO CD 1 1 20 10650 1 1 3 PRO CG C -8.260 -3.845 -8.022 1.00 . A A . 3 PRO CG 1 1 20 10651 1 1 3 PRO HA H -10.608 -4.531 -5.805 1.00 . A A . 3 PRO HA 1 1 20 10652 1 1 3 PRO HB2 H -9.571 -5.564 -8.120 1.00 . A A . 3 PRO HB2 1 1 20 10653 1 1 3 PRO HB3 H -10.402 -3.983 -8.042 1.00 . A A . 3 PRO HB3 1 1 20 10654 1 1 3 PRO HD2 H -7.024 -2.779 -6.607 1.00 . A A . 3 PRO HD2 1 1 20 10655 1 1 3 PRO HD3 H -8.463 -1.880 -7.181 1.00 . A A . 3 PRO HD3 1 1 20 10656 1 1 3 PRO HG2 H -7.451 -4.568 -8.026 1.00 . A A . 3 PRO HG2 1 1 20 10657 1 1 3 PRO HG3 H -8.323 -3.340 -8.987 1.00 . A A . 3 PRO HG3 1 1 20 10658 1 1 3 PRO N N -8.872 -3.361 -5.761 1.00 . A A . 3 PRO N 1 1 20 10659 1 1 3 PRO O O -7.836 -5.774 -4.950 1.00 . A A . 3 PRO O 1 1 20 10660 1 1 4 PRO C C -7.563 -8.593 -5.533 1.00 . A A . 4 PRO C 1 1 20 10661 1 1 4 PRO CA C -9.036 -8.313 -5.195 1.00 . A A . 4 PRO CA 1 1 20 10662 1 1 4 PRO CB C -9.959 -9.383 -5.783 1.00 . A A . 4 PRO CB 1 1 20 10663 1 1 4 PRO CD C -10.888 -7.237 -6.243 1.00 . A A . 4 PRO CD 1 1 20 10664 1 1 4 PRO CG C -11.298 -8.659 -5.866 1.00 . A A . 4 PRO CG 1 1 20 10665 1 1 4 PRO HA H -9.153 -8.319 -4.111 1.00 . A A . 4 PRO HA 1 1 20 10666 1 1 4 PRO HB2 H -9.630 -9.654 -6.788 1.00 . A A . 4 PRO HB2 1 1 20 10667 1 1 4 PRO HB3 H -10.015 -10.266 -5.146 1.00 . A A . 4 PRO HB3 1 1 20 10668 1 1 4 PRO HD2 H -10.846 -7.159 -7.330 1.00 . A A . 4 PRO HD2 1 1 20 10669 1 1 4 PRO HD3 H -11.609 -6.524 -5.841 1.00 . A A . 4 PRO HD3 1 1 20 10670 1 1 4 PRO HG2 H -11.956 -9.103 -6.614 1.00 . A A . 4 PRO HG2 1 1 20 10671 1 1 4 PRO HG3 H -11.777 -8.654 -4.885 1.00 . A A . 4 PRO HG3 1 1 20 10672 1 1 4 PRO N N -9.557 -7.035 -5.680 1.00 . A A . 4 PRO N 1 1 20 10673 1 1 4 PRO O O -7.078 -8.311 -6.632 1.00 . A A . 4 PRO O 1 1 20 10674 1 1 5 GLY C C -4.401 -8.601 -4.381 1.00 . A A . 5 GLY C 1 1 20 10675 1 1 5 GLY CA C -5.475 -9.641 -4.701 1.00 . A A . 5 GLY CA 1 1 20 10676 1 1 5 GLY H H -7.306 -9.358 -3.677 1.00 . A A . 5 GLY H 1 1 20 10677 1 1 5 GLY HA2 H -5.325 -10.490 -4.036 1.00 . A A . 5 GLY HA2 1 1 20 10678 1 1 5 GLY HA3 H -5.314 -9.982 -5.724 1.00 . A A . 5 GLY HA3 1 1 20 10679 1 1 5 GLY N N -6.855 -9.174 -4.561 1.00 . A A . 5 GLY N 1 1 20 10680 1 1 5 GLY O O -3.257 -8.994 -4.182 1.00 . A A . 5 GLY O 1 1 20 10681 1 1 6 TRP C C -3.684 -6.158 -2.402 1.00 . A A . 6 TRP C 1 1 20 10682 1 1 6 TRP CA C -3.797 -6.243 -3.932 1.00 . A A . 6 TRP CA 1 1 20 10683 1 1 6 TRP CB C -4.273 -4.912 -4.527 1.00 . A A . 6 TRP CB 1 1 20 10684 1 1 6 TRP CD1 C -5.177 -5.322 -6.856 1.00 . A A . 6 TRP CD1 1 1 20 10685 1 1 6 TRP CD2 C -3.273 -4.135 -6.880 1.00 . A A . 6 TRP CD2 1 1 20 10686 1 1 6 TRP CE2 C -3.698 -4.273 -8.236 1.00 . A A . 6 TRP CE2 1 1 20 10687 1 1 6 TRP CE3 C -2.069 -3.432 -6.657 1.00 . A A . 6 TRP CE3 1 1 20 10688 1 1 6 TRP CG C -4.245 -4.810 -6.023 1.00 . A A . 6 TRP CG 1 1 20 10689 1 1 6 TRP CH2 C -1.802 -3.023 -9.057 1.00 . A A . 6 TRP CH2 1 1 20 10690 1 1 6 TRP CZ2 C -2.986 -3.732 -9.316 1.00 . A A . 6 TRP CZ2 1 1 20 10691 1 1 6 TRP CZ3 C -1.347 -2.885 -7.735 1.00 . A A . 6 TRP CZ3 1 1 20 10692 1 1 6 TRP H H -5.683 -7.002 -4.489 1.00 . A A . 6 TRP H 1 1 20 10693 1 1 6 TRP HA H -2.810 -6.453 -4.335 1.00 . A A . 6 TRP HA 1 1 20 10694 1 1 6 TRP HB2 H -5.292 -4.716 -4.193 1.00 . A A . 6 TRP HB2 1 1 20 10695 1 1 6 TRP HB3 H -3.643 -4.122 -4.128 1.00 . A A . 6 TRP HB3 1 1 20 10696 1 1 6 TRP HD1 H -6.053 -5.877 -6.541 1.00 . A A . 6 TRP HD1 1 1 20 10697 1 1 6 TRP HE1 H -5.415 -5.283 -8.960 1.00 . A A . 6 TRP HE1 1 1 20 10698 1 1 6 TRP HE3 H -1.701 -3.310 -5.648 1.00 . A A . 6 TRP HE3 1 1 20 10699 1 1 6 TRP HH2 H -1.241 -2.586 -9.871 1.00 . A A . 6 TRP HH2 1 1 20 10700 1 1 6 TRP HZ2 H -3.343 -3.857 -10.326 1.00 . A A . 6 TRP HZ2 1 1 20 10701 1 1 6 TRP HZ3 H -0.439 -2.340 -7.550 1.00 . A A . 6 TRP HZ3 1 1 20 10702 1 1 6 TRP N N -4.730 -7.302 -4.322 1.00 . A A . 6 TRP N 1 1 20 10703 1 1 6 TRP NE1 N -4.853 -5.015 -8.163 1.00 . A A . 6 TRP NE1 1 1 20 10704 1 1 6 TRP O O -4.592 -5.653 -1.744 1.00 . A A . 6 TRP O 1 1 20 10705 1 1 7 GLU C C -1.096 -6.300 0.191 1.00 . A A . 7 GLU C 1 1 20 10706 1 1 7 GLU CA C -2.436 -6.816 -0.375 1.00 . A A . 7 GLU CA 1 1 20 10707 1 1 7 GLU CB C -2.784 -8.270 0.003 1.00 . A A . 7 GLU CB 1 1 20 10708 1 1 7 GLU CD C -0.593 -9.614 -0.113 1.00 . A A . 7 GLU CD 1 1 20 10709 1 1 7 GLU CG C -1.992 -9.401 -0.688 1.00 . A A . 7 GLU CG 1 1 20 10710 1 1 7 GLU H H -1.861 -7.083 -2.410 1.00 . A A . 7 GLU H 1 1 20 10711 1 1 7 GLU HA H -3.201 -6.204 0.104 1.00 . A A . 7 GLU HA 1 1 20 10712 1 1 7 GLU HB2 H -2.722 -8.382 1.085 1.00 . A A . 7 GLU HB2 1 1 20 10713 1 1 7 GLU HB3 H -3.834 -8.420 -0.257 1.00 . A A . 7 GLU HB3 1 1 20 10714 1 1 7 GLU HG2 H -2.551 -10.328 -0.552 1.00 . A A . 7 GLU HG2 1 1 20 10715 1 1 7 GLU HG3 H -1.932 -9.213 -1.760 1.00 . A A . 7 GLU HG3 1 1 20 10716 1 1 7 GLU N N -2.578 -6.646 -1.827 1.00 . A A . 7 GLU N 1 1 20 10717 1 1 7 GLU O O -0.075 -6.264 -0.496 1.00 . A A . 7 GLU O 1 1 20 10718 1 1 7 GLU OE1 O -0.426 -9.518 1.127 1.00 . A A . 7 GLU OE1 1 1 20 10719 1 1 7 GLU OE2 O 0.369 -9.879 -0.868 1.00 . A A . 7 GLU OE2 1 1 20 10720 1 1 8 LYS C C 1.329 -5.787 2.150 1.00 . A A . 8 LYS C 1 1 20 10721 1 1 8 LYS CA C -0.060 -5.117 2.154 1.00 . A A . 8 LYS CA 1 1 20 10722 1 1 8 LYS CB C -0.520 -4.687 3.567 1.00 . A A . 8 LYS CB 1 1 20 10723 1 1 8 LYS CD C -1.535 -6.706 4.958 1.00 . A A . 8 LYS CD 1 1 20 10724 1 1 8 LYS CE C -1.741 -7.786 3.885 1.00 . A A . 8 LYS CE 1 1 20 10725 1 1 8 LYS CG C -0.401 -5.680 4.744 1.00 . A A . 8 LYS CG 1 1 20 10726 1 1 8 LYS H H -2.027 -5.836 1.914 1.00 . A A . 8 LYS H 1 1 20 10727 1 1 8 LYS HA H 0.056 -4.188 1.591 1.00 . A A . 8 LYS HA 1 1 20 10728 1 1 8 LYS HB2 H 0.095 -3.826 3.833 1.00 . A A . 8 LYS HB2 1 1 20 10729 1 1 8 LYS HB3 H -1.547 -4.323 3.518 1.00 . A A . 8 LYS HB3 1 1 20 10730 1 1 8 LYS HD2 H -1.344 -7.212 5.905 1.00 . A A . 8 LYS HD2 1 1 20 10731 1 1 8 LYS HD3 H -2.473 -6.160 5.072 1.00 . A A . 8 LYS HD3 1 1 20 10732 1 1 8 LYS HE2 H -2.510 -8.483 4.230 1.00 . A A . 8 LYS HE2 1 1 20 10733 1 1 8 LYS HE3 H -2.119 -7.317 2.979 1.00 . A A . 8 LYS HE3 1 1 20 10734 1 1 8 LYS HG2 H 0.562 -6.186 4.713 1.00 . A A . 8 LYS HG2 1 1 20 10735 1 1 8 LYS HG3 H -0.378 -5.071 5.649 1.00 . A A . 8 LYS HG3 1 1 20 10736 1 1 8 LYS HZ1 H -0.616 -9.081 2.710 1.00 . A A . 8 LYS HZ1 1 1 20 10737 1 1 8 LYS HZ2 H 0.250 -7.881 3.350 1.00 . A A . 8 LYS HZ2 1 1 20 10738 1 1 8 LYS HZ3 H -0.221 -9.136 4.329 1.00 . A A . 8 LYS HZ3 1 1 20 10739 1 1 8 LYS N N -1.130 -5.847 1.456 1.00 . A A . 8 LYS N 1 1 20 10740 1 1 8 LYS NZ N -0.503 -8.530 3.575 1.00 . A A . 8 LYS NZ 1 1 20 10741 1 1 8 LYS O O 1.483 -6.950 2.542 1.00 . A A . 8 LYS O 1 1 20 10742 1 1 9 ARG C C 4.713 -4.311 1.842 1.00 . A A . 9 ARG C 1 1 20 10743 1 1 9 ARG CA C 3.725 -5.434 1.478 1.00 . A A . 9 ARG CA 1 1 20 10744 1 1 9 ARG CB C 3.742 -5.756 -0.022 1.00 . A A . 9 ARG CB 1 1 20 10745 1 1 9 ARG CD C 5.365 -7.859 -0.081 1.00 . A A . 9 ARG CD 1 1 20 10746 1 1 9 ARG CG C 4.975 -6.457 -0.595 1.00 . A A . 9 ARG CG 1 1 20 10747 1 1 9 ARG CZ C 3.202 -9.059 0.353 1.00 . A A . 9 ARG CZ 1 1 20 10748 1 1 9 ARG H H 2.149 -4.099 1.372 1.00 . A A . 9 ARG H 1 1 20 10749 1 1 9 ARG HA H 3.971 -6.309 2.074 1.00 . A A . 9 ARG HA 1 1 20 10750 1 1 9 ARG HB2 H 2.875 -6.373 -0.262 1.00 . A A . 9 ARG HB2 1 1 20 10751 1 1 9 ARG HB3 H 3.608 -4.820 -0.567 1.00 . A A . 9 ARG HB3 1 1 20 10752 1 1 9 ARG HD2 H 5.610 -8.492 -0.936 1.00 . A A . 9 ARG HD2 1 1 20 10753 1 1 9 ARG HD3 H 6.271 -7.761 0.521 1.00 . A A . 9 ARG HD3 1 1 20 10754 1 1 9 ARG HE H 4.431 -8.418 1.748 1.00 . A A . 9 ARG HE 1 1 20 10755 1 1 9 ARG HG2 H 4.753 -6.514 -1.653 1.00 . A A . 9 ARG HG2 1 1 20 10756 1 1 9 ARG HG3 H 5.843 -5.816 -0.486 1.00 . A A . 9 ARG HG3 1 1 20 10757 1 1 9 ARG HH11 H 3.638 -9.323 -1.613 1.00 . A A . 9 ARG HH11 1 1 20 10758 1 1 9 ARG HH12 H 1.987 -9.714 -1.061 1.00 . A A . 9 ARG HH12 1 1 20 10759 1 1 9 ARG HH21 H 2.191 -8.516 1.964 1.00 . A A . 9 ARG HH21 1 1 20 10760 1 1 9 ARG HH22 H 1.329 -9.538 0.871 1.00 . A A . 9 ARG HH22 1 1 20 10761 1 1 9 ARG N N 2.347 -5.026 1.740 1.00 . A A . 9 ARG N 1 1 20 10762 1 1 9 ARG NE N 4.331 -8.496 0.750 1.00 . A A . 9 ARG NE 1 1 20 10763 1 1 9 ARG NH1 N 2.966 -9.427 -0.878 1.00 . A A . 9 ARG NH1 1 1 20 10764 1 1 9 ARG NH2 N 2.243 -9.201 1.220 1.00 . A A . 9 ARG NH2 1 1 20 10765 1 1 9 ARG O O 4.306 -3.193 2.150 1.00 . A A . 9 ARG O 1 1 20 10766 1 1 10 MET C C 8.406 -3.983 1.544 1.00 . A A . 10 MET C 1 1 20 10767 1 1 10 MET CA C 7.077 -3.721 2.265 1.00 . A A . 10 MET CA 1 1 20 10768 1 1 10 MET CB C 7.244 -3.878 3.791 1.00 . A A . 10 MET CB 1 1 20 10769 1 1 10 MET CE C 7.616 -7.989 4.700 1.00 . A A . 10 MET CE 1 1 20 10770 1 1 10 MET CG C 7.725 -5.255 4.283 1.00 . A A . 10 MET CG 1 1 20 10771 1 1 10 MET H H 6.314 -5.527 1.519 1.00 . A A . 10 MET H 1 1 20 10772 1 1 10 MET HA H 6.780 -2.694 2.064 1.00 . A A . 10 MET HA 1 1 20 10773 1 1 10 MET HB2 H 7.965 -3.131 4.128 1.00 . A A . 10 MET HB2 1 1 20 10774 1 1 10 MET HB3 H 6.294 -3.655 4.277 1.00 . A A . 10 MET HB3 1 1 20 10775 1 1 10 MET HE1 H 8.523 -8.065 4.099 1.00 . A A . 10 MET HE1 1 1 20 10776 1 1 10 MET HE2 H 7.883 -7.783 5.737 1.00 . A A . 10 MET HE2 1 1 20 10777 1 1 10 MET HE3 H 7.069 -8.930 4.648 1.00 . A A . 10 MET HE3 1 1 20 10778 1 1 10 MET HG2 H 8.668 -5.497 3.793 1.00 . A A . 10 MET HG2 1 1 20 10779 1 1 10 MET HG3 H 7.931 -5.169 5.351 1.00 . A A . 10 MET HG3 1 1 20 10780 1 1 10 MET N N 6.015 -4.601 1.782 1.00 . A A . 10 MET N 1 1 20 10781 1 1 10 MET O O 8.756 -5.124 1.246 1.00 . A A . 10 MET O 1 1 20 10782 1 1 10 MET SD S 6.577 -6.650 4.061 1.00 . A A . 10 MET SD 1 1 20 10783 1 1 11 PHE C C 11.531 -3.015 1.780 1.00 . A A . 11 PHE C 1 1 20 10784 1 1 11 PHE CA C 10.474 -2.915 0.669 1.00 . A A . 11 PHE CA 1 1 20 10785 1 1 11 PHE CB C 10.680 -1.640 -0.155 1.00 . A A . 11 PHE CB 1 1 20 10786 1 1 11 PHE CD1 C 10.383 -2.522 -2.499 1.00 . A A . 11 PHE CD1 1 1 20 10787 1 1 11 PHE CD2 C 8.893 -0.742 -1.747 1.00 . A A . 11 PHE CD2 1 1 20 10788 1 1 11 PHE CE1 C 9.768 -2.514 -3.762 1.00 . A A . 11 PHE CE1 1 1 20 10789 1 1 11 PHE CE2 C 8.282 -0.737 -3.016 1.00 . A A . 11 PHE CE2 1 1 20 10790 1 1 11 PHE CG C 9.955 -1.635 -1.489 1.00 . A A . 11 PHE CG 1 1 20 10791 1 1 11 PHE CZ C 8.719 -1.617 -4.020 1.00 . A A . 11 PHE CZ 1 1 20 10792 1 1 11 PHE H H 8.724 -1.989 1.436 1.00 . A A . 11 PHE H 1 1 20 10793 1 1 11 PHE HA H 10.583 -3.760 -0.006 1.00 . A A . 11 PHE HA 1 1 20 10794 1 1 11 PHE HB2 H 10.367 -0.788 0.441 1.00 . A A . 11 PHE HB2 1 1 20 10795 1 1 11 PHE HB3 H 11.743 -1.519 -0.363 1.00 . A A . 11 PHE HB3 1 1 20 10796 1 1 11 PHE HD1 H 11.209 -3.195 -2.324 1.00 . A A . 11 PHE HD1 1 1 20 10797 1 1 11 PHE HD2 H 8.504 -0.080 -0.980 1.00 . A A . 11 PHE HD2 1 1 20 10798 1 1 11 PHE HE1 H 10.103 -3.186 -4.539 1.00 . A A . 11 PHE HE1 1 1 20 10799 1 1 11 PHE HE2 H 7.451 -0.082 -3.226 1.00 . A A . 11 PHE HE2 1 1 20 10800 1 1 11 PHE HZ H 8.245 -1.605 -4.991 1.00 . A A . 11 PHE HZ 1 1 20 10801 1 1 11 PHE N N 9.126 -2.901 1.234 1.00 . A A . 11 PHE N 1 1 20 10802 1 1 11 PHE O O 11.304 -2.572 2.906 1.00 . A A . 11 PHE O 1 1 20 10803 1 1 12 ALA C C 14.370 -2.407 3.034 1.00 . A A . 12 ALA C 1 1 20 10804 1 1 12 ALA CA C 13.832 -3.707 2.395 1.00 . A A . 12 ALA CA 1 1 20 10805 1 1 12 ALA CB C 14.954 -4.467 1.677 1.00 . A A . 12 ALA CB 1 1 20 10806 1 1 12 ALA H H 12.880 -3.864 0.511 1.00 . A A . 12 ALA H 1 1 20 10807 1 1 12 ALA HA H 13.471 -4.333 3.213 1.00 . A A . 12 ALA HA 1 1 20 10808 1 1 12 ALA HB1 H 15.761 -4.676 2.379 1.00 . A A . 12 ALA HB1 1 1 20 10809 1 1 12 ALA HB2 H 14.575 -5.415 1.290 1.00 . A A . 12 ALA HB2 1 1 20 10810 1 1 12 ALA HB3 H 15.346 -3.869 0.852 1.00 . A A . 12 ALA HB3 1 1 20 10811 1 1 12 ALA N N 12.727 -3.517 1.446 1.00 . A A . 12 ALA N 1 1 20 10812 1 1 12 ALA O O 15.069 -2.465 4.041 1.00 . A A . 12 ALA O 1 1 20 10813 1 1 13 ASN C C 13.193 0.545 4.061 1.00 . A A . 13 ASN C 1 1 20 10814 1 1 13 ASN CA C 14.288 0.081 3.066 1.00 . A A . 13 ASN CA 1 1 20 10815 1 1 13 ASN CB C 14.493 1.092 1.915 1.00 . A A . 13 ASN CB 1 1 20 10816 1 1 13 ASN CG C 13.272 1.252 1.012 1.00 . A A . 13 ASN CG 1 1 20 10817 1 1 13 ASN H H 13.425 -1.258 1.669 1.00 . A A . 13 ASN H 1 1 20 10818 1 1 13 ASN HA H 15.218 0.027 3.635 1.00 . A A . 13 ASN HA 1 1 20 10819 1 1 13 ASN HB2 H 14.740 2.069 2.333 1.00 . A A . 13 ASN HB2 1 1 20 10820 1 1 13 ASN HB3 H 15.338 0.765 1.308 1.00 . A A . 13 ASN HB3 1 1 20 10821 1 1 13 ASN HD21 H 14.362 2.120 -0.472 1.00 . A A . 13 ASN HD21 1 1 20 10822 1 1 13 ASN N N 14.022 -1.238 2.481 1.00 . A A . 13 ASN N 1 1 20 10823 1 1 13 ASN ND2 N 13.457 1.781 -0.197 1.00 . A A . 13 ASN ND2 1 1 20 10824 1 1 13 ASN O O 13.301 1.645 4.596 1.00 . A A . 13 ASN O 1 1 20 10825 1 1 13 ASN OD1 O 12.170 0.855 1.385 1.00 . A A . 13 ASN OD1 1 1 20 10826 1 1 14 GLY C C 9.803 0.711 4.456 1.00 . A A . 14 GLY C 1 1 20 10827 1 1 14 GLY CA C 11.011 0.078 5.163 1.00 . A A . 14 GLY CA 1 1 20 10828 1 1 14 GLY H H 12.080 -1.153 3.811 1.00 . A A . 14 GLY H 1 1 20 10829 1 1 14 GLY HA2 H 10.670 -0.840 5.641 1.00 . A A . 14 GLY HA2 1 1 20 10830 1 1 14 GLY HA3 H 11.345 0.762 5.944 1.00 . A A . 14 GLY HA3 1 1 20 10831 1 1 14 GLY N N 12.138 -0.254 4.285 1.00 . A A . 14 GLY N 1 1 20 10832 1 1 14 GLY O O 8.936 1.258 5.133 1.00 . A A . 14 GLY O 1 1 20 10833 1 1 15 THR C C 7.508 0.482 2.096 1.00 . A A . 15 THR C 1 1 20 10834 1 1 15 THR CA C 8.694 1.397 2.358 1.00 . A A . 15 THR CA 1 1 20 10835 1 1 15 THR CB C 9.266 1.953 1.047 1.00 . A A . 15 THR CB 1 1 20 10836 1 1 15 THR CG2 C 8.320 2.872 0.276 1.00 . A A . 15 THR CG2 1 1 20 10837 1 1 15 THR H H 10.409 0.140 2.587 1.00 . A A . 15 THR H 1 1 20 10838 1 1 15 THR HA H 8.351 2.251 2.929 1.00 . A A . 15 THR HA 1 1 20 10839 1 1 15 THR HB H 9.552 1.136 0.396 1.00 . A A . 15 THR HB 1 1 20 10840 1 1 15 THR HG1 H 11.118 2.013 1.507 1.00 . A A . 15 THR HG1 1 1 20 10841 1 1 15 THR HG21 H 8.151 3.790 0.838 1.00 . A A . 15 THR HG21 1 1 20 10842 1 1 15 THR HG22 H 8.770 3.113 -0.691 1.00 . A A . 15 THR HG22 1 1 20 10843 1 1 15 THR HG23 H 7.367 2.374 0.105 1.00 . A A . 15 THR HG23 1 1 20 10844 1 1 15 THR N N 9.719 0.658 3.119 1.00 . A A . 15 THR N 1 1 20 10845 1 1 15 THR O O 7.664 -0.542 1.436 1.00 . A A . 15 THR O 1 1 20 10846 1 1 15 THR OG1 O 10.420 2.692 1.347 1.00 . A A . 15 THR OG1 1 1 20 10847 1 1 16 VAL C C 4.270 0.338 1.371 1.00 . A A . 16 VAL C 1 1 20 10848 1 1 16 VAL CA C 5.133 -0.009 2.581 1.00 . A A . 16 VAL CA 1 1 20 10849 1 1 16 VAL CB C 4.344 0.121 3.905 1.00 . A A . 16 VAL CB 1 1 20 10850 1 1 16 VAL CG1 C 2.890 -0.380 3.846 1.00 . A A . 16 VAL CG1 1 1 20 10851 1 1 16 VAL CG2 C 5.056 -0.697 4.989 1.00 . A A . 16 VAL CG2 1 1 20 10852 1 1 16 VAL H H 6.254 1.711 3.125 1.00 . A A . 16 VAL H 1 1 20 10853 1 1 16 VAL HA H 5.440 -1.046 2.480 1.00 . A A . 16 VAL HA 1 1 20 10854 1 1 16 VAL HB H 4.326 1.169 4.206 1.00 . A A . 16 VAL HB 1 1 20 10855 1 1 16 VAL HG11 H 2.304 0.239 3.166 1.00 . A A . 16 VAL HG11 1 1 20 10856 1 1 16 VAL HG12 H 2.860 -1.417 3.511 1.00 . A A . 16 VAL HG12 1 1 20 10857 1 1 16 VAL HG13 H 2.438 -0.313 4.835 1.00 . A A . 16 VAL HG13 1 1 20 10858 1 1 16 VAL HG21 H 5.005 -1.757 4.733 1.00 . A A . 16 VAL HG21 1 1 20 10859 1 1 16 VAL HG22 H 6.100 -0.392 5.072 1.00 . A A . 16 VAL HG22 1 1 20 10860 1 1 16 VAL HG23 H 4.570 -0.540 5.951 1.00 . A A . 16 VAL HG23 1 1 20 10861 1 1 16 VAL N N 6.329 0.844 2.613 1.00 . A A . 16 VAL N 1 1 20 10862 1 1 16 VAL O O 4.140 1.499 0.981 1.00 . A A . 16 VAL O 1 1 20 10863 1 1 17 TYR C C 1.858 -1.805 -0.434 1.00 . A A . 17 TYR C 1 1 20 10864 1 1 17 TYR CA C 2.858 -0.640 -0.420 1.00 . A A . 17 TYR CA 1 1 20 10865 1 1 17 TYR CB C 3.788 -0.668 -1.650 1.00 . A A . 17 TYR CB 1 1 20 10866 1 1 17 TYR CD1 C 5.880 -1.978 -1.155 1.00 . A A . 17 TYR CD1 1 1 20 10867 1 1 17 TYR CD2 C 4.263 -2.950 -2.691 1.00 . A A . 17 TYR CD2 1 1 20 10868 1 1 17 TYR CE1 C 6.762 -3.043 -1.398 1.00 . A A . 17 TYR CE1 1 1 20 10869 1 1 17 TYR CE2 C 5.154 -4.007 -2.957 1.00 . A A . 17 TYR CE2 1 1 20 10870 1 1 17 TYR CG C 4.644 -1.911 -1.819 1.00 . A A . 17 TYR CG 1 1 20 10871 1 1 17 TYR CZ C 6.419 -4.038 -2.335 1.00 . A A . 17 TYR CZ 1 1 20 10872 1 1 17 TYR H H 3.825 -1.637 1.169 1.00 . A A . 17 TYR H 1 1 20 10873 1 1 17 TYR HA H 2.296 0.296 -0.421 1.00 . A A . 17 TYR HA 1 1 20 10874 1 1 17 TYR HB2 H 3.203 -0.518 -2.554 1.00 . A A . 17 TYR HB2 1 1 20 10875 1 1 17 TYR HB3 H 4.477 0.176 -1.581 1.00 . A A . 17 TYR HB3 1 1 20 10876 1 1 17 TYR HD1 H 6.175 -1.179 -0.491 1.00 . A A . 17 TYR HD1 1 1 20 10877 1 1 17 TYR HD2 H 3.303 -2.935 -3.179 1.00 . A A . 17 TYR HD2 1 1 20 10878 1 1 17 TYR HE1 H 7.719 -3.050 -0.904 1.00 . A A . 17 TYR HE1 1 1 20 10879 1 1 17 TYR HE2 H 4.893 -4.797 -3.641 1.00 . A A . 17 TYR HE2 1 1 20 10880 1 1 17 TYR HH H 8.145 -4.893 -2.217 1.00 . A A . 17 TYR HH 1 1 20 10881 1 1 17 TYR N N 3.698 -0.706 0.772 1.00 . A A . 17 TYR N 1 1 20 10882 1 1 17 TYR O O 1.871 -2.655 0.450 1.00 . A A . 17 TYR O 1 1 20 10883 1 1 17 TYR OH O 7.285 -5.050 -2.612 1.00 . A A . 17 TYR OH 1 1 20 10884 1 1 18 TYR C C 0.542 -3.709 -3.029 1.00 . A A . 18 TYR C 1 1 20 10885 1 1 18 TYR CA C 0.117 -3.002 -1.746 1.00 . A A . 18 TYR CA 1 1 20 10886 1 1 18 TYR CB C -1.339 -2.519 -1.796 1.00 . A A . 18 TYR CB 1 1 20 10887 1 1 18 TYR CD1 C -1.274 -1.187 0.340 1.00 . A A . 18 TYR CD1 1 1 20 10888 1 1 18 TYR CD2 C -2.830 -3.048 0.192 1.00 . A A . 18 TYR CD2 1 1 20 10889 1 1 18 TYR CE1 C -1.554 -1.041 1.699 1.00 . A A . 18 TYR CE1 1 1 20 10890 1 1 18 TYR CE2 C -3.213 -2.826 1.527 1.00 . A A . 18 TYR CE2 1 1 20 10891 1 1 18 TYR CG C -1.855 -2.226 -0.404 1.00 . A A . 18 TYR CG 1 1 20 10892 1 1 18 TYR CZ C -2.543 -1.851 2.301 1.00 . A A . 18 TYR CZ 1 1 20 10893 1 1 18 TYR H H 0.877 -1.051 -2.020 1.00 . A A . 18 TYR H 1 1 20 10894 1 1 18 TYR HA H 0.186 -3.730 -0.937 1.00 . A A . 18 TYR HA 1 1 20 10895 1 1 18 TYR HB2 H -1.416 -1.623 -2.415 1.00 . A A . 18 TYR HB2 1 1 20 10896 1 1 18 TYR HB3 H -1.956 -3.297 -2.246 1.00 . A A . 18 TYR HB3 1 1 20 10897 1 1 18 TYR HD1 H -0.564 -0.510 -0.110 1.00 . A A . 18 TYR HD1 1 1 20 10898 1 1 18 TYR HD2 H -3.308 -3.827 -0.385 1.00 . A A . 18 TYR HD2 1 1 20 10899 1 1 18 TYR HE1 H -0.999 -0.270 2.208 1.00 . A A . 18 TYR HE1 1 1 20 10900 1 1 18 TYR HE2 H -4.021 -3.397 1.954 1.00 . A A . 18 TYR HE2 1 1 20 10901 1 1 18 TYR HH H -2.307 -1.033 4.042 1.00 . A A . 18 TYR HH 1 1 20 10902 1 1 18 TYR N N 1.013 -1.884 -1.459 1.00 . A A . 18 TYR N 1 1 20 10903 1 1 18 TYR O O 0.891 -3.081 -4.031 1.00 . A A . 18 TYR O 1 1 20 10904 1 1 18 TYR OH O -2.871 -1.678 3.610 1.00 . A A . 18 TYR OH 1 1 20 10905 1 1 19 PHE C C -0.005 -6.887 -4.471 1.00 . A A . 19 PHE C 1 1 20 10906 1 1 19 PHE CA C 1.077 -5.935 -3.977 1.00 . A A . 19 PHE CA 1 1 20 10907 1 1 19 PHE CB C 2.228 -6.695 -3.317 1.00 . A A . 19 PHE CB 1 1 20 10908 1 1 19 PHE CD1 C 3.887 -7.371 -5.090 1.00 . A A . 19 PHE CD1 1 1 20 10909 1 1 19 PHE CD2 C 2.478 -9.092 -4.094 1.00 . A A . 19 PHE CD2 1 1 20 10910 1 1 19 PHE CE1 C 4.535 -8.345 -5.863 1.00 . A A . 19 PHE CE1 1 1 20 10911 1 1 19 PHE CE2 C 3.136 -10.071 -4.859 1.00 . A A . 19 PHE CE2 1 1 20 10912 1 1 19 PHE CG C 2.875 -7.744 -4.190 1.00 . A A . 19 PHE CG 1 1 20 10913 1 1 19 PHE CZ C 4.175 -9.699 -5.733 1.00 . A A . 19 PHE CZ 1 1 20 10914 1 1 19 PHE H H 0.239 -5.496 -2.107 1.00 . A A . 19 PHE H 1 1 20 10915 1 1 19 PHE HA H 1.469 -5.370 -4.822 1.00 . A A . 19 PHE HA 1 1 20 10916 1 1 19 PHE HB2 H 2.983 -5.970 -3.021 1.00 . A A . 19 PHE HB2 1 1 20 10917 1 1 19 PHE HB3 H 1.865 -7.174 -2.408 1.00 . A A . 19 PHE HB3 1 1 20 10918 1 1 19 PHE HD1 H 4.176 -6.338 -5.194 1.00 . A A . 19 PHE HD1 1 1 20 10919 1 1 19 PHE HD2 H 1.670 -9.379 -3.434 1.00 . A A . 19 PHE HD2 1 1 20 10920 1 1 19 PHE HE1 H 5.307 -8.029 -6.553 1.00 . A A . 19 PHE HE1 1 1 20 10921 1 1 19 PHE HE2 H 2.841 -11.107 -4.772 1.00 . A A . 19 PHE HE2 1 1 20 10922 1 1 19 PHE HZ H 4.681 -10.454 -6.319 1.00 . A A . 19 PHE HZ 1 1 20 10923 1 1 19 PHE N N 0.526 -5.039 -2.973 1.00 . A A . 19 PHE N 1 1 20 10924 1 1 19 PHE O O -0.642 -7.568 -3.670 1.00 . A A . 19 PHE O 1 1 20 10925 1 1 20 ASN C C -0.580 -9.253 -6.480 1.00 . A A . 20 ASN C 1 1 20 10926 1 1 20 ASN CA C -1.169 -7.838 -6.402 1.00 . A A . 20 ASN CA 1 1 20 10927 1 1 20 ASN CB C -1.596 -7.324 -7.775 1.00 . A A . 20 ASN CB 1 1 20 10928 1 1 20 ASN CG C -2.706 -8.214 -8.303 1.00 . A A . 20 ASN CG 1 1 20 10929 1 1 20 ASN H H 0.355 -6.370 -6.407 1.00 . A A . 20 ASN H 1 1 20 10930 1 1 20 ASN HA H -2.061 -7.872 -5.788 1.00 . A A . 20 ASN HA 1 1 20 10931 1 1 20 ASN HB2 H -1.940 -6.298 -7.706 1.00 . A A . 20 ASN HB2 1 1 20 10932 1 1 20 ASN HB3 H -0.749 -7.349 -8.456 1.00 . A A . 20 ASN HB3 1 1 20 10933 1 1 20 ASN HD21 H -4.176 -7.120 -7.422 1.00 . A A . 20 ASN HD21 1 1 20 10934 1 1 20 ASN HD22 H -4.678 -8.566 -8.269 1.00 . A A . 20 ASN HD22 1 1 20 10935 1 1 20 ASN N N -0.233 -6.917 -5.785 1.00 . A A . 20 ASN N 1 1 20 10936 1 1 20 ASN ND2 N -3.947 -7.945 -7.960 1.00 . A A . 20 ASN ND2 1 1 20 10937 1 1 20 ASN O O 0.151 -9.571 -7.422 1.00 . A A . 20 ASN O 1 1 20 10938 1 1 20 ASN OD1 O -2.442 -9.198 -8.978 1.00 . A A . 20 ASN OD1 1 1 20 10939 1 1 21 HIS C C -0.847 -12.387 -6.676 1.00 . A A . 21 HIS C 1 1 20 10940 1 1 21 HIS CA C -0.394 -11.496 -5.502 1.00 . A A . 21 HIS CA 1 1 20 10941 1 1 21 HIS CB C -0.680 -12.149 -4.140 1.00 . A A . 21 HIS CB 1 1 20 10942 1 1 21 HIS CD2 C -2.575 -13.841 -4.448 1.00 . A A . 21 HIS CD2 1 1 20 10943 1 1 21 HIS CE1 C -4.150 -12.859 -3.263 1.00 . A A . 21 HIS CE1 1 1 20 10944 1 1 21 HIS CG C -2.091 -12.662 -3.955 1.00 . A A . 21 HIS CG 1 1 20 10945 1 1 21 HIS H H -1.558 -9.832 -4.783 1.00 . A A . 21 HIS H 1 1 20 10946 1 1 21 HIS HA H 0.688 -11.419 -5.598 1.00 . A A . 21 HIS HA 1 1 20 10947 1 1 21 HIS HB2 H -0.002 -12.994 -4.021 1.00 . A A . 21 HIS HB2 1 1 20 10948 1 1 21 HIS HB3 H -0.442 -11.438 -3.347 1.00 . A A . 21 HIS HB3 1 1 20 10949 1 1 21 HIS HD2 H -2.025 -14.551 -5.052 1.00 . A A . 21 HIS HD2 1 1 20 10950 1 1 21 HIS HE1 H -5.091 -12.667 -2.766 1.00 . A A . 21 HIS HE1 1 1 20 10951 1 1 21 HIS HE2 H -4.511 -14.706 -4.195 1.00 . A A . 21 HIS HE2 1 1 20 10952 1 1 21 HIS N N -0.929 -10.128 -5.531 1.00 . A A . 21 HIS N 1 1 20 10953 1 1 21 HIS ND1 N -3.089 -12.044 -3.206 1.00 . A A . 21 HIS ND1 1 1 20 10954 1 1 21 HIS NE2 N -3.876 -13.943 -4.011 1.00 . A A . 21 HIS NE2 1 1 20 10955 1 1 21 HIS O O -0.374 -13.517 -6.786 1.00 . A A . 21 HIS O 1 1 20 10956 1 1 22 ILE C C -1.392 -12.351 -9.965 1.00 . A A . 22 ILE C 1 1 20 10957 1 1 22 ILE CA C -2.251 -12.646 -8.714 1.00 . A A . 22 ILE CA 1 1 20 10958 1 1 22 ILE CB C -3.761 -12.326 -8.919 1.00 . A A . 22 ILE CB 1 1 20 10959 1 1 22 ILE CD1 C -6.041 -12.101 -7.682 1.00 . A A . 22 ILE CD1 1 1 20 10960 1 1 22 ILE CG1 C -4.569 -12.532 -7.609 1.00 . A A . 22 ILE CG1 1 1 20 10961 1 1 22 ILE CG2 C -4.365 -13.182 -10.050 1.00 . A A . 22 ILE CG2 1 1 20 10962 1 1 22 ILE H H -2.069 -10.951 -7.451 1.00 . A A . 22 ILE H 1 1 20 10963 1 1 22 ILE HA H -2.164 -13.715 -8.513 1.00 . A A . 22 ILE HA 1 1 20 10964 1 1 22 ILE HB H -3.857 -11.282 -9.210 1.00 . A A . 22 ILE HB 1 1 20 10965 1 1 22 ILE HD11 H -6.608 -12.769 -8.328 1.00 . A A . 22 ILE HD11 1 1 20 10966 1 1 22 ILE HD12 H -6.476 -12.142 -6.682 1.00 . A A . 22 ILE HD12 1 1 20 10967 1 1 22 ILE HD13 H -6.110 -11.079 -8.054 1.00 . A A . 22 ILE HD13 1 1 20 10968 1 1 22 ILE HG12 H -4.524 -13.584 -7.317 1.00 . A A . 22 ILE HG12 1 1 20 10969 1 1 22 ILE HG13 H -4.125 -11.946 -6.804 1.00 . A A . 22 ILE HG13 1 1 20 10970 1 1 22 ILE HG21 H -3.861 -12.982 -10.994 1.00 . A A . 22 ILE HG21 1 1 20 10971 1 1 22 ILE HG22 H -4.269 -14.242 -9.812 1.00 . A A . 22 ILE HG22 1 1 20 10972 1 1 22 ILE HG23 H -5.415 -12.940 -10.200 1.00 . A A . 22 ILE HG23 1 1 20 10973 1 1 22 ILE N N -1.742 -11.905 -7.551 1.00 . A A . 22 ILE N 1 1 20 10974 1 1 22 ILE O O -1.380 -13.142 -10.905 1.00 . A A . 22 ILE O 1 1 20 10975 1 1 23 THR C C 1.512 -10.249 -10.869 1.00 . A A . 23 THR C 1 1 20 10976 1 1 23 THR CA C 0.088 -10.730 -11.153 1.00 . A A . 23 THR CA 1 1 20 10977 1 1 23 THR CB C -0.654 -9.546 -11.793 1.00 . A A . 23 THR CB 1 1 20 10978 1 1 23 THR CG2 C -2.048 -9.903 -12.312 1.00 . A A . 23 THR CG2 1 1 20 10979 1 1 23 THR H H -0.727 -10.628 -9.166 1.00 . A A . 23 THR H 1 1 20 10980 1 1 23 THR HA H 0.165 -11.521 -11.900 1.00 . A A . 23 THR HA 1 1 20 10981 1 1 23 THR HB H -0.065 -9.178 -12.634 1.00 . A A . 23 THR HB 1 1 20 10982 1 1 23 THR HG1 H -1.457 -8.809 -10.195 1.00 . A A . 23 THR HG1 1 1 20 10983 1 1 23 THR HG21 H -2.481 -9.035 -12.810 1.00 . A A . 23 THR HG21 1 1 20 10984 1 1 23 THR HG22 H -1.971 -10.721 -13.030 1.00 . A A . 23 THR HG22 1 1 20 10985 1 1 23 THR HG23 H -2.701 -10.208 -11.495 1.00 . A A . 23 THR HG23 1 1 20 10986 1 1 23 THR N N -0.644 -11.235 -9.974 1.00 . A A . 23 THR N 1 1 20 10987 1 1 23 THR O O 2.322 -10.222 -11.794 1.00 . A A . 23 THR O 1 1 20 10988 1 1 23 THR OG1 O -0.779 -8.510 -10.843 1.00 . A A . 23 THR OG1 1 1 20 10989 1 1 24 ASN C C 3.030 -7.696 -9.356 1.00 . A A . 24 ASN C 1 1 20 10990 1 1 24 ASN CA C 3.040 -9.225 -9.128 1.00 . A A . 24 ASN CA 1 1 20 10991 1 1 24 ASN CB C 4.350 -9.879 -9.621 1.00 . A A . 24 ASN CB 1 1 20 10992 1 1 24 ASN CG C 4.403 -11.388 -9.450 1.00 . A A . 24 ASN CG 1 1 20 10993 1 1 24 ASN H H 1.107 -9.978 -8.901 1.00 . A A . 24 ASN H 1 1 20 10994 1 1 24 ASN HA H 3.018 -9.345 -8.046 1.00 . A A . 24 ASN HA 1 1 20 10995 1 1 24 ASN HB2 H 4.514 -9.630 -10.670 1.00 . A A . 24 ASN HB2 1 1 20 10996 1 1 24 ASN HB3 H 5.184 -9.456 -9.061 1.00 . A A . 24 ASN HB3 1 1 20 10997 1 1 24 ASN HD21 H 3.538 -11.655 -11.246 1.00 . A A . 24 ASN HD21 1 1 20 10998 1 1 24 ASN HD22 H 3.999 -13.122 -10.355 1.00 . A A . 24 ASN HD22 1 1 20 10999 1 1 24 ASN N N 1.826 -9.899 -9.614 1.00 . A A . 24 ASN N 1 1 20 11000 1 1 24 ASN ND2 N 3.964 -12.124 -10.450 1.00 . A A . 24 ASN ND2 1 1 20 11001 1 1 24 ASN O O 4.049 -7.049 -9.111 1.00 . A A . 24 ASN O 1 1 20 11002 1 1 24 ASN OD1 O 4.850 -11.908 -8.441 1.00 . A A . 24 ASN OD1 1 1 20 11003 1 1 25 ALA C C 1.876 -5.019 -8.437 1.00 . A A . 25 ALA C 1 1 20 11004 1 1 25 ALA CA C 1.796 -5.636 -9.852 1.00 . A A . 25 ALA CA 1 1 20 11005 1 1 25 ALA CB C 0.493 -5.264 -10.568 1.00 . A A . 25 ALA CB 1 1 20 11006 1 1 25 ALA H H 1.078 -7.639 -10.009 1.00 . A A . 25 ALA H 1 1 20 11007 1 1 25 ALA HA H 2.629 -5.246 -10.439 1.00 . A A . 25 ALA HA 1 1 20 11008 1 1 25 ALA HB1 H -0.368 -5.584 -9.979 1.00 . A A . 25 ALA HB1 1 1 20 11009 1 1 25 ALA HB2 H 0.447 -4.184 -10.710 1.00 . A A . 25 ALA HB2 1 1 20 11010 1 1 25 ALA HB3 H 0.456 -5.747 -11.545 1.00 . A A . 25 ALA HB3 1 1 20 11011 1 1 25 ALA N N 1.913 -7.098 -9.805 1.00 . A A . 25 ALA N 1 1 20 11012 1 1 25 ALA O O 1.632 -5.702 -7.442 1.00 . A A . 25 ALA O 1 1 20 11013 1 1 26 SER C C 2.001 -1.576 -7.051 1.00 . A A . 26 SER C 1 1 20 11014 1 1 26 SER CA C 2.358 -3.070 -7.012 1.00 . A A . 26 SER CA 1 1 20 11015 1 1 26 SER CB C 3.780 -3.307 -6.484 1.00 . A A . 26 SER CB 1 1 20 11016 1 1 26 SER H H 2.342 -3.137 -9.131 1.00 . A A . 26 SER H 1 1 20 11017 1 1 26 SER HA H 1.673 -3.539 -6.309 1.00 . A A . 26 SER HA 1 1 20 11018 1 1 26 SER HB2 H 3.885 -2.869 -5.494 1.00 . A A . 26 SER HB2 1 1 20 11019 1 1 26 SER HB3 H 3.950 -4.379 -6.390 1.00 . A A . 26 SER HB3 1 1 20 11020 1 1 26 SER HG H 4.764 -3.276 -8.159 1.00 . A A . 26 SER HG 1 1 20 11021 1 1 26 SER N N 2.202 -3.725 -8.321 1.00 . A A . 26 SER N 1 1 20 11022 1 1 26 SER O O 2.098 -0.934 -8.095 1.00 . A A . 26 SER O 1 1 20 11023 1 1 26 SER OG O 4.757 -2.763 -7.346 1.00 . A A . 26 SER OG 1 1 20 11024 1 1 27 GLN C C 1.183 0.783 -4.317 1.00 . A A . 27 GLN C 1 1 20 11025 1 1 27 GLN CA C 0.964 0.298 -5.758 1.00 . A A . 27 GLN CA 1 1 20 11026 1 1 27 GLN CB C -0.537 0.251 -6.117 1.00 . A A . 27 GLN CB 1 1 20 11027 1 1 27 GLN CD C -0.736 2.790 -6.359 1.00 . A A . 27 GLN CD 1 1 20 11028 1 1 27 GLN CG C -1.346 1.515 -5.786 1.00 . A A . 27 GLN CG 1 1 20 11029 1 1 27 GLN H H 1.393 -1.669 -5.111 1.00 . A A . 27 GLN H 1 1 20 11030 1 1 27 GLN HA H 1.476 0.978 -6.441 1.00 . A A . 27 GLN HA 1 1 20 11031 1 1 27 GLN HB2 H -0.626 0.058 -7.187 1.00 . A A . 27 GLN HB2 1 1 20 11032 1 1 27 GLN HB3 H -1.000 -0.583 -5.586 1.00 . A A . 27 GLN HB3 1 1 20 11033 1 1 27 GLN HE21 H -1.391 2.444 -8.266 1.00 . A A . 27 GLN HE21 1 1 20 11034 1 1 27 GLN HE22 H -0.461 3.902 -7.961 1.00 . A A . 27 GLN HE22 1 1 20 11035 1 1 27 GLN HG2 H -2.355 1.397 -6.184 1.00 . A A . 27 GLN HG2 1 1 20 11036 1 1 27 GLN HG3 H -1.434 1.615 -4.704 1.00 . A A . 27 GLN HG3 1 1 20 11037 1 1 27 GLN N N 1.513 -1.054 -5.916 1.00 . A A . 27 GLN N 1 1 20 11038 1 1 27 GLN NE2 N -0.885 3.048 -7.641 1.00 . A A . 27 GLN NE2 1 1 20 11039 1 1 27 GLN O O 0.824 0.085 -3.373 1.00 . A A . 27 GLN O 1 1 20 11040 1 1 27 GLN OE1 O -0.091 3.556 -5.659 1.00 . A A . 27 GLN OE1 1 1 20 11041 1 1 28 PHE C C 0.687 2.950 -2.077 1.00 . A A . 28 PHE C 1 1 20 11042 1 1 28 PHE CA C 1.978 2.567 -2.811 1.00 . A A . 28 PHE CA 1 1 20 11043 1 1 28 PHE CB C 2.894 3.790 -2.944 1.00 . A A . 28 PHE CB 1 1 20 11044 1 1 28 PHE CD1 C 5.152 2.782 -2.457 1.00 . A A . 28 PHE CD1 1 1 20 11045 1 1 28 PHE CD2 C 4.761 3.740 -4.663 1.00 . A A . 28 PHE CD2 1 1 20 11046 1 1 28 PHE CE1 C 6.454 2.424 -2.842 1.00 . A A . 28 PHE CE1 1 1 20 11047 1 1 28 PHE CE2 C 6.069 3.387 -5.045 1.00 . A A . 28 PHE CE2 1 1 20 11048 1 1 28 PHE CG C 4.303 3.437 -3.367 1.00 . A A . 28 PHE CG 1 1 20 11049 1 1 28 PHE CZ C 6.914 2.729 -4.134 1.00 . A A . 28 PHE CZ 1 1 20 11050 1 1 28 PHE H H 1.962 2.558 -4.934 1.00 . A A . 28 PHE H 1 1 20 11051 1 1 28 PHE HA H 2.484 1.836 -2.183 1.00 . A A . 28 PHE HA 1 1 20 11052 1 1 28 PHE HB2 H 2.458 4.497 -3.652 1.00 . A A . 28 PHE HB2 1 1 20 11053 1 1 28 PHE HB3 H 2.957 4.287 -1.975 1.00 . A A . 28 PHE HB3 1 1 20 11054 1 1 28 PHE HD1 H 4.800 2.543 -1.462 1.00 . A A . 28 PHE HD1 1 1 20 11055 1 1 28 PHE HD2 H 4.117 4.244 -5.367 1.00 . A A . 28 PHE HD2 1 1 20 11056 1 1 28 PHE HE1 H 7.094 1.911 -2.143 1.00 . A A . 28 PHE HE1 1 1 20 11057 1 1 28 PHE HE2 H 6.423 3.622 -6.038 1.00 . A A . 28 PHE HE2 1 1 20 11058 1 1 28 PHE HZ H 7.917 2.457 -4.427 1.00 . A A . 28 PHE HZ 1 1 20 11059 1 1 28 PHE N N 1.755 1.976 -4.134 1.00 . A A . 28 PHE N 1 1 20 11060 1 1 28 PHE O O 0.650 2.855 -0.850 1.00 . A A . 28 PHE O 1 1 20 11061 1 1 29 GLU C C -2.307 2.521 -1.460 1.00 . A A . 29 GLU C 1 1 20 11062 1 1 29 GLU CA C -1.636 3.723 -2.153 1.00 . A A . 29 GLU CA 1 1 20 11063 1 1 29 GLU CB C -2.603 4.411 -3.144 1.00 . A A . 29 GLU CB 1 1 20 11064 1 1 29 GLU CD C -3.741 6.005 -1.486 1.00 . A A . 29 GLU CD 1 1 20 11065 1 1 29 GLU CG C -2.910 5.872 -2.769 1.00 . A A . 29 GLU CG 1 1 20 11066 1 1 29 GLU H H -0.280 3.466 -3.804 1.00 . A A . 29 GLU H 1 1 20 11067 1 1 29 GLU HA H -1.389 4.436 -1.366 1.00 . A A . 29 GLU HA 1 1 20 11068 1 1 29 GLU HB2 H -2.172 4.400 -4.146 1.00 . A A . 29 GLU HB2 1 1 20 11069 1 1 29 GLU HB3 H -3.544 3.859 -3.192 1.00 . A A . 29 GLU HB3 1 1 20 11070 1 1 29 GLU HG2 H -1.970 6.417 -2.653 1.00 . A A . 29 GLU HG2 1 1 20 11071 1 1 29 GLU HG3 H -3.456 6.328 -3.597 1.00 . A A . 29 GLU HG3 1 1 20 11072 1 1 29 GLU N N -0.362 3.378 -2.793 1.00 . A A . 29 GLU N 1 1 20 11073 1 1 29 GLU O O -2.151 1.364 -1.852 1.00 . A A . 29 GLU O 1 1 20 11074 1 1 29 GLU OE1 O -3.277 5.598 -0.397 1.00 . A A . 29 GLU OE1 1 1 20 11075 1 1 29 GLU OE2 O -4.892 6.493 -1.523 1.00 . A A . 29 GLU OE2 1 1 20 11076 1 1 30 ARG C C -5.199 2.101 0.746 1.00 . A A . 30 ARG C 1 1 20 11077 1 1 30 ARG CA C -3.685 1.898 0.539 1.00 . A A . 30 ARG CA 1 1 20 11078 1 1 30 ARG CB C -2.832 1.877 1.821 1.00 . A A . 30 ARG CB 1 1 20 11079 1 1 30 ARG CD C -3.767 3.967 3.047 1.00 . A A . 30 ARG CD 1 1 20 11080 1 1 30 ARG CG C -2.542 3.158 2.603 1.00 . A A . 30 ARG CG 1 1 20 11081 1 1 30 ARG CZ C -5.173 5.815 2.113 1.00 . A A . 30 ARG CZ 1 1 20 11082 1 1 30 ARG H H -3.207 3.830 -0.244 1.00 . A A . 30 ARG H 1 1 20 11083 1 1 30 ARG HA H -3.583 0.906 0.097 1.00 . A A . 30 ARG HA 1 1 20 11084 1 1 30 ARG HB2 H -3.239 1.147 2.516 1.00 . A A . 30 ARG HB2 1 1 20 11085 1 1 30 ARG HB3 H -1.851 1.531 1.508 1.00 . A A . 30 ARG HB3 1 1 20 11086 1 1 30 ARG HD2 H -4.593 3.287 3.260 1.00 . A A . 30 ARG HD2 1 1 20 11087 1 1 30 ARG HD3 H -3.511 4.490 3.970 1.00 . A A . 30 ARG HD3 1 1 20 11088 1 1 30 ARG HE H -3.572 5.132 1.227 1.00 . A A . 30 ARG HE 1 1 20 11089 1 1 30 ARG HG2 H -2.003 2.865 3.504 1.00 . A A . 30 ARG HG2 1 1 20 11090 1 1 30 ARG HG3 H -1.854 3.762 2.016 1.00 . A A . 30 ARG HG3 1 1 20 11091 1 1 30 ARG HH11 H -6.245 4.772 3.384 1.00 . A A . 30 ARG HH11 1 1 20 11092 1 1 30 ARG HH12 H -6.865 6.368 3.038 1.00 . A A . 30 ARG HH12 1 1 20 11093 1 1 30 ARG HH21 H -4.675 6.673 0.381 1.00 . A A . 30 ARG HH21 1 1 20 11094 1 1 30 ARG HH22 H -5.967 7.486 1.265 1.00 . A A . 30 ARG HH22 1 1 20 11095 1 1 30 ARG N N -3.092 2.833 -0.425 1.00 . A A . 30 ARG N 1 1 20 11096 1 1 30 ARG NE N -4.160 4.973 2.050 1.00 . A A . 30 ARG NE 1 1 20 11097 1 1 30 ARG NH1 N -6.108 5.715 3.022 1.00 . A A . 30 ARG NH1 1 1 20 11098 1 1 30 ARG NH2 N -5.279 6.762 1.216 1.00 . A A . 30 ARG NH2 1 1 20 11099 1 1 30 ARG O O -5.728 3.139 0.336 1.00 . A A . 30 ARG O 1 1 20 11100 1 1 31 PRO C C -7.889 2.431 2.247 1.00 . A A . 31 PRO C 1 1 20 11101 1 1 31 PRO CA C -7.382 1.185 1.502 1.00 . A A . 31 PRO CA 1 1 20 11102 1 1 31 PRO CB C -7.762 -0.086 2.268 1.00 . A A . 31 PRO CB 1 1 20 11103 1 1 31 PRO CD C -5.467 -0.220 1.665 1.00 . A A . 31 PRO CD 1 1 20 11104 1 1 31 PRO CG C -6.714 -1.089 1.812 1.00 . A A . 31 PRO CG 1 1 20 11105 1 1 31 PRO HA H -7.863 1.140 0.526 1.00 . A A . 31 PRO HA 1 1 20 11106 1 1 31 PRO HB2 H -7.660 0.079 3.343 1.00 . A A . 31 PRO HB2 1 1 20 11107 1 1 31 PRO HB3 H -8.772 -0.419 2.025 1.00 . A A . 31 PRO HB3 1 1 20 11108 1 1 31 PRO HD2 H -4.969 -0.159 2.631 1.00 . A A . 31 PRO HD2 1 1 20 11109 1 1 31 PRO HD3 H -4.801 -0.648 0.917 1.00 . A A . 31 PRO HD3 1 1 20 11110 1 1 31 PRO HG2 H -6.575 -1.878 2.548 1.00 . A A . 31 PRO HG2 1 1 20 11111 1 1 31 PRO HG3 H -6.996 -1.506 0.845 1.00 . A A . 31 PRO HG3 1 1 20 11112 1 1 31 PRO N N -5.939 1.103 1.276 1.00 . A A . 31 PRO N 1 1 20 11113 1 1 31 PRO O O -7.164 3.116 2.973 1.00 . A A . 31 PRO O 1 1 20 11114 1 1 32 SER C C -11.368 3.629 1.785 1.00 . A A . 32 SER C 1 1 20 11115 1 1 32 SER CA C -10.066 3.711 2.586 1.00 . A A . 32 SER CA 1 1 20 11116 1 1 32 SER CB C -9.449 5.121 2.511 1.00 . A A . 32 SER CB 1 1 20 11117 1 1 32 SER H H -9.669 1.955 1.497 1.00 . A A . 32 SER H 1 1 20 11118 1 1 32 SER HA H -10.286 3.497 3.633 1.00 . A A . 32 SER HA 1 1 20 11119 1 1 32 SER HB2 H -10.164 5.834 2.925 1.00 . A A . 32 SER HB2 1 1 20 11120 1 1 32 SER HB3 H -8.553 5.163 3.121 1.00 . A A . 32 SER HB3 1 1 20 11121 1 1 32 SER HG H -10.023 5.345 0.725 1.00 . A A . 32 SER HG 1 1 20 11122 1 1 32 SER N N -9.194 2.650 2.061 1.00 . A A . 32 SER N 1 1 20 11123 1 1 32 SER O O -11.549 4.379 0.821 1.00 . A A . 32 SER O 1 1 20 11124 1 1 32 SER OG O -9.164 5.494 1.174 1.00 . A A . 32 SER OG 1 1 20 11125 1 1 33 GLY C C -13.029 1.304 0.260 1.00 . A A . 33 GLY C 1 1 20 11126 1 1 33 GLY CA C -13.399 2.256 1.394 1.00 . A A . 33 GLY CA 1 1 20 11127 1 1 33 GLY H H -11.959 2.050 2.919 1.00 . A A . 33 GLY H 1 1 20 11128 1 1 33 GLY HA2 H -14.108 1.748 2.045 1.00 . A A . 33 GLY HA2 1 1 20 11129 1 1 33 GLY HA3 H -13.882 3.130 0.957 1.00 . A A . 33 GLY HA3 1 1 20 11130 1 1 33 GLY N N -12.212 2.658 2.153 1.00 . A A . 33 GLY N 1 1 20 11131 1 1 33 GLY O O -13.727 1.333 -0.775 1.00 . A A . 33 GLY O 1 1 20 11132 1 1 33 GLY OXT O -12.017 0.574 0.379 1.00 . A A . 33 GLY OXT 1 1 20 11133 2 2 1 NAG C1 C 12.488 1.569 -1.264 1.00 . B A . 101 NAG C1 1 1 20 11134 2 2 1 NAG C2 C 11.989 2.856 -1.959 1.00 . B A . 101 NAG C2 1 1 20 11135 2 2 1 NAG C3 C 10.940 2.386 -2.983 1.00 . B A . 101 NAG C3 1 1 20 11136 2 2 1 NAG C4 C 11.653 1.535 -4.027 1.00 . B A . 101 NAG C4 1 1 20 11137 2 2 1 NAG C5 C 12.296 0.301 -3.385 1.00 . B A . 101 NAG C5 1 1 20 11138 2 2 1 NAG C6 C 13.121 -0.551 -4.348 1.00 . B A . 101 NAG C6 1 1 20 11139 2 2 1 NAG C7 C 11.208 5.100 -1.312 1.00 . B A . 101 NAG C7 1 1 20 11140 2 2 1 NAG C8 C 10.732 6.004 -0.166 1.00 . B A . 101 NAG C8 1 1 20 11141 2 2 1 NAG H1 H 11.633 1.019 -0.872 1.00 . B A . 101 NAG H1 1 1 20 11142 2 2 1 NAG H2 H 12.818 3.338 -2.480 1.00 . B A . 101 NAG H2 1 1 20 11143 2 2 1 NAG H3 H 10.174 1.786 -2.480 1.00 . B A . 101 NAG H3 1 1 20 11144 2 2 1 NAG H4 H 12.397 2.149 -4.527 1.00 . B A . 101 NAG H4 1 1 20 11145 2 2 1 NAG H5 H 11.500 -0.310 -2.984 1.00 . B A . 101 NAG H5 1 1 20 11146 2 2 1 NAG H61 H 13.332 -1.516 -3.888 1.00 . B A . 101 NAG H61 1 1 20 11147 2 2 1 NAG H62 H 12.587 -0.726 -5.282 1.00 . B A . 101 NAG H62 1 1 20 11148 2 2 1 NAG H81 H 11.313 5.799 0.734 1.00 . B A . 101 NAG H81 1 1 20 11149 2 2 1 NAG H82 H 9.677 5.814 0.034 1.00 . B A . 101 NAG H82 1 1 20 11150 2 2 1 NAG H83 H 10.863 7.050 -0.444 1.00 . B A . 101 NAG H83 1 1 20 11151 2 2 1 NAG HN2 H 11.168 3.482 -0.088 1.00 . B A . 101 NAG HN2 1 1 20 11152 2 2 1 NAG HO3 H 10.661 4.346 -3.320 1.00 . B A . 101 NAG HO3 1 1 20 11153 2 2 1 NAG HO4 H 10.124 1.929 -5.116 1.00 . B A . 101 NAG HO4 1 1 20 11154 2 2 1 NAG HO6 H 14.705 0.410 -3.743 1.00 . B A . 101 NAG HO6 1 1 20 11155 2 2 1 NAG N2 N 11.436 3.823 -1.009 1.00 . B A . 101 NAG N2 1 1 20 11156 2 2 1 NAG O3 O 10.320 3.492 -3.688 1.00 . B A . 101 NAG O3 1 1 20 11157 2 2 1 NAG O4 O 10.651 1.132 -4.965 1.00 . B A . 101 NAG O4 1 1 20 11158 2 2 1 NAG O5 O 13.167 0.729 -2.257 1.00 . B A . 101 NAG O5 1 1 20 11159 2 2 1 NAG O6 O 14.359 0.127 -4.597 1.00 . B A . 101 NAG O6 1 1 20 11160 2 2 1 NAG O7 O 11.343 5.510 -2.464 1.00 . B A . 101 NAG O7 1 1 stop_ save_
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