NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
509937 | 2l7l | 17360 | cing | 4-filtered-FRED | STAR | entry | full | 960 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2l7l # This FRED archive file contains, for PDB entry <2l7l>: # # - 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_2l7l _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2l7l _Assembly.Number_of_components 6 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 19447.46 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 $Calmodulin A . 1 1 2 . 2 $Calcium_calmodulin_dependent_protein_kinase_type_1 B . 1 1 3 . 3 $CALCIUM_ION C . 1 1 4 . 3 $CALCIUM_ION D . 1 1 5 . 3 $CALCIUM_ION E . 1 1 6 . 3 $CALCIUM_ION F . 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 3 3 CA 1 CA 1 1 4 3 CA 1 CA 1 1 5 3 CA 1 CA 1 1 6 3 CA 1 CA 1 1 stop_ save_ save_Calmodulin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Calmodulin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK _Entity.Number_of_monomers 148 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 ALA . 1 1 2 ASP . 1 1 3 GLN . 1 1 4 LEU . 1 1 5 THR . 1 1 6 GLU . 1 1 7 GLU . 1 1 8 GLN . 1 1 9 ILE . 1 1 10 ALA . 1 1 11 GLU . 1 1 12 PHE . 1 1 13 LYS . 1 1 14 GLU . 1 1 15 ALA . 1 1 16 PHE . 1 1 17 SER . 1 1 18 LEU . 1 1 19 PHE . 1 1 20 ASP . 1 1 21 LYS . 1 1 22 ASP . 1 1 23 GLY . 1 1 24 ASP . 1 1 25 GLY . 1 1 26 THR . 1 1 27 ILE . 1 1 28 THR . 1 1 29 THR . 1 1 30 LYS . 1 1 31 GLU . 1 1 32 LEU . 1 1 33 GLY . 1 1 34 THR . 1 1 35 VAL . 1 1 36 MET . 1 1 37 ARG . 1 1 38 SER . 1 1 39 LEU . 1 1 40 GLY . 1 1 41 GLN . 1 1 42 ASN . 1 1 43 PRO . 1 1 44 THR . 1 1 45 GLU . 1 1 46 ALA . 1 1 47 GLU . 1 1 48 LEU . 1 1 49 GLN . 1 1 50 ASP . 1 1 51 MET . 1 1 52 ILE . 1 1 53 ASN . 1 1 54 GLU . 1 1 55 VAL . 1 1 56 ASP . 1 1 57 ALA . 1 1 58 ASP . 1 1 59 GLY . 1 1 60 ASN . 1 1 61 GLY . 1 1 62 THR . 1 1 63 ILE . 1 1 64 ASP . 1 1 65 PHE . 1 1 66 PRO . 1 1 67 GLU . 1 1 68 PHE . 1 1 69 LEU . 1 1 70 THR . 1 1 71 MET . 1 1 72 MET . 1 1 73 ALA . 1 1 74 ARG . 1 1 75 LYS . 1 1 76 MET . 1 1 77 LYS . 1 1 78 ASP . 1 1 79 THR . 1 1 80 ASP . 1 1 81 SER . 1 1 82 GLU . 1 1 83 GLU . 1 1 84 GLU . 1 1 85 ILE . 1 1 86 ARG . 1 1 87 GLU . 1 1 88 ALA . 1 1 89 PHE . 1 1 90 ARG . 1 1 91 VAL . 1 1 92 PHE . 1 1 93 ASP . 1 1 94 LYS . 1 1 95 ASP . 1 1 96 GLY . 1 1 97 ASN . 1 1 98 GLY . 1 1 99 TYR . 1 1 100 ILE . 1 1 101 SER . 1 1 102 ALA . 1 1 103 ALA . 1 1 104 GLU . 1 1 105 LEU . 1 1 106 ARG . 1 1 107 HIS . 1 1 108 VAL . 1 1 109 MET . 1 1 110 THR . 1 1 111 ASN . 1 1 112 LEU . 1 1 113 GLY . 1 1 114 GLU . 1 1 115 LYS . 1 1 116 LEU . 1 1 117 THR . 1 1 118 ASP . 1 1 119 GLU . 1 1 120 GLU . 1 1 121 VAL . 1 1 122 ASP . 1 1 123 GLU . 1 1 124 MET . 1 1 125 ILE . 1 1 126 ARG . 1 1 127 GLU . 1 1 128 ALA . 1 1 129 ASP . 1 1 130 ILE . 1 1 131 ASP . 1 1 132 GLY . 1 1 133 ASP . 1 1 134 GLY . 1 1 135 GLN . 1 1 136 VAL . 1 1 137 ASN . 1 1 138 TYR . 1 1 139 GLU . 1 1 140 GLU . 1 1 141 PHE . 1 1 142 VAL . 1 1 143 GLN . 1 1 144 MET . 1 1 145 MET . 1 1 146 THR . 1 1 147 ALA . 1 1 148 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ALA 1 1 1 1 ASP 2 2 1 1 GLN 3 3 1 1 LEU 4 4 1 1 THR 5 5 1 1 GLU 6 6 1 1 GLU 7 7 1 1 GLN 8 8 1 1 ILE 9 9 1 1 ALA 10 10 1 1 GLU 11 11 1 1 PHE 12 12 1 1 LYS 13 13 1 1 GLU 14 14 1 1 ALA 15 15 1 1 PHE 16 16 1 1 SER 17 17 1 1 LEU 18 18 1 1 PHE 19 19 1 1 ASP 20 20 1 1 LYS 21 21 1 1 ASP 22 22 1 1 GLY 23 23 1 1 ASP 24 24 1 1 GLY 25 25 1 1 THR 26 26 1 1 ILE 27 27 1 1 THR 28 28 1 1 THR 29 29 1 1 LYS 30 30 1 1 GLU 31 31 1 1 LEU 32 32 1 1 GLY 33 33 1 1 THR 34 34 1 1 VAL 35 35 1 1 MET 36 36 1 1 ARG 37 37 1 1 SER 38 38 1 1 LEU 39 39 1 1 GLY 40 40 1 1 GLN 41 41 1 1 ASN 42 42 1 1 PRO 43 43 1 1 THR 44 44 1 1 GLU 45 45 1 1 ALA 46 46 1 1 GLU 47 47 1 1 LEU 48 48 1 1 GLN 49 49 1 1 ASP 50 50 1 1 MET 51 51 1 1 ILE 52 52 1 1 ASN 53 53 1 1 GLU 54 54 1 1 VAL 55 55 1 1 ASP 56 56 1 1 ALA 57 57 1 1 ASP 58 58 1 1 GLY 59 59 1 1 ASN 60 60 1 1 GLY 61 61 1 1 THR 62 62 1 1 ILE 63 63 1 1 ASP 64 64 1 1 PHE 65 65 1 1 PRO 66 66 1 1 GLU 67 67 1 1 PHE 68 68 1 1 LEU 69 69 1 1 THR 70 70 1 1 MET 71 71 1 1 MET 72 72 1 1 ALA 73 73 1 1 ARG 74 74 1 1 LYS 75 75 1 1 MET 76 76 1 1 LYS 77 77 1 1 ASP 78 78 1 1 THR 79 79 1 1 ASP 80 80 1 1 SER 81 81 1 1 GLU 82 82 1 1 GLU 83 83 1 1 GLU 84 84 1 1 ILE 85 85 1 1 ARG 86 86 1 1 GLU 87 87 1 1 ALA 88 88 1 1 PHE 89 89 1 1 ARG 90 90 1 1 VAL 91 91 1 1 PHE 92 92 1 1 ASP 93 93 1 1 LYS 94 94 1 1 ASP 95 95 1 1 GLY 96 96 1 1 ASN 97 97 1 1 GLY 98 98 1 1 TYR 99 99 1 1 ILE 100 100 1 1 SER 101 101 1 1 ALA 102 102 1 1 ALA 103 103 1 1 GLU 104 104 1 1 LEU 105 105 1 1 ARG 106 106 1 1 HIS 107 107 1 1 VAL 108 108 1 1 MET 109 109 1 1 THR 110 110 1 1 ASN 111 111 1 1 LEU 112 112 1 1 GLY 113 113 1 1 GLU 114 114 1 1 LYS 115 115 1 1 LEU 116 116 1 1 THR 117 117 1 1 ASP 118 118 1 1 GLU 119 119 1 1 GLU 120 120 1 1 VAL 121 121 1 1 ASP 122 122 1 1 GLU 123 123 1 1 MET 124 124 1 1 ILE 125 125 1 1 ARG 126 126 1 1 GLU 127 127 1 1 ALA 128 128 1 1 ASP 129 129 1 1 ILE 130 130 1 1 ASP 131 131 1 1 GLY 132 132 1 1 ASP 133 133 1 1 GLY 134 134 1 1 GLN 135 135 1 1 VAL 136 136 1 1 ASN 137 137 1 1 TYR 138 138 1 1 GLU 139 139 1 1 GLU 140 140 1 1 PHE 141 141 1 1 VAL 142 142 1 1 GLN 143 143 1 1 MET 144 144 1 1 MET 145 145 1 1 THR 146 146 1 1 ALA 147 147 1 1 LYS 148 148 1 1 stop_ save_ save_Calcium_calmodulin_dependent_protein_kinase_type_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "Calcium calmodulin dependent protein kinase type 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code AKSKWKQAFNATAVVRHMRKLQ _Entity.Number_of_monomers 22 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 ALA . 1 2 2 LYS . 1 2 3 SER . 1 2 4 LYS . 1 2 5 TRP . 1 2 6 LYS . 1 2 7 GLN . 1 2 8 ALA . 1 2 9 PHE . 1 2 10 ASN . 1 2 11 ALA . 1 2 12 THR . 1 2 13 ALA . 1 2 14 VAL . 1 2 15 VAL . 1 2 16 ARG . 1 2 17 HIS . 1 2 18 MET . 1 2 19 ARG . 1 2 20 LYS . 1 2 21 LEU . 1 2 22 GLN . 1 2 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 ALA 1 1 1 2 LYS 2 2 1 2 SER 3 3 1 2 LYS 4 4 1 2 TRP 5 5 1 2 LYS 6 6 1 2 GLN 7 7 1 2 ALA 8 8 1 2 PHE 9 9 1 2 ASN 10 10 1 2 ALA 11 11 1 2 THR 12 12 1 2 ALA 13 13 1 2 VAL 14 14 1 2 VAL 15 15 1 2 ARG 16 16 1 2 HIS 17 17 1 2 MET 18 18 1 2 ARG 19 19 1 2 LYS 20 20 1 2 LEU 21 21 1 2 GLN 22 22 1 2 stop_ save_ save_CALCIUM_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 3 _Entity.Name "CALCIUM ION" _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 CA $CA 1 3 stop_ save_ save_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID CA _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 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 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 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 2 2 6 LYS HA . 304 . HA 1 1 1 1 2 2 2 10 ASN H . 308 . HN 1 1 2 1 1 2 2 9 PHE QD . 307 . HD# 1 1 2 1 2 2 2 10 ASN H . 308 . HN 1 1 3 1 1 2 2 10 ASN H . 308 . HN 1 1 3 1 2 2 2 11 ALA H . 309 . HN 1 1 4 1 1 2 2 9 PHE H . 307 . HN 1 1 4 1 2 2 2 10 ASN H . 308 . HN 1 1 5 1 1 2 2 9 PHE H . 307 . HN 1 1 5 1 2 2 2 9 PHE QD . 307 . HD# 1 1 6 1 1 2 2 8 ALA H . 306 . HN 1 1 6 1 2 2 2 9 PHE H . 307 . HN 1 1 7 1 1 2 2 6 LYS HA . 304 . HA 1 1 7 1 2 2 2 9 PHE H . 307 . HN 1 1 8 1 1 2 2 8 ALA MB . 306 . HB# 1 1 8 1 2 2 2 9 PHE H . 307 . HN 1 1 9 1 1 2 2 1 ALA MB . 299 . HB# 1 1 9 1 2 2 2 2 LYS H . 300 . HN 1 1 10 1 1 2 2 2 LYS H . 300 . HN 1 1 10 1 2 2 2 3 SER H . 301 . HN 1 1 11 1 1 2 2 1 ALA H1 . 299 . HT* 1 1 11 1 2 2 2 2 LYS H . 300 . HN 1 1 12 1 1 2 2 13 ALA H . 311 . HN 1 1 12 1 2 2 2 14 VAL H . 312 . HN 1 1 13 1 1 2 2 14 VAL H . 312 . HN 1 1 13 1 2 2 2 15 VAL H . 313 . HN 1 1 14 1 1 2 2 11 ALA HA . 309 . HA 1 1 14 1 2 2 2 14 VAL H . 312 . HN 1 1 15 1 1 2 2 14 VAL H . 312 . HN 1 1 15 1 2 2 2 14 VAL HB . 312 . HB 1 1 16 1 1 2 2 13 ALA MB . 311 . HB# 1 1 16 1 2 2 2 14 VAL H . 312 . HN 1 1 17 1 1 2 2 1 ALA H1 . 299 . HT* 1 1 17 1 2 2 2 1 ALA MB . 299 . HB# 1 1 18 1 1 2 2 17 HIS H . 315 . HN 1 1 18 1 2 2 2 18 MET H . 316 . HN 1 1 19 1 1 2 2 18 MET H . 316 . HN 1 1 19 1 2 2 2 19 ARG H . 317 . HN 1 1 20 1 1 2 2 15 VAL HA . 313 . HA 1 1 20 1 2 2 2 18 MET H . 316 . HN 1 1 21 1 1 2 2 14 VAL HA . 312 . HA 1 1 21 1 2 2 2 18 MET H . 316 . HN 1 1 22 1 1 2 2 18 MET H . 316 . HN 1 1 22 1 2 2 2 18 MET ME . 316 . HE# 1 1 23 1 1 2 2 15 VAL MG1 . 313 . HG1# 1 1 23 1 2 2 2 18 MET H . 316 . HN 1 1 24 1 1 2 2 11 ALA H . 309 . HN 1 1 24 1 2 2 2 13 ALA MB . 311 . HB# 1 1 25 1 1 2 2 11 ALA H . 309 . HN 1 1 25 1 2 2 2 12 THR MG . 310 . HG2# 1 1 26 1 1 2 2 11 ALA H . 309 . HN 1 1 26 1 2 2 2 11 ALA MB . 309 . HB# 1 1 27 1 1 2 2 8 ALA MB . 306 . HB# 1 1 27 1 2 2 2 11 ALA H . 309 . HN 1 1 28 1 1 2 2 8 ALA HA . 306 . HA 1 1 28 1 2 2 2 11 ALA H . 309 . HN 1 1 29 1 1 2 2 7 GLN HA . 305 . HA 1 1 29 1 2 2 2 11 ALA H . 309 . HN 1 1 30 1 1 2 2 11 ALA H . 309 . HN 1 1 30 1 2 2 2 12 THR H . 310 . HN 1 1 31 1 1 2 2 12 THR H . 310 . HN 1 1 31 1 2 2 2 13 ALA H . 311 . HN 1 1 32 1 1 2 2 12 THR HG1 . 310 . HG1 1 1 32 1 2 2 2 13 ALA H . 311 . HN 1 1 33 1 1 2 2 10 ASN HA . 308 . HA 1 1 33 1 2 2 2 13 ALA H . 311 . HN 1 1 34 1 1 2 2 11 ALA HA . 309 . HA 1 1 34 1 2 2 2 13 ALA H . 311 . HN 1 1 35 1 1 2 2 12 THR HB . 310 . HB 1 1 35 1 2 2 2 13 ALA H . 311 . HN 1 1 36 1 1 2 2 11 ALA MB . 309 . HB# 1 1 36 1 2 2 2 13 ALA H . 311 . HN 1 1 37 1 1 2 2 12 THR MG . 310 . HG2# 1 1 37 1 2 2 2 13 ALA H . 311 . HN 1 1 38 1 1 2 2 13 ALA H . 311 . HN 1 1 38 1 2 2 2 13 ALA MB . 311 . HB# 1 1 39 1 1 2 2 7 GLN H . 305 . HN 1 1 39 1 2 2 2 8 ALA MB . 306 . HB# 1 1 40 1 1 2 2 4 LYS HA . 302 . HA 1 1 40 1 2 2 2 7 GLN H . 305 . HN 1 1 41 1 1 2 2 3 SER HA . 301 . HA 1 1 41 1 2 2 2 7 GLN H . 305 . HN 1 1 42 1 1 2 2 7 GLN H . 305 . HN 1 1 42 1 2 2 2 8 ALA H . 306 . HN 1 1 43 1 1 2 2 6 LYS H . 304 . HN 1 1 43 1 2 2 2 7 GLN H . 305 . HN 1 1 44 1 1 2 2 4 LYS H . 302 . HN 1 1 44 1 2 2 2 5 TRP H . 303 . HN 1 1 45 1 1 2 2 5 TRP H . 303 . HN 1 1 45 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 46 1 1 2 2 3 SER HA . 301 . HA 1 1 46 1 2 2 2 6 LYS H . 304 . HN 1 1 47 1 1 2 2 1 ALA HA . 299 . HA 1 1 47 1 2 2 2 5 TRP H . 303 . HN 1 1 48 1 1 2 2 5 TRP HB2 . 303 . HB1 1 1 48 1 2 2 2 6 LYS H . 304 . HN 1 1 49 1 1 2 2 5 TRP H . 303 . HN 1 1 49 1 2 2 2 5 TRP HB2 . 303 . HB1 1 1 50 1 1 2 2 5 TRP HB3 . 303 . HB2 1 1 50 1 2 2 2 6 LYS H . 304 . HN 1 1 51 1 1 2 2 5 TRP H . 303 . HN 1 1 51 1 2 2 2 5 TRP HB3 . 303 . HB2 1 1 52 1 1 2 2 2 LYS HA . 300 . HA 1 1 52 1 2 2 2 6 LYS H . 304 . HN 1 1 53 1 1 2 2 3 SER H . 301 . HN 1 1 53 1 2 2 2 6 LYS H . 304 . HN 1 1 54 1 1 2 2 4 LYS H . 302 . HN 1 1 54 1 2 2 2 6 LYS H . 304 . HN 1 1 55 1 1 2 2 14 VAL HA . 312 . HA 1 1 55 1 2 2 2 17 HIS H . 315 . HN 1 1 56 1 1 2 2 15 VAL MG1 . 313 . HG1# 1 1 56 1 2 2 2 17 HIS H . 315 . HN 1 1 57 1 1 2 2 3 SER H . 301 . HN 1 1 57 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 58 1 1 2 2 4 LYS H . 302 . HN 1 1 58 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 59 1 1 2 2 1 ALA MB . 299 . HB# 1 1 59 1 2 2 2 3 SER H . 301 . HN 1 1 60 1 1 2 2 15 VAL MG1 . 313 . HG1# 1 1 60 1 2 2 2 16 ARG H . 314 . HN 1 1 61 1 1 2 2 15 VAL MG2 . 313 . HG2# 1 1 61 1 2 2 2 16 ARG H . 314 . HN 1 1 62 1 1 2 2 15 VAL HB . 313 . HB 1 1 62 1 2 2 2 16 ARG H . 314 . HN 1 1 63 1 1 2 2 12 THR HA . 310 . HA 1 1 63 1 2 2 2 16 ARG H . 314 . HN 1 1 64 1 1 2 2 13 ALA HA . 311 . HA 1 1 64 1 2 2 2 16 ARG H . 314 . HN 1 1 65 1 1 2 2 12 THR HB . 310 . HB 1 1 65 1 2 2 2 16 ARG H . 314 . HN 1 1 66 1 1 2 2 16 ARG H . 314 . HN 1 1 66 1 2 2 2 17 HIS HA . 315 . HA 1 1 67 1 1 2 2 15 VAL H . 313 . HN 1 1 67 1 2 2 2 16 ARG H . 314 . HN 1 1 68 1 1 2 2 15 VAL H . 313 . HN 1 1 68 1 2 2 2 15 VAL MG1 . 313 . HG1# 1 1 69 1 1 2 2 12 THR H . 310 . HN 1 1 69 1 2 2 2 13 ALA MB . 311 . HB# 1 1 70 1 1 2 2 12 THR H . 310 . HN 1 1 70 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 71 1 1 2 2 15 VAL H . 313 . HN 1 1 71 1 2 2 2 15 VAL HB . 313 . HB 1 1 72 1 1 2 2 14 VAL HB . 312 . HB 1 1 72 1 2 2 2 15 VAL H . 313 . HN 1 1 73 1 1 2 2 12 THR HA . 310 . HA 1 1 73 1 2 2 2 15 VAL H . 313 . HN 1 1 74 1 1 2 2 11 ALA HA . 309 . HA 1 1 74 1 2 2 2 15 VAL H . 313 . HN 1 1 75 1 1 2 2 15 VAL MG1 . 313 . HG1# 1 1 75 1 2 2 2 19 ARG H . 317 . HN 1 1 76 1 1 2 2 15 VAL H . 313 . HN 1 1 76 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 77 1 1 2 2 8 ALA H . 306 . HN 1 1 77 1 2 2 2 8 ALA MB . 306 . HB# 1 1 78 1 1 2 2 15 VAL HA . 313 . HA 1 1 78 1 2 2 2 19 ARG H . 317 . HN 1 1 79 1 1 2 2 4 LYS HA . 302 . HA 1 1 79 1 2 2 2 8 ALA H . 306 . HN 1 1 80 1 1 2 2 5 TRP HA . 303 . HA 1 1 80 1 2 2 2 8 ALA H . 306 . HN 1 1 81 1 1 2 2 12 THR H . 310 . HN 1 1 81 1 2 2 2 12 THR HG1 . 310 . HG1 1 1 82 1 1 2 2 21 LEU H . 319 . HN 1 1 82 1 2 2 2 22 GLN H . 320 . HN 1 1 83 1 1 2 2 18 MET HA . 316 . HA 1 1 83 1 2 2 2 20 LYS H . 318 . HN 1 1 84 1 1 2 2 12 THR H . 310 . HN 1 1 84 1 2 2 2 12 THR MG . 310 . HG2# 1 1 85 1 1 2 2 21 LEU H . 319 . HN 1 1 85 1 2 2 2 21 LEU HG . 319 . HG 1 1 86 1 1 2 2 11 ALA MB . 309 . HB# 1 1 86 1 2 2 2 12 THR H . 310 . HN 1 1 87 1 1 2 2 17 HIS HA . 315 . HA 1 1 87 1 2 2 2 17 HIS HE1 . 315 . HE1 1 1 88 1 1 2 2 21 LEU HG . 319 . HG 1 1 88 1 2 2 2 22 GLN H . 320 . HN 1 1 89 1 1 2 2 22 GLN H . 320 . HN 1 1 89 1 2 2 2 22 GLN HB2 . 320 . HB2 1 1 90 1 1 2 2 22 GLN H . 320 . HN 1 1 90 1 2 2 2 22 GLN HB3 . 320 . HB1 1 1 91 1 1 2 2 19 ARG HA . 317 . HA 1 1 91 1 2 2 2 22 GLN H . 320 . HN 1 1 92 1 1 2 2 21 LEU MD1 . 319 . HD1# 1 1 92 1 2 2 2 22 GLN H . 320 . HN 1 1 93 1 1 2 2 21 LEU MD2 . 319 . HD2# 1 1 93 1 2 2 2 22 GLN H . 320 . HN 1 1 94 1 1 2 2 5 TRP HE3 . 303 . HE3 1 1 94 1 2 2 2 8 ALA MB . 306 . HB# 1 1 95 1 1 2 2 5 TRP HB3 . 303 . HB2 1 1 95 1 2 2 2 5 TRP HE3 . 303 . HE3 1 1 96 1 1 2 2 5 TRP HA . 303 . HA 1 1 96 1 2 2 2 5 TRP HE3 . 303 . HE3 1 1 97 1 1 2 2 9 PHE QE . 307 . HE# 1 1 97 1 2 2 2 13 ALA MB . 311 . HB# 1 1 98 1 1 2 2 9 PHE HZ . 307 . HZ 1 1 98 1 2 2 2 13 ALA MB . 311 . HB# 1 1 99 1 1 2 2 9 PHE HZ . 307 . HZ 1 1 99 1 2 2 2 10 ASN HA . 308 . HA 1 1 100 1 1 2 2 9 PHE HA . 307 . HA 1 1 100 1 2 2 2 9 PHE QE . 307 . HE# 1 1 101 1 1 2 2 9 PHE QE . 307 . HE# 1 1 101 1 2 2 2 10 ASN HA . 308 . HA 1 1 102 1 1 2 2 6 LYS HA . 304 . HA 1 1 102 1 2 2 2 9 PHE QE . 307 . HE# 1 1 103 1 1 2 2 5 TRP HB2 . 303 . HB1 1 1 103 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 104 1 1 2 2 9 PHE QD . 307 . HD# 1 1 104 1 2 2 2 13 ALA MB . 311 . HB# 1 1 105 1 1 2 2 9 PHE QD . 307 . HD# 1 1 105 1 2 2 2 12 THR MG . 310 . HG2# 1 1 106 1 1 2 2 1 ALA MB . 299 . HB# 1 1 106 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 107 1 1 2 2 8 ALA MB . 306 . HB# 1 1 107 1 2 2 2 9 PHE QD . 307 . HD# 1 1 108 1 1 2 2 5 TRP HB3 . 303 . HB2 1 1 108 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 109 1 1 2 2 1 ALA HA . 299 . HA 1 1 109 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 110 1 1 2 2 6 LYS HA . 304 . HA 1 1 110 1 2 2 2 9 PHE QD . 307 . HD# 1 1 111 1 1 2 2 2 LYS HA . 300 . HA 1 1 111 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 112 1 1 2 2 9 PHE HA . 307 . HA 1 1 112 1 2 2 2 9 PHE QD . 307 . HD# 1 1 113 1 1 2 2 9 PHE QD . 307 . HD# 1 1 113 1 2 2 2 10 ASN HA . 308 . HA 1 1 114 1 1 2 2 17 HIS HA . 315 . HA 1 1 114 1 2 2 2 17 HIS HD2 . 315 . HD2 1 1 115 1 1 2 2 5 TRP HA . 303 . HA 1 1 115 1 2 2 2 5 TRP HZ3 . 303 . HZ3 1 1 116 1 1 2 2 14 VAL HA . 312 . HA 1 1 116 1 2 2 2 17 HIS HD2 . 315 . HD2 1 1 117 1 1 2 2 17 HIS HD2 . 315 . HD2 1 1 117 1 2 2 2 18 MET ME . 316 . HE# 1 1 118 1 1 2 2 13 ALA MB . 311 . HB# 1 1 118 1 2 2 2 14 VAL HB . 312 . HB 1 1 119 1 1 2 2 14 VAL HB . 312 . HB 1 1 119 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 120 1 1 2 2 11 ALA MB . 309 . HB# 1 1 120 1 2 2 2 14 VAL HB . 312 . HB 1 1 121 1 1 2 2 12 THR HA . 310 . HA 1 1 121 1 2 2 2 15 VAL MG1 . 313 . HG1# 1 1 122 1 1 2 2 12 THR HA . 310 . HA 1 1 122 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 123 1 1 2 2 12 THR HA . 310 . HA 1 1 123 1 2 2 2 12 THR MG . 310 . HG2# 1 1 124 1 1 2 2 11 ALA MB . 309 . HB# 1 1 124 1 2 2 2 12 THR HA . 310 . HA 1 1 125 1 1 2 2 12 THR HA . 310 . HA 1 1 125 1 2 2 2 15 VAL HB . 313 . HB 1 1 126 1 1 2 2 11 ALA HA . 309 . HA 1 1 126 1 2 2 2 14 VAL HB . 312 . HB 1 1 127 1 1 2 2 19 ARG HA . 317 . HA 1 1 127 1 2 2 2 19 ARG HG3 . 317 . HG1 1 1 128 1 1 2 2 19 ARG HA . 317 . HA 1 1 128 1 2 2 2 19 ARG HG2 . 317 . HG2 1 1 129 1 1 2 2 21 LEU HA . 319 . HA 1 1 129 1 2 2 2 21 LEU HG . 319 . HG 1 1 130 1 1 2 2 5 TRP HA . 303 . HA 1 1 130 1 2 2 2 8 ALA MB . 306 . HB# 1 1 131 1 1 2 2 11 ALA HA . 309 . HA 1 1 131 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 132 1 1 2 2 10 ASN HA . 308 . HA 1 1 132 1 2 2 2 13 ALA MB . 311 . HB# 1 1 133 1 1 2 2 7 GLN HA . 305 . HA 1 1 133 1 2 2 2 11 ALA MB . 309 . HB# 1 1 134 1 1 2 2 16 ARG HA . 314 . HA 1 1 134 1 2 2 2 19 ARG H . 317 . HN 1 1 135 1 1 2 2 17 HIS HA . 315 . HA 1 1 135 1 2 2 2 20 LYS H . 318 . HN 1 1 136 1 1 2 2 2 LYS H . 300 . HN 1 1 136 1 2 2 2 2 LYS QB . 300 . HB# 1 1 137 1 1 2 2 2 LYS H . 300 . HN 1 1 137 1 2 2 2 2 LYS QG . 300 . HG# 1 1 138 1 1 2 2 2 LYS H . 300 . HN 1 1 138 1 2 2 2 2 LYS QD . 300 . HD# 1 1 139 1 1 2 2 2 LYS HA . 300 . HA 1 1 139 1 2 2 2 2 LYS QG . 300 . HG# 1 1 140 1 1 2 2 2 LYS HA . 300 . HA 1 1 140 1 2 2 2 2 LYS QD . 300 . HD# 1 1 141 1 1 2 2 2 LYS QB . 300 . HB# 1 1 141 1 2 2 2 3 SER H . 301 . HN 1 1 142 1 1 2 2 2 LYS QB . 300 . HB# 1 1 142 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 143 1 1 2 2 2 LYS QE . 300 . HE# 1 1 143 1 2 2 2 2 LYS QG . 300 . HG# 1 1 144 1 1 2 2 2 LYS QG . 300 . HG# 1 1 144 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 145 1 1 2 2 2 LYS QG . 300 . HG# 1 1 145 1 2 2 2 6 LYS H . 304 . HN 1 1 146 1 1 2 2 2 LYS QD . 300 . HD# 1 1 146 1 2 2 2 2 LYS QE . 300 . HE# 1 1 147 1 1 2 2 2 LYS QD . 300 . HD# 1 1 147 1 2 2 2 5 TRP H . 303 . HN 1 1 148 1 1 2 2 2 LYS QD . 300 . HD# 1 1 148 1 2 2 2 5 TRP HD1 . 303 . HD1 1 1 149 1 1 2 2 2 LYS QD . 300 . HD# 1 1 149 1 2 2 2 6 LYS H . 304 . HN 1 1 150 1 1 2 2 2 LYS QE . 300 . HE# 1 1 150 1 2 2 2 9 PHE QD . 307 . HD# 1 1 151 1 1 2 2 3 SER H . 301 . HN 1 1 151 1 2 2 2 3 SER QB . 301 . HB# 1 1 152 1 1 2 2 3 SER HA . 301 . HA 1 1 152 1 2 2 2 6 LYS QB . 304 . HB# 1 1 153 1 1 2 2 3 SER QB . 301 . HB# 1 1 153 1 2 2 2 4 LYS H . 302 . HN 1 1 154 1 1 2 2 3 SER QB . 301 . HB# 1 1 154 1 2 2 2 4 LYS QD . 302 . HD# 1 1 155 1 1 2 2 3 SER QB . 301 . HB# 1 1 155 1 2 2 2 5 TRP H . 303 . HN 1 1 156 1 1 2 2 4 LYS H . 302 . HN 1 1 156 1 2 2 2 4 LYS QB . 302 . HB# 1 1 157 1 1 2 2 4 LYS H . 302 . HN 1 1 157 1 2 2 2 4 LYS QG . 302 . HG# 1 1 158 1 1 2 2 4 LYS H . 302 . HN 1 1 158 1 2 2 2 4 LYS QD . 302 . HD# 1 1 159 1 1 2 2 4 LYS HA . 302 . HA 1 1 159 1 2 2 2 4 LYS QG . 302 . HG# 1 1 160 1 1 2 2 4 LYS HA . 302 . HA 1 1 160 1 2 2 2 4 LYS QD . 302 . HD# 1 1 161 1 1 2 2 4 LYS HA . 302 . HA 1 1 161 1 2 2 2 7 GLN QB . 305 . HB# 1 1 162 1 1 2 2 4 LYS HA . 302 . HA 1 1 162 1 2 2 2 7 GLN QG . 305 . HG# 1 1 163 1 1 2 2 4 LYS QB . 302 . HB# 1 1 163 1 2 2 2 5 TRP H . 303 . HN 1 1 164 1 1 2 2 4 LYS QE . 302 . HE# 1 1 164 1 2 2 2 4 LYS QG . 302 . HG# 1 1 165 1 1 2 2 4 LYS QG . 302 . HG# 1 1 165 1 2 2 2 5 TRP H . 303 . HN 1 1 166 1 1 2 2 4 LYS QD . 302 . HD# 1 1 166 1 2 2 2 5 TRP H . 303 . HN 1 1 167 1 1 2 2 6 LYS H . 304 . HN 1 1 167 1 2 2 2 6 LYS QB . 304 . HB# 1 1 168 1 1 2 2 6 LYS H . 304 . HN 1 1 168 1 2 2 2 6 LYS QD . 304 . HD# 1 1 169 1 1 2 2 6 LYS HA . 304 . HA 1 1 169 1 2 2 2 6 LYS QG . 304 . HG# 1 1 170 1 1 2 2 6 LYS QB . 304 . HB# 1 1 170 1 2 2 2 7 GLN H . 305 . HN 1 1 171 1 1 2 2 6 LYS QB . 304 . HB# 1 1 171 1 2 2 2 9 PHE QD . 307 . HD# 1 1 172 1 1 2 2 7 GLN H . 305 . HN 1 1 172 1 2 2 2 7 GLN QB . 305 . HB# 1 1 173 1 1 2 2 7 GLN H . 305 . HN 1 1 173 1 2 2 2 7 GLN QG . 305 . HG# 1 1 174 1 1 2 2 7 GLN HA . 305 . HA 1 1 174 1 2 2 2 7 GLN QG . 305 . HG# 1 1 175 1 1 2 2 7 GLN HA . 305 . HA 1 1 175 1 2 2 2 10 ASN QD . 308 . HD2# 1 1 176 1 1 2 2 7 GLN QB . 305 . HB# 1 1 176 1 2 2 2 8 ALA H . 306 . HN 1 1 177 1 1 2 2 7 GLN QG . 305 . HG# 1 1 177 1 2 2 2 8 ALA H . 306 . HN 1 1 178 1 1 2 2 8 ALA H . 306 . HN 1 1 178 1 2 2 2 9 PHE QB . 307 . HB# 1 1 179 1 1 2 2 9 PHE H . 307 . HN 1 1 179 1 2 2 2 9 PHE QB . 307 . HB# 1 1 180 1 1 2 2 9 PHE QB . 307 . HB# 1 1 180 1 2 2 2 10 ASN H . 308 . HN 1 1 181 1 1 2 2 9 PHE QD . 307 . HD# 1 1 181 1 2 2 2 10 ASN QB . 308 . HB# 1 1 182 1 1 2 2 10 ASN H . 308 . HN 1 1 182 1 2 2 2 10 ASN QB . 308 . HB# 1 1 183 1 1 2 2 10 ASN H . 308 . HN 1 1 183 1 2 2 2 10 ASN QD . 308 . HD2# 1 1 184 1 1 2 2 10 ASN HA . 308 . HA 1 1 184 1 2 2 2 14 VAL QG . 312 . HG## 1 1 185 1 1 2 2 10 ASN QB . 308 . HB# 1 1 185 1 2 2 2 11 ALA H . 309 . HN 1 1 186 1 1 2 2 10 ASN QB . 308 . HB# 1 1 186 1 2 2 2 11 ALA HA . 309 . HA 1 1 187 1 1 2 2 10 ASN QD . 308 . HD2# 1 1 187 1 2 2 2 14 VAL QG . 312 . HG## 1 1 188 1 1 2 2 11 ALA H . 309 . HN 1 1 188 1 2 2 2 14 VAL QG . 312 . HG## 1 1 189 1 1 2 2 11 ALA HA . 309 . HA 1 1 189 1 2 2 2 14 VAL QG . 312 . HG## 1 1 190 1 1 2 2 13 ALA H . 311 . HN 1 1 190 1 2 2 2 14 VAL QG . 312 . HG## 1 1 191 1 1 2 2 14 VAL H . 312 . HN 1 1 191 1 2 2 2 14 VAL QG . 312 . HG## 1 1 192 1 1 2 2 14 VAL QG . 312 . HG## 1 1 192 1 2 2 2 15 VAL H . 313 . HN 1 1 193 1 1 2 2 14 VAL QG . 312 . HG## 1 1 193 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 1 194 1 1 2 2 14 VAL QG . 312 . HG## 1 1 194 1 2 2 2 17 HIS H . 315 . HN 1 1 195 1 1 2 2 14 VAL QG . 312 . HG## 1 1 195 1 2 2 2 17 HIS HD2 . 315 . HD2 1 1 196 1 1 2 2 14 VAL QG . 312 . HG## 1 1 196 1 2 2 2 18 MET H . 316 . HN 1 1 197 1 1 2 2 16 ARG H . 314 . HN 1 1 197 1 2 2 2 16 ARG QB . 314 . HB# 1 1 198 1 1 2 2 16 ARG H . 314 . HN 1 1 198 1 2 2 2 16 ARG QG . 314 . HG# 1 1 199 1 1 2 2 16 ARG HA . 314 . HA 1 1 199 1 2 2 2 16 ARG QG . 314 . HG# 1 1 200 1 1 2 2 16 ARG HA . 314 . HA 1 1 200 1 2 2 2 19 ARG QB . 317 . HB# 1 1 201 1 1 2 2 16 ARG QB . 314 . HB# 1 1 201 1 2 2 2 17 HIS H . 315 . HN 1 1 202 1 1 2 2 16 ARG QD . 314 . HD# 1 1 202 1 2 2 2 16 ARG QG . 314 . HG# 1 1 203 1 1 2 2 17 HIS H . 315 . HN 1 1 203 1 2 2 2 17 HIS QB . 315 . HB# 1 1 204 1 1 2 2 17 HIS QB . 315 . HB# 1 1 204 1 2 2 2 17 HIS HD2 . 315 . HD2 1 1 205 1 1 2 2 17 HIS QB . 315 . HB# 1 1 205 1 2 2 2 18 MET H . 316 . HN 1 1 206 1 1 2 2 17 HIS HD2 . 315 . HD2 1 1 206 1 2 2 2 18 MET QG . 316 . HG# 1 1 207 1 1 2 2 17 HIS HD2 . 315 . HD2 1 1 207 1 2 2 2 21 LEU QD . 319 . HD## 1 1 208 1 1 2 2 18 MET H . 316 . HN 1 1 208 1 2 2 2 18 MET QB . 316 . HB# 1 1 209 1 1 2 2 18 MET H . 316 . HN 1 1 209 1 2 2 2 18 MET QG . 316 . HG# 1 1 210 1 1 2 2 18 MET H . 316 . HN 1 1 210 1 2 2 2 19 ARG QG . 317 . HG# 1 1 211 1 1 2 2 19 ARG H . 317 . HN 1 1 211 1 2 2 2 19 ARG QB . 317 . HB# 1 1 212 1 1 2 2 19 ARG H . 317 . HN 1 1 212 1 2 2 2 19 ARG QG . 317 . HG# 1 1 213 1 1 2 2 19 ARG H . 317 . HN 1 1 213 1 2 2 2 19 ARG QD . 317 . HD# 1 1 214 1 1 2 2 19 ARG HA . 317 . HA 1 1 214 1 2 2 2 22 GLN QG . 320 . HG# 1 1 215 1 1 2 2 19 ARG QB . 317 . HB# 1 1 215 1 2 2 2 19 ARG QD . 317 . HD# 1 1 216 1 1 2 2 20 LYS H . 318 . HN 1 1 216 1 2 2 2 20 LYS QB . 318 . HB# 1 1 217 1 1 2 2 20 LYS H . 318 . HN 1 1 217 1 2 2 2 20 LYS QG . 318 . HG# 1 1 218 1 1 2 2 20 LYS HA . 318 . HA 1 1 218 1 2 2 2 20 LYS QG . 318 . HG# 1 1 219 1 1 2 2 20 LYS HA . 318 . HA 1 1 219 1 2 2 2 20 LYS QD . 318 . HD# 1 1 220 1 1 2 2 20 LYS QB . 318 . HB# 1 1 220 1 2 2 2 20 LYS QE . 318 . HE# 1 1 221 1 1 2 2 20 LYS QB . 318 . HB# 1 1 221 1 2 2 2 22 GLN H . 320 . HN 1 1 222 1 1 2 2 20 LYS QE . 318 . HE# 1 1 222 1 2 2 2 20 LYS QG . 318 . HG# 1 1 223 1 1 2 2 20 LYS QG . 318 . HG# 1 1 223 1 2 2 2 21 LEU H . 319 . HN 1 1 224 1 1 2 2 20 LYS QG . 318 . HG# 1 1 224 1 2 2 2 22 GLN H . 320 . HN 1 1 225 1 1 2 2 20 LYS QD . 318 . HD# 1 1 225 1 2 2 2 20 LYS QE . 318 . HE# 1 1 226 1 1 2 2 21 LEU H . 319 . HN 1 1 226 1 2 2 2 21 LEU QB . 319 . HB# 1 1 227 1 1 2 2 21 LEU H . 319 . HN 1 1 227 1 2 2 2 21 LEU QD . 319 . HD## 1 1 228 1 1 2 2 21 LEU HA . 319 . HA 1 1 228 1 2 2 2 21 LEU QD . 319 . HD## 1 1 229 1 1 2 2 21 LEU QB . 319 . HB# 1 1 229 1 2 2 2 21 LEU QD . 319 . HD## 1 1 230 1 1 2 2 21 LEU QB . 319 . HB# 1 1 230 1 2 2 2 22 GLN HA . 320 . HA 1 1 231 1 1 2 2 22 GLN H . 320 . HN 1 1 231 1 2 2 2 22 GLN QG . 320 . HG# 1 1 232 1 1 2 2 22 GLN H . 320 . HN 1 1 232 1 2 2 2 22 GLN QE . 320 . HE2# 1 1 233 1 1 2 2 22 GLN HA . 320 . HA 1 1 233 1 2 2 2 22 GLN QG . 320 . HG# 1 1 234 1 1 2 2 22 GLN QB . 320 . HB# 1 1 234 1 2 2 2 22 GLN QG . 320 . HG# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.97 0.0 4.97 1 1 2 1 . . . . . 4.37 0.0 4.37 1 1 3 1 . . . . . 4.16 0.0 4.16 1 1 4 1 . . . . . 4.19 0.0 4.19 1 1 5 1 . . . . . 4.66 0.0 4.66 1 1 6 1 . . . . . 4.04 0.0 4.04 1 1 7 1 . . . . . 4.15 0.0 4.15 1 1 8 1 . . . . . 3.71 0.0 3.71 1 1 9 1 . . . . . 3.58 0.0 3.58 1 1 10 1 . . . . . 3.96 0.0 3.96 1 1 11 1 . . . . . 4.4 0.0 4.4 1 1 12 1 . . . . . 4.1 0.0 4.1 1 1 13 1 . . . . . 4.12 0.0 4.12 1 1 14 1 . . . . . 4.48 0.0 4.48 1 1 15 1 . . . . . 3.37 0.0 3.37 1 1 16 1 . . . . . 4.05 0.0 4.05 1 1 17 1 . . . . . 3.11 0.0 3.11 1 1 18 1 . . . . . 4.38 0.0 4.38 1 1 19 1 . . . . . 4.3 0.0 4.3 1 1 20 1 . . . . . 5.23 0.0 5.23 1 1 21 1 . . . . . 5.5 0.0 5.5 1 1 22 1 . . . . . 5.5 0.0 5.5 1 1 23 1 . . . . . 5.5 0.0 5.5 1 1 24 1 . . . . . 5.5 0.0 5.5 1 1 25 1 . . . . . 5.03 0.0 5.03 1 1 26 1 . . . . . 3.14 0.0 3.14 1 1 27 1 . . . . . 5.5 0.0 5.5 1 1 28 1 . . . . . 4.52 0.0 4.52 1 1 29 1 . . . . . 4.83 0.0 4.83 1 1 30 1 . . . . . 3.87 0.0 3.87 1 1 31 1 . . . . . 3.84 0.0 3.84 1 1 32 1 . . . . . 3.82 0.0 3.82 1 1 33 1 . . . . . 4.31 0.0 4.31 1 1 34 1 . . . . . 4.52 0.0 4.52 1 1 35 1 . . . . . 4.7 0.0 4.7 1 1 36 1 . . . . . 4.83 0.0 4.83 1 1 37 1 . . . . . 4.52 0.0 4.52 1 1 38 1 . . . . . 3.34 0.0 3.34 1 1 39 1 . . . . . 5.17 0.0 5.17 1 1 40 1 . . . . . 4.23 0.0 4.23 1 1 41 1 . . . . . 5.16 0.0 5.16 1 1 42 1 . . . . . 3.87 0.0 3.87 1 1 43 1 . . . . . 3.43 0.0 3.43 1 1 44 1 . . . . . 3.44 0.0 3.44 1 1 45 1 . . . . . 4.15 0.0 4.15 1 1 46 1 . . . . . 4.35 0.0 4.35 1 1 47 1 . . . . . 5.5 0.0 5.5 1 1 48 1 . . . . . 4.03 0.0 4.03 1 1 49 1 . . . . . 3.75 0.0 3.75 1 1 50 1 . . . . . 4.77 0.0 4.77 1 1 51 1 . . . . . 4.1 0.0 4.1 1 1 52 1 . . . . . 4.31 0.0 4.31 1 1 53 1 . . . . . 5.13 0.0 5.13 1 1 54 1 . . . . . 5.44 0.0 5.44 1 1 55 1 . . . . . 4.69 0.0 4.69 1 1 56 1 . . . . . 5.5 0.0 5.5 1 1 57 1 . . . . . 5.5 0.0 5.5 1 1 58 1 . . . . . 5.5 0.0 5.5 1 1 59 1 . . . . . 4.53 0.0 4.53 1 1 60 1 . . . . . 4.5 0.0 4.5 1 1 61 1 . . . . . 4.31 0.0 4.31 1 1 62 1 . . . . . 4.06 0.0 4.06 1 1 63 1 . . . . . 4.89 0.0 4.89 1 1 64 1 . . . . . 4.78 0.0 4.78 1 1 65 1 . . . . . 5.5 0.0 5.5 1 1 66 1 . . . . . 5.5 0.0 5.5 1 1 67 1 . . . . . 3.85 0.0 3.85 1 1 68 1 . . . . . 4.62 0.0 4.62 1 1 69 1 . . . . . 4.7 0.0 4.7 1 1 70 1 . . . . . 4.94 0.0 4.94 1 1 71 1 . . . . . 3.32 0.0 3.32 1 1 72 1 . . . . . 4.29 0.0 4.29 1 1 73 1 . . . . . 4.64 0.0 4.64 1 1 74 1 . . . . . 4.85 0.0 4.85 1 1 75 1 . . . . . 4.76 0.0 4.76 1 1 76 1 . . . . . 3.37 0.0 3.37 1 1 77 1 . . . . . 3.07 0.0 3.07 1 1 78 1 . . . . . 5.48 0.0 5.48 1 1 79 1 . . . . . 4.48 0.0 4.48 1 1 80 1 . . . . . 4.94 0.0 4.94 1 1 81 1 . . . . . 3.89 0.0 3.89 1 1 82 1 . . . . . 3.23 0.0 3.23 1 1 83 1 . . . . . 5.5 0.0 5.5 1 1 84 1 . . . . . 3.1 0.0 3.1 1 1 85 1 . . . . . 3.47 0.0 3.47 1 1 86 1 . . . . . 3.32 0.0 3.32 1 1 87 1 . . . . . 4.94 0.0 4.94 1 1 88 1 . . . . . 4.88 0.0 4.88 1 1 89 1 . . . . . 3.81 0.0 3.81 1 1 90 1 . . . . . 3.81 0.0 3.81 1 1 91 1 . . . . . 4.73 0.0 4.73 1 1 92 1 . . . . . 5.5 0.0 5.5 1 1 93 1 . . . . . 5.5 0.0 5.5 1 1 94 1 . . . . . 4.59 0.0 4.59 1 1 95 1 . . . . . 3.56 0.0 3.56 1 1 96 1 . . . . . 3.13 0.0 3.13 1 1 97 1 . . . . . 4.16 0.0 4.16 1 1 98 1 . . . . . 4.41 0.0 4.41 1 1 99 1 . . . . . 5.5 0.0 5.5 1 1 100 1 . . . . . 4.73 0.0 4.73 1 1 101 1 . . . . . 4.67 0.0 4.67 1 1 102 1 . . . . . 5.22 0.0 5.22 1 1 103 1 . . . . . 3.07 0.0 3.07 1 1 104 1 . . . . . 4.35 0.0 4.35 1 1 105 1 . . . . . 5.5 0.0 5.5 1 1 106 1 . . . . . 3.97 0.0 3.97 1 1 107 1 . . . . . 5.43 0.0 5.43 1 1 108 1 . . . . . 3.71 0.0 3.71 1 1 109 1 . . . . . 5.15 0.0 5.15 1 1 110 1 . . . . . 3.76 0.0 3.76 1 1 111 1 . . . . . 3.09 0.0 3.09 1 1 112 1 . . . . . 3.34 0.0 3.34 1 1 113 1 . . . . . 4.18 0.0 4.18 1 1 114 1 . . . . . 5.02 0.0 5.02 1 1 115 1 . . . . . 5.39 0.0 5.39 1 1 116 1 . . . . . 4.98 0.0 4.98 1 1 117 1 . . . . . 5.4 0.0 5.4 1 1 118 1 . . . . . 5.38 0.0 5.38 1 1 119 1 . . . . . 5.06 0.0 5.06 1 1 120 1 . . . . . 5.5 0.0 5.5 1 1 121 1 . . . . . 4.31 0.0 4.31 1 1 122 1 . . . . . 3.69 0.0 3.69 1 1 123 1 . . . . . 3.18 0.0 3.18 1 1 124 1 . . . . . 4.54 0.0 4.54 1 1 125 1 . . . . . 3.89 0.0 3.89 1 1 126 1 . . . . . 5.12 0.0 5.12 1 1 127 1 . . . . . 3.95 0.0 3.95 1 1 128 1 . . . . . 3.95 0.0 3.95 1 1 129 1 . . . . . 3.5 0.0 3.5 1 1 130 1 . . . . . 3.66 0.0 3.66 1 1 131 1 . . . . . 4.72 0.0 4.72 1 1 132 1 . . . . . 3.5 0.0 3.5 1 1 133 1 . . . . . 5.08 0.0 5.08 1 1 134 1 . . . . . 4.3 0.0 4.3 1 1 135 1 . . . . . 4.34 0.0 4.34 1 1 136 1 . . . . . 3.07 0.0 3.07 1 1 137 1 . . . . . 4.63 0.0 4.63 1 1 138 1 . . . . . 5.34 0.0 5.34 1 1 139 1 . . . . . 3.54 0.0 3.54 1 1 140 1 . . . . . 3.68 0.0 3.68 1 1 141 1 . . . . . 3.96 0.0 3.96 1 1 142 1 . . . . . 5.03 0.0 5.03 1 1 143 1 . . . . . 3.3 0.0 3.3 1 1 144 1 . . . . . 4.22 0.0 4.22 1 1 145 1 . . . . . 5.04 0.0 5.04 1 1 146 1 . . . . . 2.2 0.0 2.2 1 1 147 1 . . . . . 5.34 0.0 5.34 1 1 148 1 . . . . . 4.55 0.0 4.55 1 1 149 1 . . . . . 4.49 0.0 4.49 1 1 150 1 . . . . . 5.34 0.0 5.34 1 1 151 1 . . . . . 3.42 0.0 3.42 1 1 152 1 . . . . . 3.89 0.0 3.89 1 1 153 1 . . . . . 3.65 0.0 3.65 1 1 154 1 . . . . . 4.67 0.0 4.67 1 1 155 1 . . . . . 5.34 0.0 5.34 1 1 156 1 . . . . . 3.45 0.0 3.45 1 1 157 1 . . . . . 3.94 0.0 3.94 1 1 158 1 . . . . . 4.03 0.0 4.03 1 1 159 1 . . . . . 3.44 0.0 3.44 1 1 160 1 . . . . . 3.32 0.0 3.32 1 1 161 1 . . . . . 3.9 0.0 3.9 1 1 162 1 . . . . . 4.36 0.0 4.36 1 1 163 1 . . . . . 4.08 0.0 4.08 1 1 164 1 . . . . . 3.2 0.0 3.2 1 1 165 1 . . . . . 5.34 0.0 5.34 1 1 166 1 . . . . . 5.34 0.0 5.34 1 1 167 1 . . . . . 3.34 0.0 3.34 1 1 168 1 . . . . . 4.71 0.0 4.71 1 1 169 1 . . . . . 3.63 0.0 3.63 1 1 170 1 . . . . . 3.93 0.0 3.93 1 1 171 1 . . . . . 5.34 0.0 5.34 1 1 172 1 . . . . . 3.32 0.0 3.32 1 1 173 1 . . . . . 4.49 0.0 4.49 1 1 174 1 . . . . . 3.55 0.0 3.55 1 1 175 1 . . . . . 4.75 0.0 4.75 1 1 176 1 . . . . . 3.5 0.0 3.5 1 1 177 1 . . . . . 4.61 0.0 4.61 1 1 178 1 . . . . . 5.34 0.0 5.34 1 1 179 1 . . . . . 3.19 0.0 3.19 1 1 180 1 . . . . . 3.66 0.0 3.66 1 1 181 1 . . . . . 5.34 0.0 5.34 1 1 182 1 . . . . . 3.6 0.0 3.6 1 1 183 1 . . . . . 5.34 0.0 5.34 1 1 184 1 . . . . . 5.4 0.0 5.4 1 1 185 1 . . . . . 4.39 0.0 4.39 1 1 186 1 . . . . . 4.8 0.0 4.8 1 1 187 1 . . . . . 5.27 0.0 5.27 1 1 188 1 . . . . . 5.44 0.0 5.44 1 1 189 1 . . . . . 4.0 0.0 4.0 1 1 190 1 . . . . . 5.26 0.0 5.26 1 1 191 1 . . . . . 3.24 0.0 3.24 1 1 192 1 . . . . . 3.88 0.0 3.88 1 1 193 1 . . . . . 3.81 0.0 3.81 1 1 194 1 . . . . . 5.44 0.0 5.44 1 1 195 1 . . . . . 4.11 0.0 4.11 1 1 196 1 . . . . . 5.44 0.0 5.44 1 1 197 1 . . . . . 3.29 0.0 3.29 1 1 198 1 . . . . . 4.63 0.0 4.63 1 1 199 1 . . . . . 3.45 0.0 3.45 1 1 200 1 . . . . . 4.36 0.0 4.36 1 1 201 1 . . . . . 3.77 0.0 3.77 1 1 202 1 . . . . . 2.35 0.0 2.35 1 1 203 1 . . . . . 3.31 0.0 3.31 1 1 204 1 . . . . . 3.37 0.0 3.37 1 1 205 1 . . . . . 4.2 0.0 4.2 1 1 206 1 . . . . . 4.24 0.0 4.24 1 1 207 1 . . . . . 3.88 0.0 3.88 1 1 208 1 . . . . . 3.48 0.0 3.48 1 1 209 1 . . . . . 3.58 0.0 3.58 1 1 210 1 . . . . . 5.34 0.0 5.34 1 1 211 1 . . . . . 2.97 0.0 2.97 1 1 212 1 . . . . . 3.48 0.0 3.48 1 1 213 1 . . . . . 5.34 0.0 5.34 1 1 214 1 . . . . . 4.89 0.0 4.89 1 1 215 1 . . . . . 3.34 0.0 3.34 1 1 216 1 . . . . . 3.02 0.0 3.02 1 1 217 1 . . . . . 4.89 0.0 4.89 1 1 218 1 . . . . . 3.24 0.0 3.24 1 1 219 1 . . . . . 3.51 0.0 3.51 1 1 220 1 . . . . . 4.37 0.0 4.37 1 1 221 1 . . . . . 5.34 0.0 5.34 1 1 222 1 . . . . . 3.31 0.0 3.31 1 1 223 1 . . . . . 5.34 0.0 5.34 1 1 224 1 . . . . . 5.34 0.0 5.34 1 1 225 1 . . . . . 2.35 0.0 2.35 1 1 226 1 . . . . . 3.21 0.0 3.21 1 1 227 1 . . . . . 3.38 0.0 3.38 1 1 228 1 . . . . . 3.02 0.0 3.02 1 1 229 1 . . . . . 2.82 0.0 2.82 1 1 230 1 . . . . . 5.34 0.0 5.34 1 1 231 1 . . . . . 3.88 0.0 3.88 1 1 232 1 . . . . . 5.08 0.0 5.08 1 1 233 1 . . . . . 3.59 0.0 3.59 1 1 234 1 . . . . . 2.34 0.0 2.34 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "general distance" _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 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 20 ASP OD2 . 20 . OD2 1 2 1 1 2 3 3 1 CA CA . 401 . CA 1 2 2 1 1 1 1 22 ASP OD1 . 22 . OD1 1 2 2 1 2 3 3 1 CA CA . 401 . CA 1 2 3 1 1 1 1 24 ASP OD2 . 24 . OD2 1 2 3 1 2 3 3 1 CA CA . 401 . CA 1 2 4 1 1 1 1 26 THR O . 26 . O 1 2 4 1 2 3 3 1 CA CA . 401 . CA 1 2 5 1 1 1 1 31 GLU OE1 . 31 . OE1 1 2 5 1 2 3 3 1 CA CA . 401 . CA 1 2 6 1 1 1 1 31 GLU OE2 . 31 . OE2 1 2 6 1 2 3 3 1 CA CA . 401 . CA 1 2 7 1 1 1 1 56 ASP OD2 . 56 . OD2 1 2 7 1 2 4 3 1 CA CA . 402 . CA 1 2 8 1 1 1 1 58 ASP OD2 . 58 . OD2 1 2 8 1 2 4 3 1 CA CA . 402 . CA 1 2 9 1 1 1 1 60 ASN OD1 . 60 . OD1 1 2 9 1 2 4 3 1 CA CA . 402 . CA 1 2 10 1 1 1 1 62 THR O . 62 . O 1 2 10 1 2 4 3 1 CA CA . 402 . CA 1 2 11 1 1 1 1 67 GLU OE1 . 67 . OE1 1 2 11 1 2 4 3 1 CA CA . 402 . CA 1 2 12 1 1 1 1 67 GLU OE2 . 67 . OE2 1 2 12 1 2 4 3 1 CA CA . 402 . CA 1 2 13 1 1 1 1 93 ASP OD2 . 93 . OD2 1 2 13 1 2 5 3 1 CA CA . 403 . CA 1 2 14 1 1 1 1 95 ASP OD2 . 95 . OD2 1 2 14 1 2 5 3 1 CA CA . 403 . CA 1 2 15 1 1 1 1 97 ASN OD1 . 97 . OD1 1 2 15 1 2 5 3 1 CA CA . 403 . CA 1 2 16 1 1 1 1 99 TYR O . 99 . O 1 2 16 1 2 5 3 1 CA CA . 403 . CA 1 2 17 1 1 1 1 104 GLU OE1 . 104 . OE1 1 2 17 1 2 5 3 1 CA CA . 403 . CA 1 2 18 1 1 1 1 104 GLU OE2 . 104 . OE2 1 2 18 1 2 5 3 1 CA CA . 403 . CA 1 2 19 1 1 1 1 129 ASP OD1 . 129 . OD1 1 2 19 1 2 6 3 1 CA CA . 404 . CA 1 2 20 1 1 1 1 131 ASP OD2 . 131 . OD2 1 2 20 1 2 6 3 1 CA CA . 404 . CA 1 2 21 1 1 1 1 133 ASP OD2 . 133 . OD2 1 2 21 1 2 6 3 1 CA CA . 404 . CA 1 2 22 1 1 1 1 135 GLN O . 135 . O 1 2 22 1 2 6 3 1 CA CA . 404 . CA 1 2 23 1 1 1 1 140 GLU OE1 . 140 . OE1 1 2 23 1 2 6 3 1 CA CA . 404 . CA 1 2 24 1 1 1 1 140 GLU OE2 . 140 . OE2 1 2 24 1 2 6 3 1 CA CA . 404 . CA 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 0.0 2.5 1 2 2 1 . . . . . 2.5 0.0 2.5 1 2 3 1 . . . . . 2.5 0.0 2.5 1 2 4 1 . . . . . 2.5 0.0 2.5 1 2 5 1 . . . . . 2.5 0.0 2.5 1 2 6 1 . . . . . 2.5 0.0 2.5 1 2 7 1 . . . . . 2.5 0.0 2.5 1 2 8 1 . . . . . 2.5 0.0 2.5 1 2 9 1 . . . . . 2.5 0.0 2.5 1 2 10 1 . . . . . 2.5 0.0 2.5 1 2 11 1 . . . . . 2.5 0.0 2.5 1 2 12 1 . . . . . 2.5 0.0 2.5 1 2 13 1 . . . . . 2.5 0.0 2.5 1 2 14 1 . . . . . 2.5 0.0 2.5 1 2 15 1 . . . . . 2.5 0.0 2.5 1 2 16 1 . . . . . 2.5 0.0 2.5 1 2 17 1 . . . . . 2.5 0.0 2.5 1 2 18 1 . . . . . 2.5 0.0 2.5 1 2 19 1 . . . . . 2.5 0.0 2.5 1 2 20 1 . . . . . 2.5 0.0 2.5 1 2 21 1 . . . . . 2.5 0.0 2.5 1 2 22 1 . . . . . 2.5 0.0 2.5 1 2 23 1 . . . . . 2.5 0.0 2.5 1 2 24 1 . . . . . 2.5 0.0 2.5 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 67 1 . . . 1 3 68 1 . . . 1 3 69 1 . . . 1 3 70 1 . . . 1 3 71 1 . . . 1 3 72 1 . . . 1 3 73 1 . . . 1 3 74 1 . . . 1 3 75 1 . . . 1 3 76 1 . . . 1 3 77 1 . . . 1 3 78 1 . . . 1 3 79 1 . . . 1 3 80 1 . . . 1 3 81 1 . . . 1 3 82 1 . . . 1 3 83 1 . . . 1 3 84 1 . . . 1 3 85 1 . . . 1 3 86 1 . . . 1 3 87 1 . . . 1 3 88 1 . . . 1 3 89 1 . . . 1 3 90 1 . . . 1 3 91 1 . . . 1 3 92 1 . . . 1 3 93 1 . . . 1 3 94 1 . . . 1 3 95 1 . . . 1 3 96 1 . . . 1 3 97 1 . . . 1 3 98 1 . . . 1 3 99 1 . . . 1 3 100 1 . . . 1 3 101 1 . . . 1 3 102 1 . . . 1 3 103 1 . . . 1 3 104 1 . . . 1 3 105 1 . . . 1 3 106 1 . . . 1 3 107 1 . . . 1 3 108 1 . . . 1 3 109 1 . . . 1 3 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 36 MET HA . 36 . HA 1 3 1 1 2 1 1 36 MET ME . 36 . HE# 1 3 2 1 1 1 1 124 MET ME . 124 . HE# 1 3 2 1 2 1 1 145 MET ME . 145 . HE# 1 3 3 1 1 1 1 145 MET ME . 145 . HE# 1 3 3 1 2 2 2 5 TRP HZ3 . 303 . HZ3 1 3 4 1 1 1 1 145 MET ME . 145 . HE# 1 3 4 1 2 2 2 5 TRP HH2 . 303 . HH2 1 3 5 1 1 1 1 145 MET ME . 145 . HE# 1 3 5 1 2 2 2 9 PHE QE . 307 . HE# 1 3 6 1 1 1 1 145 MET ME . 145 . HE# 1 3 6 1 2 2 2 5 TRP HE3 . 303 . HE3 1 3 7 1 1 1 1 51 MET ME . 51 . HE# 1 3 7 1 2 2 2 18 MET QG . 316 . HG# 1 3 8 1 1 1 1 51 MET ME . 51 . HE# 1 3 8 1 2 2 2 15 VAL HA . 313 . HA 1 3 9 1 1 1 1 71 MET ME . 71 . HE# 1 3 9 1 2 2 2 15 VAL HA . 313 . HA 1 3 10 1 1 1 1 72 MET ME . 72 . HE# 1 3 10 1 2 2 2 15 VAL HA . 313 . HA 1 3 11 1 1 1 1 109 MET ME . 109 . HE# 1 3 11 1 2 1 1 124 MET ME . 124 . HE# 1 3 12 1 1 1 1 124 MET ME . 124 . HE# 1 3 12 1 2 1 1 144 MET ME . 144 . HE# 1 3 13 1 1 1 1 144 MET ME . 144 . HE# 1 3 13 1 2 2 2 5 TRP HZ3 . 303 . HZ3 1 3 14 1 1 1 1 144 MET ME . 144 . HE# 1 3 14 1 2 2 2 5 TRP HE3 . 303 . HE3 1 3 15 1 1 1 1 124 MET ME . 124 . HE# 1 3 15 1 2 2 2 5 TRP HZ3 . 303 . HZ3 1 3 16 1 1 1 1 124 MET ME . 124 . HE# 1 3 16 1 2 2 2 5 TRP HH2 . 303 . HH2 1 3 17 1 1 1 1 124 MET ME . 124 . HE# 1 3 17 1 2 2 2 5 TRP HE3 . 303 . HE3 1 3 18 1 1 1 1 36 MET ME . 36 . HE# 1 3 18 1 2 1 1 71 MET ME . 71 . HE# 1 3 19 1 1 1 1 36 MET ME . 36 . HE# 1 3 19 1 2 2 2 18 MET HG2 . 316 . HG2 1 3 20 1 1 1 1 36 MET ME . 36 . HE# 1 3 20 1 2 2 2 15 VAL HA . 313 . HA 1 3 21 1 1 1 1 36 MET ME . 36 . HE# 1 3 21 1 2 1 1 51 MET HA . 51 . HA 1 3 22 1 1 1 1 145 MET ME . 145 . HE# 1 3 22 1 2 2 2 6 LYS QB . 304 . HB# 1 3 23 1 1 1 1 145 MET ME . 145 . HE# 1 3 23 1 2 2 2 7 GLN QB . 305 . HB# 1 3 24 1 1 1 1 51 MET ME . 51 . HE# 1 3 24 1 2 1 1 71 MET ME . 71 . HE# 1 3 25 1 1 1 1 51 MET ME . 51 . HE# 1 3 25 1 2 2 2 22 GLN QB . 320 . HB# 1 3 26 1 1 1 1 51 MET ME . 51 . HE# 1 3 26 1 2 2 2 22 GLN QG . 320 . HG# 1 3 27 1 1 1 1 71 MET ME . 71 . HE# 1 3 27 1 2 1 1 76 MET ME . 76 . HE# 1 3 28 1 1 1 1 71 MET ME . 71 . HE# 1 3 28 1 2 2 2 15 VAL HB . 313 . HB 1 3 29 1 1 1 1 71 MET ME . 71 . HE# 1 3 29 1 2 2 2 18 MET HG2 . 316 . HG2 1 3 30 1 1 1 1 71 MET ME . 71 . HE# 1 3 30 1 2 2 2 14 VAL HA . 312 . HA 1 3 31 1 1 1 1 71 MET ME . 71 . HE# 1 3 31 1 2 2 2 10 ASN HA . 308 . HA 1 3 32 1 1 1 1 72 MET ME . 72 . HE# 1 3 32 1 2 2 2 14 VAL QG . 312 . HG## 1 3 33 1 1 1 1 51 MET ME . 51 . HE# 1 3 33 1 2 1 1 72 MET ME . 72 . HE# 1 3 34 1 1 1 1 72 MET ME . 72 . HE# 1 3 34 1 2 1 1 76 MET ME . 76 . HE# 1 3 35 1 1 1 1 72 MET ME . 72 . HE# 1 3 35 1 2 2 2 10 ASN QB . 308 . HB# 1 3 36 1 1 1 1 72 MET ME . 72 . HE# 1 3 36 1 2 2 2 10 ASN HA . 308 . HA 1 3 37 1 1 1 1 72 MET ME . 72 . HE# 1 3 37 1 2 2 2 9 PHE QD . 307 . HD# 1 3 38 1 1 1 1 109 MET ME . 109 . HE# 1 3 38 1 2 1 1 144 MET ME . 144 . HE# 1 3 39 1 1 1 1 109 MET ME . 109 . HE# 1 3 39 1 2 2 2 7 GLN QB . 305 . HB# 1 3 40 1 1 1 1 109 MET ME . 109 . HE# 1 3 40 1 2 2 2 7 GLN QG . 305 . HG# 1 3 41 1 1 1 1 144 MET ME . 144 . HE# 1 3 41 1 2 2 2 5 TRP HH2 . 303 . HH2 1 3 42 1 1 1 1 124 MET ME . 124 . HE# 1 3 42 1 2 2 2 4 LYS QD . 302 . HD# 1 3 43 1 1 1 1 124 MET ME . 124 . HE# 1 3 43 1 2 2 2 4 LYS QE . 302 . HE# 1 3 44 1 1 1 1 124 MET ME . 124 . HE# 1 3 44 1 2 2 2 5 TRP HB2 . 303 . HB1 1 3 45 1 1 1 1 124 MET ME . 124 . HE# 1 3 45 1 2 2 2 5 TRP HB3 . 303 . HB2 1 3 46 1 1 1 1 124 MET ME . 124 . HE# 1 3 46 1 2 2 2 9 PHE HA . 307 . HA 1 3 47 1 1 1 1 36 MET ME . 36 . HE# 1 3 47 1 2 1 1 71 MET HA . 71 . HA 1 3 48 1 1 1 1 51 MET ME . 51 . HE# 1 3 48 1 2 1 1 71 MET HA . 71 . HA 1 3 49 1 1 1 1 36 MET ME . 36 . HE# 1 3 49 1 2 2 2 14 VAL QG . 312 . HG## 1 3 50 1 1 1 1 36 MET ME . 36 . HE# 1 3 50 1 2 2 2 15 VAL MG1 . 313 . HG1# 1 3 51 1 1 1 1 36 MET ME . 36 . HE# 1 3 51 1 2 2 2 19 ARG QG . 317 . HG# 1 3 52 1 1 1 1 36 MET ME . 36 . HE# 1 3 52 1 2 2 2 10 ASN QB . 308 . HB# 1 3 53 1 1 1 1 36 MET ME . 36 . HE# 1 3 53 1 2 2 2 14 VAL HA . 312 . HA 1 3 54 1 1 1 1 36 MET ME . 36 . HE# 1 3 54 1 2 2 2 19 ARG HA . 317 . HA 1 3 55 1 1 1 1 36 MET ME . 36 . HE# 1 3 55 1 2 2 2 11 ALA HA . 309 . HA 1 3 56 1 1 1 1 145 MET ME . 145 . HE# 1 3 56 1 2 2 2 9 PHE QB . 307 . HB# 1 3 57 1 1 1 1 145 MET ME . 145 . HE# 1 3 57 1 2 2 2 9 PHE HA . 307 . HA 1 3 58 1 1 1 1 145 MET ME . 145 . HE# 1 3 58 1 2 2 2 10 ASN HA . 308 . HA 1 3 59 1 1 1 1 145 MET ME . 145 . HE# 1 3 59 1 2 2 2 9 PHE QD . 307 . HD# 1 3 60 1 1 1 1 51 MET ME . 51 . HE# 1 3 60 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 3 61 1 1 1 1 51 MET ME . 51 . HE# 1 3 61 1 2 2 2 19 ARG HA . 317 . HA 1 3 62 1 1 1 1 71 MET ME . 71 . HE# 1 3 62 1 2 2 2 14 VAL MG1 . 312 . HG1# 1 3 63 1 1 1 1 71 MET ME . 71 . HE# 1 3 63 1 2 2 2 14 VAL MG2 . 312 . HG2# 1 3 64 1 1 1 1 71 MET ME . 71 . HE# 1 3 64 1 2 2 2 18 MET ME . 316 . HE# 1 3 65 1 1 1 1 71 MET ME . 71 . HE# 1 3 65 1 2 2 2 17 HIS QB . 315 . HB# 1 3 66 1 1 1 1 71 MET ME . 71 . HE# 1 3 66 1 2 1 1 72 MET HA . 72 . HA 1 3 67 1 1 1 1 71 MET ME . 71 . HE# 1 3 67 1 2 2 2 11 ALA HA . 309 . HA 1 3 68 1 1 1 1 72 MET ME . 72 . HE# 1 3 68 1 2 2 2 14 VAL MG1 . 312 . HG1# 1 3 69 1 1 1 1 72 MET ME . 72 . HE# 1 3 69 1 2 2 2 14 VAL MG2 . 312 . HG2# 1 3 70 1 1 1 1 72 MET ME . 72 . HE# 1 3 70 1 2 2 2 14 VAL HB . 312 . HB 1 3 71 1 1 1 1 72 MET ME . 72 . HE# 1 3 71 1 2 2 2 14 VAL HA . 312 . HA 1 3 72 1 1 1 1 72 MET ME . 72 . HE# 1 3 72 1 2 2 2 11 ALA HA . 309 . HA 1 3 73 1 1 1 1 109 MET ME . 109 . HE# 1 3 73 1 2 2 2 4 LYS QE . 302 . HE# 1 3 74 1 1 1 1 109 MET ME . 109 . HE# 1 3 74 1 2 2 2 8 ALA HA . 306 . HA 1 3 75 1 1 1 1 109 MET ME . 109 . HE# 1 3 75 1 2 2 2 7 GLN HA . 305 . HA 1 3 76 1 1 1 1 144 MET ME . 144 . HE# 1 3 76 1 2 2 2 2 LYS QD . 300 . HD# 1 3 77 1 1 1 1 144 MET ME . 144 . HE# 1 3 77 1 2 2 2 5 TRP HB2 . 303 . HB1 1 3 78 1 1 1 1 144 MET ME . 144 . HE# 1 3 78 1 2 2 2 5 TRP HB3 . 303 . HB2 1 3 79 1 1 1 1 144 MET ME . 144 . HE# 1 3 79 1 2 2 2 5 TRP HZ2 . 303 . HZ2 1 3 80 1 1 1 1 124 MET ME . 124 . HE# 1 3 80 1 2 2 2 4 LYS HG3 . 302 . HG1 1 3 81 1 1 1 1 124 MET ME . 124 . HE# 1 3 81 1 2 2 2 4 LYS HG2 . 302 . HG2 1 3 82 1 1 1 1 124 MET ME . 124 . HE# 1 3 82 1 2 2 2 4 LYS QB . 302 . HB# 1 3 83 1 1 1 1 124 MET ME . 124 . HE# 1 3 83 1 2 2 2 1 ALA HA . 299 . HA 1 3 84 1 1 1 1 124 MET ME . 124 . HE# 1 3 84 1 2 2 2 5 TRP HA . 303 . HA 1 3 85 1 1 1 1 124 MET ME . 124 . HE# 1 3 85 1 2 2 2 5 TRP HZ2 . 303 . HZ2 1 3 86 1 1 1 1 36 MET ME . 36 . HE# 1 3 86 1 2 2 2 15 VAL MG2 . 313 . HG2# 1 3 87 1 1 1 1 36 MET ME . 36 . HE# 1 3 87 1 2 2 2 18 MET ME . 316 . HE# 1 3 88 1 1 1 1 36 MET ME . 36 . HE# 1 3 88 1 2 2 2 18 MET HG3 . 316 . HG1 1 3 89 1 1 1 1 36 MET ME . 36 . HE# 1 3 89 1 2 2 2 17 HIS QB . 315 . HB# 1 3 90 1 1 1 1 36 MET ME . 36 . HE# 1 3 90 1 2 2 2 19 ARG QD . 317 . HD# 1 3 91 1 1 1 1 145 MET ME . 145 . HE# 1 3 91 1 2 2 2 6 LYS QG . 304 . HG# 1 3 92 1 1 1 1 145 MET ME . 145 . HE# 1 3 92 1 2 2 2 2 LYS QD . 300 . HD# 1 3 93 1 1 1 1 145 MET ME . 145 . HE# 1 3 93 1 2 2 2 2 LYS QB . 300 . HB# 1 3 94 1 1 1 1 145 MET ME . 145 . HE# 1 3 94 1 2 2 2 5 TRP QB . 303 . HB# 1 3 95 1 1 1 1 145 MET ME . 145 . HE# 1 3 95 1 2 2 2 6 LYS HA . 304 . HA 1 3 96 1 1 1 1 51 MET ME . 51 . HE# 1 3 96 1 2 2 2 14 VAL QG . 312 . HG## 1 3 97 1 1 1 1 51 MET ME . 51 . HE# 1 3 97 1 2 2 2 15 VAL MG1 . 313 . HG1# 1 3 98 1 1 1 1 51 MET ME . 51 . HE# 1 3 98 1 2 2 2 21 LEU QB . 319 . HB# 1 3 99 1 1 1 1 51 MET ME . 51 . HE# 1 3 99 1 2 2 2 17 HIS QB . 315 . HB# 1 3 100 1 1 1 1 51 MET ME . 51 . HE# 1 3 100 1 2 2 2 19 ARG QD . 317 . HD# 1 3 101 1 1 1 1 51 MET ME . 51 . HE# 1 3 101 1 2 2 2 17 HIS HA . 315 . HA 1 3 102 1 1 1 1 71 MET ME . 71 . HE# 1 3 102 1 2 2 2 14 VAL HB . 312 . HB 1 3 103 1 1 1 1 71 MET ME . 71 . HE# 1 3 103 1 2 2 2 18 MET HG3 . 316 . HG1 1 3 104 1 1 1 1 72 MET ME . 72 . HE# 1 3 104 1 2 2 2 16 ARG QG . 314 . HG# 1 3 105 1 1 1 1 109 MET HA . 109 . HA 1 3 105 1 2 1 1 109 MET ME . 109 . HE# 1 3 106 1 1 1 1 144 MET ME . 144 . HE# 1 3 106 1 2 2 2 2 LYS QB . 300 . HB# 1 3 107 1 1 1 1 144 MET ME . 144 . HE# 1 3 107 1 2 2 2 2 LYS HA . 300 . HA 1 3 108 1 1 1 1 144 MET ME . 144 . HE# 1 3 108 1 2 2 2 5 TRP HD1 . 303 . HD1 1 3 109 1 1 1 1 124 MET ME . 124 . HE# 1 3 109 1 2 2 2 5 TRP HD1 . 303 . HD1 1 3 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 . . . . . 6.0 1.8 6.0 1 3 2 1 . . . . . 6.0 1.8 6.0 1 3 3 1 . . . . . 6.0 1.8 6.0 1 3 4 1 . . . . . 6.0 1.8 6.0 1 3 5 1 . . . . . 6.0 1.8 6.0 1 3 6 1 . . . . . 6.0 1.8 6.0 1 3 7 1 . . . . . 6.0 1.8 6.0 1 3 8 1 . . . . . 6.0 1.8 6.0 1 3 9 1 . . . . . 6.0 1.8 6.0 1 3 10 1 . . . . . 6.0 1.8 6.0 1 3 11 1 . . . . . 6.0 1.8 6.0 1 3 12 1 . . . . . 6.0 1.8 6.0 1 3 13 1 . . . . . 6.0 1.8 6.0 1 3 14 1 . . . . . 6.0 1.8 6.0 1 3 15 1 . . . . . 6.0 1.8 6.0 1 3 16 1 . . . . . 6.0 1.8 6.0 1 3 17 1 . . . . . 6.0 1.8 6.0 1 3 18 1 . . . . . 6.0 1.8 6.0 1 3 19 1 . . . . . 6.0 1.8 6.0 1 3 20 1 . . . . . 6.0 1.8 6.0 1 3 21 1 . . . . . 6.0 1.8 6.0 1 3 22 1 . . . . . 6.0 1.8 6.0 1 3 23 1 . . . . . 6.0 1.8 6.0 1 3 24 1 . . . . . 6.0 1.8 6.0 1 3 25 1 . . . . . 6.0 1.8 6.0 1 3 26 1 . . . . . 6.0 1.8 6.0 1 3 27 1 . . . . . 6.0 1.8 6.0 1 3 28 1 . . . . . 6.0 1.8 6.0 1 3 29 1 . . . . . 6.0 1.8 6.0 1 3 30 1 . . . . . 6.0 1.8 6.0 1 3 31 1 . . . . . 6.0 1.8 6.0 1 3 32 1 . . . . . 6.0 1.8 6.0 1 3 33 1 . . . . . 6.0 1.8 6.0 1 3 34 1 . . . . . 6.0 1.8 6.0 1 3 35 1 . . . . . 6.0 1.8 6.0 1 3 36 1 . . . . . 6.0 1.8 6.0 1 3 37 1 . . . . . 6.0 1.8 6.0 1 3 38 1 . . . . . 6.0 1.8 6.0 1 3 39 1 . . . . . 6.0 1.8 6.0 1 3 40 1 . . . . . 6.0 1.8 6.0 1 3 41 1 . . . . . 6.0 1.8 6.0 1 3 42 1 . . . . . 6.0 1.8 6.0 1 3 43 1 . . . . . 6.0 1.8 6.0 1 3 44 1 . . . . . 6.0 1.8 6.0 1 3 45 1 . . . . . 6.0 1.8 6.0 1 3 46 1 . . . . . 6.0 1.8 6.0 1 3 47 1 . . . . . 6.0 1.8 6.0 1 3 48 1 . . . . . 6.0 1.8 6.0 1 3 49 1 . . . . . 6.0 1.8 6.0 1 3 50 1 . . . . . 6.0 1.8 6.0 1 3 51 1 . . . . . 6.0 1.8 6.0 1 3 52 1 . . . . . 6.0 1.8 6.0 1 3 53 1 . . . . . 6.0 1.8 6.0 1 3 54 1 . . . . . 6.0 1.8 6.0 1 3 55 1 . . . . . 6.0 1.8 6.0 1 3 56 1 . . . . . 6.0 1.8 6.0 1 3 57 1 . . . . . 6.0 1.8 6.0 1 3 58 1 . . . . . 6.0 1.8 6.0 1 3 59 1 . . . . . 6.0 1.8 6.0 1 3 60 1 . . . . . 6.0 1.8 6.0 1 3 61 1 . . . . . 6.0 1.8 6.0 1 3 62 1 . . . . . 6.0 1.8 6.0 1 3 63 1 . . . . . 6.0 1.8 6.0 1 3 64 1 . . . . . 6.0 1.8 6.0 1 3 65 1 . . . . . 6.0 1.8 6.0 1 3 66 1 . . . . . 6.0 1.8 6.0 1 3 67 1 . . . . . 6.0 1.8 6.0 1 3 68 1 . . . . . 6.0 1.8 6.0 1 3 69 1 . . . . . 6.0 1.8 6.0 1 3 70 1 . . . . . 6.0 1.8 6.0 1 3 71 1 . . . . . 6.0 1.8 6.0 1 3 72 1 . . . . . 6.0 1.8 6.0 1 3 73 1 . . . . . 6.0 1.8 6.0 1 3 74 1 . . . . . 6.0 1.8 6.0 1 3 75 1 . . . . . 6.0 1.8 6.0 1 3 76 1 . . . . . 6.0 1.8 6.0 1 3 77 1 . . . . . 6.0 1.8 6.0 1 3 78 1 . . . . . 6.0 1.8 6.0 1 3 79 1 . . . . . 6.0 1.8 6.0 1 3 80 1 . . . . . 6.0 1.8 6.0 1 3 81 1 . . . . . 6.0 1.8 6.0 1 3 82 1 . . . . . 6.0 1.8 6.0 1 3 83 1 . . . . . 6.0 1.8 6.0 1 3 84 1 . . . . . 6.0 1.8 6.0 1 3 85 1 . . . . . 6.0 1.8 6.0 1 3 86 1 . . . . . 6.0 1.8 6.0 1 3 87 1 . . . . . 6.0 1.8 6.0 1 3 88 1 . . . . . 6.0 1.8 6.0 1 3 89 1 . . . . . 6.0 1.8 6.0 1 3 90 1 . . . . . 6.0 1.8 6.0 1 3 91 1 . . . . . 6.0 1.8 6.0 1 3 92 1 . . . . . 6.0 1.8 6.0 1 3 93 1 . . . . . 6.0 1.8 6.0 1 3 94 1 . . . . . 6.0 1.8 6.0 1 3 95 1 . . . . . 6.0 1.8 6.0 1 3 96 1 . . . . . 6.0 1.8 6.0 1 3 97 1 . . . . . 6.0 1.8 6.0 1 3 98 1 . . . . . 6.0 1.8 6.0 1 3 99 1 . . . . . 6.0 1.8 6.0 1 3 100 1 . . . . . 6.0 1.8 6.0 1 3 101 1 . . . . . 6.0 1.8 6.0 1 3 102 1 . . . . . 6.0 1.8 6.0 1 3 103 1 . . . . . 6.0 1.8 6.0 1 3 104 1 . . . . . 6.0 1.8 6.0 1 3 105 1 . . . . . 6.0 1.8 6.0 1 3 106 1 . . . . . 6.0 1.8 6.0 1 3 107 1 . . . . . 6.0 1.8 6.0 1 3 108 1 . . . . . 6.0 1.8 6.0 1 3 109 1 . . . . . 6.0 1.8 6.0 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _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 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 11 1 . . . 1 4 12 1 . . . 1 4 13 1 . . . 1 4 14 1 . . . 1 4 15 1 . . . 1 4 16 1 . . . 1 4 17 1 . . . 1 4 18 1 . . . 1 4 19 1 . . . 1 4 20 1 . . . 1 4 21 1 . . . 1 4 22 1 . . . 1 4 23 1 . . . 1 4 24 1 . . . 1 4 25 1 . . . 1 4 26 1 . . . 1 4 27 1 . . . 1 4 28 1 . . . 1 4 29 1 . . . 1 4 30 1 . . . 1 4 31 1 . . . 1 4 32 1 . . . 1 4 33 1 . . . 1 4 34 1 . . . 1 4 35 1 . . . 1 4 36 1 . . . 1 4 37 1 . . . 1 4 38 1 . . . 1 4 39 1 . . . 1 4 40 1 . . . 1 4 41 1 . . . 1 4 42 1 . . . 1 4 43 1 . . . 1 4 44 1 . . . 1 4 45 1 . . . 1 4 46 1 . . . 1 4 47 1 . . . 1 4 48 1 . . . 1 4 49 1 . . . 1 4 50 1 . . . 1 4 51 1 . . . 1 4 52 1 . . . 1 4 53 1 . . . 1 4 54 1 . . . 1 4 55 1 . . . 1 4 56 1 . . . 1 4 57 1 . . . 1 4 58 1 . . . 1 4 59 1 . . . 1 4 60 1 . . . 1 4 61 1 . . . 1 4 62 1 . . . 1 4 63 1 . . . 1 4 64 1 . . . 1 4 65 1 . . . 1 4 66 1 . . . 1 4 67 1 . . . 1 4 68 1 . . . 1 4 69 1 . . . 1 4 70 1 . . . 1 4 71 1 . . . 1 4 72 1 . . . 1 4 73 1 . . . 1 4 74 1 . . . 1 4 75 1 . . . 1 4 76 1 . . . 1 4 77 1 . . . 1 4 78 1 . . . 1 4 79 1 . . . 1 4 80 1 . . . 1 4 81 1 . . . 1 4 82 1 . . . 1 4 83 1 . . . 1 4 84 1 . . . 1 4 85 1 . . . 1 4 86 1 . . . 1 4 87 1 . . . 1 4 88 1 . . . 1 4 89 1 . . . 1 4 90 1 . . . 1 4 91 1 . . . 1 4 92 1 . . . 1 4 93 1 . . . 1 4 94 1 . . . 1 4 95 1 . . . 1 4 96 1 . . . 1 4 97 1 . . . 1 4 98 1 . . . 1 4 99 1 . . . 1 4 100 1 . . . 1 4 101 1 . . . 1 4 102 1 . . . 1 4 103 1 . . . 1 4 104 1 . . . 1 4 105 1 . . . 1 4 106 1 . . . 1 4 107 1 . . . 1 4 108 1 . . . 1 4 109 1 . . . 1 4 110 1 . . . 1 4 111 1 . . . 1 4 112 1 . . . 1 4 113 1 . . . 1 4 114 1 . . . 1 4 115 1 . . . 1 4 116 1 . . . 1 4 117 1 . . . 1 4 118 1 . . . 1 4 119 1 . . . 1 4 120 1 . . . 1 4 121 1 . . . 1 4 122 1 . . . 1 4 123 1 . . . 1 4 124 1 . . . 1 4 125 1 . . . 1 4 126 1 . . . 1 4 127 1 . . . 1 4 128 1 . . . 1 4 129 1 . . . 1 4 130 1 . . . 1 4 131 1 . . . 1 4 132 1 . . . 1 4 133 1 . . . 1 4 134 1 . . . 1 4 135 1 . . . 1 4 136 1 . . . 1 4 137 1 . . . 1 4 138 1 . . . 1 4 139 1 . . . 1 4 140 1 . . . 1 4 141 1 . . . 1 4 142 1 . . . 1 4 143 1 . . . 1 4 144 1 . . . 1 4 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 27 ILE H . 27 . HN 1 4 1 1 2 1 1 63 ILE O . 63 . O 1 4 2 1 1 1 1 27 ILE N . 27 . N 1 4 2 1 2 1 1 63 ILE O . 63 . O 1 4 3 1 1 1 1 27 ILE O . 27 . O 1 4 3 1 2 1 1 63 ILE H . 63 . HN 1 4 4 1 1 1 1 27 ILE O . 27 . O 1 4 4 1 2 1 1 63 ILE N . 63 . N 1 4 5 1 1 1 1 6 GLU O . 6 . O 1 4 5 1 2 1 1 10 ALA H . 10 . HN 1 4 6 1 1 1 1 6 GLU O . 6 . O 1 4 6 1 2 1 1 10 ALA N . 10 . N 1 4 7 1 1 1 1 7 GLU O . 7 . O 1 4 7 1 2 1 1 11 GLU H . 11 . HN 1 4 8 1 1 1 1 7 GLU O . 7 . O 1 4 8 1 2 1 1 11 GLU N . 11 . N 1 4 9 1 1 1 1 8 GLN O . 8 . O 1 4 9 1 2 1 1 12 PHE H . 12 . HN 1 4 10 1 1 1 1 8 GLN O . 8 . O 1 4 10 1 2 1 1 12 PHE N . 12 . N 1 4 11 1 1 1 1 9 ILE O . 9 . O 1 4 11 1 2 1 1 13 LYS H . 13 . HN 1 4 12 1 1 1 1 9 ILE O . 9 . O 1 4 12 1 2 1 1 13 LYS N . 13 . N 1 4 13 1 1 1 1 10 ALA O . 10 . O 1 4 13 1 2 1 1 14 GLU H . 14 . HN 1 4 14 1 1 1 1 10 ALA O . 10 . O 1 4 14 1 2 1 1 14 GLU N . 14 . N 1 4 15 1 1 1 1 11 GLU O . 11 . O 1 4 15 1 2 1 1 15 ALA H . 15 . HN 1 4 16 1 1 1 1 11 GLU O . 11 . O 1 4 16 1 2 1 1 15 ALA N . 15 . N 1 4 17 1 1 1 1 12 PHE O . 12 . O 1 4 17 1 2 1 1 16 PHE H . 16 . HN 1 4 18 1 1 1 1 12 PHE O . 12 . O 1 4 18 1 2 1 1 16 PHE N . 16 . N 1 4 19 1 1 1 1 13 LYS O . 13 . O 1 4 19 1 2 1 1 17 SER H . 17 . HN 1 4 20 1 1 1 1 13 LYS O . 13 . O 1 4 20 1 2 1 1 17 SER N . 17 . N 1 4 21 1 1 1 1 14 GLU O . 14 . O 1 4 21 1 2 1 1 18 LEU H . 18 . HN 1 4 22 1 1 1 1 14 GLU O . 14 . O 1 4 22 1 2 1 1 18 LEU N . 18 . N 1 4 23 1 1 1 1 15 ALA O . 15 . O 1 4 23 1 2 1 1 19 PHE H . 19 . HN 1 4 24 1 1 1 1 15 ALA O . 15 . O 1 4 24 1 2 1 1 19 PHE N . 19 . N 1 4 25 1 1 1 1 29 THR O . 29 . O 1 4 25 1 2 1 1 33 GLY H . 33 . HN 1 4 26 1 1 1 1 29 THR O . 29 . O 1 4 26 1 2 1 1 33 GLY N . 33 . N 1 4 27 1 1 1 1 30 LYS O . 30 . O 1 4 27 1 2 1 1 34 THR H . 34 . HN 1 4 28 1 1 1 1 30 LYS O . 30 . O 1 4 28 1 2 1 1 34 THR N . 34 . N 1 4 29 1 1 1 1 31 GLU O . 31 . O 1 4 29 1 2 1 1 35 VAL H . 35 . HN 1 4 30 1 1 1 1 31 GLU O . 31 . O 1 4 30 1 2 1 1 35 VAL N . 35 . N 1 4 31 1 1 1 1 32 LEU O . 32 . O 1 4 31 1 2 1 1 36 MET H . 36 . HN 1 4 32 1 1 1 1 32 LEU O . 32 . O 1 4 32 1 2 1 1 36 MET N . 36 . N 1 4 33 1 1 1 1 33 GLY O . 33 . O 1 4 33 1 2 1 1 37 ARG H . 37 . HN 1 4 34 1 1 1 1 33 GLY O . 33 . O 1 4 34 1 2 1 1 37 ARG N . 37 . N 1 4 35 1 1 1 1 34 THR O . 34 . O 1 4 35 1 2 1 1 38 SER H . 38 . HN 1 4 36 1 1 1 1 34 THR O . 34 . O 1 4 36 1 2 1 1 38 SER N . 38 . N 1 4 37 1 1 1 1 45 GLU O . 45 . O 1 4 37 1 2 1 1 49 GLN H . 49 . HN 1 4 38 1 1 1 1 45 GLU O . 45 . O 1 4 38 1 2 1 1 49 GLN N . 49 . N 1 4 39 1 1 1 1 46 ALA O . 46 . O 1 4 39 1 2 1 1 50 ASP H . 50 . HN 1 4 40 1 1 1 1 46 ALA O . 46 . O 1 4 40 1 2 1 1 50 ASP N . 50 . N 1 4 41 1 1 1 1 47 GLU O . 47 . O 1 4 41 1 2 1 1 51 MET H . 51 . HN 1 4 42 1 1 1 1 47 GLU O . 47 . O 1 4 42 1 2 1 1 51 MET N . 51 . N 1 4 43 1 1 1 1 48 LEU O . 48 . O 1 4 43 1 2 1 1 52 ILE H . 52 . HN 1 4 44 1 1 1 1 48 LEU O . 48 . O 1 4 44 1 2 1 1 52 ILE N . 52 . N 1 4 45 1 1 1 1 49 GLN O . 49 . O 1 4 45 1 2 1 1 53 ASN H . 53 . HN 1 4 46 1 1 1 1 49 GLN O . 49 . O 1 4 46 1 2 1 1 53 ASN N . 53 . N 1 4 47 1 1 1 1 50 ASP O . 50 . O 1 4 47 1 2 1 1 54 GLU H . 54 . HN 1 4 48 1 1 1 1 50 ASP O . 50 . O 1 4 48 1 2 1 1 54 GLU N . 54 . N 1 4 49 1 1 1 1 65 PHE O . 65 . O 1 4 49 1 2 1 1 69 LEU H . 69 . HN 1 4 50 1 1 1 1 65 PHE O . 65 . O 1 4 50 1 2 1 1 69 LEU N . 69 . N 1 4 51 1 1 1 1 66 PRO O . 66 . O 1 4 51 1 2 1 1 70 THR H . 70 . HN 1 4 52 1 1 1 1 66 PRO O . 66 . O 1 4 52 1 2 1 1 70 THR N . 70 . N 1 4 53 1 1 1 1 67 GLU O . 67 . O 1 4 53 1 2 1 1 71 MET H . 71 . HN 1 4 54 1 1 1 1 67 GLU O . 67 . O 1 4 54 1 2 1 1 71 MET N . 71 . N 1 4 55 1 1 1 1 68 PHE O . 68 . O 1 4 55 1 2 1 1 72 MET H . 72 . HN 1 4 56 1 1 1 1 68 PHE O . 68 . O 1 4 56 1 2 1 1 72 MET N . 72 . N 1 4 57 1 1 1 1 69 LEU O . 69 . O 1 4 57 1 2 1 1 73 ALA H . 73 . HN 1 4 58 1 1 1 1 69 LEU O . 69 . O 1 4 58 1 2 1 1 73 ALA N . 73 . N 1 4 59 1 1 1 1 70 THR O . 70 . O 1 4 59 1 2 1 1 74 ARG H . 74 . HN 1 4 60 1 1 1 1 70 THR O . 70 . O 1 4 60 1 2 1 1 74 ARG N . 74 . N 1 4 61 1 1 1 1 71 MET O . 71 . O 1 4 61 1 2 1 1 75 LYS H . 75 . HN 1 4 62 1 1 1 1 71 MET O . 71 . O 1 4 62 1 2 1 1 75 LYS N . 75 . N 1 4 63 1 1 1 1 72 MET O . 72 . O 1 4 63 1 2 1 1 76 MET H . 76 . HN 1 4 64 1 1 1 1 72 MET O . 72 . O 1 4 64 1 2 1 1 76 MET N . 76 . N 1 4 65 1 1 1 1 73 ALA O . 73 . O 1 4 65 1 2 1 1 77 LYS H . 77 . HN 1 4 66 1 1 1 1 73 ALA O . 73 . O 1 4 66 1 2 1 1 77 LYS N . 77 . N 1 4 67 1 1 1 1 100 ILE H . 100 . HN 1 4 67 1 2 1 1 136 VAL O . 136 . O 1 4 68 1 1 1 1 100 ILE N . 100 . N 1 4 68 1 2 1 1 136 VAL O . 136 . O 1 4 69 1 1 1 1 100 ILE O . 100 . O 1 4 69 1 2 1 1 136 VAL H . 136 . HN 1 4 70 1 1 1 1 100 ILE O . 100 . O 1 4 70 1 2 1 1 136 VAL N . 136 . N 1 4 71 1 1 1 1 80 ASP O . 80 . O 1 4 71 1 2 1 1 84 GLU H . 84 . HN 1 4 72 1 1 1 1 80 ASP O . 80 . O 1 4 72 1 2 1 1 84 GLU N . 84 . N 1 4 73 1 1 1 1 81 SER O . 81 . O 1 4 73 1 2 1 1 85 ILE H . 85 . HN 1 4 74 1 1 1 1 81 SER O . 81 . O 1 4 74 1 2 1 1 85 ILE N . 85 . N 1 4 75 1 1 1 1 82 GLU O . 82 . O 1 4 75 1 2 1 1 86 ARG H . 86 . HN 1 4 76 1 1 1 1 82 GLU O . 82 . O 1 4 76 1 2 1 1 86 ARG N . 86 . N 1 4 77 1 1 1 1 83 GLU O . 83 . O 1 4 77 1 2 1 1 87 GLU H . 87 . HN 1 4 78 1 1 1 1 83 GLU O . 83 . O 1 4 78 1 2 1 1 87 GLU N . 87 . N 1 4 79 1 1 1 1 84 GLU O . 84 . O 1 4 79 1 2 1 1 88 ALA H . 88 . HN 1 4 80 1 1 1 1 84 GLU O . 84 . O 1 4 80 1 2 1 1 88 ALA N . 88 . N 1 4 81 1 1 1 1 85 ILE O . 85 . O 1 4 81 1 2 1 1 89 PHE H . 89 . HN 1 4 82 1 1 1 1 85 ILE O . 85 . O 1 4 82 1 2 1 1 89 PHE N . 89 . N 1 4 83 1 1 1 1 86 ARG O . 86 . O 1 4 83 1 2 1 1 90 ARG H . 90 . HN 1 4 84 1 1 1 1 86 ARG O . 86 . O 1 4 84 1 2 1 1 90 ARG N . 90 . N 1 4 85 1 1 1 1 87 GLU O . 87 . O 1 4 85 1 2 1 1 91 VAL H . 91 . HN 1 4 86 1 1 1 1 87 GLU O . 87 . O 1 4 86 1 2 1 1 91 VAL N . 91 . N 1 4 87 1 1 1 1 88 ALA O . 88 . O 1 4 87 1 2 1 1 92 PHE H . 92 . HN 1 4 88 1 1 1 1 88 ALA O . 88 . O 1 4 88 1 2 1 1 92 PHE N . 92 . N 1 4 89 1 1 1 1 102 ALA O . 102 . O 1 4 89 1 2 1 1 106 ARG H . 106 . HN 1 4 90 1 1 1 1 102 ALA O . 102 . O 1 4 90 1 2 1 1 106 ARG N . 106 . N 1 4 91 1 1 1 1 103 ALA O . 103 . O 1 4 91 1 2 1 1 107 HIS H . 107 . HN 1 4 92 1 1 1 1 103 ALA O . 103 . O 1 4 92 1 2 1 1 107 HIS N . 107 . N 1 4 93 1 1 1 1 104 GLU O . 104 . O 1 4 93 1 2 1 1 108 VAL H . 108 . HN 1 4 94 1 1 1 1 104 GLU O . 104 . O 1 4 94 1 2 1 1 108 VAL N . 108 . N 1 4 95 1 1 1 1 105 LEU O . 105 . O 1 4 95 1 2 1 1 109 MET H . 109 . HN 1 4 96 1 1 1 1 105 LEU O . 105 . O 1 4 96 1 2 1 1 109 MET N . 109 . N 1 4 97 1 1 1 1 106 ARG O . 106 . O 1 4 97 1 2 1 1 110 THR H . 110 . HN 1 4 98 1 1 1 1 106 ARG O . 106 . O 1 4 98 1 2 1 1 110 THR N . 110 . N 1 4 99 1 1 1 1 107 HIS O . 107 . O 1 4 99 1 2 1 1 111 ASN H . 111 . HN 1 4 100 1 1 1 1 107 HIS O . 107 . O 1 4 100 1 2 1 1 111 ASN N . 111 . N 1 4 101 1 1 1 1 118 ASP O . 118 . O 1 4 101 1 2 1 1 122 ASP H . 122 . HN 1 4 102 1 1 1 1 118 ASP O . 118 . O 1 4 102 1 2 1 1 122 ASP N . 122 . N 1 4 103 1 1 1 1 119 GLU O . 119 . O 1 4 103 1 2 1 1 123 GLU H . 123 . HN 1 4 104 1 1 1 1 119 GLU O . 119 . O 1 4 104 1 2 1 1 123 GLU N . 123 . N 1 4 105 1 1 1 1 120 GLU O . 120 . O 1 4 105 1 2 1 1 124 MET H . 124 . HN 1 4 106 1 1 1 1 120 GLU O . 120 . O 1 4 106 1 2 1 1 124 MET N . 124 . N 1 4 107 1 1 1 1 121 VAL O . 121 . O 1 4 107 1 2 1 1 125 ILE H . 125 . HN 1 4 108 1 1 1 1 121 VAL O . 121 . O 1 4 108 1 2 1 1 125 ILE N . 125 . N 1 4 109 1 1 1 1 122 ASP O . 122 . O 1 4 109 1 2 1 1 126 ARG H . 126 . HN 1 4 110 1 1 1 1 122 ASP O . 122 . O 1 4 110 1 2 1 1 126 ARG N . 126 . N 1 4 111 1 1 1 1 123 GLU O . 123 . O 1 4 111 1 2 1 1 127 GLU H . 127 . HN 1 4 112 1 1 1 1 123 GLU O . 123 . O 1 4 112 1 2 1 1 127 GLU N . 127 . N 1 4 113 1 1 1 1 138 TYR O . 138 . O 1 4 113 1 2 1 1 142 VAL H . 142 . HN 1 4 114 1 1 1 1 138 TYR O . 138 . O 1 4 114 1 2 1 1 142 VAL N . 142 . N 1 4 115 1 1 1 1 139 GLU O . 139 . O 1 4 115 1 2 1 1 143 GLN H . 143 . HN 1 4 116 1 1 1 1 139 GLU O . 139 . O 1 4 116 1 2 1 1 143 GLN N . 143 . N 1 4 117 1 1 1 1 140 GLU O . 140 . O 1 4 117 1 2 1 1 144 MET H . 144 . HN 1 4 118 1 1 1 1 140 GLU O . 140 . O 1 4 118 1 2 1 1 144 MET N . 144 . N 1 4 119 1 1 2 2 3 SER O . 301 . O 1 4 119 1 2 2 2 7 GLN H . 305 . HN 1 4 120 1 1 2 2 3 SER O . 301 . O 1 4 120 1 2 2 2 7 GLN N . 305 . N 1 4 121 1 1 2 2 4 LYS O . 302 . O 1 4 121 1 2 2 2 8 ALA H . 306 . HN 1 4 122 1 1 2 2 4 LYS O . 302 . O 1 4 122 1 2 2 2 8 ALA N . 306 . N 1 4 123 1 1 2 2 5 TRP O . 303 . O 1 4 123 1 2 2 2 9 PHE H . 307 . HN 1 4 124 1 1 2 2 5 TRP O . 303 . O 1 4 124 1 2 2 2 9 PHE N . 307 . N 1 4 125 1 1 2 2 6 LYS O . 304 . O 1 4 125 1 2 2 2 10 ASN H . 308 . HN 1 4 126 1 1 2 2 6 LYS O . 304 . O 1 4 126 1 2 2 2 10 ASN N . 308 . N 1 4 127 1 1 2 2 7 GLN O . 305 . O 1 4 127 1 2 2 2 11 ALA H . 309 . HN 1 4 128 1 1 2 2 7 GLN O . 305 . O 1 4 128 1 2 2 2 11 ALA N . 309 . N 1 4 129 1 1 2 2 8 ALA O . 306 . O 1 4 129 1 2 2 2 12 THR H . 310 . HN 1 4 130 1 1 2 2 8 ALA O . 306 . O 1 4 130 1 2 2 2 12 THR N . 310 . N 1 4 131 1 1 2 2 9 PHE O . 307 . O 1 4 131 1 2 2 2 13 ALA H . 311 . HN 1 4 132 1 1 2 2 9 PHE O . 307 . O 1 4 132 1 2 2 2 13 ALA N . 311 . N 1 4 133 1 1 2 2 10 ASN O . 308 . O 1 4 133 1 2 2 2 14 VAL H . 312 . HN 1 4 134 1 1 2 2 10 ASN O . 308 . O 1 4 134 1 2 2 2 14 VAL N . 312 . N 1 4 135 1 1 2 2 11 ALA O . 309 . O 1 4 135 1 2 2 2 15 VAL H . 313 . HN 1 4 136 1 1 2 2 11 ALA O . 309 . O 1 4 136 1 2 2 2 15 VAL N . 313 . N 1 4 137 1 1 2 2 12 THR O . 310 . O 1 4 137 1 2 2 2 16 ARG H . 314 . HN 1 4 138 1 1 2 2 12 THR O . 310 . O 1 4 138 1 2 2 2 16 ARG N . 314 . N 1 4 139 1 1 2 2 13 ALA O . 311 . O 1 4 139 1 2 2 2 17 HIS H . 315 . HN 1 4 140 1 1 2 2 13 ALA O . 311 . O 1 4 140 1 2 2 2 17 HIS N . 315 . N 1 4 141 1 1 2 2 14 VAL O . 312 . O 1 4 141 1 2 2 2 18 MET H . 316 . HN 1 4 142 1 1 2 2 14 VAL O . 312 . O 1 4 142 1 2 2 2 18 MET N . 316 . N 1 4 143 1 1 2 2 15 VAL O . 313 . O 1 4 143 1 2 2 2 19 ARG H . 317 . HN 1 4 144 1 1 2 2 15 VAL O . 313 . O 1 4 144 1 2 2 2 19 ARG N . 317 . N 1 4 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 . . . . . 2.1 0.0 2.1 1 4 2 1 . . . . . 3.1 0.0 3.1 1 4 3 1 . . . . . 2.1 0.0 2.1 1 4 4 1 . . . . . 3.1 0.0 3.1 1 4 5 1 . . . . . 2.1 0.0 2.1 1 4 6 1 . . . . . 3.1 0.0 3.1 1 4 7 1 . . . . . 2.1 0.0 2.1 1 4 8 1 . . . . . 3.1 0.0 3.1 1 4 9 1 . . . . . 2.1 0.0 2.1 1 4 10 1 . . . . . 3.1 0.0 3.1 1 4 11 1 . . . . . 2.1 0.0 2.1 1 4 12 1 . . . . . 3.1 0.0 3.1 1 4 13 1 . . . . . 2.1 0.0 2.1 1 4 14 1 . . . . . 3.1 0.0 3.1 1 4 15 1 . . . . . 2.1 0.0 2.1 1 4 16 1 . . . . . 3.1 0.0 3.1 1 4 17 1 . . . . . 2.1 0.0 2.1 1 4 18 1 . . . . . 3.1 0.0 3.1 1 4 19 1 . . . . . 2.1 0.0 2.1 1 4 20 1 . . . . . 3.1 0.0 3.1 1 4 21 1 . . . . . 2.1 0.0 2.1 1 4 22 1 . . . . . 3.1 0.0 3.1 1 4 23 1 . . . . . 2.1 0.0 2.1 1 4 24 1 . . . . . 3.1 0.0 3.1 1 4 25 1 . . . . . 2.1 0.0 2.1 1 4 26 1 . . . . . 3.1 0.0 3.1 1 4 27 1 . . . . . 2.1 0.0 2.1 1 4 28 1 . . . . . 3.1 0.0 3.1 1 4 29 1 . . . . . 2.1 0.0 2.1 1 4 30 1 . . . . . 3.1 0.0 3.1 1 4 31 1 . . . . . 2.1 0.0 2.1 1 4 32 1 . . . . . 3.1 0.0 3.1 1 4 33 1 . . . . . 2.1 0.0 2.1 1 4 34 1 . . . . . 3.1 0.0 3.1 1 4 35 1 . . . . . 2.1 0.0 2.1 1 4 36 1 . . . . . 3.1 0.0 3.1 1 4 37 1 . . . . . 2.1 0.0 2.1 1 4 38 1 . . . . . 3.1 0.0 3.1 1 4 39 1 . . . . . 2.1 0.0 2.1 1 4 40 1 . . . . . 3.1 0.0 3.1 1 4 41 1 . . . . . 2.1 0.0 2.1 1 4 42 1 . . . . . 3.1 0.0 3.1 1 4 43 1 . . . . . 2.1 0.0 2.1 1 4 44 1 . . . . . 3.1 0.0 3.1 1 4 45 1 . . . . . 2.1 0.0 2.1 1 4 46 1 . . . . . 3.1 0.0 3.1 1 4 47 1 . . . . . 2.1 0.0 2.1 1 4 48 1 . . . . . 3.1 0.0 3.1 1 4 49 1 . . . . . 2.1 0.0 2.1 1 4 50 1 . . . . . 3.1 0.0 3.1 1 4 51 1 . . . . . 2.1 0.0 2.1 1 4 52 1 . . . . . 3.1 0.0 3.1 1 4 53 1 . . . . . 2.1 0.0 2.1 1 4 54 1 . . . . . 3.1 0.0 3.1 1 4 55 1 . . . . . 2.1 0.0 2.1 1 4 56 1 . . . . . 3.1 0.0 3.1 1 4 57 1 . . . . . 2.1 0.0 2.1 1 4 58 1 . . . . . 3.1 0.0 3.1 1 4 59 1 . . . . . 2.1 0.0 2.1 1 4 60 1 . . . . . 3.1 0.0 3.1 1 4 61 1 . . . . . 2.1 0.0 2.1 1 4 62 1 . . . . . 3.1 0.0 3.1 1 4 63 1 . . . . . 2.1 0.0 2.1 1 4 64 1 . . . . . 3.1 0.0 3.1 1 4 65 1 . . . . . 2.1 0.0 2.1 1 4 66 1 . . . . . 3.1 0.0 3.1 1 4 67 1 . . . . . 2.1 0.0 2.1 1 4 68 1 . . . . . 3.1 0.0 3.1 1 4 69 1 . . . . . 2.1 0.0 2.1 1 4 70 1 . . . . . 3.1 0.0 3.1 1 4 71 1 . . . . . 2.1 0.0 2.1 1 4 72 1 . . . . . 3.1 0.0 3.1 1 4 73 1 . . . . . 2.1 0.0 2.1 1 4 74 1 . . . . . 3.1 0.0 3.1 1 4 75 1 . . . . . 2.1 0.0 2.1 1 4 76 1 . . . . . 3.1 0.0 3.1 1 4 77 1 . . . . . 2.1 0.0 2.1 1 4 78 1 . . . . . 3.1 0.0 3.1 1 4 79 1 . . . . . 2.1 0.0 2.1 1 4 80 1 . . . . . 3.1 0.0 3.1 1 4 81 1 . . . . . 2.1 0.0 2.1 1 4 82 1 . . . . . 3.1 0.0 3.1 1 4 83 1 . . . . . 2.1 0.0 2.1 1 4 84 1 . . . . . 3.1 0.0 3.1 1 4 85 1 . . . . . 2.1 0.0 2.1 1 4 86 1 . . . . . 3.1 0.0 3.1 1 4 87 1 . . . . . 2.1 0.0 2.1 1 4 88 1 . . . . . 3.1 0.0 3.1 1 4 89 1 . . . . . 2.1 0.0 2.1 1 4 90 1 . . . . . 3.1 0.0 3.1 1 4 91 1 . . . . . 2.1 0.0 2.1 1 4 92 1 . . . . . 3.1 0.0 3.1 1 4 93 1 . . . . . 2.1 0.0 2.1 1 4 94 1 . . . . . 3.1 0.0 3.1 1 4 95 1 . . . . . 2.1 0.0 2.1 1 4 96 1 . . . . . 3.1 0.0 3.1 1 4 97 1 . . . . . 2.1 0.0 2.1 1 4 98 1 . . . . . 3.1 0.0 3.1 1 4 99 1 . . . . . 2.1 0.0 2.1 1 4 100 1 . . . . . 3.1 0.0 3.1 1 4 101 1 . . . . . 2.1 0.0 2.1 1 4 102 1 . . . . . 3.1 0.0 3.1 1 4 103 1 . . . . . 2.1 0.0 2.1 1 4 104 1 . . . . . 3.1 0.0 3.1 1 4 105 1 . . . . . 2.1 0.0 2.1 1 4 106 1 . . . . . 3.1 0.0 3.1 1 4 107 1 . . . . . 2.1 0.0 2.1 1 4 108 1 . . . . . 3.1 0.0 3.1 1 4 109 1 . . . . . 2.1 0.0 2.1 1 4 110 1 . . . . . 3.1 0.0 3.1 1 4 111 1 . . . . . 2.1 0.0 2.1 1 4 112 1 . . . . . 3.1 0.0 3.1 1 4 113 1 . . . . . 2.1 0.0 2.1 1 4 114 1 . . . . . 3.1 0.0 3.1 1 4 115 1 . . . . . 2.1 0.0 2.1 1 4 116 1 . . . . . 3.1 0.0 3.1 1 4 117 1 . . . . . 2.1 0.0 2.1 1 4 118 1 . . . . . 3.1 0.0 3.1 1 4 119 1 . . . . . 2.1 0.0 2.1 1 4 120 1 . . . . . 3.1 0.0 3.1 1 4 121 1 . . . . . 2.1 0.0 2.1 1 4 122 1 . . . . . 3.1 0.0 3.1 1 4 123 1 . . . . . 2.1 0.0 2.1 1 4 124 1 . . . . . 3.1 0.0 3.1 1 4 125 1 . . . . . 2.1 0.0 2.1 1 4 126 1 . . . . . 3.1 0.0 3.1 1 4 127 1 . . . . . 2.1 0.0 2.1 1 4 128 1 . . . . . 3.1 0.0 3.1 1 4 129 1 . . . . . 2.1 0.0 2.1 1 4 130 1 . . . . . 3.1 0.0 3.1 1 4 131 1 . . . . . 2.1 0.0 2.1 1 4 132 1 . . . . . 3.1 0.0 3.1 1 4 133 1 . . . . . 2.1 0.0 2.1 1 4 134 1 . . . . . 3.1 0.0 3.1 1 4 135 1 . . . . . 2.1 0.0 2.1 1 4 136 1 . . . . . 3.1 0.0 3.1 1 4 137 1 . . . . . 2.1 0.0 2.1 1 4 138 1 . . . . . 3.1 0.0 3.1 1 4 139 1 . . . . . 2.1 0.0 2.1 1 4 140 1 . . . . . 3.1 0.0 3.1 1 4 141 1 . . . . . 2.1 0.0 2.1 1 4 142 1 . . . . . 3.1 0.0 3.1 1 4 143 1 . . . . . 2.1 0.0 2.1 1 4 144 1 . . . . . 3.1 0.0 3.1 1 4 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 ALA N 1 1 1 ALA CA 1 1 1 ALA C 1 1 2 ASP N -136.8 -126.8 . 1 . N . 1 . CA . 1 . C . 2 . N 1 1 2 . 1 1 1 ALA C 1 1 2 ASP N 1 1 2 ASP CA 1 1 2 ASP C -96.3 -86.3 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 3 . 1 1 2 ASP N 1 1 2 ASP CA 1 1 2 ASP C 1 1 3 GLN N 2.9 12.9 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 4 . 1 1 2 ASP C 1 1 3 GLN N 1 1 3 GLN CA 1 1 3 GLN C -145.5 -135.5 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 5 . 1 1 3 GLN N 1 1 3 GLN CA 1 1 3 GLN C 1 1 4 LEU N 90.9 100.9 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 6 . 1 1 3 GLN C 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C -107.7 -97.7 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 7 . 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C 1 1 5 THR N 135.1 145.1 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 8 . 1 1 4 LEU C 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR C -82.3 -72.3 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 9 . 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR C 1 1 6 GLU N 163.5 173.5 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 10 . 1 1 5 THR C 1 1 6 GLU N 1 1 6 GLU CA 1 1 6 GLU C -67.1 -57.1 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 11 . 1 1 6 GLU N 1 1 6 GLU CA 1 1 6 GLU C 1 1 7 GLU N -32.8 -22.8 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 12 . 1 1 6 GLU C 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C -74.8 -64.799995 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 13 . 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C 1 1 8 GLN N -45.7 -35.7 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 14 . 1 1 7 GLU C 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C -69.6 -59.6 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 15 . 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C 1 1 9 ILE N -42.2 -32.2 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 16 . 1 1 8 GLN C 1 1 9 ILE N 1 1 9 ILE CA 1 1 9 ILE C -67.3 -57.3 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 17 . 1 1 9 ILE N 1 1 9 ILE CA 1 1 9 ILE C 1 1 10 ALA N -48.1 -38.1 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 18 . 1 1 9 ILE C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -74.3 -64.3 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 19 . 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C 1 1 11 GLU N -48.4 -38.4 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 20 . 1 1 10 ALA C 1 1 11 GLU N 1 1 11 GLU CA 1 1 11 GLU C -67.9 -57.899998 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 21 . 1 1 11 GLU N 1 1 11 GLU CA 1 1 11 GLU C 1 1 12 PHE N -42.9 -32.9 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 22 . 1 1 11 GLU C 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C -78.3 -68.3 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 23 . 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C 1 1 13 LYS N -33.8 -23.8 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 24 . 1 1 12 PHE C 1 1 13 LYS N 1 1 13 LYS CA 1 1 13 LYS C -68.1 -58.1 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 25 . 1 1 13 LYS N 1 1 13 LYS CA 1 1 13 LYS C 1 1 14 GLU N -49.3 -39.3 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 26 . 1 1 13 LYS C 1 1 14 GLU N 1 1 14 GLU CA 1 1 14 GLU C -70.0 -60.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 27 . 1 1 14 GLU N 1 1 14 GLU CA 1 1 14 GLU C 1 1 15 ALA N -57.899998 -47.9 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 28 . 1 1 14 GLU C 1 1 15 ALA N 1 1 15 ALA CA 1 1 15 ALA C -64.2 -54.2 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 29 . 1 1 15 ALA N 1 1 15 ALA CA 1 1 15 ALA C 1 1 16 PHE N -44.5 -34.5 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 30 . 1 1 15 ALA C 1 1 16 PHE N 1 1 16 PHE CA 1 1 16 PHE C -63.8 -53.8 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 31 . 1 1 16 PHE N 1 1 16 PHE CA 1 1 16 PHE C 1 1 17 SER N -50.2 -40.2 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 32 . 1 1 16 PHE C 1 1 17 SER N 1 1 17 SER CA 1 1 17 SER C -65.5 -55.5 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 33 . 1 1 17 SER N 1 1 17 SER CA 1 1 17 SER C 1 1 18 LEU N -38.0 -28.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 34 . 1 1 17 SER C 1 1 18 LEU N 1 1 18 LEU CA 1 1 18 LEU C -80.5 -70.5 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 35 . 1 1 18 LEU N 1 1 18 LEU CA 1 1 18 LEU C 1 1 19 PHE N -26.8 -16.8 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 36 . 1 1 18 LEU C 1 1 19 PHE N 1 1 19 PHE CA 1 1 19 PHE C -93.9 -83.9 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 37 . 1 1 19 PHE N 1 1 19 PHE CA 1 1 19 PHE C 1 1 20 ASP N -45.7 -35.7 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 38 . 1 1 19 PHE C 1 1 20 ASP N 1 1 20 ASP CA 1 1 20 ASP C -93.5 -83.5 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 39 . 1 1 20 ASP N 1 1 20 ASP CA 1 1 20 ASP C 1 1 21 LYS N 72.9 82.9 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 40 . 1 1 20 ASP C 1 1 21 LYS N 1 1 21 LYS CA 1 1 21 LYS C -64.4 -54.4 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 41 . 1 1 21 LYS N 1 1 21 LYS CA 1 1 21 LYS C 1 1 22 ASP N -38.1 -28.099998 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 42 . 1 1 21 LYS C 1 1 22 ASP N 1 1 22 ASP CA 1 1 22 ASP C -92.1 -82.1 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 43 . 1 1 22 ASP N 1 1 22 ASP CA 1 1 22 ASP C 1 1 23 GLY N -11.7 -1.7 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 44 . 1 1 22 ASP C 1 1 23 GLY N 1 1 23 GLY CA 1 1 23 GLY C 48.8 58.8 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 45 . 1 1 23 GLY N 1 1 23 GLY CA 1 1 23 GLY C 1 1 24 ASP N 27.1 37.1 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 46 . 1 1 23 GLY C 1 1 24 ASP N 1 1 24 ASP CA 1 1 24 ASP C -84.3 -74.3 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 47 . 1 1 24 ASP N 1 1 24 ASP CA 1 1 24 ASP C 1 1 25 GLY N -8.7 1.3 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 48 . 1 1 24 ASP C 1 1 25 GLY N 1 1 25 GLY CA 1 1 25 GLY C 79.2 89.2 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 49 . 1 1 25 GLY N 1 1 25 GLY CA 1 1 25 GLY C 1 1 26 THR N 1.6 11.6 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 50 . 1 1 25 GLY C 1 1 26 THR N 1 1 26 THR CA 1 1 26 THR C -149.5 -139.5 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 51 . 1 1 26 THR N 1 1 26 THR CA 1 1 26 THR C 1 1 27 ILE N 143.5 153.5 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 52 . 1 1 26 THR C 1 1 27 ILE N 1 1 27 ILE CA 1 1 27 ILE C -115.799995 -105.799995 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 53 . 1 1 27 ILE N 1 1 27 ILE CA 1 1 27 ILE C 1 1 28 THR N 121.09999 131.1 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 54 . 1 1 27 ILE C 1 1 28 THR N 1 1 28 THR CA 1 1 28 THR C -97.5 -87.49999 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 55 . 1 1 28 THR N 1 1 28 THR CA 1 1 28 THR C 1 1 29 THR N 159.0 169.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 56 . 1 1 28 THR C 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C -62.899998 -52.899998 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 57 . 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C 1 1 30 LYS N -45.5 -35.5 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 58 . 1 1 29 THR C 1 1 30 LYS N 1 1 30 LYS CA 1 1 30 LYS C -68.0 -58.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 59 . 1 1 30 LYS N 1 1 30 LYS CA 1 1 30 LYS C 1 1 31 GLU N -47.7 -37.7 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 60 . 1 1 30 LYS C 1 1 31 GLU N 1 1 31 GLU CA 1 1 31 GLU C -70.6 -60.6 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 61 . 1 1 31 GLU N 1 1 31 GLU CA 1 1 31 GLU C 1 1 32 LEU N -54.2 -44.2 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 62 . 1 1 31 GLU C 1 1 32 LEU N 1 1 32 LEU CA 1 1 32 LEU C -66.6 -56.6 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 63 . 1 1 32 LEU N 1 1 32 LEU CA 1 1 32 LEU C 1 1 33 GLY N -44.8 -34.8 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 64 . 1 1 32 LEU C 1 1 33 GLY N 1 1 33 GLY CA 1 1 33 GLY C -75.1 -65.09999 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 65 . 1 1 33 GLY N 1 1 33 GLY CA 1 1 33 GLY C 1 1 34 THR N -50.6 -40.6 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 66 . 1 1 33 GLY C 1 1 34 THR N 1 1 34 THR CA 1 1 34 THR C -63.899998 -53.9 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 67 . 1 1 34 THR N 1 1 34 THR CA 1 1 34 THR C 1 1 35 VAL N -55.9 -45.9 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 68 . 1 1 34 THR C 1 1 35 VAL N 1 1 35 VAL CA 1 1 35 VAL C -70.3 -60.299995 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 69 . 1 1 35 VAL N 1 1 35 VAL CA 1 1 35 VAL C 1 1 36 MET N -50.8 -40.8 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 70 . 1 1 35 VAL C 1 1 36 MET N 1 1 36 MET CA 1 1 36 MET C -66.7 -56.7 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 71 . 1 1 36 MET N 1 1 36 MET CA 1 1 36 MET C 1 1 37 ARG N -52.8 -42.799995 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 72 . 1 1 36 MET C 1 1 37 ARG N 1 1 37 ARG CA 1 1 37 ARG C -65.9 -55.9 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 73 . 1 1 37 ARG N 1 1 37 ARG CA 1 1 37 ARG C 1 1 38 SER N -35.7 -25.7 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 74 . 1 1 37 ARG C 1 1 38 SER N 1 1 38 SER CA 1 1 38 SER C -67.4 -57.4 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 75 . 1 1 38 SER N 1 1 38 SER CA 1 1 38 SER C 1 1 39 LEU N -23.5 -13.499999 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 76 . 1 1 38 SER C 1 1 39 LEU N 1 1 39 LEU CA 1 1 39 LEU C -83.1 -73.1 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 77 . 1 1 39 LEU N 1 1 39 LEU CA 1 1 39 LEU C 1 1 40 GLY N 12.2 22.2 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 78 . 1 1 39 LEU C 1 1 40 GLY N 1 1 40 GLY CA 1 1 40 GLY C 87.2 97.2 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 79 . 1 1 40 GLY N 1 1 40 GLY CA 1 1 40 GLY C 1 1 41 GLN N -3.2 6.8 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 80 . 1 1 40 GLY C 1 1 41 GLN N 1 1 41 GLN CA 1 1 41 GLN C -106.0 -95.99999 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 81 . 1 1 41 GLN N 1 1 41 GLN CA 1 1 41 GLN C 1 1 42 ASN N 153.4 163.4 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 82 . 1 1 41 GLN C 1 1 42 ASN N 1 1 42 ASN CA 1 1 42 ASN C -147.9 -137.9 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 83 . 1 1 42 ASN N 1 1 42 ASN CA 1 1 42 ASN C 1 1 43 PRO N 48.4 58.4 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 84 . 1 1 43 PRO N 1 1 43 PRO CA 1 1 43 PRO C 1 1 44 THR N 149.0 159.0 . 43 . N . 43 . CA . 43 . C . 44 . N 1 1 85 . 1 1 43 PRO C 1 1 44 THR N 1 1 44 THR CA 1 1 44 THR C -86.5 -76.5 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 86 . 1 1 44 THR N 1 1 44 THR CA 1 1 44 THR C 1 1 45 GLU N 158.59999 168.6 . 44 . N . 44 . CA . 44 . C . 45 . N 1 1 87 . 1 1 44 THR C 1 1 45 GLU N 1 1 45 GLU CA 1 1 45 GLU C -60.099995 -50.1 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 88 . 1 1 45 GLU N 1 1 45 GLU CA 1 1 45 GLU C 1 1 46 ALA N -42.7 -32.7 . 45 . N . 45 . CA . 45 . C . 46 . N 1 1 89 . 1 1 45 GLU C 1 1 46 ALA N 1 1 46 ALA CA 1 1 46 ALA C -68.1 -58.1 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 90 . 1 1 46 ALA N 1 1 46 ALA CA 1 1 46 ALA C 1 1 47 GLU N -42.9 -32.9 . 46 . N . 46 . CA . 46 . C . 47 . N 1 1 91 . 1 1 46 ALA C 1 1 47 GLU N 1 1 47 GLU CA 1 1 47 GLU C -72.5 -62.5 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 92 . 1 1 47 GLU N 1 1 47 GLU CA 1 1 47 GLU C 1 1 48 LEU N -50.5 -40.5 . 47 . N . 47 . CA . 47 . C . 48 . N 1 1 93 . 1 1 47 GLU C 1 1 48 LEU N 1 1 48 LEU CA 1 1 48 LEU C -71.9 -61.9 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1 94 . 1 1 48 LEU N 1 1 48 LEU CA 1 1 48 LEU C 1 1 49 GLN N -52.899998 -42.9 . 48 . N . 48 . CA . 48 . C . 49 . N 1 1 95 . 1 1 48 LEU C 1 1 49 GLN N 1 1 49 GLN CA 1 1 49 GLN C -60.299995 -50.3 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 96 . 1 1 49 GLN N 1 1 49 GLN CA 1 1 49 GLN C 1 1 50 ASP N -47.4 -37.4 . 49 . N . 49 . CA . 49 . C . 50 . N 1 1 97 . 1 1 49 GLN C 1 1 50 ASP N 1 1 50 ASP CA 1 1 50 ASP C -67.4 -57.4 . 49 . C . 50 . N . 50 . CA . 50 . C 1 1 98 . 1 1 50 ASP N 1 1 50 ASP CA 1 1 50 ASP C 1 1 51 MET N -48.6 -38.6 . 50 . N . 50 . CA . 50 . C . 51 . N 1 1 99 . 1 1 50 ASP C 1 1 51 MET N 1 1 51 MET CA 1 1 51 MET C -64.7 -54.7 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 100 . 1 1 51 MET N 1 1 51 MET CA 1 1 51 MET C 1 1 52 ILE N -54.9 -44.9 . 51 . N . 51 . CA . 51 . C . 52 . N 1 1 101 . 1 1 51 MET C 1 1 52 ILE N 1 1 52 ILE CA 1 1 52 ILE C -70.5 -60.5 . 51 . C . 52 . N . 52 . CA . 52 . C 1 1 102 . 1 1 52 ILE N 1 1 52 ILE CA 1 1 52 ILE C 1 1 53 ASN N -58.699997 -48.7 . 52 . N . 52 . CA . 52 . C . 53 . N 1 1 103 . 1 1 52 ILE C 1 1 53 ASN N 1 1 53 ASN CA 1 1 53 ASN C -58.8 -48.8 . 52 . C . 53 . N . 53 . CA . 53 . C 1 1 104 . 1 1 53 ASN N 1 1 53 ASN CA 1 1 53 ASN C 1 1 54 GLU N -43.5 -33.499996 . 53 . N . 53 . CA . 53 . C . 54 . N 1 1 105 . 1 1 53 ASN C 1 1 54 GLU N 1 1 54 GLU CA 1 1 54 GLU C -61.9 -51.9 . 53 . C . 54 . N . 54 . CA . 54 . C 1 1 106 . 1 1 54 GLU N 1 1 54 GLU CA 1 1 54 GLU C 1 1 55 VAL N -44.2 -34.2 . 54 . N . 54 . CA . 54 . C . 55 . N 1 1 107 . 1 1 54 GLU C 1 1 55 VAL N 1 1 55 VAL CA 1 1 55 VAL C -102.8 -92.8 . 54 . C . 55 . N . 55 . CA . 55 . C 1 1 108 . 1 1 55 VAL N 1 1 55 VAL CA 1 1 55 VAL C 1 1 56 ASP N -16.4 -6.4 . 55 . N . 55 . CA . 55 . C . 56 . N 1 1 109 . 1 1 55 VAL C 1 1 56 ASP N 1 1 56 ASP CA 1 1 56 ASP C -76.8 -66.8 . 55 . C . 56 . N . 56 . CA . 56 . C 1 1 110 . 1 1 56 ASP N 1 1 56 ASP CA 1 1 56 ASP C 1 1 57 ALA N 79.0 89.0 . 56 . N . 56 . CA . 56 . C . 57 . N 1 1 111 . 1 1 56 ASP C 1 1 57 ALA N 1 1 57 ALA CA 1 1 57 ALA C -57.8 -47.8 . 56 . C . 57 . N . 57 . CA . 57 . C 1 1 112 . 1 1 57 ALA N 1 1 57 ALA CA 1 1 57 ALA C 1 1 58 ASP N -44.5 -34.5 . 57 . N . 57 . CA . 57 . C . 58 . N 1 1 113 . 1 1 57 ALA C 1 1 58 ASP N 1 1 58 ASP CA 1 1 58 ASP C -96.7 -86.7 . 57 . C . 58 . N . 58 . CA . 58 . C 1 1 114 . 1 1 58 ASP N 1 1 58 ASP CA 1 1 58 ASP C 1 1 59 GLY N -11.6 -1.6 . 58 . N . 58 . CA . 58 . C . 59 . N 1 1 115 . 1 1 58 ASP C 1 1 59 GLY N 1 1 59 GLY CA 1 1 59 GLY C 54.2 64.2 . 58 . C . 59 . N . 59 . CA . 59 . C 1 1 116 . 1 1 59 GLY N 1 1 59 GLY CA 1 1 59 GLY C 1 1 60 ASN N 30.899998 40.9 . 59 . N . 59 . CA . 59 . C . 60 . N 1 1 117 . 1 1 59 GLY C 1 1 60 ASN N 1 1 60 ASN CA 1 1 60 ASN C -87.2 -77.2 . 59 . C . 60 . N . 60 . CA . 60 . C 1 1 118 . 1 1 60 ASN N 1 1 60 ASN CA 1 1 60 ASN C 1 1 61 GLY N -0.2 9.8 . 60 . N . 60 . CA . 60 . C . 61 . N 1 1 119 . 1 1 60 ASN C 1 1 61 GLY N 1 1 61 GLY CA 1 1 61 GLY C 76.9 86.9 . 60 . C . 61 . N . 61 . CA . 61 . C 1 1 120 . 1 1 61 GLY N 1 1 61 GLY CA 1 1 61 GLY C 1 1 62 THR N -9.1 0.8999999 . 61 . N . 61 . CA . 61 . C . 62 . N 1 1 121 . 1 1 61 GLY C 1 1 62 THR N 1 1 62 THR CA 1 1 62 THR C -143.8 -133.8 . 61 . C . 62 . N . 62 . CA . 62 . C 1 1 122 . 1 1 62 THR N 1 1 62 THR CA 1 1 62 THR C 1 1 63 ILE N 152.1 162.1 . 62 . N . 62 . CA . 62 . C . 63 . N 1 1 123 . 1 1 62 THR C 1 1 63 ILE N 1 1 63 ILE CA 1 1 63 ILE C -118.19999 -108.2 . 62 . C . 63 . N . 63 . CA . 63 . C 1 1 124 . 1 1 63 ILE N 1 1 63 ILE CA 1 1 63 ILE C 1 1 64 ASP N 120.299995 130.3 . 63 . N . 63 . CA . 63 . C . 64 . N 1 1 125 . 1 1 63 ILE C 1 1 64 ASP N 1 1 64 ASP CA 1 1 64 ASP C -95.1 -85.1 . 63 . C . 64 . N . 64 . CA . 64 . C 1 1 126 . 1 1 64 ASP N 1 1 64 ASP CA 1 1 64 ASP C 1 1 65 PHE N 172.3 182.3 . 64 . N . 64 . CA . 64 . C . 65 . N 1 1 127 . 1 1 64 ASP C 1 1 65 PHE N 1 1 65 PHE CA 1 1 65 PHE C -57.3 -47.3 . 64 . C . 65 . N . 65 . CA . 65 . C 1 1 128 . 1 1 65 PHE N 1 1 65 PHE CA 1 1 65 PHE C 1 1 66 PRO N -54.7 -44.699997 . 65 . N . 65 . CA . 65 . C . 66 . N 1 1 129 . 1 1 66 PRO N 1 1 66 PRO CA 1 1 66 PRO C 1 1 67 GLU N -49.5 -39.5 . 66 . N . 66 . CA . 66 . C . 67 . N 1 1 130 . 1 1 66 PRO C 1 1 67 GLU N 1 1 67 GLU CA 1 1 67 GLU C -69.2 -59.2 . 66 . C . 67 . N . 67 . CA . 67 . C 1 1 131 . 1 1 67 GLU N 1 1 67 GLU CA 1 1 67 GLU C 1 1 68 PHE N -40.0 -30.0 . 67 . N . 67 . CA . 67 . C . 68 . N 1 1 132 . 1 1 67 GLU C 1 1 68 PHE N 1 1 68 PHE CA 1 1 68 PHE C -63.0 -53.0 . 67 . C . 68 . N . 68 . CA . 68 . C 1 1 133 . 1 1 68 PHE N 1 1 68 PHE CA 1 1 68 PHE C 1 1 69 LEU N -52.2 -42.2 . 68 . N . 68 . CA . 68 . C . 69 . N 1 1 134 . 1 1 68 PHE C 1 1 69 LEU N 1 1 69 LEU CA 1 1 69 LEU C -59.8 -49.8 . 68 . C . 69 . N . 69 . CA . 69 . C 1 1 135 . 1 1 69 LEU N 1 1 69 LEU CA 1 1 69 LEU C 1 1 70 THR N -41.4 -31.399998 . 69 . N . 69 . CA . 69 . C . 70 . N 1 1 136 . 1 1 69 LEU C 1 1 70 THR N 1 1 70 THR CA 1 1 70 THR C -67.8 -57.8 . 69 . C . 70 . N . 70 . CA . 70 . C 1 1 137 . 1 1 70 THR N 1 1 70 THR CA 1 1 70 THR C 1 1 71 MET N -49.8 -39.799995 . 70 . N . 70 . CA . 70 . C . 71 . N 1 1 138 . 1 1 70 THR C 1 1 71 MET N 1 1 71 MET CA 1 1 71 MET C -63.2 -53.199997 . 70 . C . 71 . N . 71 . CA . 71 . C 1 1 139 . 1 1 71 MET N 1 1 71 MET CA 1 1 71 MET C 1 1 72 MET N -53.7 -43.7 . 71 . N . 71 . CA . 71 . C . 72 . N 1 1 140 . 1 1 71 MET C 1 1 72 MET N 1 1 72 MET CA 1 1 72 MET C -75.49999 -65.5 . 71 . C . 72 . N . 72 . CA . 72 . C 1 1 141 . 1 1 72 MET N 1 1 72 MET CA 1 1 72 MET C 1 1 73 ALA N -24.9 -14.9 . 72 . N . 72 . CA . 72 . C . 73 . N 1 1 142 . 1 1 72 MET C 1 1 73 ALA N 1 1 73 ALA CA 1 1 73 ALA C -82.9 -72.9 . 72 . C . 73 . N . 73 . CA . 73 . C 1 1 143 . 1 1 73 ALA N 1 1 73 ALA CA 1 1 73 ALA C 1 1 74 ARG N -30.199999 -20.2 . 73 . N . 73 . CA . 73 . C . 74 . N 1 1 144 . 1 1 73 ALA C 1 1 74 ARG N 1 1 74 ARG CA 1 1 74 ARG C -73.59999 -63.599995 . 73 . C . 74 . N . 74 . CA . 74 . C 1 1 145 . 1 1 74 ARG N 1 1 74 ARG CA 1 1 74 ARG C 1 1 75 LYS N -54.299995 -44.3 . 74 . N . 74 . CA . 74 . C . 75 . N 1 1 146 . 1 1 74 ARG C 1 1 75 LYS N 1 1 75 LYS CA 1 1 75 LYS C -76.8 -66.8 . 74 . C . 75 . N . 75 . CA . 75 . C 1 1 147 . 1 1 75 LYS N 1 1 75 LYS CA 1 1 75 LYS C 1 1 76 MET N -42.4 -32.399998 . 75 . N . 75 . CA . 75 . C . 76 . N 1 1 148 . 1 1 75 LYS C 1 1 76 MET N 1 1 76 MET CA 1 1 76 MET C -61.7 -51.7 . 75 . C . 76 . N . 76 . CA . 76 . C 1 1 149 . 1 1 76 MET N 1 1 76 MET CA 1 1 76 MET C 1 1 77 LYS N -47.6 -37.6 . 76 . N . 76 . CA . 76 . C . 77 . N 1 1 150 . 1 1 76 MET C 1 1 77 LYS N 1 1 77 LYS CA 1 1 77 LYS C -66.99999 -57.0 . 76 . C . 77 . N . 77 . CA . 77 . C 1 1 151 . 1 1 77 LYS N 1 1 77 LYS CA 1 1 77 LYS C 1 1 78 ASP N -51.5 -41.5 . 77 . N . 77 . CA . 77 . C . 78 . N 1 1 152 . 1 1 77 LYS C 1 1 78 ASP N 1 1 78 ASP CA 1 1 78 ASP C -104.49999 -94.5 . 77 . C . 78 . N . 78 . CA . 78 . C 1 1 153 . 1 1 78 ASP N 1 1 78 ASP CA 1 1 78 ASP C 1 1 79 THR N 17.1 27.1 . 78 . N . 78 . CA . 78 . C . 79 . N 1 1 154 . 1 1 78 ASP C 1 1 79 THR N 1 1 79 THR CA 1 1 79 THR C -60.800003 -50.8 . 78 . C . 79 . N . 79 . CA . 79 . C 1 1 155 . 1 1 79 THR N 1 1 79 THR CA 1 1 79 THR C 1 1 80 ASP N 93.4 103.4 . 79 . N . 79 . CA . 79 . C . 80 . N 1 1 156 . 1 1 79 THR C 1 1 80 ASP N 1 1 80 ASP CA 1 1 80 ASP C -98.5 -88.5 . 79 . C . 80 . N . 80 . CA . 80 . C 1 1 157 . 1 1 80 ASP N 1 1 80 ASP CA 1 1 80 ASP C 1 1 81 SER N 81.1 91.1 . 80 . N . 80 . CA . 80 . C . 81 . N 1 1 158 . 1 1 80 ASP C 1 1 81 SER N 1 1 81 SER CA 1 1 81 SER C -49.2 -39.2 . 80 . C . 81 . N . 81 . CA . 81 . C 1 1 159 . 1 1 81 SER N 1 1 81 SER CA 1 1 81 SER C 1 1 82 GLU N -24.1 -14.1 . 81 . N . 81 . CA . 81 . C . 82 . N 1 1 160 . 1 1 81 SER C 1 1 82 GLU N 1 1 82 GLU CA 1 1 82 GLU C -83.9 -73.9 . 81 . C . 82 . N . 82 . CA . 82 . C 1 1 161 . 1 1 82 GLU N 1 1 82 GLU CA 1 1 82 GLU C 1 1 83 GLU N -69.0 -59.0 . 82 . N . 82 . CA . 82 . C . 83 . N 1 1 162 . 1 1 82 GLU C 1 1 83 GLU N 1 1 83 GLU CA 1 1 83 GLU C -70.0 -60.0 . 82 . C . 83 . N . 83 . CA . 83 . C 1 1 163 . 1 1 83 GLU N 1 1 83 GLU CA 1 1 83 GLU C 1 1 84 GLU N -45.9 -35.9 . 83 . N . 83 . CA . 83 . C . 84 . N 1 1 164 . 1 1 83 GLU C 1 1 84 GLU N 1 1 84 GLU CA 1 1 84 GLU C -62.5 -52.5 . 83 . C . 84 . N . 84 . CA . 84 . C 1 1 165 . 1 1 84 GLU N 1 1 84 GLU CA 1 1 84 GLU C 1 1 85 ILE N -53.3 -43.3 . 84 . N . 84 . CA . 84 . C . 85 . N 1 1 166 . 1 1 84 GLU C 1 1 85 ILE N 1 1 85 ILE CA 1 1 85 ILE C -72.5 -62.5 . 84 . C . 85 . N . 85 . CA . 85 . C 1 1 167 . 1 1 85 ILE N 1 1 85 ILE CA 1 1 85 ILE C 1 1 86 ARG N -46.899998 -36.9 . 85 . N . 85 . CA . 85 . C . 86 . N 1 1 168 . 1 1 85 ILE C 1 1 86 ARG N 1 1 86 ARG CA 1 1 86 ARG C -67.7 -57.699997 . 85 . C . 86 . N . 86 . CA . 86 . C 1 1 169 . 1 1 86 ARG N 1 1 86 ARG CA 1 1 86 ARG C 1 1 87 GLU N -48.4 -38.4 . 86 . N . 86 . CA . 86 . C . 87 . N 1 1 170 . 1 1 86 ARG C 1 1 87 GLU N 1 1 87 GLU CA 1 1 87 GLU C -73.4 -63.4 . 86 . C . 87 . N . 87 . CA . 87 . C 1 1 171 . 1 1 87 GLU N 1 1 87 GLU CA 1 1 87 GLU C 1 1 88 ALA N -47.2 -37.2 . 87 . N . 87 . CA . 87 . C . 88 . N 1 1 172 . 1 1 87 GLU C 1 1 88 ALA N 1 1 88 ALA CA 1 1 88 ALA C -71.0 -60.999996 . 87 . C . 88 . N . 88 . CA . 88 . C 1 1 173 . 1 1 88 ALA N 1 1 88 ALA CA 1 1 88 ALA C 1 1 89 PHE N -50.0 -40.0 . 88 . N . 88 . CA . 88 . C . 89 . N 1 1 174 . 1 1 88 ALA C 1 1 89 PHE N 1 1 89 PHE CA 1 1 89 PHE C -58.8 -48.8 . 88 . C . 89 . N . 89 . CA . 89 . C 1 1 175 . 1 1 89 PHE N 1 1 89 PHE CA 1 1 89 PHE C 1 1 90 ARG N -49.0 -39.0 . 89 . N . 89 . CA . 89 . C . 90 . N 1 1 176 . 1 1 89 PHE C 1 1 90 ARG N 1 1 90 ARG CA 1 1 90 ARG C -72.0 -61.999996 . 89 . C . 90 . N . 90 . CA . 90 . C 1 1 177 . 1 1 90 ARG N 1 1 90 ARG CA 1 1 90 ARG C 1 1 91 VAL N -40.1 -30.100002 . 90 . N . 90 . CA . 90 . C . 91 . N 1 1 178 . 1 1 90 ARG C 1 1 91 VAL N 1 1 91 VAL CA 1 1 91 VAL C -75.8 -65.8 . 90 . C . 91 . N . 91 . CA . 91 . C 1 1 179 . 1 1 91 VAL N 1 1 91 VAL CA 1 1 91 VAL C 1 1 92 PHE N -51.1 -41.1 . 91 . N . 91 . CA . 91 . C . 92 . N 1 1 180 . 1 1 91 VAL C 1 1 92 PHE N 1 1 92 PHE CA 1 1 92 PHE C -74.9 -64.9 . 91 . C . 92 . N . 92 . CA . 92 . C 1 1 181 . 1 1 92 PHE N 1 1 92 PHE CA 1 1 92 PHE C 1 1 93 ASP N -44.8 -34.8 . 92 . N . 92 . CA . 92 . C . 93 . N 1 1 182 . 1 1 92 PHE C 1 1 93 ASP N 1 1 93 ASP CA 1 1 93 ASP C -87.1 -77.1 . 92 . C . 93 . N . 93 . CA . 93 . C 1 1 183 . 1 1 93 ASP N 1 1 93 ASP CA 1 1 93 ASP C 1 1 94 LYS N 69.7 79.7 . 93 . N . 93 . CA . 93 . C . 94 . N 1 1 184 . 1 1 93 ASP C 1 1 94 LYS N 1 1 94 LYS CA 1 1 94 LYS C -53.999996 -44.0 . 93 . C . 94 . N . 94 . CA . 94 . C 1 1 185 . 1 1 94 LYS N 1 1 94 LYS CA 1 1 94 LYS C 1 1 95 ASP N -50.6 -40.6 . 94 . N . 94 . CA . 94 . C . 95 . N 1 1 186 . 1 1 94 LYS C 1 1 95 ASP N 1 1 95 ASP CA 1 1 95 ASP C -86.0 -76.0 . 94 . C . 95 . N . 95 . CA . 95 . C 1 1 187 . 1 1 95 ASP N 1 1 95 ASP CA 1 1 95 ASP C 1 1 96 GLY N -9.5 0.5 . 95 . N . 95 . CA . 95 . C . 96 . N 1 1 188 . 1 1 95 ASP C 1 1 96 GLY N 1 1 96 GLY CA 1 1 96 GLY C 45.2 55.2 . 95 . C . 96 . N . 96 . CA . 96 . C 1 1 189 . 1 1 96 GLY N 1 1 96 GLY CA 1 1 96 GLY C 1 1 97 ASN N 32.5 42.5 . 96 . N . 96 . CA . 96 . C . 97 . N 1 1 190 . 1 1 96 GLY C 1 1 97 ASN N 1 1 97 ASN CA 1 1 97 ASN C -87.0 -77.0 . 96 . C . 97 . N . 97 . CA . 97 . C 1 1 191 . 1 1 97 ASN N 1 1 97 ASN CA 1 1 97 ASN C 1 1 98 GLY N -5.9999995 4.0 . 97 . N . 97 . CA . 97 . C . 98 . N 1 1 192 . 1 1 97 ASN C 1 1 98 GLY N 1 1 98 GLY CA 1 1 98 GLY C 88.09999 98.1 . 97 . C . 98 . N . 98 . CA . 98 . C 1 1 193 . 1 1 98 GLY N 1 1 98 GLY CA 1 1 98 GLY C 1 1 99 TYR N -8.2 1.7999998 . 98 . N . 98 . CA . 98 . C . 99 . N 1 1 194 . 1 1 98 GLY C 1 1 99 TYR N 1 1 99 TYR CA 1 1 99 TYR C -136.4 -126.4 . 98 . C . 99 . N . 99 . CA . 99 . C 1 1 195 . 1 1 99 TYR N 1 1 99 TYR CA 1 1 99 TYR C 1 1 100 ILE N 133.2 143.2 . 99 . N . 99 . CA . 99 . C . 100 . N 1 1 196 . 1 1 99 TYR C 1 1 100 ILE N 1 1 100 ILE CA 1 1 100 ILE C -99.799995 -89.8 . 99 . C . 100 . N . 100 . CA . 100 . C 1 1 197 . 1 1 100 ILE N 1 1 100 ILE CA 1 1 100 ILE C 1 1 101 SER N 110.9 120.9 . 100 . N . 100 . CA . 100 . C . 101 . N 1 1 198 . 1 1 100 ILE C 1 1 101 SER N 1 1 101 SER CA 1 1 101 SER C -90.6 -80.6 . 100 . C . 101 . N . 101 . CA . 101 . C 1 1 199 . 1 1 101 SER N 1 1 101 SER CA 1 1 101 SER C 1 1 102 ALA N 154.5 164.5 . 101 . N . 101 . CA . 101 . C . 102 . N 1 1 200 . 1 1 101 SER C 1 1 102 ALA N 1 1 102 ALA CA 1 1 102 ALA C -69.8 -59.8 . 101 . C . 102 . N . 102 . CA . 102 . C 1 1 201 . 1 1 102 ALA N 1 1 102 ALA CA 1 1 102 ALA C 1 1 103 ALA N -49.8 -39.799995 . 102 . N . 102 . CA . 102 . C . 103 . N 1 1 202 . 1 1 102 ALA C 1 1 103 ALA N 1 1 103 ALA CA 1 1 103 ALA C -60.5 -50.5 . 102 . C . 103 . N . 103 . CA . 103 . C 1 1 203 . 1 1 103 ALA N 1 1 103 ALA CA 1 1 103 ALA C 1 1 104 GLU N -48.8 -38.8 . 103 . N . 103 . CA . 103 . C . 104 . N 1 1 204 . 1 1 103 ALA C 1 1 104 GLU N 1 1 104 GLU CA 1 1 104 GLU C -66.5 -56.5 . 103 . C . 104 . N . 104 . CA . 104 . C 1 1 205 . 1 1 104 GLU N 1 1 104 GLU CA 1 1 104 GLU C 1 1 105 LEU N -50.4 -40.4 . 104 . N . 104 . CA . 104 . C . 105 . N 1 1 206 . 1 1 104 GLU C 1 1 105 LEU N 1 1 105 LEU CA 1 1 105 LEU C -64.5 -54.5 . 104 . C . 105 . N . 105 . CA . 105 . C 1 1 207 . 1 1 105 LEU N 1 1 105 LEU CA 1 1 105 LEU C 1 1 106 ARG N -44.2 -34.2 . 105 . N . 105 . CA . 105 . C . 106 . N 1 1 208 . 1 1 105 LEU C 1 1 106 ARG N 1 1 106 ARG CA 1 1 106 ARG C -65.4 -55.4 . 105 . C . 106 . N . 106 . CA . 106 . C 1 1 209 . 1 1 106 ARG N 1 1 106 ARG CA 1 1 106 ARG C 1 1 107 HIS N -44.4 -34.4 . 106 . N . 106 . CA . 106 . C . 107 . N 1 1 210 . 1 1 106 ARG C 1 1 107 HIS N 1 1 107 HIS CA 1 1 107 HIS C -69.5 -59.499996 . 106 . C . 107 . N . 107 . CA . 107 . C 1 1 211 . 1 1 107 HIS N 1 1 107 HIS CA 1 1 107 HIS C 1 1 108 VAL N -56.1 -46.099995 . 107 . N . 107 . CA . 107 . C . 108 . N 1 1 212 . 1 1 107 HIS C 1 1 108 VAL N 1 1 108 VAL CA 1 1 108 VAL C -70.0 -60.0 . 107 . C . 108 . N . 108 . CA . 108 . C 1 1 213 . 1 1 108 VAL N 1 1 108 VAL CA 1 1 108 VAL C 1 1 109 MET N -46.2 -36.2 . 108 . N . 108 . CA . 108 . C . 109 . N 1 1 214 . 1 1 108 VAL C 1 1 109 MET N 1 1 109 MET CA 1 1 109 MET C -71.6 -61.600002 . 108 . C . 109 . N . 109 . CA . 109 . C 1 1 215 . 1 1 109 MET N 1 1 109 MET CA 1 1 109 MET C 1 1 110 THR N -44.699997 -34.7 . 109 . N . 109 . CA . 109 . C . 110 . N 1 1 216 . 1 1 109 MET C 1 1 110 THR N 1 1 110 THR CA 1 1 110 THR C -65.9 -55.9 . 109 . C . 110 . N . 110 . CA . 110 . C 1 1 217 . 1 1 110 THR N 1 1 110 THR CA 1 1 110 THR C 1 1 111 ASN N -44.699997 -34.7 . 110 . N . 110 . CA . 110 . C . 111 . N 1 1 218 . 1 1 110 THR C 1 1 111 ASN N 1 1 111 ASN CA 1 1 111 ASN C -64.6 -54.6 . 110 . C . 111 . N . 111 . CA . 111 . C 1 1 219 . 1 1 111 ASN N 1 1 111 ASN CA 1 1 111 ASN C 1 1 112 LEU N -39.0 -29.0 . 111 . N . 111 . CA . 111 . C . 112 . N 1 1 220 . 1 1 111 ASN C 1 1 112 LEU N 1 1 112 LEU CA 1 1 112 LEU C -75.49999 -65.5 . 111 . C . 112 . N . 112 . CA . 112 . C 1 1 221 . 1 1 112 LEU N 1 1 112 LEU CA 1 1 112 LEU C 1 1 113 GLY N -10.6 -0.6 . 112 . N . 112 . CA . 112 . C . 113 . N 1 1 222 . 1 1 112 LEU C 1 1 113 GLY N 1 1 113 GLY CA 1 1 113 GLY C 80.0 89.99999 . 112 . C . 113 . N . 113 . CA . 113 . C 1 1 223 . 1 1 113 GLY N 1 1 113 GLY CA 1 1 113 GLY C 1 1 114 GLU N 12.7 22.7 . 113 . N . 113 . CA . 113 . C . 114 . N 1 1 224 . 1 1 113 GLY C 1 1 114 GLU N 1 1 114 GLU CA 1 1 114 GLU C -96.4 -86.4 . 113 . C . 114 . N . 114 . CA . 114 . C 1 1 225 . 1 1 114 GLU N 1 1 114 GLU CA 1 1 114 GLU C 1 1 115 LYS N 117.1 127.1 . 114 . N . 114 . CA . 114 . C . 115 . N 1 1 226 . 1 1 114 GLU C 1 1 115 LYS N 1 1 115 LYS CA 1 1 115 LYS C -86.0 -76.0 . 114 . C . 115 . N . 115 . CA . 115 . C 1 1 227 . 1 1 115 LYS N 1 1 115 LYS CA 1 1 115 LYS C 1 1 116 LEU N 97.2 107.2 . 115 . N . 115 . CA . 115 . C . 116 . N 1 1 228 . 1 1 115 LYS C 1 1 116 LEU N 1 1 116 LEU CA 1 1 116 LEU C -133.3 -123.299995 . 115 . C . 116 . N . 116 . CA . 116 . C 1 1 229 . 1 1 116 LEU N 1 1 116 LEU CA 1 1 116 LEU C 1 1 117 THR N 133.6 143.6 . 116 . N . 116 . CA . 116 . C . 117 . N 1 1 230 . 1 1 116 LEU C 1 1 117 THR N 1 1 117 THR CA 1 1 117 THR C -91.1 -81.1 . 116 . C . 117 . N . 117 . CA . 117 . C 1 1 231 . 1 1 117 THR N 1 1 117 THR CA 1 1 117 THR C 1 1 118 ASP N 161.2 171.19998 . 117 . N . 117 . CA . 117 . C . 118 . N 1 1 232 . 1 1 117 THR C 1 1 118 ASP N 1 1 118 ASP CA 1 1 118 ASP C -65.09999 -55.1 . 117 . C . 118 . N . 118 . CA . 118 . C 1 1 233 . 1 1 118 ASP N 1 1 118 ASP CA 1 1 118 ASP C 1 1 119 GLU N -41.699997 -31.7 . 118 . N . 118 . CA . 118 . C . 119 . N 1 1 234 . 1 1 118 ASP C 1 1 119 GLU N 1 1 119 GLU CA 1 1 119 GLU C -74.9 -64.9 . 118 . C . 119 . N . 119 . CA . 119 . C 1 1 235 . 1 1 119 GLU N 1 1 119 GLU CA 1 1 119 GLU C 1 1 120 GLU N -47.8 -37.8 . 119 . N . 119 . CA . 119 . C . 120 . N 1 1 236 . 1 1 119 GLU C 1 1 120 GLU N 1 1 120 GLU CA 1 1 120 GLU C -68.899994 -58.9 . 119 . C . 120 . N . 120 . CA . 120 . C 1 1 237 . 1 1 120 GLU N 1 1 120 GLU CA 1 1 120 GLU C 1 1 121 VAL N -45.2 -35.2 . 120 . N . 120 . CA . 120 . C . 121 . N 1 1 238 . 1 1 120 GLU C 1 1 121 VAL N 1 1 121 VAL CA 1 1 121 VAL C -69.3 -59.299995 . 120 . C . 121 . N . 121 . CA . 121 . C 1 1 239 . 1 1 121 VAL N 1 1 121 VAL CA 1 1 121 VAL C 1 1 122 ASP N -48.9 -38.9 . 121 . N . 121 . CA . 121 . C . 122 . N 1 1 240 . 1 1 121 VAL C 1 1 122 ASP N 1 1 122 ASP CA 1 1 122 ASP C -66.1 -56.1 . 121 . C . 122 . N . 122 . CA . 122 . C 1 1 241 . 1 1 122 ASP N 1 1 122 ASP CA 1 1 122 ASP C 1 1 123 GLU N -41.9 -31.9 . 122 . N . 122 . CA . 122 . C . 123 . N 1 1 242 . 1 1 122 ASP C 1 1 123 GLU N 1 1 123 GLU CA 1 1 123 GLU C -72.0 -61.999996 . 122 . C . 123 . N . 123 . CA . 123 . C 1 1 243 . 1 1 123 GLU N 1 1 123 GLU CA 1 1 123 GLU C 1 1 124 MET N -42.1 -32.1 . 123 . N . 123 . CA . 123 . C . 124 . N 1 1 244 . 1 1 123 GLU C 1 1 124 MET N 1 1 124 MET CA 1 1 124 MET C -66.9 -56.9 . 123 . C . 124 . N . 124 . CA . 124 . C 1 1 245 . 1 1 124 MET N 1 1 124 MET CA 1 1 124 MET C 1 1 125 ILE N -52.6 -42.6 . 124 . N . 124 . CA . 124 . C . 125 . N 1 1 246 . 1 1 124 MET C 1 1 125 ILE N 1 1 125 ILE CA 1 1 125 ILE C -70.5 -60.5 . 124 . C . 125 . N . 125 . CA . 125 . C 1 1 247 . 1 1 125 ILE N 1 1 125 ILE CA 1 1 125 ILE C 1 1 126 ARG N -47.4 -37.4 . 125 . N . 125 . CA . 125 . C . 126 . N 1 1 248 . 1 1 125 ILE C 1 1 126 ARG N 1 1 126 ARG CA 1 1 126 ARG C -64.799995 -54.8 . 125 . C . 126 . N . 126 . CA . 126 . C 1 1 249 . 1 1 126 ARG N 1 1 126 ARG CA 1 1 126 ARG C 1 1 127 GLU N -44.5 -34.5 . 126 . N . 126 . CA . 126 . C . 127 . N 1 1 250 . 1 1 126 ARG C 1 1 127 GLU N 1 1 127 GLU CA 1 1 127 GLU C -68.6 -58.6 . 126 . C . 127 . N . 127 . CA . 127 . C 1 1 251 . 1 1 127 GLU N 1 1 127 GLU CA 1 1 127 GLU C 1 1 128 ALA N -40.0 -30.0 . 127 . N . 127 . CA . 127 . C . 128 . N 1 1 252 . 1 1 127 GLU C 1 1 128 ALA N 1 1 128 ALA CA 1 1 128 ALA C -92.1 -82.1 . 127 . C . 128 . N . 128 . CA . 128 . C 1 1 253 . 1 1 128 ALA N 1 1 128 ALA CA 1 1 128 ALA C 1 1 129 ASP N -30.699999 -20.7 . 128 . N . 128 . CA . 128 . C . 129 . N 1 1 254 . 1 1 128 ALA C 1 1 129 ASP N 1 1 129 ASP CA 1 1 129 ASP C -85.5 -75.49999 . 128 . C . 129 . N . 129 . CA . 129 . C 1 1 255 . 1 1 129 ASP N 1 1 129 ASP CA 1 1 129 ASP C 1 1 130 ILE N 92.4 102.4 . 129 . N . 129 . CA . 129 . C . 130 . N 1 1 256 . 1 1 129 ASP C 1 1 130 ILE N 1 1 130 ILE CA 1 1 130 ILE C -79.299995 -69.3 . 129 . C . 130 . N . 130 . CA . 130 . C 1 1 257 . 1 1 130 ILE N 1 1 130 ILE CA 1 1 130 ILE C 1 1 131 ASP N -33.4 -23.4 . 130 . N . 130 . CA . 130 . C . 131 . N 1 1 258 . 1 1 130 ILE C 1 1 131 ASP N 1 1 131 ASP CA 1 1 131 ASP C -89.0 -79.0 . 130 . C . 131 . N . 131 . CA . 131 . C 1 1 259 . 1 1 131 ASP N 1 1 131 ASP CA 1 1 131 ASP C 1 1 132 GLY N -20.0 -10.0 . 131 . N . 131 . CA . 131 . C . 132 . N 1 1 260 . 1 1 131 ASP C 1 1 132 GLY N 1 1 132 GLY CA 1 1 132 GLY C 65.4 75.4 . 131 . C . 132 . N . 132 . CA . 132 . C 1 1 261 . 1 1 132 GLY N 1 1 132 GLY CA 1 1 132 GLY C 1 1 133 ASP N 21.0 30.999998 . 132 . N . 132 . CA . 132 . C . 133 . N 1 1 262 . 1 1 132 GLY C 1 1 133 ASP N 1 1 133 ASP CA 1 1 133 ASP C -86.7 -76.7 . 132 . C . 133 . N . 133 . CA . 133 . C 1 1 263 . 1 1 133 ASP N 1 1 133 ASP CA 1 1 133 ASP C 1 1 134 GLY N -7.8 2.2 . 133 . N . 133 . CA . 133 . C . 134 . N 1 1 264 . 1 1 133 ASP C 1 1 134 GLY N 1 1 134 GLY CA 1 1 134 GLY C 83.2 93.2 . 133 . C . 134 . N . 134 . CA . 134 . C 1 1 265 . 1 1 134 GLY N 1 1 134 GLY CA 1 1 134 GLY C 1 1 135 GLN N 2.0 11.999999 . 134 . N . 134 . CA . 134 . C . 135 . N 1 1 266 . 1 1 134 GLY C 1 1 135 GLN N 1 1 135 GLN CA 1 1 135 GLN C -144.9 -134.9 . 134 . C . 135 . N . 135 . CA . 135 . C 1 1 267 . 1 1 135 GLN N 1 1 135 GLN CA 1 1 135 GLN C 1 1 136 VAL N 162.8 172.8 . 135 . N . 135 . CA . 135 . C . 136 . N 1 1 268 . 1 1 135 GLN C 1 1 136 VAL N 1 1 136 VAL CA 1 1 136 VAL C -123.59999 -113.6 . 135 . C . 136 . N . 136 . CA . 136 . C 1 1 269 . 1 1 136 VAL N 1 1 136 VAL CA 1 1 136 VAL C 1 1 137 ASN N 116.7 126.7 . 136 . N . 136 . CA . 136 . C . 137 . N 1 1 270 . 1 1 136 VAL C 1 1 137 ASN N 1 1 137 ASN CA 1 1 137 ASN C -94.8 -84.8 . 136 . C . 137 . N . 137 . CA . 137 . C 1 1 271 . 1 1 137 ASN N 1 1 137 ASN CA 1 1 137 ASN C 1 1 138 TYR N 169.5 179.5 . 137 . N . 137 . CA . 137 . C . 138 . N 1 1 272 . 1 1 137 ASN C 1 1 138 TYR N 1 1 138 TYR CA 1 1 138 TYR C -66.99999 -57.0 . 137 . C . 138 . N . 138 . CA . 138 . C 1 1 273 . 1 1 138 TYR N 1 1 138 TYR CA 1 1 138 TYR C 1 1 139 GLU N -54.5 -44.5 . 138 . N . 138 . CA . 138 . C . 139 . N 1 1 274 . 1 1 138 TYR C 1 1 139 GLU N 1 1 139 GLU CA 1 1 139 GLU C -64.6 -54.6 . 138 . C . 139 . N . 139 . CA . 139 . C 1 1 275 . 1 1 139 GLU N 1 1 139 GLU CA 1 1 139 GLU C 1 1 140 GLU N -41.0 -30.999998 . 139 . N . 139 . CA . 139 . C . 140 . N 1 1 276 . 1 1 139 GLU C 1 1 140 GLU N 1 1 140 GLU CA 1 1 140 GLU C -74.6 -64.6 . 139 . C . 140 . N . 140 . CA . 140 . C 1 1 277 . 1 1 140 GLU N 1 1 140 GLU CA 1 1 140 GLU C 1 1 141 PHE N -39.9 -29.9 . 140 . N . 140 . CA . 140 . C . 141 . N 1 1 278 . 1 1 140 GLU C 1 1 141 PHE N 1 1 141 PHE CA 1 1 141 PHE C -65.9 -55.9 . 140 . C . 141 . N . 141 . CA . 141 . C 1 1 279 . 1 1 141 PHE N 1 1 141 PHE CA 1 1 141 PHE C 1 1 142 VAL N -56.1 -46.099995 . 141 . N . 141 . CA . 141 . C . 142 . N 1 1 280 . 1 1 141 PHE C 1 1 142 VAL N 1 1 142 VAL CA 1 1 142 VAL C -65.6 -55.6 . 141 . C . 142 . N . 142 . CA . 142 . C 1 1 281 . 1 1 142 VAL N 1 1 142 VAL CA 1 1 142 VAL C 1 1 143 GLN N -48.4 -38.4 . 142 . N . 142 . CA . 142 . C . 143 . N 1 1 282 . 1 1 142 VAL C 1 1 143 GLN N 1 1 143 GLN CA 1 1 143 GLN C -72.4 -62.4 . 142 . C . 143 . N . 143 . CA . 143 . C 1 1 283 . 1 1 143 GLN N 1 1 143 GLN CA 1 1 143 GLN C 1 1 144 MET N -42.3 -32.3 . 143 . N . 143 . CA . 143 . C . 144 . N 1 1 284 . 1 1 143 GLN C 1 1 144 MET N 1 1 144 MET CA 1 1 144 MET C -74.0 -64.0 . 143 . C . 144 . N . 144 . CA . 144 . C 1 1 285 . 1 1 144 MET N 1 1 144 MET CA 1 1 144 MET C 1 1 145 MET N -16.8 -6.8 . 144 . N . 144 . CA . 144 . C . 145 . N 1 1 286 . 1 1 144 MET C 1 1 145 MET N 1 1 145 MET CA 1 1 145 MET C -79.1 -69.1 . 144 . C . 145 . N . 145 . CA . 145 . C 1 1 287 . 1 1 145 MET N 1 1 145 MET CA 1 1 145 MET C 1 1 146 THR N -10.5 -0.5 . 145 . N . 145 . CA . 145 . C . 146 . N 1 1 288 . 1 1 145 MET C 1 1 146 THR N 1 1 146 THR CA 1 1 146 THR C -53.999996 -44.0 . 145 . C . 146 . N . 146 . CA . 146 . C 1 1 289 . 1 1 146 THR N 1 1 146 THR CA 1 1 146 THR C 1 1 147 ALA N 105.799995 115.799995 . 146 . N . 146 . CA . 146 . C . 147 . N 1 1 290 . 1 1 146 THR C 1 1 147 ALA N 1 1 147 ALA CA 1 1 147 ALA C -70.7 -60.7 . 146 . C . 147 . N . 147 . CA . 147 . C 1 1 291 . 1 1 147 ALA N 1 1 147 ALA CA 1 1 147 ALA C 1 1 148 LYS N 12.1 22.1 . 147 . N . 147 . CA . 147 . C . 148 . N 1 1 292 . 1 1 147 ALA C 1 1 148 LYS N 1 1 148 LYS CA 1 1 148 LYS C -150.3 -140.29999 . 147 . C . 148 . N . 148 . CA . 148 . C 1 1 293 . 2 2 1 ALA N 2 2 1 ALA CA 2 2 1 ALA C 2 2 2 LYS N -53.0 -43.0 . 299 . N . 299 . CA . 299 . C . 300 . N 1 1 294 . 2 2 1 ALA C 2 2 2 LYS N 2 2 2 LYS CA 2 2 2 LYS C -69.4 -59.400005 . 299 . C . 300 . N . 300 . CA . 300 . C 1 1 295 . 2 2 2 LYS N 2 2 2 LYS CA 2 2 2 LYS C 2 2 3 SER N -31.6 -21.6 . 300 . N . 300 . CA . 300 . C . 301 . N 1 1 296 . 2 2 2 LYS C 2 2 3 SER N 2 2 3 SER CA 2 2 3 SER C -63.3 -53.3 . 300 . C . 301 . N . 301 . CA . 301 . C 1 1 297 . 2 2 3 SER N 2 2 3 SER CA 2 2 3 SER C 2 2 4 LYS N -53.3 -43.3 . 301 . N . 301 . CA . 301 . C . 302 . N 1 1 298 . 2 2 3 SER C 2 2 4 LYS N 2 2 4 LYS CA 2 2 4 LYS C -64.7 -54.7 . 301 . C . 302 . N . 302 . CA . 302 . C 1 1 299 . 2 2 4 LYS N 2 2 4 LYS CA 2 2 4 LYS C 2 2 5 TRP N -46.7 -36.7 . 302 . N . 302 . CA . 302 . C . 303 . N 1 1 300 . 2 2 4 LYS C 2 2 5 TRP N 2 2 5 TRP CA 2 2 5 TRP C -60.200005 -50.2 . 302 . C . 303 . N . 303 . CA . 303 . C 1 1 301 . 2 2 5 TRP N 2 2 5 TRP CA 2 2 5 TRP C 2 2 6 LYS N -57.1 -47.1 . 303 . N . 303 . CA . 303 . C . 304 . N 1 1 302 . 2 2 5 TRP C 2 2 6 LYS N 2 2 6 LYS CA 2 2 6 LYS C -64.799995 -54.8 . 303 . C . 304 . N . 304 . CA . 304 . C 1 1 303 . 2 2 6 LYS N 2 2 6 LYS CA 2 2 6 LYS C 2 2 7 GLN N -45.8 -35.8 . 304 . N . 304 . CA . 304 . C . 305 . N 1 1 304 . 2 2 6 LYS C 2 2 7 GLN N 2 2 7 GLN CA 2 2 7 GLN C -58.6 -48.6 . 304 . C . 305 . N . 305 . CA . 305 . C 1 1 305 . 2 2 7 GLN N 2 2 7 GLN CA 2 2 7 GLN C 2 2 8 ALA N -75.6 -65.6 . 305 . N . 305 . CA . 305 . C . 306 . N 1 1 306 . 2 2 7 GLN C 2 2 8 ALA N 2 2 8 ALA CA 2 2 8 ALA C -63.699997 -53.7 . 305 . C . 306 . N . 306 . CA . 306 . C 1 1 307 . 2 2 8 ALA N 2 2 8 ALA CA 2 2 8 ALA C 2 2 9 PHE N -44.999996 -35.0 . 306 . N . 306 . CA . 306 . C . 307 . N 1 1 308 . 2 2 8 ALA C 2 2 9 PHE N 2 2 9 PHE CA 2 2 9 PHE C -57.500004 -47.5 . 306 . C . 307 . N . 307 . CA . 307 . C 1 1 309 . 2 2 9 PHE N 2 2 9 PHE CA 2 2 9 PHE C 2 2 10 ASN N -68.8 -58.8 . 307 . N . 307 . CA . 307 . C . 308 . N 1 1 310 . 2 2 9 PHE C 2 2 10 ASN N 2 2 10 ASN CA 2 2 10 ASN C -61.799995 -51.8 . 307 . C . 308 . N . 308 . CA . 308 . C 1 1 311 . 2 2 10 ASN N 2 2 10 ASN CA 2 2 10 ASN C 2 2 11 ALA N -43.6 -33.6 . 308 . N . 308 . CA . 308 . C . 309 . N 1 1 312 . 2 2 10 ASN C 2 2 11 ALA N 2 2 11 ALA CA 2 2 11 ALA C -58.1 -48.1 . 308 . C . 309 . N . 309 . CA . 309 . C 1 1 313 . 2 2 11 ALA N 2 2 11 ALA CA 2 2 11 ALA C 2 2 12 THR N -62.700005 -52.7 . 309 . N . 309 . CA . 309 . C . 310 . N 1 1 314 . 2 2 11 ALA C 2 2 12 THR N 2 2 12 THR CA 2 2 12 THR C -69.8 -59.8 . 309 . C . 310 . N . 310 . CA . 310 . C 1 1 315 . 2 2 12 THR N 2 2 12 THR CA 2 2 12 THR C 2 2 13 ALA N -44.699997 -34.7 . 310 . N . 310 . CA . 310 . C . 311 . N 1 1 316 . 2 2 12 THR C 2 2 13 ALA N 2 2 13 ALA CA 2 2 13 ALA C -68.0 -58.0 . 310 . C . 311 . N . 311 . CA . 311 . C 1 1 317 . 2 2 13 ALA N 2 2 13 ALA CA 2 2 13 ALA C 2 2 14 VAL N -53.999996 -44.0 . 311 . N . 311 . CA . 311 . C . 312 . N 1 1 318 . 2 2 13 ALA C 2 2 14 VAL N 2 2 14 VAL CA 2 2 14 VAL C -72.1 -62.1 . 311 . C . 312 . N . 312 . CA . 312 . C 1 1 319 . 2 2 14 VAL N 2 2 14 VAL CA 2 2 14 VAL C 2 2 15 VAL N -43.7 -33.7 . 312 . N . 312 . CA . 312 . C . 313 . N 1 1 320 . 2 2 14 VAL C 2 2 15 VAL N 2 2 15 VAL CA 2 2 15 VAL C -64.7 -54.7 . 312 . C . 313 . N . 313 . CA . 313 . C 1 1 321 . 2 2 15 VAL N 2 2 15 VAL CA 2 2 15 VAL C 2 2 16 ARG N -58.2 -48.2 . 313 . N . 313 . CA . 313 . C . 314 . N 1 1 322 . 2 2 15 VAL C 2 2 16 ARG N 2 2 16 ARG CA 2 2 16 ARG C -71.9 -61.9 . 313 . C . 314 . N . 314 . CA . 314 . C 1 1 323 . 2 2 16 ARG N 2 2 16 ARG CA 2 2 16 ARG C 2 2 17 HIS N -39.5 -29.5 . 314 . N . 314 . CA . 314 . C . 315 . N 1 1 324 . 2 2 16 ARG C 2 2 17 HIS N 2 2 17 HIS CA 2 2 17 HIS C -78.7 -68.7 . 314 . C . 315 . N . 315 . CA . 315 . C 1 1 325 . 2 2 17 HIS N 2 2 17 HIS CA 2 2 17 HIS C 2 2 18 MET N -50.999996 -41.0 . 315 . N . 315 . CA . 315 . C . 316 . N 1 1 326 . 2 2 17 HIS C 2 2 18 MET N 2 2 18 MET CA 2 2 18 MET C -76.2 -66.2 . 315 . C . 316 . N . 316 . CA . 316 . C 1 1 327 . 2 2 18 MET N 2 2 18 MET CA 2 2 18 MET C 2 2 19 ARG N -49.5 -39.5 . 316 . N . 316 . CA . 316 . C . 317 . N 1 1 328 . 2 2 18 MET C 2 2 19 ARG N 2 2 19 ARG CA 2 2 19 ARG C -68.8 -58.8 . 316 . C . 317 . N . 317 . CA . 317 . C 1 1 329 . 2 2 19 ARG N 2 2 19 ARG CA 2 2 19 ARG C 2 2 20 LYS N -32.5 -22.499998 . 317 . N . 317 . CA . 317 . C . 318 . N 1 1 330 . 2 2 19 ARG C 2 2 20 LYS N 2 2 20 LYS CA 2 2 20 LYS C -69.0 -59.0 . 317 . C . 318 . N . 318 . CA . 318 . C 1 1 331 . 2 2 20 LYS N 2 2 20 LYS CA 2 2 20 LYS C 2 2 21 LEU N -48.3 -38.3 . 318 . N . 318 . CA . 318 . C . 319 . N 1 1 332 . 2 2 20 LYS C 2 2 21 LEU N 2 2 21 LEU CA 2 2 21 LEU C -64.4 -54.4 . 318 . C . 319 . N . 319 . CA . 319 . C 1 1 333 . 2 2 21 LEU N 2 2 21 LEU CA 2 2 21 LEU C 2 2 22 GLN N -30.100002 -20.1 . 319 . N . 319 . CA . 319 . C . 320 . N 1 1 334 . 2 2 21 LEU C 2 2 22 GLN N 2 2 22 GLN CA 2 2 22 GLN C -83.2 -73.2 . 319 . C . 320 . N . 320 . CA . 320 . C 1 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_7 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID 1 _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID . _RDC_constraint_list.Block_ID . loop_ _RDC_constraint.ID _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 1 1 3 GLN N 1 1 3 GLN H 1.2103 . . . . 3 . N . 3 . HN 1 1 2 1 1 4 LEU N 1 1 4 LEU H -11.6898 . . . . 4 . N . 4 . HN 1 1 3 1 1 5 THR N 1 1 5 THR H 0.4764 . . . . 5 . N . 5 . HN 1 1 4 1 1 6 GLU N 1 1 6 GLU H 18.4155 . . . . 6 . N . 6 . HN 1 1 5 1 1 7 GLU N 1 1 7 GLU H 13.7115 . . . . 7 . N . 7 . HN 1 1 6 1 1 8 GLN N 1 1 8 GLN H 16.9452 . . . . 8 . N . 8 . HN 1 1 7 1 1 10 ALA N 1 1 10 ALA H 15.6335 . . . . 10 . HN . 10 . N 1 1 8 1 1 11 GLU N 1 1 11 GLU H 19.0678 . . . . 11 . HN . 11 . N 1 1 9 1 1 12 PHE N 1 1 12 PHE H 18.9999 . . . . 12 . HN . 12 . N 1 1 10 1 1 13 LYS N 1 1 13 LYS H 14.4718 . . . . 13 . HN . 13 . N 1 1 11 1 1 15 ALA N 1 1 15 ALA H 18.3638 . . . . 15 . HN . 15 . N 1 1 12 1 1 16 PHE N 1 1 16 PHE H 18.1717 . . . . 16 . HN . 16 . N 1 1 13 1 1 17 SER N 1 1 17 SER H 9.3269 . . . . 17 . HN . 17 . N 1 1 14 1 1 18 LEU N 1 1 18 LEU H 16.5747 . . . . 18 . HN . 18 . N 1 1 15 1 1 19 PHE N 1 1 19 PHE H 18.7237 . . . . 19 . HN . 19 . N 1 1 16 1 1 20 ASP N 1 1 20 ASP H 7.2539 . . . . 20 . N . 20 . HN 1 1 17 1 1 21 LYS N 1 1 21 LYS H -1.3827 . . . . 21 . N . 21 . HN 1 1 18 1 1 22 ASP N 1 1 22 ASP H -3.0355 . . . . 22 . N . 22 . HN 1 1 19 1 1 23 GLY N 1 1 23 GLY H -3.0319 . . . . 23 . N . 23 . HN 1 1 20 1 1 24 ASP N 1 1 24 ASP H 6.4967 . . . . 24 . N . 24 . HN 1 1 21 1 1 25 GLY N 1 1 25 GLY H -11.8352 . . . . 25 . N . 25 . HN 1 1 22 1 1 26 THR N 1 1 26 THR H 12.9457 . . . . 26 . N . 26 . HN 1 1 23 1 1 27 ILE N 1 1 27 ILE H 12.9974 . . . . 27 . HN . 27 . N 1 1 24 1 1 28 THR N 1 1 28 THR H -4.7896 . . . . 28 . N . 28 . HN 1 1 25 1 1 29 THR N 1 1 29 THR H -20.3628 . . . . 29 . N . 29 . HN 1 1 26 1 1 31 GLU N 1 1 31 GLU H -12.7328 . . . . 31 . N . 31 . HN 1 1 27 1 1 32 LEU N 1 1 32 LEU H -17.2412 . . . . 32 . N . 32 . HN 1 1 28 1 1 33 GLY N 1 1 33 GLY H -14.9847 . . . . 33 . HN . 33 . N 1 1 29 1 1 34 THR N 1 1 34 THR H -12.2828 . . . . 34 . HN . 34 . N 1 1 30 1 1 35 VAL N 1 1 35 VAL H -10.4794 . . . . 35 . HN . 35 . N 1 1 31 1 1 37 ARG N 1 1 37 ARG H -16.8534 . . . . 37 . HN . 37 . N 1 1 32 1 1 38 SER N 1 1 38 SER H -4.9463 . . . . 38 . HN . 38 . N 1 1 33 1 1 39 LEU N 1 1 39 LEU H -16.1393 . . . . 39 . N . 39 . HN 1 1 34 1 1 40 GLY N 1 1 40 GLY H 2.111 . . . . 40 . N . 40 . HN 1 1 35 1 1 41 GLN N 1 1 41 GLN H 1.2139 . . . . 41 . N . 41 . HN 1 1 36 1 1 42 ASN N 1 1 42 ASN H 2.1125 . . . . 42 . N . 42 . HN 1 1 37 1 1 44 THR N 1 1 44 THR H 7.9473 . . . . 44 . N . 44 . HN 1 1 38 1 1 45 GLU N 1 1 45 GLU H 19.2614 . . . . 45 . N . 45 . HN 1 1 39 1 1 46 ALA N 1 1 46 ALA H 13.1971 . . . . 46 . N . 46 . HN 1 1 40 1 1 47 GLU N 1 1 47 GLU H 17.6213 . . . . 47 . N . 47 . HN 1 1 41 1 1 49 GLN N 1 1 49 GLN H 17.3076 . . . . 49 . HN . 49 . N 1 1 42 1 1 52 ILE N 1 1 52 ILE H 18.3334 . . . . 52 . HN . 52 . N 1 1 43 1 1 53 ASN N 1 1 53 ASN H 16.1545 . . . . 53 . HN . 53 . N 1 1 44 1 1 54 GLU N 1 1 54 GLU H 6.3548 . . . . 54 . HN . 54 . N 1 1 45 1 1 55 VAL N 1 1 55 VAL H 17.6218 . . . . 55 . N . 55 . HN 1 1 46 1 1 56 ASP N 1 1 56 ASP H 8.1297 . . . . 56 . N . 56 . HN 1 1 47 1 1 57 ALA N 1 1 57 ALA H -13.0608 . . . . 57 . N . 57 . HN 1 1 48 1 1 58 ASP N 1 1 58 ASP H -9.2321 . . . . 58 . N . 58 . HN 1 1 49 1 1 59 GLY N 1 1 59 GLY H -14.8007 . . . . 59 . N . 59 . HN 1 1 50 1 1 60 ASN N 1 1 60 ASN H 0.5646 . . . . 60 . N . 60 . HN 1 1 51 1 1 61 GLY N 1 1 61 GLY H 14.6051 . . . . 61 . N . 61 . HN 1 1 52 1 1 62 THR N 1 1 62 THR H 6.2427 . . . . 62 . N . 62 . HN 1 1 53 1 1 63 ILE N 1 1 63 ILE H 9.5382 . . . . 63 . HN . 63 . N 1 1 54 1 1 64 ASP N 1 1 64 ASP H 2.6949 . . . . 64 . N . 64 . HN 1 1 55 1 1 65 PHE N 1 1 65 PHE H -0.4546 . . . . 65 . N . 65 . HN 1 1 56 1 1 68 PHE N 1 1 68 PHE H -0.6148 . . . . 68 . N . 68 . HN 1 1 57 1 1 69 LEU N 1 1 69 LEU H -5.4546 . . . . 69 . HN . 69 . N 1 1 58 1 1 70 THR N 1 1 70 THR H -3.4521 . . . . 70 . HN . 70 . N 1 1 59 1 1 73 ALA N 1 1 73 ALA H -9.3948 . . . . 73 . HN . 73 . N 1 1 60 1 1 76 MET N 1 1 76 MET H -8.6543 . . . . 76 . HN . 76 . N 1 1 61 1 1 78 ASP N 1 1 78 ASP H 2.1683 . . . . 78 . N . 78 . HN 1 1 62 1 1 79 THR N 1 1 79 THR H 2.4577 . . . . 79 . N . 79 . HN 1 1 63 1 1 80 ASP N 1 1 80 ASP H 5.1698 . . . . 80 . N . 80 . HN 1 1 64 1 1 81 SER N 1 1 81 SER H 16.7597 . . . . 81 . N . 81 . HN 1 1 65 1 1 83 GLU N 1 1 83 GLU H 9.4566 . . . . 83 . N . 83 . HN 1 1 66 1 1 84 GLU N 1 1 84 GLU H 20.0724 . . . . 84 . HN . 84 . N 1 1 67 1 1 88 ALA N 1 1 88 ALA H 22.1373 . . . . 88 . HN . 88 . N 1 1 68 1 1 89 PHE N 1 1 89 PHE H 17.9421 . . . . 89 . HN . 89 . N 1 1 69 1 1 90 ARG N 1 1 90 ARG H 7.0836 . . . . 90 . HN . 90 . N 1 1 70 1 1 91 VAL N 1 1 91 VAL H 18.7901 . . . . 91 . HN . 91 . N 1 1 71 1 1 92 PHE N 1 1 92 PHE H 20.1773 . . . . 92 . HN . 92 . N 1 1 72 1 1 93 ASP N 1 1 93 ASP H 8.1262 . . . . 93 . N . 93 . HN 1 1 73 1 1 94 LYS N 1 1 94 LYS H -0.1865 . . . . 94 . N . 94 . HN 1 1 74 1 1 95 ASP N 1 1 95 ASP H -1.0517 . . . . 95 . N . 95 . HN 1 1 75 1 1 96 GLY N 1 1 96 GLY H -2.3487 . . . . 96 . N . 96 . HN 1 1 76 1 1 97 ASN N 1 1 97 ASN H 1.6711 . . . . 97 . N . 97 . HN 1 1 77 1 1 98 GLY N 1 1 98 GLY H -14.1576 . . . . 98 . N . 98 . HN 1 1 78 1 1 99 TYR N 1 1 99 TYR H 18.3588 . . . . 99 . N . 99 . HN 1 1 79 1 1 100 ILE N 1 1 100 ILE H 15.1596 . . . . 100 . HN . 100 . N 1 1 80 1 1 101 SER N 1 1 101 SER H -1.7364 . . . . 101 . N . 101 . HN 1 1 81 1 1 102 ALA N 1 1 102 ALA H -20.4211 . . . . 102 . N . 102 . HN 1 1 82 1 1 103 ALA N 1 1 103 ALA H -18.2984 . . . . 103 . N . 103 . HN 1 1 83 1 1 105 LEU N 1 1 105 LEU H -19.0901 . . . . 105 . N . 105 . HN 1 1 84 1 1 106 ARG N 1 1 106 ARG H -18.0825 . . . . 106 . HN . 106 . N 1 1 85 1 1 107 HIS N 1 1 107 HIS H -13.1581 . . . . 107 . HN . 107 . N 1 1 86 1 1 108 VAL N 1 1 108 VAL H -16.044 . . . . 108 . HN . 108 . N 1 1 87 1 1 109 MET N 1 1 109 MET H -20.7272 . . . . 109 . HN . 109 . N 1 1 88 1 1 110 THR N 1 1 110 THR H -12.8256 . . . . 110 . HN . 110 . N 1 1 89 1 1 111 ASN N 1 1 111 ASN H -10.6001 . . . . 111 . HN . 111 . N 1 1 90 1 1 113 GLY N 1 1 113 GLY H -2.6974 . . . . 113 . N . 113 . HN 1 1 91 1 1 115 LYS N 1 1 115 LYS H -0.0593 . . . . 115 . N . 115 . HN 1 1 92 1 1 116 LEU N 1 1 116 LEU H 3.9584 . . . . 116 . N . 116 . HN 1 1 93 1 1 117 THR N 1 1 117 THR H 17.0319 . . . . 117 . N . 117 . HN 1 1 94 1 1 118 ASP N 1 1 118 ASP H 14.745 . . . . 118 . N . 118 . HN 1 1 95 1 1 119 GLU N 1 1 119 GLU H 4.7141 . . . . 119 . N . 119 . HN 1 1 96 1 1 120 GLU N 1 1 120 GLU H 10.8869 . . . . 120 . N . 120 . HN 1 1 97 1 1 121 VAL N 1 1 121 VAL H 16.9573 . . . . 121 . N . 121 . HN 1 1 98 1 1 123 GLU N 1 1 123 GLU H 4.9549 . . . . 123 . HN . 123 . N 1 1 99 1 1 126 ARG N 1 1 126 ARG H 9.5164 . . . . 126 . HN . 126 . N 1 1 100 1 1 127 GLU N 1 1 127 GLU H 5.2645 . . . . 127 . HN . 127 . N 1 1 101 1 1 128 ALA N 1 1 128 ALA H 20.8002 . . . . 128 . N . 128 . HN 1 1 102 1 1 129 ASP N 1 1 129 ASP H 7.0684 . . . . 129 . N . 129 . HN 1 1 103 1 1 130 ILE N 1 1 130 ILE H -7.3755 . . . . 130 . N . 130 . HN 1 1 104 1 1 131 ASP N 1 1 131 ASP H -11.7531 . . . . 131 . N . 131 . HN 1 1 105 1 1 132 GLY N 1 1 132 GLY H -17.0901 . . . . 132 . N . 132 . HN 1 1 106 1 1 133 ASP N 1 1 133 ASP H 1.5666 . . . . 133 . N . 133 . HN 1 1 107 1 1 134 GLY N 1 1 134 GLY H 17.8884 . . . . 134 . N . 134 . HN 1 1 108 1 1 135 GLN N 1 1 135 GLN H 2.5722 . . . . 135 . N . 135 . HN 1 1 109 1 1 136 VAL N 1 1 136 VAL H 7.7242 . . . . 136 . HN . 136 . N 1 1 110 1 1 137 ASN N 1 1 137 ASN H -0.0426 . . . . 137 . N . 137 . HN 1 1 111 1 1 140 GLU N 1 1 140 GLU H 11.1632 . . . . 140 . N . 140 . HN 1 1 112 1 1 141 PHE N 1 1 141 PHE H 3.1627 . . . . 141 . N . 141 . HN 1 1 113 1 1 146 THR N 1 1 146 THR H -10.635 . . . . 146 . N . 146 . HN 1 1 114 1 1 147 ALA N 1 1 147 ALA H 9.6705 . . . . 147 . N . 147 . HN 1 1 115 1 1 148 LYS N 1 1 148 LYS H -1.9559 . . . . 148 . N . 148 . HN 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ALA C C -18.930 0.472 2.998 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -18.260 -0.877 2.768 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -18.954 -1.955 3.604 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -16.402 -1.740 3.144 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -16.756 -0.398 4.125 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H -16.320 -0.172 2.499 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H -18.328 -1.136 1.722 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H -19.957 -2.107 3.235 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H -18.993 -1.640 4.637 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H -18.400 -2.879 3.531 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N -16.826 -0.791 3.164 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O -18.365 1.518 2.679 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 ASP C C -20.592 2.172 5.234 1.00 . A A . 2 ASP C 1 1 1 14 1 1 2 ASP CA C -20.880 1.674 3.824 1.00 . A A . 2 ASP CA 1 1 1 15 1 1 2 ASP CB C -22.380 1.423 3.670 1.00 . A A . 2 ASP CB 1 1 1 16 1 1 2 ASP CG C -22.810 0.260 4.559 1.00 . A A . 2 ASP CG 1 1 1 17 1 1 2 ASP H H -20.539 -0.419 3.787 1.00 . A A . 2 ASP H 1 1 1 18 1 1 2 ASP HA H -20.582 2.435 3.118 1.00 . A A . 2 ASP HA 1 1 1 19 1 1 2 ASP HB2 H -22.922 2.311 3.955 1.00 . A A . 2 ASP HB2 1 1 1 20 1 1 2 ASP HB3 H -22.599 1.184 2.641 1.00 . A A . 2 ASP HB3 1 1 1 21 1 1 2 ASP N N -20.138 0.444 3.554 1.00 . A A . 2 ASP N 1 1 1 22 1 1 2 ASP O O -21.148 3.180 5.672 1.00 . A A . 2 ASP O 1 1 1 23 1 1 2 ASP OD1 O -21.944 -0.351 5.162 1.00 . A A . 2 ASP OD1 1 1 1 24 1 1 2 ASP OD2 O -24.000 0.000 4.623 1.00 . A A . 2 ASP OD2 1 1 1 25 1 1 3 GLN C C -17.877 1.607 7.562 1.00 . A A . 3 GLN C 1 1 1 26 1 1 3 GLN CA C -19.360 1.841 7.312 1.00 . A A . 3 GLN CA 1 1 1 27 1 1 3 GLN CB C -20.178 1.025 8.312 1.00 . A A . 3 GLN CB 1 1 1 28 1 1 3 GLN CD C -22.479 0.612 9.202 1.00 . A A . 3 GLN CD 1 1 1 29 1 1 3 GLN CG C -21.645 1.452 8.243 1.00 . A A . 3 GLN CG 1 1 1 30 1 1 3 GLN H H -19.306 0.669 5.542 1.00 . A A . 3 GLN H 1 1 1 31 1 1 3 GLN HA H -19.575 2.891 7.464 1.00 . A A . 3 GLN HA 1 1 1 32 1 1 3 GLN HB2 H -20.097 -0.025 8.069 1.00 . A A . 3 GLN HB2 1 1 1 33 1 1 3 GLN HB3 H -19.802 1.193 9.310 1.00 . A A . 3 GLN HB3 1 1 1 34 1 1 3 GLN HE21 H -23.010 2.159 10.325 1.00 . A A . 3 GLN HE21 1 1 1 35 1 1 3 GLN HE22 H -23.629 0.658 10.820 1.00 . A A . 3 GLN HE22 1 1 1 36 1 1 3 GLN HG2 H -21.727 2.494 8.515 1.00 . A A . 3 GLN HG2 1 1 1 37 1 1 3 GLN HG3 H -22.012 1.314 7.237 1.00 . A A . 3 GLN HG3 1 1 1 38 1 1 3 GLN N N -19.718 1.463 5.945 1.00 . A A . 3 GLN N 1 1 1 39 1 1 3 GLN NE2 N -23.090 1.191 10.199 1.00 . A A . 3 GLN NE2 1 1 1 40 1 1 3 GLN O O -17.470 0.515 7.960 1.00 . A A . 3 GLN O 1 1 1 41 1 1 3 GLN OE1 O -22.578 -0.604 9.039 1.00 . A A . 3 GLN OE1 1 1 1 42 1 1 4 LEU C C -15.243 3.107 8.895 1.00 . A A . 4 LEU C 1 1 1 43 1 1 4 LEU CA C -15.624 2.542 7.532 1.00 . A A . 4 LEU CA 1 1 1 44 1 1 4 LEU CB C -14.888 3.312 6.427 1.00 . A A . 4 LEU CB 1 1 1 45 1 1 4 LEU CD1 C -16.273 2.201 4.660 1.00 . A A . 4 LEU CD1 1 1 1 46 1 1 4 LEU CD2 C -14.062 3.218 4.071 1.00 . A A . 4 LEU CD2 1 1 1 47 1 1 4 LEU CG C -14.845 2.467 5.150 1.00 . A A . 4 LEU CG 1 1 1 48 1 1 4 LEU H H -17.454 3.486 7.015 1.00 . A A . 4 LEU H 1 1 1 49 1 1 4 LEU HA H -15.325 1.502 7.494 1.00 . A A . 4 LEU HA 1 1 1 50 1 1 4 LEU HB2 H -15.407 4.238 6.228 1.00 . A A . 4 LEU HB2 1 1 1 51 1 1 4 LEU HB3 H -13.879 3.526 6.743 1.00 . A A . 4 LEU HB3 1 1 1 52 1 1 4 LEU HD11 H -16.249 1.901 3.623 1.00 . A A . 4 LEU HD11 1 1 1 53 1 1 4 LEU HD12 H -16.866 3.098 4.761 1.00 . A A . 4 LEU HD12 1 1 1 54 1 1 4 LEU HD13 H -16.712 1.411 5.250 1.00 . A A . 4 LEU HD13 1 1 1 55 1 1 4 LEU HD21 H -14.240 2.757 3.111 1.00 . A A . 4 LEU HD21 1 1 1 56 1 1 4 LEU HD22 H -13.007 3.178 4.299 1.00 . A A . 4 LEU HD22 1 1 1 57 1 1 4 LEU HD23 H -14.387 4.248 4.041 1.00 . A A . 4 LEU HD23 1 1 1 58 1 1 4 LEU HG H -14.358 1.525 5.360 1.00 . A A . 4 LEU HG 1 1 1 59 1 1 4 LEU N N -17.069 2.640 7.330 1.00 . A A . 4 LEU N 1 1 1 60 1 1 4 LEU O O -15.731 4.162 9.301 1.00 . A A . 4 LEU O 1 1 1 61 1 1 5 THR C C -12.879 3.934 10.785 1.00 . A A . 5 THR C 1 1 1 62 1 1 5 THR CA C -13.929 2.835 10.915 1.00 . A A . 5 THR CA 1 1 1 63 1 1 5 THR CB C -13.339 1.652 11.688 1.00 . A A . 5 THR CB 1 1 1 64 1 1 5 THR CG2 C -14.381 0.537 11.787 1.00 . A A . 5 THR CG2 1 1 1 65 1 1 5 THR H H -14.013 1.564 9.222 1.00 . A A . 5 THR H 1 1 1 66 1 1 5 THR HA H -14.778 3.220 11.460 1.00 . A A . 5 THR HA 1 1 1 67 1 1 5 THR HB H -13.062 1.971 12.680 1.00 . A A . 5 THR HB 1 1 1 68 1 1 5 THR HG1 H -11.857 0.409 11.488 1.00 . A A . 5 THR HG1 1 1 1 69 1 1 5 THR HG21 H -14.668 0.222 10.795 1.00 . A A . 5 THR HG21 1 1 1 70 1 1 5 THR HG22 H -15.250 0.903 12.314 1.00 . A A . 5 THR HG22 1 1 1 71 1 1 5 THR HG23 H -13.961 -0.301 12.323 1.00 . A A . 5 THR HG23 1 1 1 72 1 1 5 THR N N -14.368 2.395 9.598 1.00 . A A . 5 THR N 1 1 1 73 1 1 5 THR O O -12.275 4.108 9.731 1.00 . A A . 5 THR O 1 1 1 74 1 1 5 THR OG1 O -12.190 1.169 11.005 1.00 . A A . 5 THR OG1 1 1 1 75 1 1 6 GLU C C -10.266 5.189 11.804 1.00 . A A . 6 GLU C 1 1 1 76 1 1 6 GLU CA C -11.684 5.747 11.873 1.00 . A A . 6 GLU CA 1 1 1 77 1 1 6 GLU CB C -11.843 6.591 13.141 1.00 . A A . 6 GLU CB 1 1 1 78 1 1 6 GLU CD C -13.225 8.336 11.987 1.00 . A A . 6 GLU CD 1 1 1 79 1 1 6 GLU CG C -13.196 7.312 13.117 1.00 . A A . 6 GLU CG 1 1 1 80 1 1 6 GLU H H -13.172 4.478 12.685 1.00 . A A . 6 GLU H 1 1 1 81 1 1 6 GLU HA H -11.852 6.374 11.014 1.00 . A A . 6 GLU HA 1 1 1 82 1 1 6 GLU HB2 H -11.792 5.950 14.010 1.00 . A A . 6 GLU HB2 1 1 1 83 1 1 6 GLU HB3 H -11.051 7.323 13.187 1.00 . A A . 6 GLU HB3 1 1 1 84 1 1 6 GLU HG2 H -13.982 6.587 12.962 1.00 . A A . 6 GLU HG2 1 1 1 85 1 1 6 GLU HG3 H -13.352 7.814 14.060 1.00 . A A . 6 GLU HG3 1 1 1 86 1 1 6 GLU N N -12.665 4.667 11.867 1.00 . A A . 6 GLU N 1 1 1 87 1 1 6 GLU O O -9.307 5.920 11.536 1.00 . A A . 6 GLU O 1 1 1 88 1 1 6 GLU OE1 O -12.309 9.140 11.921 1.00 . A A . 6 GLU OE1 1 1 1 89 1 1 6 GLU OE2 O -14.160 8.301 11.205 1.00 . A A . 6 GLU OE2 1 1 1 90 1 1 7 GLU C C -8.347 3.088 10.556 1.00 . A A . 7 GLU C 1 1 1 91 1 1 7 GLU CA C -8.832 3.250 11.995 1.00 . A A . 7 GLU CA 1 1 1 92 1 1 7 GLU CB C -8.909 1.875 12.668 1.00 . A A . 7 GLU CB 1 1 1 93 1 1 7 GLU CD C -6.726 2.083 13.871 1.00 . A A . 7 GLU CD 1 1 1 94 1 1 7 GLU CG C -7.501 1.291 12.824 1.00 . A A . 7 GLU CG 1 1 1 95 1 1 7 GLU H H -10.942 3.351 12.201 1.00 . A A . 7 GLU H 1 1 1 96 1 1 7 GLU HA H -8.128 3.861 12.535 1.00 . A A . 7 GLU HA 1 1 1 97 1 1 7 GLU HB2 H -9.366 1.978 13.643 1.00 . A A . 7 GLU HB2 1 1 1 98 1 1 7 GLU HB3 H -9.506 1.210 12.061 1.00 . A A . 7 GLU HB3 1 1 1 99 1 1 7 GLU HG2 H -7.575 0.260 13.138 1.00 . A A . 7 GLU HG2 1 1 1 100 1 1 7 GLU HG3 H -6.981 1.341 11.880 1.00 . A A . 7 GLU HG3 1 1 1 101 1 1 7 GLU N N -10.140 3.889 12.036 1.00 . A A . 7 GLU N 1 1 1 102 1 1 7 GLU O O -7.256 3.534 10.209 1.00 . A A . 7 GLU O 1 1 1 103 1 1 7 GLU OE1 O -7.332 2.911 14.529 1.00 . A A . 7 GLU OE1 1 1 1 104 1 1 7 GLU OE2 O -5.534 1.851 13.997 1.00 . A A . 7 GLU OE2 1 1 1 105 1 1 8 GLN C C -8.751 3.561 7.573 1.00 . A A . 8 GLN C 1 1 1 106 1 1 8 GLN CA C -8.798 2.237 8.328 1.00 . A A . 8 GLN CA 1 1 1 107 1 1 8 GLN CB C -9.811 1.299 7.670 1.00 . A A . 8 GLN CB 1 1 1 108 1 1 8 GLN CD C -10.774 -1.008 7.709 1.00 . A A . 8 GLN CD 1 1 1 109 1 1 8 GLN CG C -9.765 -0.066 8.360 1.00 . A A . 8 GLN CG 1 1 1 110 1 1 8 GLN H H -10.026 2.125 10.050 1.00 . A A . 8 GLN H 1 1 1 111 1 1 8 GLN HA H -7.822 1.778 8.290 1.00 . A A . 8 GLN HA 1 1 1 112 1 1 8 GLN HB2 H -10.802 1.717 7.760 1.00 . A A . 8 GLN HB2 1 1 1 113 1 1 8 GLN HB3 H -9.563 1.179 6.629 1.00 . A A . 8 GLN HB3 1 1 1 114 1 1 8 GLN HE21 H -10.451 -2.482 8.999 1.00 . A A . 8 GLN HE21 1 1 1 115 1 1 8 GLN HE22 H -11.604 -2.809 7.798 1.00 . A A . 8 GLN HE22 1 1 1 116 1 1 8 GLN HG2 H -8.772 -0.481 8.270 1.00 . A A . 8 GLN HG2 1 1 1 117 1 1 8 GLN HG3 H -10.010 0.052 9.405 1.00 . A A . 8 GLN HG3 1 1 1 118 1 1 8 GLN N N -9.163 2.455 9.724 1.00 . A A . 8 GLN N 1 1 1 119 1 1 8 GLN NE2 N -10.958 -2.198 8.211 1.00 . A A . 8 GLN NE2 1 1 1 120 1 1 8 GLN O O -7.920 3.758 6.682 1.00 . A A . 8 GLN O 1 1 1 121 1 1 8 GLN OE1 O -11.408 -0.651 6.716 1.00 . A A . 8 GLN OE1 1 1 1 122 1 1 9 ILE C C -8.416 6.544 7.559 1.00 . A A . 9 ILE C 1 1 1 123 1 1 9 ILE CA C -9.709 5.777 7.313 1.00 . A A . 9 ILE CA 1 1 1 124 1 1 9 ILE CB C -10.896 6.579 7.855 1.00 . A A . 9 ILE CB 1 1 1 125 1 1 9 ILE CD1 C -13.372 6.511 8.181 1.00 . A A . 9 ILE CD1 1 1 1 126 1 1 9 ILE CG1 C -12.200 5.933 7.386 1.00 . A A . 9 ILE CG1 1 1 1 127 1 1 9 ILE CG2 C -10.831 8.020 7.336 1.00 . A A . 9 ILE CG2 1 1 1 128 1 1 9 ILE H H -10.275 4.252 8.664 1.00 . A A . 9 ILE H 1 1 1 129 1 1 9 ILE HA H -9.838 5.644 6.250 1.00 . A A . 9 ILE HA 1 1 1 130 1 1 9 ILE HB H -10.861 6.584 8.932 1.00 . A A . 9 ILE HB 1 1 1 131 1 1 9 ILE HD11 H -14.302 6.206 7.726 1.00 . A A . 9 ILE HD11 1 1 1 132 1 1 9 ILE HD12 H -13.308 7.590 8.182 1.00 . A A . 9 ILE HD12 1 1 1 133 1 1 9 ILE HD13 H -13.332 6.149 9.198 1.00 . A A . 9 ILE HD13 1 1 1 134 1 1 9 ILE HG12 H -12.343 6.136 6.334 1.00 . A A . 9 ILE HG12 1 1 1 135 1 1 9 ILE HG13 H -12.150 4.868 7.541 1.00 . A A . 9 ILE HG13 1 1 1 136 1 1 9 ILE HG21 H -10.597 8.012 6.281 1.00 . A A . 9 ILE HG21 1 1 1 137 1 1 9 ILE HG22 H -10.062 8.559 7.869 1.00 . A A . 9 ILE HG22 1 1 1 138 1 1 9 ILE HG23 H -11.784 8.504 7.490 1.00 . A A . 9 ILE HG23 1 1 1 139 1 1 9 ILE N N -9.645 4.468 7.945 1.00 . A A . 9 ILE N 1 1 1 140 1 1 9 ILE O O -7.901 7.208 6.659 1.00 . A A . 9 ILE O 1 1 1 141 1 1 10 ALA C C -5.466 6.541 8.357 1.00 . A A . 10 ALA C 1 1 1 142 1 1 10 ALA CA C -6.653 7.143 9.114 1.00 . A A . 10 ALA CA 1 1 1 143 1 1 10 ALA CB C -6.407 7.046 10.619 1.00 . A A . 10 ALA CB 1 1 1 144 1 1 10 ALA H H -8.315 5.891 9.469 1.00 . A A . 10 ALA H 1 1 1 145 1 1 10 ALA HA H -6.751 8.183 8.842 1.00 . A A . 10 ALA HA 1 1 1 146 1 1 10 ALA HB1 H -5.460 7.502 10.861 1.00 . A A . 10 ALA HB1 1 1 1 147 1 1 10 ALA HB2 H -6.392 6.007 10.915 1.00 . A A . 10 ALA HB2 1 1 1 148 1 1 10 ALA HB3 H -7.199 7.558 11.146 1.00 . A A . 10 ALA HB3 1 1 1 149 1 1 10 ALA N N -7.890 6.451 8.779 1.00 . A A . 10 ALA N 1 1 1 150 1 1 10 ALA O O -4.583 7.261 7.888 1.00 . A A . 10 ALA O 1 1 1 151 1 1 11 GLU C C -4.244 5.044 6.117 1.00 . A A . 11 GLU C 1 1 1 152 1 1 11 GLU CA C -4.347 4.541 7.556 1.00 . A A . 11 GLU CA 1 1 1 153 1 1 11 GLU CB C -4.602 3.032 7.559 1.00 . A A . 11 GLU CB 1 1 1 154 1 1 11 GLU CD C -5.061 1.078 9.054 1.00 . A A . 11 GLU CD 1 1 1 155 1 1 11 GLU CG C -4.520 2.506 8.992 1.00 . A A . 11 GLU CG 1 1 1 156 1 1 11 GLU H H -6.166 4.683 8.652 1.00 . A A . 11 GLU H 1 1 1 157 1 1 11 GLU HA H -3.422 4.743 8.073 1.00 . A A . 11 GLU HA 1 1 1 158 1 1 11 GLU HB2 H -5.583 2.831 7.155 1.00 . A A . 11 GLU HB2 1 1 1 159 1 1 11 GLU HB3 H -3.855 2.541 6.954 1.00 . A A . 11 GLU HB3 1 1 1 160 1 1 11 GLU HG2 H -3.489 2.513 9.314 1.00 . A A . 11 GLU HG2 1 1 1 161 1 1 11 GLU HG3 H -5.098 3.138 9.642 1.00 . A A . 11 GLU HG3 1 1 1 162 1 1 11 GLU N N -5.443 5.216 8.252 1.00 . A A . 11 GLU N 1 1 1 163 1 1 11 GLU O O -3.158 5.393 5.637 1.00 . A A . 11 GLU O 1 1 1 164 1 1 11 GLU OE1 O -5.212 0.478 8.003 1.00 . A A . 11 GLU OE1 1 1 1 165 1 1 11 GLU OE2 O -5.339 0.617 10.148 1.00 . A A . 11 GLU OE2 1 1 1 166 1 1 12 PHE C C -5.190 7.075 4.013 1.00 . A A . 12 PHE C 1 1 1 167 1 1 12 PHE CA C -5.415 5.578 4.057 1.00 . A A . 12 PHE CA 1 1 1 168 1 1 12 PHE CB C -6.756 5.216 3.412 1.00 . A A . 12 PHE CB 1 1 1 169 1 1 12 PHE CD1 C -6.198 2.822 4.069 1.00 . A A . 12 PHE CD1 1 1 1 170 1 1 12 PHE CD2 C -8.524 3.503 3.968 1.00 . A A . 12 PHE CD2 1 1 1 171 1 1 12 PHE CE1 C -6.588 1.546 4.452 1.00 . A A . 12 PHE CE1 1 1 1 172 1 1 12 PHE CE2 C -8.911 2.217 4.351 1.00 . A A . 12 PHE CE2 1 1 1 173 1 1 12 PHE CG C -7.166 3.814 3.824 1.00 . A A . 12 PHE CG 1 1 1 174 1 1 12 PHE CZ C -7.943 1.239 4.594 1.00 . A A . 12 PHE CZ 1 1 1 175 1 1 12 PHE H H -6.221 4.828 5.865 1.00 . A A . 12 PHE H 1 1 1 176 1 1 12 PHE HA H -4.620 5.112 3.500 1.00 . A A . 12 PHE HA 1 1 1 177 1 1 12 PHE HB2 H -7.507 5.918 3.737 1.00 . A A . 12 PHE HB2 1 1 1 178 1 1 12 PHE HB3 H -6.663 5.262 2.337 1.00 . A A . 12 PHE HB3 1 1 1 179 1 1 12 PHE HD1 H -5.150 3.034 3.962 1.00 . A A . 12 PHE HD1 1 1 1 180 1 1 12 PHE HD2 H -9.274 4.255 3.782 1.00 . A A . 12 PHE HD2 1 1 1 181 1 1 12 PHE HE1 H -5.840 0.798 4.633 1.00 . A A . 12 PHE HE1 1 1 1 182 1 1 12 PHE HE2 H -9.959 1.980 4.463 1.00 . A A . 12 PHE HE2 1 1 1 183 1 1 12 PHE HZ H -8.244 0.247 4.889 1.00 . A A . 12 PHE HZ 1 1 1 184 1 1 12 PHE N N -5.382 5.101 5.435 1.00 . A A . 12 PHE N 1 1 1 185 1 1 12 PHE O O -4.718 7.603 3.014 1.00 . A A . 12 PHE O 1 1 1 186 1 1 13 LYS C C -3.867 9.546 4.950 1.00 . A A . 13 LYS C 1 1 1 187 1 1 13 LYS CA C -5.344 9.196 5.148 1.00 . A A . 13 LYS CA 1 1 1 188 1 1 13 LYS CB C -5.825 9.726 6.503 1.00 . A A . 13 LYS CB 1 1 1 189 1 1 13 LYS CD C -7.311 11.662 5.918 1.00 . A A . 13 LYS CD 1 1 1 190 1 1 13 LYS CE C -7.430 13.180 5.917 1.00 . A A . 13 LYS CE 1 1 1 191 1 1 13 LYS CG C -5.936 11.259 6.461 1.00 . A A . 13 LYS CG 1 1 1 192 1 1 13 LYS H H -5.895 7.284 5.875 1.00 . A A . 13 LYS H 1 1 1 193 1 1 13 LYS HA H -5.922 9.647 4.361 1.00 . A A . 13 LYS HA 1 1 1 194 1 1 13 LYS HB2 H -6.788 9.292 6.737 1.00 . A A . 13 LYS HB2 1 1 1 195 1 1 13 LYS HB3 H -5.114 9.442 7.267 1.00 . A A . 13 LYS HB3 1 1 1 196 1 1 13 LYS HD2 H -7.430 11.292 4.912 1.00 . A A . 13 LYS HD2 1 1 1 197 1 1 13 LYS HD3 H -8.082 11.245 6.549 1.00 . A A . 13 LYS HD3 1 1 1 198 1 1 13 LYS HE2 H -7.332 13.550 6.926 1.00 . A A . 13 LYS HE2 1 1 1 199 1 1 13 LYS HE3 H -6.650 13.600 5.300 1.00 . A A . 13 LYS HE3 1 1 1 200 1 1 13 LYS HG2 H -5.816 11.655 7.460 1.00 . A A . 13 LYS HG2 1 1 1 201 1 1 13 LYS HG3 H -5.165 11.663 5.820 1.00 . A A . 13 LYS HG3 1 1 1 202 1 1 13 LYS HZ1 H -9.238 14.201 6.038 1.00 . A A . 13 LYS HZ1 1 1 1 203 1 1 13 LYS HZ2 H -9.336 12.711 5.229 1.00 . A A . 13 LYS HZ2 1 1 1 204 1 1 13 LYS HZ3 H -8.633 14.053 4.461 1.00 . A A . 13 LYS HZ3 1 1 1 205 1 1 13 LYS N N -5.522 7.754 5.099 1.00 . A A . 13 LYS N 1 1 1 206 1 1 13 LYS NZ N -8.760 13.567 5.370 1.00 . A A . 13 LYS NZ 1 1 1 207 1 1 13 LYS O O -3.516 10.392 4.118 1.00 . A A . 13 LYS O 1 1 1 208 1 1 14 GLU C C -1.099 8.662 4.202 1.00 . A A . 14 GLU C 1 1 1 209 1 1 14 GLU CA C -1.567 9.120 5.579 1.00 . A A . 14 GLU CA 1 1 1 210 1 1 14 GLU CB C -0.814 8.364 6.677 1.00 . A A . 14 GLU CB 1 1 1 211 1 1 14 GLU CD C -0.718 10.364 8.183 1.00 . A A . 14 GLU CD 1 1 1 212 1 1 14 GLU CG C -1.206 8.925 8.047 1.00 . A A . 14 GLU CG 1 1 1 213 1 1 14 GLU H H -3.326 8.203 6.335 1.00 . A A . 14 GLU H 1 1 1 214 1 1 14 GLU HA H -1.378 10.178 5.680 1.00 . A A . 14 GLU HA 1 1 1 215 1 1 14 GLU HB2 H -1.069 7.316 6.629 1.00 . A A . 14 GLU HB2 1 1 1 216 1 1 14 GLU HB3 H 0.249 8.483 6.533 1.00 . A A . 14 GLU HB3 1 1 1 217 1 1 14 GLU HG2 H -2.284 8.903 8.146 1.00 . A A . 14 GLU HG2 1 1 1 218 1 1 14 GLU HG3 H -0.764 8.322 8.823 1.00 . A A . 14 GLU HG3 1 1 1 219 1 1 14 GLU N N -3.000 8.878 5.703 1.00 . A A . 14 GLU N 1 1 1 220 1 1 14 GLU O O -0.407 9.392 3.491 1.00 . A A . 14 GLU O 1 1 1 221 1 1 14 GLU OE1 O 0.168 10.740 7.434 1.00 . A A . 14 GLU OE1 1 1 1 222 1 1 14 GLU OE2 O -1.239 11.068 9.033 1.00 . A A . 14 GLU OE2 1 1 1 223 1 1 15 ALA C C -1.609 7.810 1.411 1.00 . A A . 15 ALA C 1 1 1 224 1 1 15 ALA CA C -1.091 6.906 2.529 1.00 . A A . 15 ALA CA 1 1 1 225 1 1 15 ALA CB C -1.654 5.483 2.367 1.00 . A A . 15 ALA CB 1 1 1 226 1 1 15 ALA H H -2.016 6.888 4.436 1.00 . A A . 15 ALA H 1 1 1 227 1 1 15 ALA HA H -0.014 6.871 2.477 1.00 . A A . 15 ALA HA 1 1 1 228 1 1 15 ALA HB1 H -1.726 5.016 3.339 1.00 . A A . 15 ALA HB1 1 1 1 229 1 1 15 ALA HB2 H -0.997 4.901 1.740 1.00 . A A . 15 ALA HB2 1 1 1 230 1 1 15 ALA HB3 H -2.637 5.524 1.918 1.00 . A A . 15 ALA HB3 1 1 1 231 1 1 15 ALA N N -1.479 7.442 3.827 1.00 . A A . 15 ALA N 1 1 1 232 1 1 15 ALA O O -0.937 8.019 0.397 1.00 . A A . 15 ALA O 1 1 1 233 1 1 16 PHE C C -2.469 10.386 0.321 1.00 . A A . 16 PHE C 1 1 1 234 1 1 16 PHE CA C -3.408 9.226 0.612 1.00 . A A . 16 PHE CA 1 1 1 235 1 1 16 PHE CB C -4.750 9.762 1.124 1.00 . A A . 16 PHE CB 1 1 1 236 1 1 16 PHE CD1 C -6.045 10.208 -0.979 1.00 . A A . 16 PHE CD1 1 1 1 237 1 1 16 PHE CD2 C -5.166 12.089 0.271 1.00 . A A . 16 PHE CD2 1 1 1 238 1 1 16 PHE CE1 C -6.589 11.085 -1.918 1.00 . A A . 16 PHE CE1 1 1 1 239 1 1 16 PHE CE2 C -5.712 12.969 -0.669 1.00 . A A . 16 PHE CE2 1 1 1 240 1 1 16 PHE CG C -5.334 10.709 0.115 1.00 . A A . 16 PHE CG 1 1 1 241 1 1 16 PHE CZ C -6.423 12.465 -1.764 1.00 . A A . 16 PHE CZ 1 1 1 242 1 1 16 PHE H H -3.300 8.151 2.427 1.00 . A A . 16 PHE H 1 1 1 243 1 1 16 PHE HA H -3.576 8.670 -0.295 1.00 . A A . 16 PHE HA 1 1 1 244 1 1 16 PHE HB2 H -5.431 8.940 1.273 1.00 . A A . 16 PHE HB2 1 1 1 245 1 1 16 PHE HB3 H -4.600 10.279 2.058 1.00 . A A . 16 PHE HB3 1 1 1 246 1 1 16 PHE HD1 H -6.172 9.143 -1.097 1.00 . A A . 16 PHE HD1 1 1 1 247 1 1 16 PHE HD2 H -4.618 12.475 1.118 1.00 . A A . 16 PHE HD2 1 1 1 248 1 1 16 PHE HE1 H -7.142 10.696 -2.758 1.00 . A A . 16 PHE HE1 1 1 1 249 1 1 16 PHE HE2 H -5.583 14.033 -0.551 1.00 . A A . 16 PHE HE2 1 1 1 250 1 1 16 PHE HZ H -6.842 13.141 -2.492 1.00 . A A . 16 PHE HZ 1 1 1 251 1 1 16 PHE N N -2.809 8.349 1.607 1.00 . A A . 16 PHE N 1 1 1 252 1 1 16 PHE O O -2.219 10.718 -0.838 1.00 . A A . 16 PHE O 1 1 1 253 1 1 17 SER C C 0.227 11.648 0.447 1.00 . A A . 17 SER C 1 1 1 254 1 1 17 SER CA C -1.010 12.108 1.213 1.00 . A A . 17 SER CA 1 1 1 255 1 1 17 SER CB C -0.593 12.659 2.575 1.00 . A A . 17 SER CB 1 1 1 256 1 1 17 SER H H -2.170 10.680 2.284 1.00 . A A . 17 SER H 1 1 1 257 1 1 17 SER HA H -1.496 12.889 0.651 1.00 . A A . 17 SER HA 1 1 1 258 1 1 17 SER HB2 H 0.026 13.530 2.441 1.00 . A A . 17 SER HB2 1 1 1 259 1 1 17 SER HB3 H -1.478 12.929 3.134 1.00 . A A . 17 SER HB3 1 1 1 260 1 1 17 SER HG H 0.106 10.855 2.764 1.00 . A A . 17 SER HG 1 1 1 261 1 1 17 SER N N -1.937 10.991 1.381 1.00 . A A . 17 SER N 1 1 1 262 1 1 17 SER O O 0.754 12.372 -0.398 1.00 . A A . 17 SER O 1 1 1 263 1 1 17 SER OG O 0.141 11.666 3.276 1.00 . A A . 17 SER OG 1 1 1 264 1 1 18 LEU C C 1.575 9.692 -1.406 1.00 . A A . 18 LEU C 1 1 1 265 1 1 18 LEU CA C 1.857 9.895 0.079 1.00 . A A . 18 LEU CA 1 1 1 266 1 1 18 LEU CB C 2.245 8.555 0.722 1.00 . A A . 18 LEU CB 1 1 1 267 1 1 18 LEU CD1 C 4.191 6.953 0.794 1.00 . A A . 18 LEU CD1 1 1 1 268 1 1 18 LEU CD2 C 2.746 7.035 -1.287 1.00 . A A . 18 LEU CD2 1 1 1 269 1 1 18 LEU CG C 3.355 7.867 -0.112 1.00 . A A . 18 LEU CG 1 1 1 270 1 1 18 LEU H H 0.238 9.899 1.435 1.00 . A A . 18 LEU H 1 1 1 271 1 1 18 LEU HA H 2.678 10.583 0.190 1.00 . A A . 18 LEU HA 1 1 1 272 1 1 18 LEU HB2 H 2.605 8.745 1.728 1.00 . A A . 18 LEU HB2 1 1 1 273 1 1 18 LEU HB3 H 1.377 7.915 0.772 1.00 . A A . 18 LEU HB3 1 1 1 274 1 1 18 LEU HD11 H 3.533 6.342 1.394 1.00 . A A . 18 LEU HD11 1 1 1 275 1 1 18 LEU HD12 H 4.811 7.556 1.440 1.00 . A A . 18 LEU HD12 1 1 1 276 1 1 18 LEU HD13 H 4.812 6.318 0.183 1.00 . A A . 18 LEU HD13 1 1 1 277 1 1 18 LEU HD21 H 3.154 7.395 -2.222 1.00 . A A . 18 LEU HD21 1 1 1 278 1 1 18 LEU HD22 H 1.667 7.134 -1.317 1.00 . A A . 18 LEU HD22 1 1 1 279 1 1 18 LEU HD23 H 2.998 5.986 -1.177 1.00 . A A . 18 LEU HD23 1 1 1 280 1 1 18 LEU HG H 4.003 8.627 -0.523 1.00 . A A . 18 LEU HG 1 1 1 281 1 1 18 LEU N N 0.685 10.438 0.747 1.00 . A A . 18 LEU N 1 1 1 282 1 1 18 LEU O O 2.494 9.672 -2.226 1.00 . A A . 18 LEU O 1 1 1 283 1 1 19 PHE C C -0.448 10.701 -3.784 1.00 . A A . 19 PHE C 1 1 1 284 1 1 19 PHE CA C -0.102 9.366 -3.139 1.00 . A A . 19 PHE CA 1 1 1 285 1 1 19 PHE CB C -1.305 8.423 -3.223 1.00 . A A . 19 PHE CB 1 1 1 286 1 1 19 PHE CD1 C 0.123 6.350 -3.463 1.00 . A A . 19 PHE CD1 1 1 1 287 1 1 19 PHE CD2 C -1.530 6.419 -1.696 1.00 . A A . 19 PHE CD2 1 1 1 288 1 1 19 PHE CE1 C 0.505 5.070 -3.058 1.00 . A A . 19 PHE CE1 1 1 1 289 1 1 19 PHE CE2 C -1.145 5.136 -1.293 1.00 . A A . 19 PHE CE2 1 1 1 290 1 1 19 PHE CG C -0.895 7.031 -2.784 1.00 . A A . 19 PHE CG 1 1 1 291 1 1 19 PHE CZ C -0.127 4.462 -1.973 1.00 . A A . 19 PHE CZ 1 1 1 292 1 1 19 PHE H H -0.391 9.605 -1.048 1.00 . A A . 19 PHE H 1 1 1 293 1 1 19 PHE HA H 0.719 8.937 -3.686 1.00 . A A . 19 PHE HA 1 1 1 294 1 1 19 PHE HB2 H -2.091 8.791 -2.578 1.00 . A A . 19 PHE HB2 1 1 1 295 1 1 19 PHE HB3 H -1.665 8.388 -4.240 1.00 . A A . 19 PHE HB3 1 1 1 296 1 1 19 PHE HD1 H 0.612 6.806 -4.301 1.00 . A A . 19 PHE HD1 1 1 1 297 1 1 19 PHE HD2 H -2.315 6.934 -1.169 1.00 . A A . 19 PHE HD2 1 1 1 298 1 1 19 PHE HE1 H 1.291 4.552 -3.582 1.00 . A A . 19 PHE HE1 1 1 1 299 1 1 19 PHE HE2 H -1.636 4.664 -0.460 1.00 . A A . 19 PHE HE2 1 1 1 300 1 1 19 PHE HZ H 0.171 3.474 -1.660 1.00 . A A . 19 PHE HZ 1 1 1 301 1 1 19 PHE N N 0.297 9.555 -1.746 1.00 . A A . 19 PHE N 1 1 1 302 1 1 19 PHE O O -0.184 10.914 -4.967 1.00 . A A . 19 PHE O 1 1 1 303 1 1 20 ASP C C -0.287 13.907 -3.268 1.00 . A A . 20 ASP C 1 1 1 304 1 1 20 ASP CA C -1.422 12.913 -3.509 1.00 . A A . 20 ASP CA 1 1 1 305 1 1 20 ASP CB C -2.704 13.387 -2.809 1.00 . A A . 20 ASP CB 1 1 1 306 1 1 20 ASP CG C -3.450 14.377 -3.698 1.00 . A A . 20 ASP CG 1 1 1 307 1 1 20 ASP H H -1.226 11.370 -2.068 1.00 . A A . 20 ASP H 1 1 1 308 1 1 20 ASP HA H -1.603 12.841 -4.572 1.00 . A A . 20 ASP HA 1 1 1 309 1 1 20 ASP HB2 H -3.339 12.536 -2.609 1.00 . A A . 20 ASP HB2 1 1 1 310 1 1 20 ASP HB3 H -2.451 13.869 -1.873 1.00 . A A . 20 ASP HB3 1 1 1 311 1 1 20 ASP N N -1.042 11.597 -3.002 1.00 . A A . 20 ASP N 1 1 1 312 1 1 20 ASP O O -0.233 14.567 -2.231 1.00 . A A . 20 ASP O 1 1 1 313 1 1 20 ASP OD1 O -3.163 15.555 -3.613 1.00 . A A . 20 ASP OD1 1 1 1 314 1 1 20 ASP OD2 O -4.296 13.933 -4.457 1.00 . A A . 20 ASP OD2 1 1 1 315 1 1 21 LYS C C 1.293 16.366 -4.070 1.00 . A A . 21 LYS C 1 1 1 316 1 1 21 LYS CA C 1.755 14.911 -4.106 1.00 . A A . 21 LYS CA 1 1 1 317 1 1 21 LYS CB C 2.706 14.715 -5.285 1.00 . A A . 21 LYS CB 1 1 1 318 1 1 21 LYS CD C 4.252 13.110 -6.416 1.00 . A A . 21 LYS CD 1 1 1 319 1 1 21 LYS CE C 4.879 11.717 -6.340 1.00 . A A . 21 LYS CE 1 1 1 320 1 1 21 LYS CG C 3.334 13.323 -5.210 1.00 . A A . 21 LYS CG 1 1 1 321 1 1 21 LYS H H 0.527 13.447 -5.033 1.00 . A A . 21 LYS H 1 1 1 322 1 1 21 LYS HA H 2.287 14.688 -3.192 1.00 . A A . 21 LYS HA 1 1 1 323 1 1 21 LYS HB2 H 2.159 14.816 -6.211 1.00 . A A . 21 LYS HB2 1 1 1 324 1 1 21 LYS HB3 H 3.486 15.461 -5.244 1.00 . A A . 21 LYS HB3 1 1 1 325 1 1 21 LYS HD2 H 3.675 13.197 -7.326 1.00 . A A . 21 LYS HD2 1 1 1 326 1 1 21 LYS HD3 H 5.033 13.855 -6.411 1.00 . A A . 21 LYS HD3 1 1 1 327 1 1 21 LYS HE2 H 5.465 11.637 -5.438 1.00 . A A . 21 LYS HE2 1 1 1 328 1 1 21 LYS HE3 H 4.098 10.971 -6.329 1.00 . A A . 21 LYS HE3 1 1 1 329 1 1 21 LYS HG2 H 3.910 13.236 -4.299 1.00 . A A . 21 LYS HG2 1 1 1 330 1 1 21 LYS HG3 H 2.556 12.576 -5.215 1.00 . A A . 21 LYS HG3 1 1 1 331 1 1 21 LYS HZ1 H 6.733 11.343 -7.210 1.00 . A A . 21 LYS HZ1 1 1 1 332 1 1 21 LYS HZ2 H 5.721 12.341 -8.139 1.00 . A A . 21 LYS HZ2 1 1 1 333 1 1 21 LYS HZ3 H 5.427 10.670 -8.055 1.00 . A A . 21 LYS HZ3 1 1 1 334 1 1 21 LYS N N 0.622 14.000 -4.228 1.00 . A A . 21 LYS N 1 1 1 335 1 1 21 LYS NZ N 5.756 11.502 -7.525 1.00 . A A . 21 LYS NZ 1 1 1 336 1 1 21 LYS O O 1.817 17.174 -3.305 1.00 . A A . 21 LYS O 1 1 1 337 1 1 22 ASP C C -1.170 18.322 -3.820 1.00 . A A . 22 ASP C 1 1 1 338 1 1 22 ASP CA C -0.198 18.059 -4.967 1.00 . A A . 22 ASP CA 1 1 1 339 1 1 22 ASP CB C -0.901 18.292 -6.307 1.00 . A A . 22 ASP CB 1 1 1 340 1 1 22 ASP CG C -2.064 17.322 -6.461 1.00 . A A . 22 ASP CG 1 1 1 341 1 1 22 ASP H H -0.058 16.002 -5.494 1.00 . A A . 22 ASP H 1 1 1 342 1 1 22 ASP HA H 0.630 18.748 -4.887 1.00 . A A . 22 ASP HA 1 1 1 343 1 1 22 ASP HB2 H -1.270 19.305 -6.349 1.00 . A A . 22 ASP HB2 1 1 1 344 1 1 22 ASP HB3 H -0.198 18.134 -7.111 1.00 . A A . 22 ASP HB3 1 1 1 345 1 1 22 ASP N N 0.315 16.692 -4.907 1.00 . A A . 22 ASP N 1 1 1 346 1 1 22 ASP O O -1.632 19.448 -3.633 1.00 . A A . 22 ASP O 1 1 1 347 1 1 22 ASP OD1 O -2.506 16.803 -5.455 1.00 . A A . 22 ASP OD1 1 1 1 348 1 1 22 ASP OD2 O -2.495 17.116 -7.584 1.00 . A A . 22 ASP OD2 1 1 1 349 1 1 23 GLY C C -3.653 18.162 -2.344 1.00 . A A . 23 GLY C 1 1 1 350 1 1 23 GLY CA C -2.389 17.418 -1.926 1.00 . A A . 23 GLY CA 1 1 1 351 1 1 23 GLY H H -1.077 16.404 -3.252 1.00 . A A . 23 GLY H 1 1 1 352 1 1 23 GLY HA2 H -2.655 16.438 -1.554 1.00 . A A . 23 GLY HA2 1 1 1 353 1 1 23 GLY HA3 H -1.899 17.972 -1.139 1.00 . A A . 23 GLY HA3 1 1 1 354 1 1 23 GLY N N -1.475 17.278 -3.055 1.00 . A A . 23 GLY N 1 1 1 355 1 1 23 GLY O O -4.219 18.926 -1.563 1.00 . A A . 23 GLY O 1 1 1 356 1 1 24 ASP C C -6.540 17.971 -3.512 1.00 . A A . 24 ASP C 1 1 1 357 1 1 24 ASP CA C -5.281 18.608 -4.089 1.00 . A A . 24 ASP CA 1 1 1 358 1 1 24 ASP CB C -5.318 18.521 -5.616 1.00 . A A . 24 ASP CB 1 1 1 359 1 1 24 ASP CG C -5.218 17.065 -6.058 1.00 . A A . 24 ASP CG 1 1 1 360 1 1 24 ASP H H -3.594 17.324 -4.162 1.00 . A A . 24 ASP H 1 1 1 361 1 1 24 ASP HA H -5.251 19.648 -3.802 1.00 . A A . 24 ASP HA 1 1 1 362 1 1 24 ASP HB2 H -6.245 18.942 -5.977 1.00 . A A . 24 ASP HB2 1 1 1 363 1 1 24 ASP HB3 H -4.488 19.077 -6.027 1.00 . A A . 24 ASP HB3 1 1 1 364 1 1 24 ASP N N -4.087 17.941 -3.581 1.00 . A A . 24 ASP N 1 1 1 365 1 1 24 ASP O O -7.651 18.445 -3.748 1.00 . A A . 24 ASP O 1 1 1 366 1 1 24 ASP OD1 O -5.317 16.200 -5.203 1.00 . A A . 24 ASP OD1 1 1 1 367 1 1 24 ASP OD2 O -5.046 16.837 -7.243 1.00 . A A . 24 ASP OD2 1 1 1 368 1 1 25 GLY C C -8.160 15.278 -3.140 1.00 . A A . 25 GLY C 1 1 1 369 1 1 25 GLY CA C -7.486 16.207 -2.141 1.00 . A A . 25 GLY CA 1 1 1 370 1 1 25 GLY H H -5.448 16.568 -2.596 1.00 . A A . 25 GLY H 1 1 1 371 1 1 25 GLY HA2 H -7.134 15.628 -1.300 1.00 . A A . 25 GLY HA2 1 1 1 372 1 1 25 GLY HA3 H -8.205 16.935 -1.794 1.00 . A A . 25 GLY HA3 1 1 1 373 1 1 25 GLY N N -6.358 16.898 -2.750 1.00 . A A . 25 GLY N 1 1 1 374 1 1 25 GLY O O -9.232 14.737 -2.873 1.00 . A A . 25 GLY O 1 1 1 375 1 1 26 THR C C -6.941 13.465 -6.028 1.00 . A A . 26 THR C 1 1 1 376 1 1 26 THR CA C -8.064 14.212 -5.326 1.00 . A A . 26 THR CA 1 1 1 377 1 1 26 THR CB C -8.850 15.037 -6.347 1.00 . A A . 26 THR CB 1 1 1 378 1 1 26 THR CG2 C -9.975 15.789 -5.635 1.00 . A A . 26 THR CG2 1 1 1 379 1 1 26 THR H H -6.667 15.542 -4.446 1.00 . A A . 26 THR H 1 1 1 380 1 1 26 THR HA H -8.730 13.491 -4.873 1.00 . A A . 26 THR HA 1 1 1 381 1 1 26 THR HB H -9.276 14.381 -7.091 1.00 . A A . 26 THR HB 1 1 1 382 1 1 26 THR HG1 H -7.248 15.475 -7.360 1.00 . A A . 26 THR HG1 1 1 1 383 1 1 26 THR HG21 H -10.641 16.221 -6.368 1.00 . A A . 26 THR HG21 1 1 1 384 1 1 26 THR HG22 H -9.552 16.575 -5.025 1.00 . A A . 26 THR HG22 1 1 1 385 1 1 26 THR HG23 H -10.525 15.105 -5.007 1.00 . A A . 26 THR HG23 1 1 1 386 1 1 26 THR N N -7.522 15.089 -4.292 1.00 . A A . 26 THR N 1 1 1 387 1 1 26 THR O O -5.854 14.003 -6.221 1.00 . A A . 26 THR O 1 1 1 388 1 1 26 THR OG1 O -7.979 15.966 -6.976 1.00 . A A . 26 THR OG1 1 1 1 389 1 1 27 ILE C C -6.657 11.147 -8.558 1.00 . A A . 27 ILE C 1 1 1 390 1 1 27 ILE CA C -6.230 11.394 -7.115 1.00 . A A . 27 ILE CA 1 1 1 391 1 1 27 ILE CB C -6.057 10.057 -6.386 1.00 . A A . 27 ILE CB 1 1 1 392 1 1 27 ILE CD1 C -5.516 9.050 -4.167 1.00 . A A . 27 ILE CD1 1 1 1 393 1 1 27 ILE CG1 C -5.358 10.293 -5.046 1.00 . A A . 27 ILE CG1 1 1 1 394 1 1 27 ILE CG2 C -5.217 9.105 -7.239 1.00 . A A . 27 ILE CG2 1 1 1 395 1 1 27 ILE H H -8.106 11.854 -6.239 1.00 . A A . 27 ILE H 1 1 1 396 1 1 27 ILE HA H -5.276 11.904 -7.121 1.00 . A A . 27 ILE HA 1 1 1 397 1 1 27 ILE HB H -7.029 9.620 -6.212 1.00 . A A . 27 ILE HB 1 1 1 398 1 1 27 ILE HD11 H -5.075 9.233 -3.199 1.00 . A A . 27 ILE HD11 1 1 1 399 1 1 27 ILE HD12 H -5.022 8.213 -4.637 1.00 . A A . 27 ILE HD12 1 1 1 400 1 1 27 ILE HD13 H -6.565 8.827 -4.048 1.00 . A A . 27 ILE HD13 1 1 1 401 1 1 27 ILE HG12 H -4.307 10.480 -5.219 1.00 . A A . 27 ILE HG12 1 1 1 402 1 1 27 ILE HG13 H -5.798 11.145 -4.553 1.00 . A A . 27 ILE HG13 1 1 1 403 1 1 27 ILE HG21 H -5.817 8.734 -8.056 1.00 . A A . 27 ILE HG21 1 1 1 404 1 1 27 ILE HG22 H -4.880 8.278 -6.634 1.00 . A A . 27 ILE HG22 1 1 1 405 1 1 27 ILE HG23 H -4.362 9.636 -7.632 1.00 . A A . 27 ILE HG23 1 1 1 406 1 1 27 ILE N N -7.216 12.223 -6.419 1.00 . A A . 27 ILE N 1 1 1 407 1 1 27 ILE O O -7.801 10.767 -8.828 1.00 . A A . 27 ILE O 1 1 1 408 1 1 28 THR C C -5.446 9.826 -11.365 1.00 . A A . 28 THR C 1 1 1 409 1 1 28 THR CA C -5.995 11.170 -10.904 1.00 . A A . 28 THR CA 1 1 1 410 1 1 28 THR CB C -5.356 12.290 -11.722 1.00 . A A . 28 THR CB 1 1 1 411 1 1 28 THR CG2 C -5.552 13.624 -11.001 1.00 . A A . 28 THR CG2 1 1 1 412 1 1 28 THR H H -4.837 11.673 -9.202 1.00 . A A . 28 THR H 1 1 1 413 1 1 28 THR HA H -7.064 11.186 -11.071 1.00 . A A . 28 THR HA 1 1 1 414 1 1 28 THR HB H -5.824 12.339 -12.693 1.00 . A A . 28 THR HB 1 1 1 415 1 1 28 THR HG1 H -3.745 11.269 -11.335 1.00 . A A . 28 THR HG1 1 1 1 416 1 1 28 THR HG21 H -4.963 13.636 -10.096 1.00 . A A . 28 THR HG21 1 1 1 417 1 1 28 THR HG22 H -6.596 13.749 -10.753 1.00 . A A . 28 THR HG22 1 1 1 418 1 1 28 THR HG23 H -5.237 14.430 -11.646 1.00 . A A . 28 THR HG23 1 1 1 419 1 1 28 THR N N -5.727 11.369 -9.482 1.00 . A A . 28 THR N 1 1 1 420 1 1 28 THR O O -4.707 9.161 -10.637 1.00 . A A . 28 THR O 1 1 1 421 1 1 28 THR OG1 O -3.968 12.031 -11.876 1.00 . A A . 28 THR OG1 1 1 1 422 1 1 29 THR C C -3.842 8.136 -13.227 1.00 . A A . 29 THR C 1 1 1 423 1 1 29 THR CA C -5.363 8.159 -13.120 1.00 . A A . 29 THR CA 1 1 1 424 1 1 29 THR CB C -5.979 7.935 -14.511 1.00 . A A . 29 THR CB 1 1 1 425 1 1 29 THR CG2 C -5.272 6.771 -15.222 1.00 . A A . 29 THR CG2 1 1 1 426 1 1 29 THR H H -6.415 9.996 -13.106 1.00 . A A . 29 THR H 1 1 1 427 1 1 29 THR HA H -5.679 7.366 -12.464 1.00 . A A . 29 THR HA 1 1 1 428 1 1 29 THR HB H -5.862 8.831 -15.100 1.00 . A A . 29 THR HB 1 1 1 429 1 1 29 THR HG1 H -7.633 7.879 -13.489 1.00 . A A . 29 THR HG1 1 1 1 430 1 1 29 THR HG21 H -5.054 5.989 -14.510 1.00 . A A . 29 THR HG21 1 1 1 431 1 1 29 THR HG22 H -4.350 7.126 -15.659 1.00 . A A . 29 THR HG22 1 1 1 432 1 1 29 THR HG23 H -5.910 6.384 -15.999 1.00 . A A . 29 THR HG23 1 1 1 433 1 1 29 THR N N -5.819 9.429 -12.574 1.00 . A A . 29 THR N 1 1 1 434 1 1 29 THR O O -3.199 7.148 -12.874 1.00 . A A . 29 THR O 1 1 1 435 1 1 29 THR OG1 O -7.362 7.637 -14.378 1.00 . A A . 29 THR OG1 1 1 1 436 1 1 30 LYS C C -1.141 9.199 -12.527 1.00 . A A . 30 LYS C 1 1 1 437 1 1 30 LYS CA C -1.835 9.312 -13.878 1.00 . A A . 30 LYS CA 1 1 1 438 1 1 30 LYS CB C -1.461 10.644 -14.527 1.00 . A A . 30 LYS CB 1 1 1 439 1 1 30 LYS CD C 0.402 11.960 -15.563 1.00 . A A . 30 LYS CD 1 1 1 440 1 1 30 LYS CE C 0.321 13.169 -14.624 1.00 . A A . 30 LYS CE 1 1 1 441 1 1 30 LYS CG C 0.044 10.675 -14.804 1.00 . A A . 30 LYS CG 1 1 1 442 1 1 30 LYS H H -3.838 9.981 -13.993 1.00 . A A . 30 LYS H 1 1 1 443 1 1 30 LYS HA H -1.500 8.509 -14.515 1.00 . A A . 30 LYS HA 1 1 1 444 1 1 30 LYS HB2 H -2.002 10.756 -15.455 1.00 . A A . 30 LYS HB2 1 1 1 445 1 1 30 LYS HB3 H -1.719 11.449 -13.859 1.00 . A A . 30 LYS HB3 1 1 1 446 1 1 30 LYS HD2 H 1.404 11.876 -15.959 1.00 . A A . 30 LYS HD2 1 1 1 447 1 1 30 LYS HD3 H -0.294 12.097 -16.378 1.00 . A A . 30 LYS HD3 1 1 1 448 1 1 30 LYS HE2 H -0.711 13.440 -14.469 1.00 . A A . 30 LYS HE2 1 1 1 449 1 1 30 LYS HE3 H 0.777 12.927 -13.676 1.00 . A A . 30 LYS HE3 1 1 1 450 1 1 30 LYS HG2 H 0.584 10.642 -13.868 1.00 . A A . 30 LYS HG2 1 1 1 451 1 1 30 LYS HG3 H 0.316 9.820 -15.405 1.00 . A A . 30 LYS HG3 1 1 1 452 1 1 30 LYS HZ1 H 0.401 15.140 -15.283 1.00 . A A . 30 LYS HZ1 1 1 1 453 1 1 30 LYS HZ2 H 1.351 14.065 -16.193 1.00 . A A . 30 LYS HZ2 1 1 1 454 1 1 30 LYS HZ3 H 1.865 14.562 -14.652 1.00 . A A . 30 LYS HZ3 1 1 1 455 1 1 30 LYS N N -3.276 9.225 -13.722 1.00 . A A . 30 LYS N 1 1 1 456 1 1 30 LYS NZ N 1.039 14.321 -15.234 1.00 . A A . 30 LYS NZ 1 1 1 457 1 1 30 LYS O O -0.079 8.593 -12.419 1.00 . A A . 30 LYS O 1 1 1 458 1 1 31 GLU C C -1.222 8.336 -9.586 1.00 . A A . 31 GLU C 1 1 1 459 1 1 31 GLU CA C -1.160 9.741 -10.165 1.00 . A A . 31 GLU CA 1 1 1 460 1 1 31 GLU CB C -1.916 10.698 -9.245 1.00 . A A . 31 GLU CB 1 1 1 461 1 1 31 GLU CD C -2.498 13.092 -8.852 1.00 . A A . 31 GLU CD 1 1 1 462 1 1 31 GLU CG C -1.648 12.139 -9.679 1.00 . A A . 31 GLU CG 1 1 1 463 1 1 31 GLU H H -2.592 10.257 -11.636 1.00 . A A . 31 GLU H 1 1 1 464 1 1 31 GLU HA H -0.130 10.054 -10.219 1.00 . A A . 31 GLU HA 1 1 1 465 1 1 31 GLU HB2 H -2.975 10.494 -9.309 1.00 . A A . 31 GLU HB2 1 1 1 466 1 1 31 GLU HB3 H -1.583 10.561 -8.228 1.00 . A A . 31 GLU HB3 1 1 1 467 1 1 31 GLU HG2 H -0.604 12.369 -9.531 1.00 . A A . 31 GLU HG2 1 1 1 468 1 1 31 GLU HG3 H -1.897 12.253 -10.723 1.00 . A A . 31 GLU HG3 1 1 1 469 1 1 31 GLU N N -1.744 9.786 -11.499 1.00 . A A . 31 GLU N 1 1 1 470 1 1 31 GLU O O -0.195 7.761 -9.234 1.00 . A A . 31 GLU O 1 1 1 471 1 1 31 GLU OE1 O -3.254 12.606 -8.030 1.00 . A A . 31 GLU OE1 1 1 1 472 1 1 31 GLU OE2 O -2.381 14.289 -9.052 1.00 . A A . 31 GLU OE2 1 1 1 473 1 1 32 LEU C C -1.779 5.448 -9.727 1.00 . A A . 32 LEU C 1 1 1 474 1 1 32 LEU CA C -2.604 6.454 -8.938 1.00 . A A . 32 LEU CA 1 1 1 475 1 1 32 LEU CB C -4.083 6.053 -8.985 1.00 . A A . 32 LEU CB 1 1 1 476 1 1 32 LEU CD1 C -3.798 4.610 -6.936 1.00 . A A . 32 LEU CD1 1 1 1 477 1 1 32 LEU CD2 C -5.748 4.251 -8.479 1.00 . A A . 32 LEU CD2 1 1 1 478 1 1 32 LEU CG C -4.269 4.641 -8.401 1.00 . A A . 32 LEU CG 1 1 1 479 1 1 32 LEU H H -3.215 8.302 -9.771 1.00 . A A . 32 LEU H 1 1 1 480 1 1 32 LEU HA H -2.273 6.458 -7.911 1.00 . A A . 32 LEU HA 1 1 1 481 1 1 32 LEU HB2 H -4.660 6.757 -8.402 1.00 . A A . 32 LEU HB2 1 1 1 482 1 1 32 LEU HB3 H -4.427 6.066 -10.007 1.00 . A A . 32 LEU HB3 1 1 1 483 1 1 32 LEU HD11 H -4.010 5.560 -6.462 1.00 . A A . 32 LEU HD11 1 1 1 484 1 1 32 LEU HD12 H -2.735 4.426 -6.905 1.00 . A A . 32 LEU HD12 1 1 1 485 1 1 32 LEU HD13 H -4.310 3.821 -6.400 1.00 . A A . 32 LEU HD13 1 1 1 486 1 1 32 LEU HD21 H -6.294 4.739 -7.688 1.00 . A A . 32 LEU HD21 1 1 1 487 1 1 32 LEU HD22 H -5.840 3.180 -8.369 1.00 . A A . 32 LEU HD22 1 1 1 488 1 1 32 LEU HD23 H -6.149 4.549 -9.435 1.00 . A A . 32 LEU HD23 1 1 1 489 1 1 32 LEU HG H -3.688 3.934 -8.975 1.00 . A A . 32 LEU HG 1 1 1 490 1 1 32 LEU N N -2.428 7.790 -9.491 1.00 . A A . 32 LEU N 1 1 1 491 1 1 32 LEU O O -1.235 4.500 -9.164 1.00 . A A . 32 LEU O 1 1 1 492 1 1 33 GLY C C 0.559 4.951 -11.676 1.00 . A A . 33 GLY C 1 1 1 493 1 1 33 GLY CA C -0.940 4.749 -11.880 1.00 . A A . 33 GLY CA 1 1 1 494 1 1 33 GLY H H -2.164 6.415 -11.428 1.00 . A A . 33 GLY H 1 1 1 495 1 1 33 GLY HA2 H -1.198 3.726 -11.639 1.00 . A A . 33 GLY HA2 1 1 1 496 1 1 33 GLY HA3 H -1.185 4.943 -12.912 1.00 . A A . 33 GLY HA3 1 1 1 497 1 1 33 GLY N N -1.704 5.648 -11.031 1.00 . A A . 33 GLY N 1 1 1 498 1 1 33 GLY O O 1.311 3.992 -11.537 1.00 . A A . 33 GLY O 1 1 1 499 1 1 34 THR C C 2.941 5.910 -10.192 1.00 . A A . 34 THR C 1 1 1 500 1 1 34 THR CA C 2.407 6.508 -11.484 1.00 . A A . 34 THR CA 1 1 1 501 1 1 34 THR CB C 2.614 8.026 -11.462 1.00 . A A . 34 THR CB 1 1 1 502 1 1 34 THR CG2 C 4.081 8.347 -11.181 1.00 . A A . 34 THR CG2 1 1 1 503 1 1 34 THR H H 0.349 6.939 -11.774 1.00 . A A . 34 THR H 1 1 1 504 1 1 34 THR HA H 2.959 6.097 -12.316 1.00 . A A . 34 THR HA 1 1 1 505 1 1 34 THR HB H 2.004 8.454 -10.681 1.00 . A A . 34 THR HB 1 1 1 506 1 1 34 THR HG1 H 1.440 8.129 -13.008 1.00 . A A . 34 THR HG1 1 1 1 507 1 1 34 THR HG21 H 4.269 9.387 -11.402 1.00 . A A . 34 THR HG21 1 1 1 508 1 1 34 THR HG22 H 4.710 7.728 -11.803 1.00 . A A . 34 THR HG22 1 1 1 509 1 1 34 THR HG23 H 4.299 8.155 -10.141 1.00 . A A . 34 THR HG23 1 1 1 510 1 1 34 THR N N 0.990 6.207 -11.658 1.00 . A A . 34 THR N 1 1 1 511 1 1 34 THR O O 3.970 5.236 -10.192 1.00 . A A . 34 THR O 1 1 1 512 1 1 34 THR OG1 O 2.234 8.581 -12.713 1.00 . A A . 34 THR OG1 1 1 1 513 1 1 35 VAL C C 2.606 4.113 -7.789 1.00 . A A . 35 VAL C 1 1 1 514 1 1 35 VAL CA C 2.670 5.635 -7.803 1.00 . A A . 35 VAL CA 1 1 1 515 1 1 35 VAL CB C 1.775 6.197 -6.695 1.00 . A A . 35 VAL CB 1 1 1 516 1 1 35 VAL CG1 C 1.840 7.731 -6.712 1.00 . A A . 35 VAL CG1 1 1 1 517 1 1 35 VAL CG2 C 0.331 5.747 -6.933 1.00 . A A . 35 VAL CG2 1 1 1 518 1 1 35 VAL H H 1.430 6.704 -9.148 1.00 . A A . 35 VAL H 1 1 1 519 1 1 35 VAL HA H 3.687 5.946 -7.617 1.00 . A A . 35 VAL HA 1 1 1 520 1 1 35 VAL HB H 2.120 5.830 -5.740 1.00 . A A . 35 VAL HB 1 1 1 521 1 1 35 VAL HG11 H 1.812 8.086 -7.732 1.00 . A A . 35 VAL HG11 1 1 1 522 1 1 35 VAL HG12 H 2.756 8.057 -6.244 1.00 . A A . 35 VAL HG12 1 1 1 523 1 1 35 VAL HG13 H 0.997 8.137 -6.169 1.00 . A A . 35 VAL HG13 1 1 1 524 1 1 35 VAL HG21 H -0.345 6.368 -6.360 1.00 . A A . 35 VAL HG21 1 1 1 525 1 1 35 VAL HG22 H 0.216 4.717 -6.630 1.00 . A A . 35 VAL HG22 1 1 1 526 1 1 35 VAL HG23 H 0.102 5.844 -7.977 1.00 . A A . 35 VAL HG23 1 1 1 527 1 1 35 VAL N N 2.243 6.159 -9.090 1.00 . A A . 35 VAL N 1 1 1 528 1 1 35 VAL O O 3.541 3.451 -7.341 1.00 . A A . 35 VAL O 1 1 1 529 1 1 36 MET C C 2.450 1.486 -9.161 1.00 . A A . 36 MET C 1 1 1 530 1 1 36 MET CA C 1.351 2.111 -8.314 1.00 . A A . 36 MET CA 1 1 1 531 1 1 36 MET CB C -0.028 1.743 -8.885 1.00 . A A . 36 MET CB 1 1 1 532 1 1 36 MET CE C -3.456 0.734 -6.919 1.00 . A A . 36 MET CE 1 1 1 533 1 1 36 MET CG C -1.083 1.815 -7.776 1.00 . A A . 36 MET CG 1 1 1 534 1 1 36 MET H H 0.786 4.128 -8.632 1.00 . A A . 36 MET H 1 1 1 535 1 1 36 MET HA H 1.432 1.731 -7.306 1.00 . A A . 36 MET HA 1 1 1 536 1 1 36 MET HB2 H -0.284 2.441 -9.668 1.00 . A A . 36 MET HB2 1 1 1 537 1 1 36 MET HB3 H -0.005 0.743 -9.291 1.00 . A A . 36 MET HB3 1 1 1 538 1 1 36 MET HE1 H -2.925 1.118 -6.057 1.00 . A A . 36 MET HE1 1 1 1 539 1 1 36 MET HE2 H -3.398 -0.343 -6.921 1.00 . A A . 36 MET HE2 1 1 1 540 1 1 36 MET HE3 H -4.498 1.031 -6.867 1.00 . A A . 36 MET HE3 1 1 1 541 1 1 36 MET HG2 H -0.816 1.124 -6.994 1.00 . A A . 36 MET HG2 1 1 1 542 1 1 36 MET HG3 H -1.110 2.817 -7.373 1.00 . A A . 36 MET HG3 1 1 1 543 1 1 36 MET N N 1.502 3.558 -8.284 1.00 . A A . 36 MET N 1 1 1 544 1 1 36 MET O O 3.137 0.576 -8.720 1.00 . A A . 36 MET O 1 1 1 545 1 1 36 MET SD S -2.711 1.382 -8.444 1.00 . A A . 36 MET SD 1 1 1 546 1 1 37 ARG C C 4.994 1.510 -10.615 1.00 . A A . 37 ARG C 1 1 1 547 1 1 37 ARG CA C 3.620 1.433 -11.272 1.00 . A A . 37 ARG CA 1 1 1 548 1 1 37 ARG CB C 3.638 2.251 -12.564 1.00 . A A . 37 ARG CB 1 1 1 549 1 1 37 ARG CD C 2.272 2.967 -14.535 1.00 . A A . 37 ARG CD 1 1 1 550 1 1 37 ARG CG C 2.366 1.981 -13.377 1.00 . A A . 37 ARG CG 1 1 1 551 1 1 37 ARG CZ C 1.891 5.339 -14.860 1.00 . A A . 37 ARG CZ 1 1 1 552 1 1 37 ARG H H 2.010 2.677 -10.708 1.00 . A A . 37 ARG H 1 1 1 553 1 1 37 ARG HA H 3.389 0.406 -11.504 1.00 . A A . 37 ARG HA 1 1 1 554 1 1 37 ARG HB2 H 3.696 3.300 -12.322 1.00 . A A . 37 ARG HB2 1 1 1 555 1 1 37 ARG HB3 H 4.500 1.970 -13.152 1.00 . A A . 37 ARG HB3 1 1 1 556 1 1 37 ARG HD2 H 3.197 2.952 -15.091 1.00 . A A . 37 ARG HD2 1 1 1 557 1 1 37 ARG HD3 H 1.460 2.674 -15.184 1.00 . A A . 37 ARG HD3 1 1 1 558 1 1 37 ARG HE H 1.978 4.459 -13.066 1.00 . A A . 37 ARG HE 1 1 1 559 1 1 37 ARG HG2 H 2.406 0.990 -13.776 1.00 . A A . 37 ARG HG2 1 1 1 560 1 1 37 ARG HG3 H 1.498 2.081 -12.748 1.00 . A A . 37 ARG HG3 1 1 1 561 1 1 37 ARG HH11 H 2.128 4.236 -16.512 1.00 . A A . 37 ARG HH11 1 1 1 562 1 1 37 ARG HH12 H 1.858 5.926 -16.772 1.00 . A A . 37 ARG HH12 1 1 1 563 1 1 37 ARG HH21 H 1.617 6.676 -13.395 1.00 . A A . 37 ARG HH21 1 1 1 564 1 1 37 ARG HH22 H 1.570 7.308 -15.007 1.00 . A A . 37 ARG HH22 1 1 1 565 1 1 37 ARG N N 2.606 1.970 -10.381 1.00 . A A . 37 ARG N 1 1 1 566 1 1 37 ARG NE N 2.033 4.310 -14.031 1.00 . A A . 37 ARG NE 1 1 1 567 1 1 37 ARG NH1 N 1.965 5.152 -16.148 1.00 . A A . 37 ARG NH1 1 1 1 568 1 1 37 ARG NH2 N 1.676 6.533 -14.383 1.00 . A A . 37 ARG NH2 1 1 1 569 1 1 37 ARG O O 5.845 0.648 -10.831 1.00 . A A . 37 ARG O 1 1 1 570 1 1 38 SER C C 6.779 1.558 -8.213 1.00 . A A . 38 SER C 1 1 1 571 1 1 38 SER CA C 6.479 2.738 -9.133 1.00 . A A . 38 SER CA 1 1 1 572 1 1 38 SER CB C 6.445 4.037 -8.313 1.00 . A A . 38 SER CB 1 1 1 573 1 1 38 SER H H 4.484 3.206 -9.678 1.00 . A A . 38 SER H 1 1 1 574 1 1 38 SER HA H 7.261 2.808 -9.877 1.00 . A A . 38 SER HA 1 1 1 575 1 1 38 SER HB2 H 7.362 4.586 -8.450 1.00 . A A . 38 SER HB2 1 1 1 576 1 1 38 SER HB3 H 5.618 4.646 -8.649 1.00 . A A . 38 SER HB3 1 1 1 577 1 1 38 SER HG H 5.445 3.275 -6.822 1.00 . A A . 38 SER HG 1 1 1 578 1 1 38 SER N N 5.202 2.552 -9.816 1.00 . A A . 38 SER N 1 1 1 579 1 1 38 SER O O 7.928 1.318 -7.849 1.00 . A A . 38 SER O 1 1 1 580 1 1 38 SER OG O 6.285 3.728 -6.932 1.00 . A A . 38 SER OG 1 1 1 581 1 1 39 LEU C C 6.672 -1.442 -7.648 1.00 . A A . 39 LEU C 1 1 1 582 1 1 39 LEU CA C 5.912 -0.322 -6.950 1.00 . A A . 39 LEU CA 1 1 1 583 1 1 39 LEU CB C 4.547 -0.840 -6.498 1.00 . A A . 39 LEU CB 1 1 1 584 1 1 39 LEU CD1 C 2.395 -0.124 -5.421 1.00 . A A . 39 LEU CD1 1 1 1 585 1 1 39 LEU CD2 C 4.568 0.233 -4.204 1.00 . A A . 39 LEU CD2 1 1 1 586 1 1 39 LEU CG C 3.880 0.208 -5.591 1.00 . A A . 39 LEU CG 1 1 1 587 1 1 39 LEU H H 4.845 1.060 -8.159 1.00 . A A . 39 LEU H 1 1 1 588 1 1 39 LEU HA H 6.471 -0.013 -6.081 1.00 . A A . 39 LEU HA 1 1 1 589 1 1 39 LEU HB2 H 3.933 -1.027 -7.364 1.00 . A A . 39 LEU HB2 1 1 1 590 1 1 39 LEU HB3 H 4.675 -1.763 -5.952 1.00 . A A . 39 LEU HB3 1 1 1 591 1 1 39 LEU HD11 H 1.963 -0.348 -6.384 1.00 . A A . 39 LEU HD11 1 1 1 592 1 1 39 LEU HD12 H 1.886 0.723 -4.988 1.00 . A A . 39 LEU HD12 1 1 1 593 1 1 39 LEU HD13 H 2.288 -0.979 -4.769 1.00 . A A . 39 LEU HD13 1 1 1 594 1 1 39 LEU HD21 H 5.408 0.911 -4.233 1.00 . A A . 39 LEU HD21 1 1 1 595 1 1 39 LEU HD22 H 4.917 -0.757 -3.943 1.00 . A A . 39 LEU HD22 1 1 1 596 1 1 39 LEU HD23 H 3.868 0.568 -3.451 1.00 . A A . 39 LEU HD23 1 1 1 597 1 1 39 LEU HG H 3.971 1.181 -6.050 1.00 . A A . 39 LEU HG 1 1 1 598 1 1 39 LEU N N 5.741 0.825 -7.837 1.00 . A A . 39 LEU N 1 1 1 599 1 1 39 LEU O O 6.549 -2.610 -7.278 1.00 . A A . 39 LEU O 1 1 1 600 1 1 40 GLY C C 7.367 -2.860 -10.325 1.00 . A A . 40 GLY C 1 1 1 601 1 1 40 GLY CA C 8.249 -2.069 -9.378 1.00 . A A . 40 GLY CA 1 1 1 602 1 1 40 GLY H H 7.542 -0.142 -8.903 1.00 . A A . 40 GLY H 1 1 1 603 1 1 40 GLY HA2 H 9.019 -1.561 -9.942 1.00 . A A . 40 GLY HA2 1 1 1 604 1 1 40 GLY HA3 H 8.709 -2.746 -8.675 1.00 . A A . 40 GLY HA3 1 1 1 605 1 1 40 GLY N N 7.466 -1.082 -8.654 1.00 . A A . 40 GLY N 1 1 1 606 1 1 40 GLY O O 7.778 -3.892 -10.853 1.00 . A A . 40 GLY O 1 1 1 607 1 1 41 GLN C C 4.984 -2.243 -12.679 1.00 . A A . 41 GLN C 1 1 1 608 1 1 41 GLN CA C 5.196 -3.062 -11.413 1.00 . A A . 41 GLN CA 1 1 1 609 1 1 41 GLN CB C 3.865 -3.259 -10.684 1.00 . A A . 41 GLN CB 1 1 1 610 1 1 41 GLN CD C 2.849 -3.854 -8.482 1.00 . A A . 41 GLN CD 1 1 1 611 1 1 41 GLN CG C 4.120 -3.896 -9.316 1.00 . A A . 41 GLN CG 1 1 1 612 1 1 41 GLN H H 5.868 -1.549 -10.090 1.00 . A A . 41 GLN H 1 1 1 613 1 1 41 GLN HA H 5.589 -4.032 -11.691 1.00 . A A . 41 GLN HA 1 1 1 614 1 1 41 GLN HB2 H 3.365 -2.310 -10.559 1.00 . A A . 41 GLN HB2 1 1 1 615 1 1 41 GLN HB3 H 3.241 -3.923 -11.259 1.00 . A A . 41 GLN HB3 1 1 1 616 1 1 41 GLN HE21 H 2.545 -5.813 -8.572 1.00 . A A . 41 GLN HE21 1 1 1 617 1 1 41 GLN HE22 H 1.389 -4.938 -7.689 1.00 . A A . 41 GLN HE22 1 1 1 618 1 1 41 GLN HG2 H 4.425 -4.922 -9.450 1.00 . A A . 41 GLN HG2 1 1 1 619 1 1 41 GLN HG3 H 4.900 -3.355 -8.798 1.00 . A A . 41 GLN HG3 1 1 1 620 1 1 41 GLN N N 6.143 -2.379 -10.534 1.00 . A A . 41 GLN N 1 1 1 621 1 1 41 GLN NE2 N 2.208 -4.960 -8.226 1.00 . A A . 41 GLN NE2 1 1 1 622 1 1 41 GLN O O 5.126 -1.020 -12.667 1.00 . A A . 41 GLN O 1 1 1 623 1 1 41 GLN OE1 O 2.427 -2.780 -8.054 1.00 . A A . 41 GLN OE1 1 1 1 624 1 1 42 ASN C C 3.074 -2.620 -15.646 1.00 . A A . 42 ASN C 1 1 1 625 1 1 42 ASN CA C 4.431 -2.251 -15.056 1.00 . A A . 42 ASN CA 1 1 1 626 1 1 42 ASN CB C 5.535 -2.643 -16.038 1.00 . A A . 42 ASN CB 1 1 1 627 1 1 42 ASN CG C 6.897 -2.545 -15.356 1.00 . A A . 42 ASN CG 1 1 1 628 1 1 42 ASN H H 4.560 -3.896 -13.721 1.00 . A A . 42 ASN H 1 1 1 629 1 1 42 ASN HA H 4.468 -1.179 -14.918 1.00 . A A . 42 ASN HA 1 1 1 630 1 1 42 ASN HB2 H 5.373 -3.655 -16.378 1.00 . A A . 42 ASN HB2 1 1 1 631 1 1 42 ASN HB3 H 5.514 -1.973 -16.885 1.00 . A A . 42 ASN HB3 1 1 1 632 1 1 42 ASN HD21 H 6.279 -1.261 -13.971 1.00 . A A . 42 ASN HD21 1 1 1 633 1 1 42 ASN HD22 H 7.913 -1.708 -13.870 1.00 . A A . 42 ASN HD22 1 1 1 634 1 1 42 ASN N N 4.649 -2.923 -13.773 1.00 . A A . 42 ASN N 1 1 1 635 1 1 42 ASN ND2 N 7.042 -1.774 -14.313 1.00 . A A . 42 ASN ND2 1 1 1 636 1 1 42 ASN O O 2.983 -3.073 -16.787 1.00 . A A . 42 ASN O 1 1 1 637 1 1 42 ASN OD1 O 7.854 -3.189 -15.786 1.00 . A A . 42 ASN OD1 1 1 1 638 1 1 43 PRO C C 0.261 -1.843 -16.561 1.00 . A A . 43 PRO C 1 1 1 639 1 1 43 PRO CA C 0.630 -2.692 -15.346 1.00 . A A . 43 PRO CA 1 1 1 640 1 1 43 PRO CB C -0.237 -2.325 -14.119 1.00 . A A . 43 PRO CB 1 1 1 641 1 1 43 PRO CD C 2.044 -1.904 -13.514 1.00 . A A . 43 PRO CD 1 1 1 642 1 1 43 PRO CG C 0.619 -1.415 -13.298 1.00 . A A . 43 PRO CG 1 1 1 643 1 1 43 PRO HA H 0.516 -3.740 -15.575 1.00 . A A . 43 PRO HA 1 1 1 644 1 1 43 PRO HB2 H -1.144 -1.816 -14.427 1.00 . A A . 43 PRO HB2 1 1 1 645 1 1 43 PRO HB3 H -0.481 -3.212 -13.551 1.00 . A A . 43 PRO HB3 1 1 1 646 1 1 43 PRO HD2 H 2.749 -1.104 -13.405 1.00 . A A . 43 PRO HD2 1 1 1 647 1 1 43 PRO HD3 H 2.271 -2.701 -12.835 1.00 . A A . 43 PRO HD3 1 1 1 648 1 1 43 PRO HG2 H 0.515 -0.393 -13.634 1.00 . A A . 43 PRO HG2 1 1 1 649 1 1 43 PRO HG3 H 0.363 -1.493 -12.251 1.00 . A A . 43 PRO HG3 1 1 1 650 1 1 43 PRO N N 2.024 -2.413 -14.892 1.00 . A A . 43 PRO N 1 1 1 651 1 1 43 PRO O O 0.717 -0.707 -16.696 1.00 . A A . 43 PRO O 1 1 1 652 1 1 44 THR C C -2.077 -0.673 -18.313 1.00 . A A . 44 THR C 1 1 1 653 1 1 44 THR CA C -0.977 -1.680 -18.639 1.00 . A A . 44 THR CA 1 1 1 654 1 1 44 THR CB C -1.496 -2.677 -19.680 1.00 . A A . 44 THR CB 1 1 1 655 1 1 44 THR CG2 C -0.603 -3.918 -19.692 1.00 . A A . 44 THR CG2 1 1 1 656 1 1 44 THR H H -0.889 -3.310 -17.285 1.00 . A A . 44 THR H 1 1 1 657 1 1 44 THR HA H -0.128 -1.157 -19.051 1.00 . A A . 44 THR HA 1 1 1 658 1 1 44 THR HB H -1.481 -2.218 -20.657 1.00 . A A . 44 THR HB 1 1 1 659 1 1 44 THR HG1 H -3.016 -2.738 -18.465 1.00 . A A . 44 THR HG1 1 1 1 660 1 1 44 THR HG21 H -0.869 -4.544 -20.532 1.00 . A A . 44 THR HG21 1 1 1 661 1 1 44 THR HG22 H -0.742 -4.471 -18.774 1.00 . A A . 44 THR HG22 1 1 1 662 1 1 44 THR HG23 H 0.430 -3.619 -19.780 1.00 . A A . 44 THR HG23 1 1 1 663 1 1 44 THR N N -0.562 -2.400 -17.440 1.00 . A A . 44 THR N 1 1 1 664 1 1 44 THR O O -2.754 -0.781 -17.293 1.00 . A A . 44 THR O 1 1 1 665 1 1 44 THR OG1 O -2.827 -3.054 -19.353 1.00 . A A . 44 THR OG1 1 1 1 666 1 1 45 GLU C C -4.621 0.699 -18.743 1.00 . A A . 45 GLU C 1 1 1 667 1 1 45 GLU CA C -3.256 1.340 -18.968 1.00 . A A . 45 GLU CA 1 1 1 668 1 1 45 GLU CB C -3.318 2.269 -20.182 1.00 . A A . 45 GLU CB 1 1 1 669 1 1 45 GLU CD C -4.323 4.376 -21.084 1.00 . A A . 45 GLU CD 1 1 1 670 1 1 45 GLU CG C -4.311 3.401 -19.912 1.00 . A A . 45 GLU CG 1 1 1 671 1 1 45 GLU H H -1.663 0.366 -19.971 1.00 . A A . 45 GLU H 1 1 1 672 1 1 45 GLU HA H -2.991 1.920 -18.097 1.00 . A A . 45 GLU HA 1 1 1 673 1 1 45 GLU HB2 H -2.338 2.686 -20.367 1.00 . A A . 45 GLU HB2 1 1 1 674 1 1 45 GLU HB3 H -3.641 1.710 -21.047 1.00 . A A . 45 GLU HB3 1 1 1 675 1 1 45 GLU HG2 H -5.300 2.987 -19.783 1.00 . A A . 45 GLU HG2 1 1 1 676 1 1 45 GLU HG3 H -4.023 3.926 -19.014 1.00 . A A . 45 GLU HG3 1 1 1 677 1 1 45 GLU N N -2.242 0.315 -19.182 1.00 . A A . 45 GLU N 1 1 1 678 1 1 45 GLU O O -5.419 1.180 -17.938 1.00 . A A . 45 GLU O 1 1 1 679 1 1 45 GLU OE1 O -3.768 4.037 -22.116 1.00 . A A . 45 GLU OE1 1 1 1 680 1 1 45 GLU OE2 O -4.886 5.447 -20.931 1.00 . A A . 45 GLU OE2 1 1 1 681 1 1 46 ALA C C -6.330 -1.601 -17.892 1.00 . A A . 46 ALA C 1 1 1 682 1 1 46 ALA CA C -6.151 -1.094 -19.322 1.00 . A A . 46 ALA CA 1 1 1 683 1 1 46 ALA CB C -6.201 -2.271 -20.298 1.00 . A A . 46 ALA CB 1 1 1 684 1 1 46 ALA H H -4.205 -0.730 -20.078 1.00 . A A . 46 ALA H 1 1 1 685 1 1 46 ALA HA H -6.956 -0.412 -19.556 1.00 . A A . 46 ALA HA 1 1 1 686 1 1 46 ALA HB1 H -5.385 -2.947 -20.090 1.00 . A A . 46 ALA HB1 1 1 1 687 1 1 46 ALA HB2 H -6.113 -1.904 -21.310 1.00 . A A . 46 ALA HB2 1 1 1 688 1 1 46 ALA HB3 H -7.140 -2.793 -20.186 1.00 . A A . 46 ALA HB3 1 1 1 689 1 1 46 ALA N N -4.881 -0.391 -19.454 1.00 . A A . 46 ALA N 1 1 1 690 1 1 46 ALA O O -7.445 -1.637 -17.370 1.00 . A A . 46 ALA O 1 1 1 691 1 1 47 GLU C C -5.618 -1.354 -14.937 1.00 . A A . 47 GLU C 1 1 1 692 1 1 47 GLU CA C -5.266 -2.486 -15.899 1.00 . A A . 47 GLU CA 1 1 1 693 1 1 47 GLU CB C -3.920 -3.104 -15.513 1.00 . A A . 47 GLU CB 1 1 1 694 1 1 47 GLU CD C -2.319 -4.956 -16.023 1.00 . A A . 47 GLU CD 1 1 1 695 1 1 47 GLU CG C -3.676 -4.354 -16.361 1.00 . A A . 47 GLU CG 1 1 1 696 1 1 47 GLU H H -4.366 -1.927 -17.741 1.00 . A A . 47 GLU H 1 1 1 697 1 1 47 GLU HA H -6.029 -3.247 -15.834 1.00 . A A . 47 GLU HA 1 1 1 698 1 1 47 GLU HB2 H -3.129 -2.390 -15.684 1.00 . A A . 47 GLU HB2 1 1 1 699 1 1 47 GLU HB3 H -3.936 -3.380 -14.470 1.00 . A A . 47 GLU HB3 1 1 1 700 1 1 47 GLU HG2 H -4.451 -5.080 -16.162 1.00 . A A . 47 GLU HG2 1 1 1 701 1 1 47 GLU HG3 H -3.697 -4.086 -17.407 1.00 . A A . 47 GLU HG3 1 1 1 702 1 1 47 GLU N N -5.222 -1.988 -17.268 1.00 . A A . 47 GLU N 1 1 1 703 1 1 47 GLU O O -6.376 -1.547 -13.985 1.00 . A A . 47 GLU O 1 1 1 704 1 1 47 GLU OE1 O -1.682 -4.453 -15.114 1.00 . A A . 47 GLU OE1 1 1 1 705 1 1 47 GLU OE2 O -1.935 -5.910 -16.679 1.00 . A A . 47 GLU OE2 1 1 1 706 1 1 48 LEU C C -6.751 1.485 -14.562 1.00 . A A . 48 LEU C 1 1 1 707 1 1 48 LEU CA C -5.327 0.985 -14.343 1.00 . A A . 48 LEU CA 1 1 1 708 1 1 48 LEU CB C -4.331 2.100 -14.667 1.00 . A A . 48 LEU CB 1 1 1 709 1 1 48 LEU CD1 C -1.898 2.670 -14.821 1.00 . A A . 48 LEU CD1 1 1 1 710 1 1 48 LEU CD2 C -2.763 1.479 -12.781 1.00 . A A . 48 LEU CD2 1 1 1 711 1 1 48 LEU CG C -2.910 1.639 -14.309 1.00 . A A . 48 LEU CG 1 1 1 712 1 1 48 LEU H H -4.470 -0.075 -15.967 1.00 . A A . 48 LEU H 1 1 1 713 1 1 48 LEU HA H -5.217 0.698 -13.312 1.00 . A A . 48 LEU HA 1 1 1 714 1 1 48 LEU HB2 H -4.381 2.329 -15.722 1.00 . A A . 48 LEU HB2 1 1 1 715 1 1 48 LEU HB3 H -4.579 2.982 -14.095 1.00 . A A . 48 LEU HB3 1 1 1 716 1 1 48 LEU HD11 H -1.811 2.587 -15.895 1.00 . A A . 48 LEU HD11 1 1 1 717 1 1 48 LEU HD12 H -0.936 2.485 -14.367 1.00 . A A . 48 LEU HD12 1 1 1 718 1 1 48 LEU HD13 H -2.234 3.663 -14.562 1.00 . A A . 48 LEU HD13 1 1 1 719 1 1 48 LEU HD21 H -1.725 1.605 -12.498 1.00 . A A . 48 LEU HD21 1 1 1 720 1 1 48 LEU HD22 H -3.088 0.491 -12.489 1.00 . A A . 48 LEU HD22 1 1 1 721 1 1 48 LEU HD23 H -3.364 2.219 -12.272 1.00 . A A . 48 LEU HD23 1 1 1 722 1 1 48 LEU HG H -2.718 0.690 -14.788 1.00 . A A . 48 LEU HG 1 1 1 723 1 1 48 LEU N N -5.063 -0.172 -15.194 1.00 . A A . 48 LEU N 1 1 1 724 1 1 48 LEU O O -7.498 1.704 -13.613 1.00 . A A . 48 LEU O 1 1 1 725 1 1 49 GLN C C -9.505 1.291 -15.457 1.00 . A A . 49 GLN C 1 1 1 726 1 1 49 GLN CA C -8.456 2.158 -16.141 1.00 . A A . 49 GLN CA 1 1 1 727 1 1 49 GLN CB C -8.666 2.120 -17.657 1.00 . A A . 49 GLN CB 1 1 1 728 1 1 49 GLN CD C -8.341 4.579 -17.975 1.00 . A A . 49 GLN CD 1 1 1 729 1 1 49 GLN CG C -7.808 3.195 -18.326 1.00 . A A . 49 GLN CG 1 1 1 730 1 1 49 GLN H H -6.479 1.514 -16.545 1.00 . A A . 49 GLN H 1 1 1 731 1 1 49 GLN HA H -8.556 3.175 -15.794 1.00 . A A . 49 GLN HA 1 1 1 732 1 1 49 GLN HB2 H -8.380 1.148 -18.032 1.00 . A A . 49 GLN HB2 1 1 1 733 1 1 49 GLN HB3 H -9.706 2.301 -17.881 1.00 . A A . 49 GLN HB3 1 1 1 734 1 1 49 GLN HE21 H -6.572 5.281 -17.414 1.00 . A A . 49 GLN HE21 1 1 1 735 1 1 49 GLN HE22 H -7.860 6.381 -17.297 1.00 . A A . 49 GLN HE22 1 1 1 736 1 1 49 GLN HG2 H -6.788 3.105 -17.980 1.00 . A A . 49 GLN HG2 1 1 1 737 1 1 49 GLN HG3 H -7.836 3.062 -19.398 1.00 . A A . 49 GLN HG3 1 1 1 738 1 1 49 GLN N N -7.119 1.675 -15.822 1.00 . A A . 49 GLN N 1 1 1 739 1 1 49 GLN NE2 N -7.523 5.489 -17.525 1.00 . A A . 49 GLN NE2 1 1 1 740 1 1 49 GLN O O -10.435 1.801 -14.833 1.00 . A A . 49 GLN O 1 1 1 741 1 1 49 GLN OE1 O -9.537 4.839 -18.115 1.00 . A A . 49 GLN OE1 1 1 1 742 1 1 50 ASP C C -10.231 -0.802 -13.425 1.00 . A A . 50 ASP C 1 1 1 743 1 1 50 ASP CA C -10.276 -0.952 -14.941 1.00 . A A . 50 ASP CA 1 1 1 744 1 1 50 ASP CB C -9.928 -2.386 -15.333 1.00 . A A . 50 ASP CB 1 1 1 745 1 1 50 ASP CG C -10.298 -2.633 -16.792 1.00 . A A . 50 ASP CG 1 1 1 746 1 1 50 ASP H H -8.576 -0.374 -16.066 1.00 . A A . 50 ASP H 1 1 1 747 1 1 50 ASP HA H -11.276 -0.727 -15.283 1.00 . A A . 50 ASP HA 1 1 1 748 1 1 50 ASP HB2 H -8.869 -2.544 -15.203 1.00 . A A . 50 ASP HB2 1 1 1 749 1 1 50 ASP HB3 H -10.476 -3.070 -14.707 1.00 . A A . 50 ASP HB3 1 1 1 750 1 1 50 ASP N N -9.342 -0.023 -15.565 1.00 . A A . 50 ASP N 1 1 1 751 1 1 50 ASP O O -11.263 -0.839 -12.757 1.00 . A A . 50 ASP O 1 1 1 752 1 1 50 ASP OD1 O -11.028 -1.826 -17.344 1.00 . A A . 50 ASP OD1 1 1 1 753 1 1 50 ASP OD2 O -9.848 -3.628 -17.334 1.00 . A A . 50 ASP OD2 1 1 1 754 1 1 51 MET C C -9.662 0.745 -10.963 1.00 . A A . 51 MET C 1 1 1 755 1 1 51 MET CA C -8.873 -0.464 -11.448 1.00 . A A . 51 MET CA 1 1 1 756 1 1 51 MET CB C -7.383 -0.277 -11.100 1.00 . A A . 51 MET CB 1 1 1 757 1 1 51 MET CE C -5.227 -1.302 -8.522 1.00 . A A . 51 MET CE 1 1 1 758 1 1 51 MET CG C -7.221 0.161 -9.638 1.00 . A A . 51 MET CG 1 1 1 759 1 1 51 MET H H -8.237 -0.600 -13.467 1.00 . A A . 51 MET H 1 1 1 760 1 1 51 MET HA H -9.239 -1.350 -10.953 1.00 . A A . 51 MET HA 1 1 1 761 1 1 51 MET HB2 H -6.862 -1.211 -11.248 1.00 . A A . 51 MET HB2 1 1 1 762 1 1 51 MET HB3 H -6.954 0.474 -11.743 1.00 . A A . 51 MET HB3 1 1 1 763 1 1 51 MET HE1 H -4.209 -1.619 -8.682 1.00 . A A . 51 MET HE1 1 1 1 764 1 1 51 MET HE2 H -5.897 -2.015 -8.976 1.00 . A A . 51 MET HE2 1 1 1 765 1 1 51 MET HE3 H -5.433 -1.239 -7.463 1.00 . A A . 51 MET HE3 1 1 1 766 1 1 51 MET HG2 H -7.696 1.121 -9.487 1.00 . A A . 51 MET HG2 1 1 1 767 1 1 51 MET HG3 H -7.670 -0.570 -8.986 1.00 . A A . 51 MET HG3 1 1 1 768 1 1 51 MET N N -9.028 -0.626 -12.888 1.00 . A A . 51 MET N 1 1 1 769 1 1 51 MET O O -10.371 0.673 -9.958 1.00 . A A . 51 MET O 1 1 1 770 1 1 51 MET SD S -5.462 0.324 -9.266 1.00 . A A . 51 MET SD 1 1 1 771 1 1 52 ILE C C -11.716 2.952 -11.552 1.00 . A A . 52 ILE C 1 1 1 772 1 1 52 ILE CA C -10.222 3.076 -11.294 1.00 . A A . 52 ILE CA 1 1 1 773 1 1 52 ILE CB C -9.672 4.259 -12.082 1.00 . A A . 52 ILE CB 1 1 1 774 1 1 52 ILE CD1 C -7.559 5.381 -12.804 1.00 . A A . 52 ILE CD1 1 1 1 775 1 1 52 ILE CG1 C -8.167 4.365 -11.841 1.00 . A A . 52 ILE CG1 1 1 1 776 1 1 52 ILE CG2 C -10.346 5.549 -11.605 1.00 . A A . 52 ILE CG2 1 1 1 777 1 1 52 ILE H H -8.951 1.851 -12.469 1.00 . A A . 52 ILE H 1 1 1 778 1 1 52 ILE HA H -10.058 3.259 -10.245 1.00 . A A . 52 ILE HA 1 1 1 779 1 1 52 ILE HB H -9.868 4.113 -13.133 1.00 . A A . 52 ILE HB 1 1 1 780 1 1 52 ILE HD11 H -7.968 5.238 -13.794 1.00 . A A . 52 ILE HD11 1 1 1 781 1 1 52 ILE HD12 H -6.490 5.244 -12.833 1.00 . A A . 52 ILE HD12 1 1 1 782 1 1 52 ILE HD13 H -7.787 6.378 -12.459 1.00 . A A . 52 ILE HD13 1 1 1 783 1 1 52 ILE HG12 H -7.993 4.687 -10.828 1.00 . A A . 52 ILE HG12 1 1 1 784 1 1 52 ILE HG13 H -7.707 3.402 -11.998 1.00 . A A . 52 ILE HG13 1 1 1 785 1 1 52 ILE HG21 H -11.397 5.520 -11.848 1.00 . A A . 52 ILE HG21 1 1 1 786 1 1 52 ILE HG22 H -9.887 6.397 -12.094 1.00 . A A . 52 ILE HG22 1 1 1 787 1 1 52 ILE HG23 H -10.225 5.643 -10.536 1.00 . A A . 52 ILE HG23 1 1 1 788 1 1 52 ILE N N -9.524 1.857 -11.675 1.00 . A A . 52 ILE N 1 1 1 789 1 1 52 ILE O O -12.529 3.219 -10.673 1.00 . A A . 52 ILE O 1 1 1 790 1 1 53 ASN C C -14.210 1.549 -12.117 1.00 . A A . 53 ASN C 1 1 1 791 1 1 53 ASN CA C -13.461 2.383 -13.145 1.00 . A A . 53 ASN CA 1 1 1 792 1 1 53 ASN CB C -13.563 1.716 -14.519 1.00 . A A . 53 ASN CB 1 1 1 793 1 1 53 ASN CG C -12.978 2.631 -15.592 1.00 . A A . 53 ASN CG 1 1 1 794 1 1 53 ASN H H -11.362 2.330 -13.420 1.00 . A A . 53 ASN H 1 1 1 795 1 1 53 ASN HA H -13.919 3.360 -13.200 1.00 . A A . 53 ASN HA 1 1 1 796 1 1 53 ASN HB2 H -13.018 0.784 -14.506 1.00 . A A . 53 ASN HB2 1 1 1 797 1 1 53 ASN HB3 H -14.601 1.521 -14.746 1.00 . A A . 53 ASN HB3 1 1 1 798 1 1 53 ASN HD21 H -12.919 4.228 -14.413 1.00 . A A . 53 ASN HD21 1 1 1 799 1 1 53 ASN HD22 H -12.353 4.472 -15.995 1.00 . A A . 53 ASN HD22 1 1 1 800 1 1 53 ASN N N -12.062 2.536 -12.765 1.00 . A A . 53 ASN N 1 1 1 801 1 1 53 ASN ND2 N -12.730 3.881 -15.310 1.00 . A A . 53 ASN ND2 1 1 1 802 1 1 53 ASN O O -15.399 1.761 -11.882 1.00 . A A . 53 ASN O 1 1 1 803 1 1 53 ASN OD1 O -12.736 2.193 -16.716 1.00 . A A . 53 ASN OD1 1 1 1 804 1 1 54 GLU C C -14.557 0.543 -9.288 1.00 . A A . 54 GLU C 1 1 1 805 1 1 54 GLU CA C -14.128 -0.263 -10.510 1.00 . A A . 54 GLU CA 1 1 1 806 1 1 54 GLU CB C -13.140 -1.348 -10.082 1.00 . A A . 54 GLU CB 1 1 1 807 1 1 54 GLU CD C -12.881 -3.455 -8.757 1.00 . A A . 54 GLU CD 1 1 1 808 1 1 54 GLU CG C -13.827 -2.313 -9.114 1.00 . A A . 54 GLU CG 1 1 1 809 1 1 54 GLU H H -12.566 0.470 -11.733 1.00 . A A . 54 GLU H 1 1 1 810 1 1 54 GLU HA H -14.997 -0.735 -10.940 1.00 . A A . 54 GLU HA 1 1 1 811 1 1 54 GLU HB2 H -12.801 -1.890 -10.953 1.00 . A A . 54 GLU HB2 1 1 1 812 1 1 54 GLU HB3 H -12.294 -0.890 -9.591 1.00 . A A . 54 GLU HB3 1 1 1 813 1 1 54 GLU HG2 H -14.101 -1.783 -8.213 1.00 . A A . 54 GLU HG2 1 1 1 814 1 1 54 GLU HG3 H -14.714 -2.716 -9.578 1.00 . A A . 54 GLU HG3 1 1 1 815 1 1 54 GLU N N -13.511 0.598 -11.510 1.00 . A A . 54 GLU N 1 1 1 816 1 1 54 GLU O O -15.658 0.362 -8.770 1.00 . A A . 54 GLU O 1 1 1 817 1 1 54 GLU OE1 O -11.706 -3.344 -9.066 1.00 . A A . 54 GLU OE1 1 1 1 818 1 1 54 GLU OE2 O -13.346 -4.424 -8.183 1.00 . A A . 54 GLU OE2 1 1 1 819 1 1 55 VAL C C -14.684 3.546 -8.084 1.00 . A A . 55 VAL C 1 1 1 820 1 1 55 VAL CA C -13.980 2.258 -7.662 1.00 . A A . 55 VAL CA 1 1 1 821 1 1 55 VAL CB C -12.685 2.596 -6.916 1.00 . A A . 55 VAL CB 1 1 1 822 1 1 55 VAL CG1 C -11.672 3.180 -7.896 1.00 . A A . 55 VAL CG1 1 1 1 823 1 1 55 VAL CG2 C -12.977 3.619 -5.815 1.00 . A A . 55 VAL CG2 1 1 1 824 1 1 55 VAL H H -12.816 1.532 -9.279 1.00 . A A . 55 VAL H 1 1 1 825 1 1 55 VAL HA H -14.630 1.708 -6.993 1.00 . A A . 55 VAL HA 1 1 1 826 1 1 55 VAL HB H -12.280 1.697 -6.476 1.00 . A A . 55 VAL HB 1 1 1 827 1 1 55 VAL HG11 H -10.841 3.601 -7.349 1.00 . A A . 55 VAL HG11 1 1 1 828 1 1 55 VAL HG12 H -12.143 3.952 -8.486 1.00 . A A . 55 VAL HG12 1 1 1 829 1 1 55 VAL HG13 H -11.317 2.395 -8.544 1.00 . A A . 55 VAL HG13 1 1 1 830 1 1 55 VAL HG21 H -12.140 3.665 -5.133 1.00 . A A . 55 VAL HG21 1 1 1 831 1 1 55 VAL HG22 H -13.865 3.322 -5.278 1.00 . A A . 55 VAL HG22 1 1 1 832 1 1 55 VAL HG23 H -13.133 4.588 -6.261 1.00 . A A . 55 VAL HG23 1 1 1 833 1 1 55 VAL N N -13.680 1.431 -8.828 1.00 . A A . 55 VAL N 1 1 1 834 1 1 55 VAL O O -15.332 4.203 -7.267 1.00 . A A . 55 VAL O 1 1 1 835 1 1 56 ASP C C -16.702 4.907 -9.904 1.00 . A A . 56 ASP C 1 1 1 836 1 1 56 ASP CA C -15.186 5.109 -9.857 1.00 . A A . 56 ASP CA 1 1 1 837 1 1 56 ASP CB C -14.640 5.431 -11.265 1.00 . A A . 56 ASP CB 1 1 1 838 1 1 56 ASP CG C -14.642 6.937 -11.503 1.00 . A A . 56 ASP CG 1 1 1 839 1 1 56 ASP H H -14.032 3.343 -9.967 1.00 . A A . 56 ASP H 1 1 1 840 1 1 56 ASP HA H -14.958 5.924 -9.190 1.00 . A A . 56 ASP HA 1 1 1 841 1 1 56 ASP HB2 H -13.629 5.070 -11.348 1.00 . A A . 56 ASP HB2 1 1 1 842 1 1 56 ASP HB3 H -15.249 4.948 -12.015 1.00 . A A . 56 ASP HB3 1 1 1 843 1 1 56 ASP N N -14.557 3.899 -9.356 1.00 . A A . 56 ASP N 1 1 1 844 1 1 56 ASP O O -17.264 4.540 -10.935 1.00 . A A . 56 ASP O 1 1 1 845 1 1 56 ASP OD1 O -15.692 7.473 -11.790 1.00 . A A . 56 ASP OD1 1 1 1 846 1 1 56 ASP OD2 O -13.589 7.537 -11.368 1.00 . A A . 56 ASP OD2 1 1 1 847 1 1 57 ALA C C -19.509 5.869 -9.699 1.00 . A A . 57 ALA C 1 1 1 848 1 1 57 ALA CA C -18.794 4.982 -8.693 1.00 . A A . 57 ALA CA 1 1 1 849 1 1 57 ALA CB C -19.280 5.324 -7.287 1.00 . A A . 57 ALA CB 1 1 1 850 1 1 57 ALA H H -16.854 5.438 -7.983 1.00 . A A . 57 ALA H 1 1 1 851 1 1 57 ALA HA H -19.040 3.949 -8.898 1.00 . A A . 57 ALA HA 1 1 1 852 1 1 57 ALA HB1 H -20.352 5.203 -7.241 1.00 . A A . 57 ALA HB1 1 1 1 853 1 1 57 ALA HB2 H -19.023 6.348 -7.059 1.00 . A A . 57 ALA HB2 1 1 1 854 1 1 57 ALA HB3 H -18.813 4.666 -6.571 1.00 . A A . 57 ALA HB3 1 1 1 855 1 1 57 ALA N N -17.354 5.146 -8.776 1.00 . A A . 57 ALA N 1 1 1 856 1 1 57 ALA O O -20.622 5.559 -10.118 1.00 . A A . 57 ALA O 1 1 1 857 1 1 58 ASP C C -18.876 7.764 -12.416 1.00 . A A . 58 ASP C 1 1 1 858 1 1 58 ASP CA C -19.491 7.912 -11.025 1.00 . A A . 58 ASP CA 1 1 1 859 1 1 58 ASP CB C -19.280 9.339 -10.522 1.00 . A A . 58 ASP CB 1 1 1 860 1 1 58 ASP CG C -17.794 9.602 -10.301 1.00 . A A . 58 ASP CG 1 1 1 861 1 1 58 ASP H H -17.996 7.200 -9.717 1.00 . A A . 58 ASP H 1 1 1 862 1 1 58 ASP HA H -20.554 7.723 -11.090 1.00 . A A . 58 ASP HA 1 1 1 863 1 1 58 ASP HB2 H -19.665 10.038 -11.247 1.00 . A A . 58 ASP HB2 1 1 1 864 1 1 58 ASP HB3 H -19.805 9.466 -9.587 1.00 . A A . 58 ASP HB3 1 1 1 865 1 1 58 ASP N N -18.883 6.983 -10.071 1.00 . A A . 58 ASP N 1 1 1 866 1 1 58 ASP O O -19.339 8.378 -13.377 1.00 . A A . 58 ASP O 1 1 1 867 1 1 58 ASP OD1 O -17.030 9.344 -11.213 1.00 . A A . 58 ASP OD1 1 1 1 868 1 1 58 ASP OD2 O -17.441 10.057 -9.225 1.00 . A A . 58 ASP OD2 1 1 1 869 1 1 59 GLY C C -16.700 8.076 -14.392 1.00 . A A . 59 GLY C 1 1 1 870 1 1 59 GLY CA C -17.165 6.748 -13.805 1.00 . A A . 59 GLY CA 1 1 1 871 1 1 59 GLY H H -17.500 6.488 -11.723 1.00 . A A . 59 GLY H 1 1 1 872 1 1 59 GLY HA2 H -16.307 6.108 -13.663 1.00 . A A . 59 GLY HA2 1 1 1 873 1 1 59 GLY HA3 H -17.848 6.277 -14.493 1.00 . A A . 59 GLY HA3 1 1 1 874 1 1 59 GLY N N -17.831 6.954 -12.521 1.00 . A A . 59 GLY N 1 1 1 875 1 1 59 GLY O O -16.690 8.255 -15.610 1.00 . A A . 59 GLY O 1 1 1 876 1 1 60 ASN C C -14.438 10.240 -14.507 1.00 . A A . 60 ASN C 1 1 1 877 1 1 60 ASN CA C -15.863 10.318 -13.974 1.00 . A A . 60 ASN CA 1 1 1 878 1 1 60 ASN CB C -15.917 11.319 -12.817 1.00 . A A . 60 ASN CB 1 1 1 879 1 1 60 ASN CG C -14.965 10.884 -11.709 1.00 . A A . 60 ASN CG 1 1 1 880 1 1 60 ASN H H -16.346 8.814 -12.565 1.00 . A A . 60 ASN H 1 1 1 881 1 1 60 ASN HA H -16.513 10.664 -14.763 1.00 . A A . 60 ASN HA 1 1 1 882 1 1 60 ASN HB2 H -15.630 12.297 -13.174 1.00 . A A . 60 ASN HB2 1 1 1 883 1 1 60 ASN HB3 H -16.923 11.361 -12.427 1.00 . A A . 60 ASN HB3 1 1 1 884 1 1 60 ASN HD21 H -15.184 12.558 -10.661 1.00 . A A . 60 ASN HD21 1 1 1 885 1 1 60 ASN HD22 H -14.128 11.412 -9.985 1.00 . A A . 60 ASN HD22 1 1 1 886 1 1 60 ASN N N -16.319 9.009 -13.523 1.00 . A A . 60 ASN N 1 1 1 887 1 1 60 ASN ND2 N -14.741 11.684 -10.701 1.00 . A A . 60 ASN ND2 1 1 1 888 1 1 60 ASN O O -13.919 11.209 -15.060 1.00 . A A . 60 ASN O 1 1 1 889 1 1 60 ASN OD1 O -14.411 9.788 -11.763 1.00 . A A . 60 ASN OD1 1 1 1 890 1 1 61 GLY C C -11.431 9.351 -13.789 1.00 . A A . 61 GLY C 1 1 1 891 1 1 61 GLY CA C -12.445 8.887 -14.826 1.00 . A A . 61 GLY CA 1 1 1 892 1 1 61 GLY H H -14.271 8.337 -13.904 1.00 . A A . 61 GLY H 1 1 1 893 1 1 61 GLY HA2 H -12.287 7.837 -15.026 1.00 . A A . 61 GLY HA2 1 1 1 894 1 1 61 GLY HA3 H -12.301 9.448 -15.736 1.00 . A A . 61 GLY HA3 1 1 1 895 1 1 61 GLY N N -13.810 9.078 -14.348 1.00 . A A . 61 GLY N 1 1 1 896 1 1 61 GLY O O -10.226 9.341 -14.039 1.00 . A A . 61 GLY O 1 1 1 897 1 1 62 THR C C -11.600 9.815 -10.196 1.00 . A A . 62 THR C 1 1 1 898 1 1 62 THR CA C -11.043 10.224 -11.549 1.00 . A A . 62 THR CA 1 1 1 899 1 1 62 THR CB C -10.905 11.742 -11.612 1.00 . A A . 62 THR CB 1 1 1 900 1 1 62 THR CG2 C -10.367 12.143 -12.985 1.00 . A A . 62 THR CG2 1 1 1 901 1 1 62 THR H H -12.890 9.740 -12.473 1.00 . A A . 62 THR H 1 1 1 902 1 1 62 THR HA H -10.064 9.778 -11.667 1.00 . A A . 62 THR HA 1 1 1 903 1 1 62 THR HB H -10.220 12.075 -10.850 1.00 . A A . 62 THR HB 1 1 1 904 1 1 62 THR HG1 H -12.590 11.910 -10.652 1.00 . A A . 62 THR HG1 1 1 1 905 1 1 62 THR HG21 H -9.531 11.507 -13.242 1.00 . A A . 62 THR HG21 1 1 1 906 1 1 62 THR HG22 H -10.043 13.171 -12.958 1.00 . A A . 62 THR HG22 1 1 1 907 1 1 62 THR HG23 H -11.145 12.028 -13.725 1.00 . A A . 62 THR HG23 1 1 1 908 1 1 62 THR N N -11.922 9.761 -12.622 1.00 . A A . 62 THR N 1 1 1 909 1 1 62 THR O O -12.809 9.670 -10.037 1.00 . A A . 62 THR O 1 1 1 910 1 1 62 THR OG1 O -12.177 12.342 -11.404 1.00 . A A . 62 THR OG1 1 1 1 911 1 1 63 ILE C C -10.751 10.293 -6.849 1.00 . A A . 63 ILE C 1 1 1 912 1 1 63 ILE CA C -11.133 9.231 -7.870 1.00 . A A . 63 ILE CA 1 1 1 913 1 1 63 ILE CB C -10.477 7.893 -7.502 1.00 . A A . 63 ILE CB 1 1 1 914 1 1 63 ILE CD1 C -8.241 6.794 -7.261 1.00 . A A . 63 ILE CD1 1 1 1 915 1 1 63 ILE CG1 C -9.018 7.901 -7.975 1.00 . A A . 63 ILE CG1 1 1 1 916 1 1 63 ILE CG2 C -11.231 6.736 -8.172 1.00 . A A . 63 ILE CG2 1 1 1 917 1 1 63 ILE H H -9.756 9.762 -9.398 1.00 . A A . 63 ILE H 1 1 1 918 1 1 63 ILE HA H -12.206 9.110 -7.844 1.00 . A A . 63 ILE HA 1 1 1 919 1 1 63 ILE HB H -10.508 7.760 -6.429 1.00 . A A . 63 ILE HB 1 1 1 920 1 1 63 ILE HD11 H -7.195 6.872 -7.514 1.00 . A A . 63 ILE HD11 1 1 1 921 1 1 63 ILE HD12 H -8.617 5.832 -7.570 1.00 . A A . 63 ILE HD12 1 1 1 922 1 1 63 ILE HD13 H -8.360 6.902 -6.192 1.00 . A A . 63 ILE HD13 1 1 1 923 1 1 63 ILE HG12 H -8.986 7.730 -9.042 1.00 . A A . 63 ILE HG12 1 1 1 924 1 1 63 ILE HG13 H -8.571 8.853 -7.749 1.00 . A A . 63 ILE HG13 1 1 1 925 1 1 63 ILE HG21 H -10.591 5.864 -8.216 1.00 . A A . 63 ILE HG21 1 1 1 926 1 1 63 ILE HG22 H -11.520 7.022 -9.172 1.00 . A A . 63 ILE HG22 1 1 1 927 1 1 63 ILE HG23 H -12.113 6.501 -7.596 1.00 . A A . 63 ILE HG23 1 1 1 928 1 1 63 ILE N N -10.713 9.631 -9.216 1.00 . A A . 63 ILE N 1 1 1 929 1 1 63 ILE O O -9.598 10.718 -6.775 1.00 . A A . 63 ILE O 1 1 1 930 1 1 64 ASP C C -11.023 11.077 -3.743 1.00 . A A . 64 ASP C 1 1 1 931 1 1 64 ASP CA C -11.493 11.734 -5.043 1.00 . A A . 64 ASP CA 1 1 1 932 1 1 64 ASP CB C -12.770 12.542 -4.804 1.00 . A A . 64 ASP CB 1 1 1 933 1 1 64 ASP CG C -13.229 13.189 -6.100 1.00 . A A . 64 ASP CG 1 1 1 934 1 1 64 ASP H H -12.632 10.346 -6.168 1.00 . A A . 64 ASP H 1 1 1 935 1 1 64 ASP HA H -10.719 12.405 -5.391 1.00 . A A . 64 ASP HA 1 1 1 936 1 1 64 ASP HB2 H -13.551 11.892 -4.437 1.00 . A A . 64 ASP HB2 1 1 1 937 1 1 64 ASP HB3 H -12.571 13.317 -4.080 1.00 . A A . 64 ASP HB3 1 1 1 938 1 1 64 ASP N N -11.732 10.719 -6.061 1.00 . A A . 64 ASP N 1 1 1 939 1 1 64 ASP O O -11.036 9.851 -3.616 1.00 . A A . 64 ASP O 1 1 1 940 1 1 64 ASP OD1 O -12.388 13.421 -6.953 1.00 . A A . 64 ASP OD1 1 1 1 941 1 1 64 ASP OD2 O -14.414 13.445 -6.222 1.00 . A A . 64 ASP OD2 1 1 1 942 1 1 65 PHE C C -11.091 10.296 -0.977 1.00 . A A . 65 PHE C 1 1 1 943 1 1 65 PHE CA C -10.129 11.377 -1.499 1.00 . A A . 65 PHE CA 1 1 1 944 1 1 65 PHE CB C -9.949 12.528 -0.480 1.00 . A A . 65 PHE CB 1 1 1 945 1 1 65 PHE CD1 C -8.838 11.136 1.275 1.00 . A A . 65 PHE CD1 1 1 1 946 1 1 65 PHE CD2 C -10.918 12.241 1.845 1.00 . A A . 65 PHE CD2 1 1 1 947 1 1 65 PHE CE1 C -8.770 10.596 2.560 1.00 . A A . 65 PHE CE1 1 1 1 948 1 1 65 PHE CE2 C -10.852 11.699 3.135 1.00 . A A . 65 PHE CE2 1 1 1 949 1 1 65 PHE CG C -9.904 11.958 0.917 1.00 . A A . 65 PHE CG 1 1 1 950 1 1 65 PHE CZ C -9.775 10.878 3.493 1.00 . A A . 65 PHE CZ 1 1 1 951 1 1 65 PHE H H -10.619 12.865 -2.937 1.00 . A A . 65 PHE H 1 1 1 952 1 1 65 PHE HA H -9.163 10.916 -1.658 1.00 . A A . 65 PHE HA 1 1 1 953 1 1 65 PHE HB2 H -9.016 13.042 -0.681 1.00 . A A . 65 PHE HB2 1 1 1 954 1 1 65 PHE HB3 H -10.754 13.234 -0.560 1.00 . A A . 65 PHE HB3 1 1 1 955 1 1 65 PHE HD1 H -8.064 10.918 0.557 1.00 . A A . 65 PHE HD1 1 1 1 956 1 1 65 PHE HD2 H -11.750 12.872 1.567 1.00 . A A . 65 PHE HD2 1 1 1 957 1 1 65 PHE HE1 H -7.942 9.959 2.833 1.00 . A A . 65 PHE HE1 1 1 1 958 1 1 65 PHE HE2 H -11.629 11.916 3.855 1.00 . A A . 65 PHE HE2 1 1 1 959 1 1 65 PHE HZ H -9.721 10.461 4.487 1.00 . A A . 65 PHE HZ 1 1 1 960 1 1 65 PHE N N -10.604 11.899 -2.782 1.00 . A A . 65 PHE N 1 1 1 961 1 1 65 PHE O O -10.673 9.173 -0.675 1.00 . A A . 65 PHE O 1 1 1 962 1 1 66 PRO C C -13.293 8.288 -1.191 1.00 . A A . 66 PRO C 1 1 1 963 1 1 66 PRO CA C -13.369 9.612 -0.405 1.00 . A A . 66 PRO CA 1 1 1 964 1 1 66 PRO CB C -14.710 10.333 -0.670 1.00 . A A . 66 PRO CB 1 1 1 965 1 1 66 PRO CD C -12.966 11.893 -1.206 1.00 . A A . 66 PRO CD 1 1 1 966 1 1 66 PRO CG C -14.389 11.789 -0.697 1.00 . A A . 66 PRO CG 1 1 1 967 1 1 66 PRO HA H -13.250 9.434 0.651 1.00 . A A . 66 PRO HA 1 1 1 968 1 1 66 PRO HB2 H -15.118 10.029 -1.626 1.00 . A A . 66 PRO HB2 1 1 1 969 1 1 66 PRO HB3 H -15.414 10.126 0.119 1.00 . A A . 66 PRO HB3 1 1 1 970 1 1 66 PRO HD2 H -12.952 12.058 -2.266 1.00 . A A . 66 PRO HD2 1 1 1 971 1 1 66 PRO HD3 H -12.479 12.680 -0.692 1.00 . A A . 66 PRO HD3 1 1 1 972 1 1 66 PRO HG2 H -15.062 12.319 -1.362 1.00 . A A . 66 PRO HG2 1 1 1 973 1 1 66 PRO HG3 H -14.449 12.207 0.300 1.00 . A A . 66 PRO HG3 1 1 1 974 1 1 66 PRO N N -12.357 10.596 -0.880 1.00 . A A . 66 PRO N 1 1 1 975 1 1 66 PRO O O -13.302 7.186 -0.617 1.00 . A A . 66 PRO O 1 1 1 976 1 1 67 GLU C C -11.890 6.422 -3.048 1.00 . A A . 67 GLU C 1 1 1 977 1 1 67 GLU CA C -13.149 7.226 -3.364 1.00 . A A . 67 GLU CA 1 1 1 978 1 1 67 GLU CB C -13.158 7.636 -4.837 1.00 . A A . 67 GLU CB 1 1 1 979 1 1 67 GLU CD C -14.577 8.616 -6.647 1.00 . A A . 67 GLU CD 1 1 1 980 1 1 67 GLU CG C -14.445 8.405 -5.147 1.00 . A A . 67 GLU CG 1 1 1 981 1 1 67 GLU H H -13.205 9.296 -2.919 1.00 . A A . 67 GLU H 1 1 1 982 1 1 67 GLU HA H -14.018 6.612 -3.167 1.00 . A A . 67 GLU HA 1 1 1 983 1 1 67 GLU HB2 H -12.306 8.268 -5.039 1.00 . A A . 67 GLU HB2 1 1 1 984 1 1 67 GLU HB3 H -13.110 6.757 -5.457 1.00 . A A . 67 GLU HB3 1 1 1 985 1 1 67 GLU HG2 H -15.296 7.844 -4.787 1.00 . A A . 67 GLU HG2 1 1 1 986 1 1 67 GLU HG3 H -14.416 9.365 -4.653 1.00 . A A . 67 GLU HG3 1 1 1 987 1 1 67 GLU N N -13.215 8.405 -2.512 1.00 . A A . 67 GLU N 1 1 1 988 1 1 67 GLU O O -11.893 5.192 -3.103 1.00 . A A . 67 GLU O 1 1 1 989 1 1 67 GLU OE1 O -14.054 7.799 -7.385 1.00 . A A . 67 GLU OE1 1 1 1 990 1 1 67 GLU OE2 O -15.190 9.597 -7.033 1.00 . A A . 67 GLU OE2 1 1 1 991 1 1 68 PHE C C -9.801 5.506 -1.200 1.00 . A A . 68 PHE C 1 1 1 992 1 1 68 PHE CA C -9.567 6.457 -2.371 1.00 . A A . 68 PHE CA 1 1 1 993 1 1 68 PHE CB C -8.502 7.494 -2.008 1.00 . A A . 68 PHE CB 1 1 1 994 1 1 68 PHE CD1 C -6.471 6.365 -2.967 1.00 . A A . 68 PHE CD1 1 1 1 995 1 1 68 PHE CD2 C -6.633 6.628 -0.562 1.00 . A A . 68 PHE CD2 1 1 1 996 1 1 68 PHE CE1 C -5.232 5.734 -2.813 1.00 . A A . 68 PHE CE1 1 1 1 997 1 1 68 PHE CE2 C -5.395 5.997 -0.408 1.00 . A A . 68 PHE CE2 1 1 1 998 1 1 68 PHE CG C -7.170 6.812 -1.840 1.00 . A A . 68 PHE CG 1 1 1 999 1 1 68 PHE CZ C -4.695 5.550 -1.533 1.00 . A A . 68 PHE CZ 1 1 1 1000 1 1 68 PHE H H -10.873 8.100 -2.663 1.00 . A A . 68 PHE H 1 1 1 1001 1 1 68 PHE HA H -9.234 5.886 -3.226 1.00 . A A . 68 PHE HA 1 1 1 1002 1 1 68 PHE HB2 H -8.436 8.228 -2.795 1.00 . A A . 68 PHE HB2 1 1 1 1003 1 1 68 PHE HB3 H -8.773 7.980 -1.085 1.00 . A A . 68 PHE HB3 1 1 1 1004 1 1 68 PHE HD1 H -6.885 6.507 -3.954 1.00 . A A . 68 PHE HD1 1 1 1 1005 1 1 68 PHE HD2 H -7.173 6.976 0.307 1.00 . A A . 68 PHE HD2 1 1 1 1006 1 1 68 PHE HE1 H -4.690 5.388 -3.681 1.00 . A A . 68 PHE HE1 1 1 1 1007 1 1 68 PHE HE2 H -4.981 5.856 0.579 1.00 . A A . 68 PHE HE2 1 1 1 1008 1 1 68 PHE HZ H -3.742 5.061 -1.414 1.00 . A A . 68 PHE HZ 1 1 1 1009 1 1 68 PHE N N -10.817 7.124 -2.702 1.00 . A A . 68 PHE N 1 1 1 1010 1 1 68 PHE O O -9.357 4.356 -1.218 1.00 . A A . 68 PHE O 1 1 1 1011 1 1 69 LEU C C -11.525 3.928 0.575 1.00 . A A . 69 LEU C 1 1 1 1012 1 1 69 LEU CA C -10.784 5.188 0.999 1.00 . A A . 69 LEU CA 1 1 1 1013 1 1 69 LEU CB C -11.654 5.977 1.981 1.00 . A A . 69 LEU CB 1 1 1 1014 1 1 69 LEU CD1 C -11.977 8.193 3.100 1.00 . A A . 69 LEU CD1 1 1 1 1015 1 1 69 LEU CD2 C -9.682 7.224 2.898 1.00 . A A . 69 LEU CD2 1 1 1 1016 1 1 69 LEU CG C -11.044 7.364 2.215 1.00 . A A . 69 LEU CG 1 1 1 1017 1 1 69 LEU H H -10.800 6.934 -0.208 1.00 . A A . 69 LEU H 1 1 1 1018 1 1 69 LEU HA H -9.863 4.906 1.477 1.00 . A A . 69 LEU HA 1 1 1 1019 1 1 69 LEU HB2 H -12.648 6.083 1.573 1.00 . A A . 69 LEU HB2 1 1 1 1020 1 1 69 LEU HB3 H -11.706 5.446 2.921 1.00 . A A . 69 LEU HB3 1 1 1 1021 1 1 69 LEU HD11 H -12.999 8.053 2.779 1.00 . A A . 69 LEU HD11 1 1 1 1022 1 1 69 LEU HD12 H -11.716 9.236 3.013 1.00 . A A . 69 LEU HD12 1 1 1 1023 1 1 69 LEU HD13 H -11.876 7.881 4.129 1.00 . A A . 69 LEU HD13 1 1 1 1024 1 1 69 LEU HD21 H -9.756 6.505 3.699 1.00 . A A . 69 LEU HD21 1 1 1 1025 1 1 69 LEU HD22 H -9.380 8.179 3.300 1.00 . A A . 69 LEU HD22 1 1 1 1026 1 1 69 LEU HD23 H -8.949 6.891 2.178 1.00 . A A . 69 LEU HD23 1 1 1 1027 1 1 69 LEU HG H -10.921 7.866 1.267 1.00 . A A . 69 LEU HG 1 1 1 1028 1 1 69 LEU N N -10.499 5.999 -0.181 1.00 . A A . 69 LEU N 1 1 1 1029 1 1 69 LEU O O -11.356 2.862 1.172 1.00 . A A . 69 LEU O 1 1 1 1030 1 1 70 THR C C -12.141 1.829 -1.504 1.00 . A A . 70 THR C 1 1 1 1031 1 1 70 THR CA C -13.094 2.903 -0.968 1.00 . A A . 70 THR CA 1 1 1 1032 1 1 70 THR CB C -14.042 3.335 -2.085 1.00 . A A . 70 THR CB 1 1 1 1033 1 1 70 THR CG2 C -15.057 2.223 -2.360 1.00 . A A . 70 THR CG2 1 1 1 1034 1 1 70 THR H H -12.430 4.934 -0.907 1.00 . A A . 70 THR H 1 1 1 1035 1 1 70 THR HA H -13.673 2.485 -0.160 1.00 . A A . 70 THR HA 1 1 1 1036 1 1 70 THR HB H -13.478 3.527 -2.982 1.00 . A A . 70 THR HB 1 1 1 1037 1 1 70 THR HG1 H -14.149 5.258 -1.854 1.00 . A A . 70 THR HG1 1 1 1 1038 1 1 70 THR HG21 H -14.540 1.342 -2.708 1.00 . A A . 70 THR HG21 1 1 1 1039 1 1 70 THR HG22 H -15.752 2.555 -3.116 1.00 . A A . 70 THR HG22 1 1 1 1040 1 1 70 THR HG23 H -15.594 1.993 -1.452 1.00 . A A . 70 THR HG23 1 1 1 1041 1 1 70 THR N N -12.343 4.055 -0.467 1.00 . A A . 70 THR N 1 1 1 1042 1 1 70 THR O O -12.264 0.656 -1.167 1.00 . A A . 70 THR O 1 1 1 1043 1 1 70 THR OG1 O -14.726 4.511 -1.687 1.00 . A A . 70 THR OG1 1 1 1 1044 1 1 71 MET C C -9.492 0.528 -1.809 1.00 . A A . 71 MET C 1 1 1 1045 1 1 71 MET CA C -10.230 1.288 -2.918 1.00 . A A . 71 MET CA 1 1 1 1046 1 1 71 MET CB C -9.214 2.055 -3.767 1.00 . A A . 71 MET CB 1 1 1 1047 1 1 71 MET CE C -5.836 1.525 -3.846 1.00 . A A . 71 MET CE 1 1 1 1048 1 1 71 MET CG C -8.404 1.068 -4.607 1.00 . A A . 71 MET CG 1 1 1 1049 1 1 71 MET H H -11.130 3.190 -2.579 1.00 . A A . 71 MET H 1 1 1 1050 1 1 71 MET HA H -10.738 0.581 -3.555 1.00 . A A . 71 MET HA 1 1 1 1051 1 1 71 MET HB2 H -9.738 2.739 -4.423 1.00 . A A . 71 MET HB2 1 1 1 1052 1 1 71 MET HB3 H -8.548 2.612 -3.126 1.00 . A A . 71 MET HB3 1 1 1 1053 1 1 71 MET HE1 H -6.422 1.402 -2.944 1.00 . A A . 71 MET HE1 1 1 1 1054 1 1 71 MET HE2 H -5.136 2.332 -3.707 1.00 . A A . 71 MET HE2 1 1 1 1055 1 1 71 MET HE3 H -5.294 0.617 -4.055 1.00 . A A . 71 MET HE3 1 1 1 1056 1 1 71 MET HG2 H -8.114 0.225 -3.999 1.00 . A A . 71 MET HG2 1 1 1 1057 1 1 71 MET HG3 H -9.007 0.723 -5.435 1.00 . A A . 71 MET HG3 1 1 1 1058 1 1 71 MET N N -11.189 2.238 -2.341 1.00 . A A . 71 MET N 1 1 1 1059 1 1 71 MET O O -9.439 -0.717 -1.796 1.00 . A A . 71 MET O 1 1 1 1060 1 1 71 MET SD S -6.929 1.899 -5.243 1.00 . A A . 71 MET SD 1 1 1 1061 1 1 72 MET C C -9.130 -0.125 1.122 1.00 . A A . 72 MET C 1 1 1 1062 1 1 72 MET CA C -8.194 0.674 0.225 1.00 . A A . 72 MET CA 1 1 1 1063 1 1 72 MET CB C -7.499 1.762 1.047 1.00 . A A . 72 MET CB 1 1 1 1064 1 1 72 MET CE C -4.802 0.063 -0.269 1.00 . A A . 72 MET CE 1 1 1 1065 1 1 72 MET CG C -6.285 2.326 0.277 1.00 . A A . 72 MET CG 1 1 1 1066 1 1 72 MET H H -9.003 2.256 -0.924 1.00 . A A . 72 MET H 1 1 1 1067 1 1 72 MET HA H -7.446 0.013 -0.179 1.00 . A A . 72 MET HA 1 1 1 1068 1 1 72 MET HB2 H -8.202 2.558 1.254 1.00 . A A . 72 MET HB2 1 1 1 1069 1 1 72 MET HB3 H -7.161 1.335 1.975 1.00 . A A . 72 MET HB3 1 1 1 1070 1 1 72 MET HE1 H -5.331 0.302 -1.175 1.00 . A A . 72 MET HE1 1 1 1 1071 1 1 72 MET HE2 H -5.294 -0.756 0.229 1.00 . A A . 72 MET HE2 1 1 1 1072 1 1 72 MET HE3 H -3.788 -0.228 -0.509 1.00 . A A . 72 MET HE3 1 1 1 1073 1 1 72 MET HG2 H -6.418 2.177 -0.781 1.00 . A A . 72 MET HG2 1 1 1 1074 1 1 72 MET HG3 H -6.201 3.389 0.470 1.00 . A A . 72 MET HG3 1 1 1 1075 1 1 72 MET N N -8.927 1.280 -0.874 1.00 . A A . 72 MET N 1 1 1 1076 1 1 72 MET O O -8.748 -1.161 1.662 1.00 . A A . 72 MET O 1 1 1 1077 1 1 72 MET SD S -4.761 1.508 0.829 1.00 . A A . 72 MET SD 1 1 1 1078 1 1 73 ALA C C -11.735 -1.651 1.501 1.00 . A A . 73 ALA C 1 1 1 1079 1 1 73 ALA CA C -11.333 -0.314 2.113 1.00 . A A . 73 ALA CA 1 1 1 1080 1 1 73 ALA CB C -12.571 0.563 2.277 1.00 . A A . 73 ALA CB 1 1 1 1081 1 1 73 ALA H H -10.604 1.193 0.818 1.00 . A A . 73 ALA H 1 1 1 1082 1 1 73 ALA HA H -10.900 -0.486 3.085 1.00 . A A . 73 ALA HA 1 1 1 1083 1 1 73 ALA HB1 H -12.948 0.836 1.305 1.00 . A A . 73 ALA HB1 1 1 1 1084 1 1 73 ALA HB2 H -12.309 1.457 2.825 1.00 . A A . 73 ALA HB2 1 1 1 1085 1 1 73 ALA HB3 H -13.330 0.017 2.818 1.00 . A A . 73 ALA HB3 1 1 1 1086 1 1 73 ALA N N -10.355 0.362 1.275 1.00 . A A . 73 ALA N 1 1 1 1087 1 1 73 ALA O O -11.980 -2.624 2.216 1.00 . A A . 73 ALA O 1 1 1 1088 1 1 74 ARG C C -11.169 -4.025 -0.216 1.00 . A A . 74 ARG C 1 1 1 1089 1 1 74 ARG CA C -12.167 -2.924 -0.521 1.00 . A A . 74 ARG CA 1 1 1 1090 1 1 74 ARG CB C -12.210 -2.672 -2.034 1.00 . A A . 74 ARG CB 1 1 1 1091 1 1 74 ARG CD C -13.433 -1.483 -3.857 1.00 . A A . 74 ARG CD 1 1 1 1092 1 1 74 ARG CG C -13.500 -1.936 -2.399 1.00 . A A . 74 ARG CG 1 1 1 1093 1 1 74 ARG CZ C -14.405 -3.293 -5.159 1.00 . A A . 74 ARG CZ 1 1 1 1094 1 1 74 ARG H H -11.585 -0.893 -0.348 1.00 . A A . 74 ARG H 1 1 1 1095 1 1 74 ARG HA H -13.146 -3.236 -0.189 1.00 . A A . 74 ARG HA 1 1 1 1096 1 1 74 ARG HB2 H -11.361 -2.069 -2.318 1.00 . A A . 74 ARG HB2 1 1 1 1097 1 1 74 ARG HB3 H -12.175 -3.614 -2.563 1.00 . A A . 74 ARG HB3 1 1 1 1098 1 1 74 ARG HD2 H -14.326 -0.928 -4.100 1.00 . A A . 74 ARG HD2 1 1 1 1099 1 1 74 ARG HD3 H -12.571 -0.846 -3.992 1.00 . A A . 74 ARG HD3 1 1 1 1100 1 1 74 ARG HE H -12.439 -2.942 -5.031 1.00 . A A . 74 ARG HE 1 1 1 1101 1 1 74 ARG HG2 H -14.338 -2.606 -2.271 1.00 . A A . 74 ARG HG2 1 1 1 1102 1 1 74 ARG HG3 H -13.626 -1.081 -1.760 1.00 . A A . 74 ARG HG3 1 1 1 1103 1 1 74 ARG HH11 H -15.685 -2.115 -4.170 1.00 . A A . 74 ARG HH11 1 1 1 1104 1 1 74 ARG HH12 H -16.402 -3.392 -5.093 1.00 . A A . 74 ARG HH12 1 1 1 1105 1 1 74 ARG HH21 H -13.369 -4.620 -6.243 1.00 . A A . 74 ARG HH21 1 1 1 1106 1 1 74 ARG HH22 H -15.091 -4.812 -6.267 1.00 . A A . 74 ARG HH22 1 1 1 1107 1 1 74 ARG N N -11.796 -1.696 0.172 1.00 . A A . 74 ARG N 1 1 1 1108 1 1 74 ARG NE N -13.325 -2.641 -4.740 1.00 . A A . 74 ARG NE 1 1 1 1109 1 1 74 ARG NH1 N -15.590 -2.903 -4.778 1.00 . A A . 74 ARG NH1 1 1 1 1110 1 1 74 ARG NH2 N -14.278 -4.322 -5.952 1.00 . A A . 74 ARG NH2 1 1 1 1111 1 1 74 ARG O O -11.552 -5.153 0.091 1.00 . A A . 74 ARG O 1 1 1 1112 1 1 75 LYS C C -8.699 -4.910 1.485 1.00 . A A . 75 LYS C 1 1 1 1113 1 1 75 LYS CA C -8.856 -4.689 -0.014 1.00 . A A . 75 LYS CA 1 1 1 1114 1 1 75 LYS CB C -7.518 -4.238 -0.604 1.00 . A A . 75 LYS CB 1 1 1 1115 1 1 75 LYS CD C -6.767 -6.637 -0.626 1.00 . A A . 75 LYS CD 1 1 1 1116 1 1 75 LYS CE C -5.518 -7.503 -0.687 1.00 . A A . 75 LYS CE 1 1 1 1117 1 1 75 LYS CG C -6.395 -5.212 -0.196 1.00 . A A . 75 LYS CG 1 1 1 1118 1 1 75 LYS H H -9.634 -2.774 -0.551 1.00 . A A . 75 LYS H 1 1 1 1119 1 1 75 LYS HA H -9.140 -5.620 -0.477 1.00 . A A . 75 LYS HA 1 1 1 1120 1 1 75 LYS HB2 H -7.597 -4.217 -1.680 1.00 . A A . 75 LYS HB2 1 1 1 1121 1 1 75 LYS HB3 H -7.282 -3.249 -0.243 1.00 . A A . 75 LYS HB3 1 1 1 1122 1 1 75 LYS HD2 H -7.450 -7.062 0.095 1.00 . A A . 75 LYS HD2 1 1 1 1123 1 1 75 LYS HD3 H -7.235 -6.612 -1.591 1.00 . A A . 75 LYS HD3 1 1 1 1124 1 1 75 LYS HE2 H -4.821 -7.070 -1.380 1.00 . A A . 75 LYS HE2 1 1 1 1125 1 1 75 LYS HE3 H -5.072 -7.555 0.291 1.00 . A A . 75 LYS HE3 1 1 1 1126 1 1 75 LYS HG2 H -5.475 -4.917 -0.676 1.00 . A A . 75 LYS HG2 1 1 1 1127 1 1 75 LYS HG3 H -6.255 -5.185 0.875 1.00 . A A . 75 LYS HG3 1 1 1 1128 1 1 75 LYS HZ1 H -6.793 -8.839 -1.646 1.00 . A A . 75 LYS HZ1 1 1 1 1129 1 1 75 LYS HZ2 H -5.966 -9.497 -0.315 1.00 . A A . 75 LYS HZ2 1 1 1 1130 1 1 75 LYS HZ3 H -5.148 -9.231 -1.780 1.00 . A A . 75 LYS HZ3 1 1 1 1131 1 1 75 LYS N N -9.889 -3.696 -0.298 1.00 . A A . 75 LYS N 1 1 1 1132 1 1 75 LYS NZ N -5.885 -8.871 -1.142 1.00 . A A . 75 LYS NZ 1 1 1 1133 1 1 75 LYS O O -8.397 -6.015 1.939 1.00 . A A . 75 LYS O 1 1 1 1134 1 1 76 MET C C -9.729 -4.917 4.272 1.00 . A A . 76 MET C 1 1 1 1135 1 1 76 MET CA C -8.729 -3.933 3.686 1.00 . A A . 76 MET CA 1 1 1 1136 1 1 76 MET CB C -8.915 -2.558 4.321 1.00 . A A . 76 MET CB 1 1 1 1137 1 1 76 MET CE C -6.060 -1.620 5.581 1.00 . A A . 76 MET CE 1 1 1 1138 1 1 76 MET CG C -8.592 -2.620 5.819 1.00 . A A . 76 MET CG 1 1 1 1139 1 1 76 MET H H -9.119 -2.996 1.830 1.00 . A A . 76 MET H 1 1 1 1140 1 1 76 MET HA H -7.732 -4.281 3.892 1.00 . A A . 76 MET HA 1 1 1 1141 1 1 76 MET HB2 H -8.268 -1.845 3.839 1.00 . A A . 76 MET HB2 1 1 1 1142 1 1 76 MET HB3 H -9.940 -2.251 4.198 1.00 . A A . 76 MET HB3 1 1 1 1143 1 1 76 MET HE1 H -6.541 -0.789 6.078 1.00 . A A . 76 MET HE1 1 1 1 1144 1 1 76 MET HE2 H -6.134 -1.494 4.511 1.00 . A A . 76 MET HE2 1 1 1 1145 1 1 76 MET HE3 H -5.017 -1.659 5.863 1.00 . A A . 76 MET HE3 1 1 1 1146 1 1 76 MET HG2 H -8.724 -1.639 6.247 1.00 . A A . 76 MET HG2 1 1 1 1147 1 1 76 MET HG3 H -9.263 -3.314 6.302 1.00 . A A . 76 MET HG3 1 1 1 1148 1 1 76 MET N N -8.884 -3.851 2.246 1.00 . A A . 76 MET N 1 1 1 1149 1 1 76 MET O O -9.469 -5.563 5.285 1.00 . A A . 76 MET O 1 1 1 1150 1 1 76 MET SD S -6.876 -3.155 6.079 1.00 . A A . 76 MET SD 1 1 1 1151 1 1 77 LYS C C -11.437 -7.360 4.082 1.00 . A A . 77 LYS C 1 1 1 1152 1 1 77 LYS CA C -11.915 -5.913 4.134 1.00 . A A . 77 LYS CA 1 1 1 1153 1 1 77 LYS CB C -13.171 -5.771 3.274 1.00 . A A . 77 LYS CB 1 1 1 1154 1 1 77 LYS CD C -14.726 -6.189 5.208 1.00 . A A . 77 LYS CD 1 1 1 1155 1 1 77 LYS CE C -16.129 -6.696 5.516 1.00 . A A . 77 LYS CE 1 1 1 1156 1 1 77 LYS CG C -14.296 -6.669 3.813 1.00 . A A . 77 LYS CG 1 1 1 1157 1 1 77 LYS H H -11.055 -4.461 2.850 1.00 . A A . 77 LYS H 1 1 1 1158 1 1 77 LYS HA H -12.149 -5.650 5.149 1.00 . A A . 77 LYS HA 1 1 1 1159 1 1 77 LYS HB2 H -13.499 -4.741 3.288 1.00 . A A . 77 LYS HB2 1 1 1 1160 1 1 77 LYS HB3 H -12.942 -6.060 2.259 1.00 . A A . 77 LYS HB3 1 1 1 1161 1 1 77 LYS HD2 H -14.046 -6.580 5.950 1.00 . A A . 77 LYS HD2 1 1 1 1162 1 1 77 LYS HD3 H -14.721 -5.110 5.244 1.00 . A A . 77 LYS HD3 1 1 1 1163 1 1 77 LYS HE2 H -16.147 -7.773 5.434 1.00 . A A . 77 LYS HE2 1 1 1 1164 1 1 77 LYS HE3 H -16.406 -6.404 6.517 1.00 . A A . 77 LYS HE3 1 1 1 1165 1 1 77 LYS HG2 H -15.139 -6.626 3.137 1.00 . A A . 77 LYS HG2 1 1 1 1166 1 1 77 LYS HG3 H -13.949 -7.690 3.880 1.00 . A A . 77 LYS HG3 1 1 1 1167 1 1 77 LYS HZ1 H -16.626 -5.317 4.039 1.00 . A A . 77 LYS HZ1 1 1 1 1168 1 1 77 LYS HZ2 H -17.923 -5.750 5.047 1.00 . A A . 77 LYS HZ2 1 1 1 1169 1 1 77 LYS HZ3 H -17.374 -6.827 3.854 1.00 . A A . 77 LYS HZ3 1 1 1 1170 1 1 77 LYS N N -10.887 -5.013 3.645 1.00 . A A . 77 LYS N 1 1 1 1171 1 1 77 LYS NZ N -17.085 -6.104 4.540 1.00 . A A . 77 LYS NZ 1 1 1 1172 1 1 77 LYS O O -11.570 -8.103 5.054 1.00 . A A . 77 LYS O 1 1 1 1173 1 1 78 ASP C C -8.905 -9.196 2.988 1.00 . A A . 78 ASP C 1 1 1 1174 1 1 78 ASP CA C -10.405 -9.128 2.758 1.00 . A A . 78 ASP CA 1 1 1 1175 1 1 78 ASP CB C -10.734 -9.623 1.349 1.00 . A A . 78 ASP CB 1 1 1 1176 1 1 78 ASP CG C -10.168 -8.661 0.311 1.00 . A A . 78 ASP CG 1 1 1 1177 1 1 78 ASP H H -10.816 -7.126 2.194 1.00 . A A . 78 ASP H 1 1 1 1178 1 1 78 ASP HA H -10.896 -9.779 3.473 1.00 . A A . 78 ASP HA 1 1 1 1179 1 1 78 ASP HB2 H -10.301 -10.601 1.204 1.00 . A A . 78 ASP HB2 1 1 1 1180 1 1 78 ASP HB3 H -11.806 -9.684 1.232 1.00 . A A . 78 ASP HB3 1 1 1 1181 1 1 78 ASP N N -10.890 -7.761 2.938 1.00 . A A . 78 ASP N 1 1 1 1182 1 1 78 ASP O O -8.221 -10.061 2.440 1.00 . A A . 78 ASP O 1 1 1 1183 1 1 78 ASP OD1 O -9.661 -7.625 0.709 1.00 . A A . 78 ASP OD1 1 1 1 1184 1 1 78 ASP OD2 O -10.248 -8.976 -0.864 1.00 . A A . 78 ASP OD2 1 1 1 1185 1 1 79 THR C C -6.427 -9.643 4.315 1.00 . A A . 79 THR C 1 1 1 1186 1 1 79 THR CA C -6.964 -8.236 4.085 1.00 . A A . 79 THR CA 1 1 1 1187 1 1 79 THR CB C -6.701 -7.398 5.342 1.00 . A A . 79 THR CB 1 1 1 1188 1 1 79 THR CG2 C -5.197 -7.265 5.585 1.00 . A A . 79 THR CG2 1 1 1 1189 1 1 79 THR H H -8.984 -7.601 4.197 1.00 . A A . 79 THR H 1 1 1 1190 1 1 79 THR HA H -6.445 -7.788 3.251 1.00 . A A . 79 THR HA 1 1 1 1191 1 1 79 THR HB H -7.155 -7.878 6.195 1.00 . A A . 79 THR HB 1 1 1 1192 1 1 79 THR HG1 H -6.631 -5.581 4.676 1.00 . A A . 79 THR HG1 1 1 1 1193 1 1 79 THR HG21 H -4.744 -6.750 4.752 1.00 . A A . 79 THR HG21 1 1 1 1194 1 1 79 THR HG22 H -4.755 -8.245 5.691 1.00 . A A . 79 THR HG22 1 1 1 1195 1 1 79 THR HG23 H -5.031 -6.697 6.489 1.00 . A A . 79 THR HG23 1 1 1 1196 1 1 79 THR N N -8.393 -8.273 3.798 1.00 . A A . 79 THR N 1 1 1 1197 1 1 79 THR O O -6.632 -10.233 5.374 1.00 . A A . 79 THR O 1 1 1 1198 1 1 79 THR OG1 O -7.254 -6.109 5.178 1.00 . A A . 79 THR OG1 1 1 1 1199 1 1 80 ASP C C -3.655 -11.410 3.743 1.00 . A A . 80 ASP C 1 1 1 1200 1 1 80 ASP CA C -5.142 -11.508 3.414 1.00 . A A . 80 ASP CA 1 1 1 1201 1 1 80 ASP CB C -5.325 -12.251 2.090 1.00 . A A . 80 ASP CB 1 1 1 1202 1 1 80 ASP CG C -6.793 -12.616 1.904 1.00 . A A . 80 ASP CG 1 1 1 1203 1 1 80 ASP H H -5.588 -9.649 2.497 1.00 . A A . 80 ASP H 1 1 1 1204 1 1 80 ASP HA H -5.637 -12.064 4.197 1.00 . A A . 80 ASP HA 1 1 1 1205 1 1 80 ASP HB2 H -5.005 -11.616 1.276 1.00 . A A . 80 ASP HB2 1 1 1 1206 1 1 80 ASP HB3 H -4.730 -13.151 2.099 1.00 . A A . 80 ASP HB3 1 1 1 1207 1 1 80 ASP N N -5.727 -10.174 3.314 1.00 . A A . 80 ASP N 1 1 1 1208 1 1 80 ASP O O -2.802 -11.622 2.881 1.00 . A A . 80 ASP O 1 1 1 1209 1 1 80 ASP OD1 O -7.531 -12.533 2.872 1.00 . A A . 80 ASP OD1 1 1 1 1210 1 1 80 ASP OD2 O -7.158 -12.975 0.797 1.00 . A A . 80 ASP OD2 1 1 1 1211 1 1 81 SER C C -1.112 -12.092 4.849 1.00 . A A . 81 SER C 1 1 1 1212 1 1 81 SER CA C -1.957 -10.961 5.424 1.00 . A A . 81 SER CA 1 1 1 1213 1 1 81 SER CB C -1.881 -10.995 6.951 1.00 . A A . 81 SER CB 1 1 1 1214 1 1 81 SER H H -4.068 -10.923 5.640 1.00 . A A . 81 SER H 1 1 1 1215 1 1 81 SER HA H -1.566 -10.016 5.079 1.00 . A A . 81 SER HA 1 1 1 1216 1 1 81 SER HB2 H -0.872 -10.794 7.267 1.00 . A A . 81 SER HB2 1 1 1 1217 1 1 81 SER HB3 H -2.542 -10.241 7.361 1.00 . A A . 81 SER HB3 1 1 1 1218 1 1 81 SER HG H -1.560 -12.898 7.204 1.00 . A A . 81 SER HG 1 1 1 1219 1 1 81 SER N N -3.348 -11.089 4.996 1.00 . A A . 81 SER N 1 1 1 1220 1 1 81 SER O O 0.098 -11.950 4.671 1.00 . A A . 81 SER O 1 1 1 1221 1 1 81 SER OG O -2.268 -12.283 7.411 1.00 . A A . 81 SER OG 1 1 1 1222 1 1 82 GLU C C -0.495 -14.046 2.619 1.00 . A A . 82 GLU C 1 1 1 1223 1 1 82 GLU CA C -1.050 -14.363 4.005 1.00 . A A . 82 GLU CA 1 1 1 1224 1 1 82 GLU CB C -2.004 -15.559 3.908 1.00 . A A . 82 GLU CB 1 1 1 1225 1 1 82 GLU CD C -2.160 -18.006 3.398 1.00 . A A . 82 GLU CD 1 1 1 1226 1 1 82 GLU CG C -1.234 -16.794 3.434 1.00 . A A . 82 GLU CG 1 1 1 1227 1 1 82 GLU H H -2.724 -13.272 4.712 1.00 . A A . 82 GLU H 1 1 1 1228 1 1 82 GLU HA H -0.235 -14.621 4.663 1.00 . A A . 82 GLU HA 1 1 1 1229 1 1 82 GLU HB2 H -2.438 -15.754 4.879 1.00 . A A . 82 GLU HB2 1 1 1 1230 1 1 82 GLU HB3 H -2.789 -15.335 3.201 1.00 . A A . 82 GLU HB3 1 1 1 1231 1 1 82 GLU HG2 H -0.842 -16.615 2.444 1.00 . A A . 82 GLU HG2 1 1 1 1232 1 1 82 GLU HG3 H -0.419 -16.990 4.113 1.00 . A A . 82 GLU HG3 1 1 1 1233 1 1 82 GLU N N -1.758 -13.214 4.554 1.00 . A A . 82 GLU N 1 1 1 1234 1 1 82 GLU O O 0.721 -13.916 2.439 1.00 . A A . 82 GLU O 1 1 1 1235 1 1 82 GLU OE1 O -3.360 -17.814 3.505 1.00 . A A . 82 GLU OE1 1 1 1 1236 1 1 82 GLU OE2 O -1.655 -19.108 3.261 1.00 . A A . 82 GLU OE2 1 1 1 1237 1 1 83 GLU C C -0.416 -12.205 0.186 1.00 . A A . 83 GLU C 1 1 1 1238 1 1 83 GLU CA C -0.964 -13.623 0.280 1.00 . A A . 83 GLU CA 1 1 1 1239 1 1 83 GLU CB C -2.146 -13.785 -0.674 1.00 . A A . 83 GLU CB 1 1 1 1240 1 1 83 GLU CD C -3.784 -15.418 -1.624 1.00 . A A . 83 GLU CD 1 1 1 1241 1 1 83 GLU CG C -2.552 -15.257 -0.739 1.00 . A A . 83 GLU CG 1 1 1 1242 1 1 83 GLU H H -2.338 -14.030 1.833 1.00 . A A . 83 GLU H 1 1 1 1243 1 1 83 GLU HA H -0.187 -14.317 -0.006 1.00 . A A . 83 GLU HA 1 1 1 1244 1 1 83 GLU HB2 H -2.979 -13.195 -0.320 1.00 . A A . 83 GLU HB2 1 1 1 1245 1 1 83 GLU HB3 H -1.862 -13.452 -1.657 1.00 . A A . 83 GLU HB3 1 1 1 1246 1 1 83 GLU HG2 H -1.738 -15.834 -1.149 1.00 . A A . 83 GLU HG2 1 1 1 1247 1 1 83 GLU HG3 H -2.779 -15.611 0.256 1.00 . A A . 83 GLU HG3 1 1 1 1248 1 1 83 GLU N N -1.384 -13.922 1.642 1.00 . A A . 83 GLU N 1 1 1 1249 1 1 83 GLU O O 0.593 -11.960 -0.477 1.00 . A A . 83 GLU O 1 1 1 1250 1 1 83 GLU OE1 O -4.246 -14.418 -2.151 1.00 . A A . 83 GLU OE1 1 1 1 1251 1 1 83 GLU OE2 O -4.246 -16.538 -1.765 1.00 . A A . 83 GLU OE2 1 1 1 1252 1 1 84 GLU C C 0.819 -9.760 1.103 1.00 . A A . 84 GLU C 1 1 1 1253 1 1 84 GLU CA C -0.668 -9.878 0.809 1.00 . A A . 84 GLU CA 1 1 1 1254 1 1 84 GLU CB C -1.443 -9.075 1.852 1.00 . A A . 84 GLU CB 1 1 1 1255 1 1 84 GLU CD C -3.647 -8.059 2.432 1.00 . A A . 84 GLU CD 1 1 1 1256 1 1 84 GLU CG C -2.906 -8.944 1.431 1.00 . A A . 84 GLU CG 1 1 1 1257 1 1 84 GLU H H -1.899 -11.516 1.340 1.00 . A A . 84 GLU H 1 1 1 1258 1 1 84 GLU HA H -0.871 -9.468 -0.169 1.00 . A A . 84 GLU HA 1 1 1 1259 1 1 84 GLU HB2 H -1.390 -9.585 2.801 1.00 . A A . 84 GLU HB2 1 1 1 1260 1 1 84 GLU HB3 H -1.008 -8.095 1.948 1.00 . A A . 84 GLU HB3 1 1 1 1261 1 1 84 GLU HG2 H -2.954 -8.503 0.448 1.00 . A A . 84 GLU HG2 1 1 1 1262 1 1 84 GLU HG3 H -3.363 -9.919 1.408 1.00 . A A . 84 GLU HG3 1 1 1 1263 1 1 84 GLU N N -1.093 -11.269 0.841 1.00 . A A . 84 GLU N 1 1 1 1264 1 1 84 GLU O O 1.568 -9.180 0.319 1.00 . A A . 84 GLU O 1 1 1 1265 1 1 84 GLU OE1 O -4.025 -8.567 3.471 1.00 . A A . 84 GLU OE1 1 1 1 1266 1 1 84 GLU OE2 O -3.824 -6.887 2.144 1.00 . A A . 84 GLU OE2 1 1 1 1267 1 1 85 ILE C C 3.503 -11.009 1.608 1.00 . A A . 85 ILE C 1 1 1 1268 1 1 85 ILE CA C 2.646 -10.251 2.613 1.00 . A A . 85 ILE CA 1 1 1 1269 1 1 85 ILE CB C 2.840 -10.857 4.002 1.00 . A A . 85 ILE CB 1 1 1 1270 1 1 85 ILE CD1 C 2.137 -10.683 6.392 1.00 . A A . 85 ILE CD1 1 1 1 1271 1 1 85 ILE CG1 C 2.119 -9.986 5.031 1.00 . A A . 85 ILE CG1 1 1 1 1272 1 1 85 ILE CG2 C 4.339 -10.907 4.340 1.00 . A A . 85 ILE CG2 1 1 1 1273 1 1 85 ILE H H 0.602 -10.761 2.828 1.00 . A A . 85 ILE H 1 1 1 1274 1 1 85 ILE HA H 2.961 -9.216 2.633 1.00 . A A . 85 ILE HA 1 1 1 1275 1 1 85 ILE HB H 2.432 -11.856 4.019 1.00 . A A . 85 ILE HB 1 1 1 1276 1 1 85 ILE HD11 H 3.146 -10.686 6.774 1.00 . A A . 85 ILE HD11 1 1 1 1277 1 1 85 ILE HD12 H 1.793 -11.701 6.281 1.00 . A A . 85 ILE HD12 1 1 1 1278 1 1 85 ILE HD13 H 1.492 -10.155 7.078 1.00 . A A . 85 ILE HD13 1 1 1 1279 1 1 85 ILE HG12 H 2.614 -9.033 5.104 1.00 . A A . 85 ILE HG12 1 1 1 1280 1 1 85 ILE HG13 H 1.095 -9.835 4.721 1.00 . A A . 85 ILE HG13 1 1 1 1281 1 1 85 ILE HG21 H 4.785 -9.945 4.135 1.00 . A A . 85 ILE HG21 1 1 1 1282 1 1 85 ILE HG22 H 4.822 -11.663 3.738 1.00 . A A . 85 ILE HG22 1 1 1 1283 1 1 85 ILE HG23 H 4.467 -11.146 5.383 1.00 . A A . 85 ILE HG23 1 1 1 1284 1 1 85 ILE N N 1.243 -10.310 2.235 1.00 . A A . 85 ILE N 1 1 1 1285 1 1 85 ILE O O 4.570 -10.548 1.227 1.00 . A A . 85 ILE O 1 1 1 1286 1 1 86 ARG C C 4.169 -12.186 -0.996 1.00 . A A . 86 ARG C 1 1 1 1287 1 1 86 ARG CA C 3.816 -12.987 0.255 1.00 . A A . 86 ARG CA 1 1 1 1288 1 1 86 ARG CB C 2.992 -14.214 -0.150 1.00 . A A . 86 ARG CB 1 1 1 1289 1 1 86 ARG CD C 2.987 -16.340 -1.470 1.00 . A A . 86 ARG CD 1 1 1 1290 1 1 86 ARG CG C 3.821 -15.124 -1.062 1.00 . A A . 86 ARG CG 1 1 1 1291 1 1 86 ARG CZ C 4.172 -17.047 -3.469 1.00 . A A . 86 ARG CZ 1 1 1 1292 1 1 86 ARG H H 2.186 -12.521 1.540 1.00 . A A . 86 ARG H 1 1 1 1293 1 1 86 ARG HA H 4.723 -13.319 0.734 1.00 . A A . 86 ARG HA 1 1 1 1294 1 1 86 ARG HB2 H 2.699 -14.759 0.734 1.00 . A A . 86 ARG HB2 1 1 1 1295 1 1 86 ARG HB3 H 2.108 -13.890 -0.681 1.00 . A A . 86 ARG HB3 1 1 1 1296 1 1 86 ARG HD2 H 2.599 -16.822 -0.586 1.00 . A A . 86 ARG HD2 1 1 1 1297 1 1 86 ARG HD3 H 2.165 -16.017 -2.091 1.00 . A A . 86 ARG HD3 1 1 1 1298 1 1 86 ARG HE H 4.109 -18.112 -1.774 1.00 . A A . 86 ARG HE 1 1 1 1299 1 1 86 ARG HG2 H 4.115 -14.582 -1.947 1.00 . A A . 86 ARG HG2 1 1 1 1300 1 1 86 ARG HG3 H 4.701 -15.457 -0.533 1.00 . A A . 86 ARG HG3 1 1 1 1301 1 1 86 ARG HH11 H 3.220 -15.289 -3.568 1.00 . A A . 86 ARG HH11 1 1 1 1302 1 1 86 ARG HH12 H 4.056 -15.770 -5.006 1.00 . A A . 86 ARG HH12 1 1 1 1303 1 1 86 ARG HH21 H 5.209 -18.750 -3.658 1.00 . A A . 86 ARG HH21 1 1 1 1304 1 1 86 ARG HH22 H 5.182 -17.729 -5.057 1.00 . A A . 86 ARG HH22 1 1 1 1305 1 1 86 ARG N N 3.043 -12.183 1.195 1.00 . A A . 86 ARG N 1 1 1 1306 1 1 86 ARG NE N 3.813 -17.287 -2.211 1.00 . A A . 86 ARG NE 1 1 1 1307 1 1 86 ARG NH1 N 3.786 -15.950 -4.060 1.00 . A A . 86 ARG NH1 1 1 1 1308 1 1 86 ARG NH2 N 4.911 -17.909 -4.111 1.00 . A A . 86 ARG NH2 1 1 1 1309 1 1 86 ARG O O 5.339 -12.094 -1.381 1.00 . A A . 86 ARG O 1 1 1 1310 1 1 87 GLU C C 4.172 -9.550 -2.515 1.00 . A A . 87 GLU C 1 1 1 1311 1 1 87 GLU CA C 3.396 -10.821 -2.831 1.00 . A A . 87 GLU CA 1 1 1 1312 1 1 87 GLU CB C 2.061 -10.451 -3.474 1.00 . A A . 87 GLU CB 1 1 1 1313 1 1 87 GLU CD C 2.802 -10.864 -5.828 1.00 . A A . 87 GLU CD 1 1 1 1314 1 1 87 GLU CG C 2.299 -9.812 -4.848 1.00 . A A . 87 GLU CG 1 1 1 1315 1 1 87 GLU H H 2.252 -11.702 -1.280 1.00 . A A . 87 GLU H 1 1 1 1316 1 1 87 GLU HA H 3.964 -11.416 -3.532 1.00 . A A . 87 GLU HA 1 1 1 1317 1 1 87 GLU HB2 H 1.462 -11.343 -3.592 1.00 . A A . 87 GLU HB2 1 1 1 1318 1 1 87 GLU HB3 H 1.547 -9.753 -2.836 1.00 . A A . 87 GLU HB3 1 1 1 1319 1 1 87 GLU HG2 H 1.373 -9.399 -5.218 1.00 . A A . 87 GLU HG2 1 1 1 1320 1 1 87 GLU HG3 H 3.032 -9.023 -4.762 1.00 . A A . 87 GLU HG3 1 1 1 1321 1 1 87 GLU N N 3.163 -11.604 -1.627 1.00 . A A . 87 GLU N 1 1 1 1322 1 1 87 GLU O O 5.083 -9.171 -3.252 1.00 . A A . 87 GLU O 1 1 1 1323 1 1 87 GLU OE1 O 2.789 -12.031 -5.473 1.00 . A A . 87 GLU OE1 1 1 1 1324 1 1 87 GLU OE2 O 3.197 -10.487 -6.919 1.00 . A A . 87 GLU OE2 1 1 1 1325 1 1 88 ALA C C 5.954 -7.932 -0.705 1.00 . A A . 88 ALA C 1 1 1 1326 1 1 88 ALA CA C 4.488 -7.662 -1.026 1.00 . A A . 88 ALA CA 1 1 1 1327 1 1 88 ALA CB C 3.787 -7.059 0.194 1.00 . A A . 88 ALA CB 1 1 1 1328 1 1 88 ALA H H 3.090 -9.232 -0.848 1.00 . A A . 88 ALA H 1 1 1 1329 1 1 88 ALA HA H 4.433 -6.959 -1.842 1.00 . A A . 88 ALA HA 1 1 1 1330 1 1 88 ALA HB1 H 2.718 -7.164 0.082 1.00 . A A . 88 ALA HB1 1 1 1 1331 1 1 88 ALA HB2 H 4.035 -6.013 0.271 1.00 . A A . 88 ALA HB2 1 1 1 1332 1 1 88 ALA HB3 H 4.106 -7.573 1.089 1.00 . A A . 88 ALA HB3 1 1 1 1333 1 1 88 ALA N N 3.813 -8.893 -1.416 1.00 . A A . 88 ALA N 1 1 1 1334 1 1 88 ALA O O 6.842 -7.199 -1.139 1.00 . A A . 88 ALA O 1 1 1 1335 1 1 89 PHE C C 8.408 -9.554 -0.792 1.00 . A A . 89 PHE C 1 1 1 1336 1 1 89 PHE CA C 7.552 -9.350 0.451 1.00 . A A . 89 PHE CA 1 1 1 1337 1 1 89 PHE CB C 7.546 -10.631 1.296 1.00 . A A . 89 PHE CB 1 1 1 1338 1 1 89 PHE CD1 C 9.981 -11.254 1.451 1.00 . A A . 89 PHE CD1 1 1 1 1339 1 1 89 PHE CD2 C 8.890 -10.316 3.399 1.00 . A A . 89 PHE CD2 1 1 1 1340 1 1 89 PHE CE1 C 11.177 -11.348 2.169 1.00 . A A . 89 PHE CE1 1 1 1 1341 1 1 89 PHE CE2 C 10.084 -10.408 4.117 1.00 . A A . 89 PHE CE2 1 1 1 1342 1 1 89 PHE CG C 8.838 -10.739 2.066 1.00 . A A . 89 PHE CG 1 1 1 1343 1 1 89 PHE CZ C 11.228 -10.925 3.503 1.00 . A A . 89 PHE CZ 1 1 1 1344 1 1 89 PHE H H 5.450 -9.525 0.392 1.00 . A A . 89 PHE H 1 1 1 1345 1 1 89 PHE HA H 7.972 -8.547 1.035 1.00 . A A . 89 PHE HA 1 1 1 1346 1 1 89 PHE HB2 H 6.724 -10.598 1.992 1.00 . A A . 89 PHE HB2 1 1 1 1347 1 1 89 PHE HB3 H 7.441 -11.491 0.651 1.00 . A A . 89 PHE HB3 1 1 1 1348 1 1 89 PHE HD1 H 9.941 -11.582 0.421 1.00 . A A . 89 PHE HD1 1 1 1 1349 1 1 89 PHE HD2 H 8.004 -9.919 3.872 1.00 . A A . 89 PHE HD2 1 1 1 1350 1 1 89 PHE HE1 H 12.059 -11.748 1.694 1.00 . A A . 89 PHE HE1 1 1 1 1351 1 1 89 PHE HE2 H 10.122 -10.080 5.145 1.00 . A A . 89 PHE HE2 1 1 1 1352 1 1 89 PHE HZ H 12.151 -10.994 4.057 1.00 . A A . 89 PHE HZ 1 1 1 1353 1 1 89 PHE N N 6.196 -8.987 0.065 1.00 . A A . 89 PHE N 1 1 1 1354 1 1 89 PHE O O 9.578 -9.175 -0.817 1.00 . A A . 89 PHE O 1 1 1 1355 1 1 90 ARG C C 8.874 -9.059 -3.760 1.00 . A A . 90 ARG C 1 1 1 1356 1 1 90 ARG CA C 8.533 -10.379 -3.071 1.00 . A A . 90 ARG CA 1 1 1 1357 1 1 90 ARG CB C 7.685 -11.242 -4.003 1.00 . A A . 90 ARG CB 1 1 1 1358 1 1 90 ARG CD C 6.639 -13.490 -4.287 1.00 . A A . 90 ARG CD 1 1 1 1359 1 1 90 ARG CG C 7.632 -12.671 -3.463 1.00 . A A . 90 ARG CG 1 1 1 1360 1 1 90 ARG CZ C 6.287 -14.069 -6.617 1.00 . A A . 90 ARG CZ 1 1 1 1361 1 1 90 ARG H H 6.867 -10.414 -1.764 1.00 . A A . 90 ARG H 1 1 1 1362 1 1 90 ARG HA H 9.450 -10.903 -2.851 1.00 . A A . 90 ARG HA 1 1 1 1363 1 1 90 ARG HB2 H 6.684 -10.838 -4.057 1.00 . A A . 90 ARG HB2 1 1 1 1364 1 1 90 ARG HB3 H 8.125 -11.247 -4.989 1.00 . A A . 90 ARG HB3 1 1 1 1365 1 1 90 ARG HD2 H 6.567 -14.484 -3.873 1.00 . A A . 90 ARG HD2 1 1 1 1366 1 1 90 ARG HD3 H 5.667 -13.017 -4.247 1.00 . A A . 90 ARG HD3 1 1 1 1367 1 1 90 ARG HE H 7.981 -13.270 -5.911 1.00 . A A . 90 ARG HE 1 1 1 1368 1 1 90 ARG HG2 H 8.614 -13.117 -3.536 1.00 . A A . 90 ARG HG2 1 1 1 1369 1 1 90 ARG HG3 H 7.321 -12.658 -2.432 1.00 . A A . 90 ARG HG3 1 1 1 1370 1 1 90 ARG HH11 H 4.765 -14.427 -5.366 1.00 . A A . 90 ARG HH11 1 1 1 1371 1 1 90 ARG HH12 H 4.488 -14.849 -7.022 1.00 . A A . 90 ARG HH12 1 1 1 1372 1 1 90 ARG HH21 H 7.624 -13.819 -8.086 1.00 . A A . 90 ARG HH21 1 1 1 1373 1 1 90 ARG HH22 H 6.106 -14.505 -8.562 1.00 . A A . 90 ARG HH22 1 1 1 1374 1 1 90 ARG N N 7.814 -10.148 -1.823 1.00 . A A . 90 ARG N 1 1 1 1375 1 1 90 ARG NE N 7.082 -13.578 -5.673 1.00 . A A . 90 ARG NE 1 1 1 1376 1 1 90 ARG NH1 N 5.087 -14.480 -6.311 1.00 . A A . 90 ARG NH1 1 1 1 1377 1 1 90 ARG NH2 N 6.705 -14.136 -7.851 1.00 . A A . 90 ARG NH2 1 1 1 1378 1 1 90 ARG O O 9.956 -8.906 -4.326 1.00 . A A . 90 ARG O 1 1 1 1379 1 1 91 VAL C C 9.342 -6.093 -3.702 1.00 . A A . 91 VAL C 1 1 1 1380 1 1 91 VAL CA C 8.161 -6.813 -4.351 1.00 . A A . 91 VAL CA 1 1 1 1381 1 1 91 VAL CB C 6.897 -5.955 -4.221 1.00 . A A . 91 VAL CB 1 1 1 1382 1 1 91 VAL CG1 C 7.183 -4.535 -4.717 1.00 . A A . 91 VAL CG1 1 1 1 1383 1 1 91 VAL CG2 C 5.773 -6.570 -5.061 1.00 . A A . 91 VAL CG2 1 1 1 1384 1 1 91 VAL H H 7.093 -8.288 -3.256 1.00 . A A . 91 VAL H 1 1 1 1385 1 1 91 VAL HA H 8.373 -6.964 -5.397 1.00 . A A . 91 VAL HA 1 1 1 1386 1 1 91 VAL HB H 6.594 -5.918 -3.184 1.00 . A A . 91 VAL HB 1 1 1 1387 1 1 91 VAL HG11 H 7.777 -4.010 -3.983 1.00 . A A . 91 VAL HG11 1 1 1 1388 1 1 91 VAL HG12 H 6.252 -4.010 -4.868 1.00 . A A . 91 VAL HG12 1 1 1 1389 1 1 91 VAL HG13 H 7.725 -4.583 -5.650 1.00 . A A . 91 VAL HG13 1 1 1 1390 1 1 91 VAL HG21 H 5.746 -7.637 -4.900 1.00 . A A . 91 VAL HG21 1 1 1 1391 1 1 91 VAL HG22 H 5.953 -6.369 -6.106 1.00 . A A . 91 VAL HG22 1 1 1 1392 1 1 91 VAL HG23 H 4.828 -6.137 -4.768 1.00 . A A . 91 VAL HG23 1 1 1 1393 1 1 91 VAL N N 7.942 -8.111 -3.717 1.00 . A A . 91 VAL N 1 1 1 1394 1 1 91 VAL O O 10.214 -5.560 -4.389 1.00 . A A . 91 VAL O 1 1 1 1395 1 1 92 PHE C C 11.729 -6.240 -1.782 1.00 . A A . 92 PHE C 1 1 1 1396 1 1 92 PHE CA C 10.442 -5.444 -1.640 1.00 . A A . 92 PHE CA 1 1 1 1397 1 1 92 PHE CB C 10.069 -5.306 -0.161 1.00 . A A . 92 PHE CB 1 1 1 1398 1 1 92 PHE CD1 C 8.098 -3.872 -0.862 1.00 . A A . 92 PHE CD1 1 1 1 1399 1 1 92 PHE CD2 C 7.789 -5.519 0.890 1.00 . A A . 92 PHE CD2 1 1 1 1400 1 1 92 PHE CE1 C 6.759 -3.499 -0.747 1.00 . A A . 92 PHE CE1 1 1 1 1401 1 1 92 PHE CE2 C 6.447 -5.145 1.001 1.00 . A A . 92 PHE CE2 1 1 1 1402 1 1 92 PHE CG C 8.619 -4.887 -0.041 1.00 . A A . 92 PHE CG 1 1 1 1403 1 1 92 PHE CZ C 5.931 -4.133 0.182 1.00 . A A . 92 PHE CZ 1 1 1 1404 1 1 92 PHE H H 8.643 -6.544 -1.894 1.00 . A A . 92 PHE H 1 1 1 1405 1 1 92 PHE HA H 10.615 -4.463 -2.052 1.00 . A A . 92 PHE HA 1 1 1 1406 1 1 92 PHE HB2 H 10.214 -6.256 0.336 1.00 . A A . 92 PHE HB2 1 1 1 1407 1 1 92 PHE HB3 H 10.697 -4.561 0.299 1.00 . A A . 92 PHE HB3 1 1 1 1408 1 1 92 PHE HD1 H 8.726 -3.375 -1.577 1.00 . A A . 92 PHE HD1 1 1 1 1409 1 1 92 PHE HD2 H 8.186 -6.297 1.523 1.00 . A A . 92 PHE HD2 1 1 1 1410 1 1 92 PHE HE1 H 6.362 -2.721 -1.380 1.00 . A A . 92 PHE HE1 1 1 1 1411 1 1 92 PHE HE2 H 5.811 -5.634 1.717 1.00 . A A . 92 PHE HE2 1 1 1 1412 1 1 92 PHE HZ H 4.896 -3.844 0.267 1.00 . A A . 92 PHE HZ 1 1 1 1413 1 1 92 PHE N N 9.364 -6.090 -2.378 1.00 . A A . 92 PHE N 1 1 1 1414 1 1 92 PHE O O 12.817 -5.672 -1.828 1.00 . A A . 92 PHE O 1 1 1 1415 1 1 93 ASP C C 13.056 -8.704 -3.461 1.00 . A A . 93 ASP C 1 1 1 1416 1 1 93 ASP CA C 12.767 -8.431 -1.985 1.00 . A A . 93 ASP CA 1 1 1 1417 1 1 93 ASP CB C 12.522 -9.747 -1.233 1.00 . A A . 93 ASP CB 1 1 1 1418 1 1 93 ASP CG C 13.849 -10.336 -0.769 1.00 . A A . 93 ASP CG 1 1 1 1419 1 1 93 ASP H H 10.705 -7.958 -1.817 1.00 . A A . 93 ASP H 1 1 1 1420 1 1 93 ASP HA H 13.624 -7.934 -1.552 1.00 . A A . 93 ASP HA 1 1 1 1421 1 1 93 ASP HB2 H 11.898 -9.555 -0.371 1.00 . A A . 93 ASP HB2 1 1 1 1422 1 1 93 ASP HB3 H 12.022 -10.455 -1.882 1.00 . A A . 93 ASP HB3 1 1 1 1423 1 1 93 ASP N N 11.600 -7.563 -1.846 1.00 . A A . 93 ASP N 1 1 1 1424 1 1 93 ASP O O 12.661 -9.735 -4.003 1.00 . A A . 93 ASP O 1 1 1 1425 1 1 93 ASP OD1 O 14.462 -11.054 -1.534 1.00 . A A . 93 ASP OD1 1 1 1 1426 1 1 93 ASP OD2 O 14.235 -10.044 0.346 1.00 . A A . 93 ASP OD2 1 1 1 1427 1 1 94 LYS C C 14.952 -9.151 -5.747 1.00 . A A . 94 LYS C 1 1 1 1428 1 1 94 LYS CA C 14.064 -7.933 -5.520 1.00 . A A . 94 LYS CA 1 1 1 1429 1 1 94 LYS CB C 14.785 -6.684 -6.023 1.00 . A A . 94 LYS CB 1 1 1 1430 1 1 94 LYS CD C 12.659 -5.508 -6.693 1.00 . A A . 94 LYS CD 1 1 1 1431 1 1 94 LYS CE C 12.038 -4.116 -6.811 1.00 . A A . 94 LYS CE 1 1 1 1432 1 1 94 LYS CG C 13.905 -5.450 -5.797 1.00 . A A . 94 LYS CG 1 1 1 1433 1 1 94 LYS H H 14.030 -6.968 -3.631 1.00 . A A . 94 LYS H 1 1 1 1434 1 1 94 LYS HA H 13.154 -8.063 -6.080 1.00 . A A . 94 LYS HA 1 1 1 1435 1 1 94 LYS HB2 H 15.716 -6.567 -5.488 1.00 . A A . 94 LYS HB2 1 1 1 1436 1 1 94 LYS HB3 H 14.989 -6.790 -7.079 1.00 . A A . 94 LYS HB3 1 1 1 1437 1 1 94 LYS HD2 H 12.931 -5.864 -7.675 1.00 . A A . 94 LYS HD2 1 1 1 1438 1 1 94 LYS HD3 H 11.932 -6.175 -6.258 1.00 . A A . 94 LYS HD3 1 1 1 1439 1 1 94 LYS HE2 H 12.791 -3.407 -7.124 1.00 . A A . 94 LYS HE2 1 1 1 1440 1 1 94 LYS HE3 H 11.242 -4.141 -7.541 1.00 . A A . 94 LYS HE3 1 1 1 1441 1 1 94 LYS HG2 H 13.599 -5.420 -4.761 1.00 . A A . 94 LYS HG2 1 1 1 1442 1 1 94 LYS HG3 H 14.475 -4.561 -6.026 1.00 . A A . 94 LYS HG3 1 1 1 1443 1 1 94 LYS HZ1 H 10.461 -3.553 -5.575 1.00 . A A . 94 LYS HZ1 1 1 1 1444 1 1 94 LYS HZ2 H 11.946 -2.833 -5.176 1.00 . A A . 94 LYS HZ2 1 1 1 1445 1 1 94 LYS HZ3 H 11.660 -4.464 -4.794 1.00 . A A . 94 LYS HZ3 1 1 1 1446 1 1 94 LYS N N 13.740 -7.775 -4.107 1.00 . A A . 94 LYS N 1 1 1 1447 1 1 94 LYS NZ N 11.485 -3.711 -5.489 1.00 . A A . 94 LYS NZ 1 1 1 1448 1 1 94 LYS O O 14.739 -9.920 -6.684 1.00 . A A . 94 LYS O 1 1 1 1449 1 1 95 ASP C C 16.182 -11.748 -4.600 1.00 . A A . 95 ASP C 1 1 1 1450 1 1 95 ASP CA C 16.864 -10.446 -5.014 1.00 . A A . 95 ASP CA 1 1 1 1451 1 1 95 ASP CB C 18.100 -10.209 -4.140 1.00 . A A . 95 ASP CB 1 1 1 1452 1 1 95 ASP CG C 17.691 -10.118 -2.676 1.00 . A A . 95 ASP CG 1 1 1 1453 1 1 95 ASP H H 16.066 -8.670 -4.163 1.00 . A A . 95 ASP H 1 1 1 1454 1 1 95 ASP HA H 17.178 -10.528 -6.043 1.00 . A A . 95 ASP HA 1 1 1 1455 1 1 95 ASP HB2 H 18.793 -11.025 -4.271 1.00 . A A . 95 ASP HB2 1 1 1 1456 1 1 95 ASP HB3 H 18.574 -9.285 -4.436 1.00 . A A . 95 ASP HB3 1 1 1 1457 1 1 95 ASP N N 15.947 -9.319 -4.887 1.00 . A A . 95 ASP N 1 1 1 1458 1 1 95 ASP O O 16.677 -12.838 -4.888 1.00 . A A . 95 ASP O 1 1 1 1459 1 1 95 ASP OD1 O 16.587 -10.525 -2.368 1.00 . A A . 95 ASP OD1 1 1 1 1460 1 1 95 ASP OD2 O 18.485 -9.636 -1.884 1.00 . A A . 95 ASP OD2 1 1 1 1461 1 1 96 GLY C C 15.151 -13.629 -2.497 1.00 . A A . 96 GLY C 1 1 1 1462 1 1 96 GLY CA C 14.310 -12.804 -3.468 1.00 . A A . 96 GLY CA 1 1 1 1463 1 1 96 GLY H H 14.703 -10.734 -3.707 1.00 . A A . 96 GLY H 1 1 1 1464 1 1 96 GLY HA2 H 13.398 -12.491 -2.978 1.00 . A A . 96 GLY HA2 1 1 1 1465 1 1 96 GLY HA3 H 14.062 -13.413 -4.322 1.00 . A A . 96 GLY HA3 1 1 1 1466 1 1 96 GLY N N 15.046 -11.627 -3.919 1.00 . A A . 96 GLY N 1 1 1 1467 1 1 96 GLY O O 15.024 -14.852 -2.439 1.00 . A A . 96 GLY O 1 1 1 1468 1 1 97 ASN C C 16.079 -14.077 0.441 1.00 . A A . 97 ASN C 1 1 1 1469 1 1 97 ASN CA C 16.875 -13.646 -0.783 1.00 . A A . 97 ASN CA 1 1 1 1470 1 1 97 ASN CB C 18.018 -12.724 -0.351 1.00 . A A . 97 ASN CB 1 1 1 1471 1 1 97 ASN CG C 17.455 -11.432 0.233 1.00 . A A . 97 ASN CG 1 1 1 1472 1 1 97 ASN H H 16.082 -11.984 -1.829 1.00 . A A . 97 ASN H 1 1 1 1473 1 1 97 ASN HA H 17.296 -14.521 -1.255 1.00 . A A . 97 ASN HA 1 1 1 1474 1 1 97 ASN HB2 H 18.617 -13.223 0.397 1.00 . A A . 97 ASN HB2 1 1 1 1475 1 1 97 ASN HB3 H 18.634 -12.490 -1.206 1.00 . A A . 97 ASN HB3 1 1 1 1476 1 1 97 ASN HD21 H 19.240 -10.631 0.571 1.00 . A A . 97 ASN HD21 1 1 1 1477 1 1 97 ASN HD22 H 17.914 -9.666 1.016 1.00 . A A . 97 ASN HD22 1 1 1 1478 1 1 97 ASN N N 16.016 -12.956 -1.741 1.00 . A A . 97 ASN N 1 1 1 1479 1 1 97 ASN ND2 N 18.271 -10.499 0.640 1.00 . A A . 97 ASN ND2 1 1 1 1480 1 1 97 ASN O O 16.563 -14.850 1.268 1.00 . A A . 97 ASN O 1 1 1 1481 1 1 97 ASN OD1 O 16.240 -11.268 0.320 1.00 . A A . 97 ASN OD1 1 1 1 1482 1 1 98 GLY C C 14.111 -12.899 2.793 1.00 . A A . 98 GLY C 1 1 1 1483 1 1 98 GLY CA C 13.987 -13.924 1.675 1.00 . A A . 98 GLY CA 1 1 1 1484 1 1 98 GLY H H 14.524 -12.967 -0.143 1.00 . A A . 98 GLY H 1 1 1 1485 1 1 98 GLY HA2 H 12.963 -13.952 1.336 1.00 . A A . 98 GLY HA2 1 1 1 1486 1 1 98 GLY HA3 H 14.262 -14.897 2.058 1.00 . A A . 98 GLY HA3 1 1 1 1487 1 1 98 GLY N N 14.852 -13.579 0.549 1.00 . A A . 98 GLY N 1 1 1 1488 1 1 98 GLY O O 13.377 -12.957 3.778 1.00 . A A . 98 GLY O 1 1 1 1489 1 1 99 TYR C C 15.202 -9.542 2.994 1.00 . A A . 99 TYR C 1 1 1 1490 1 1 99 TYR CA C 15.254 -10.914 3.648 1.00 . A A . 99 TYR CA 1 1 1 1491 1 1 99 TYR CB C 16.604 -11.114 4.330 1.00 . A A . 99 TYR CB 1 1 1 1492 1 1 99 TYR CD1 C 16.945 -13.609 4.410 1.00 . A A . 99 TYR CD1 1 1 1 1493 1 1 99 TYR CD2 C 16.237 -12.463 6.425 1.00 . A A . 99 TYR CD2 1 1 1 1494 1 1 99 TYR CE1 C 16.938 -14.827 5.100 1.00 . A A . 99 TYR CE1 1 1 1 1495 1 1 99 TYR CE2 C 16.229 -13.680 7.116 1.00 . A A . 99 TYR CE2 1 1 1 1496 1 1 99 TYR CG C 16.595 -12.428 5.072 1.00 . A A . 99 TYR CG 1 1 1 1497 1 1 99 TYR CZ C 16.580 -14.863 6.453 1.00 . A A . 99 TYR CZ 1 1 1 1498 1 1 99 TYR H H 15.602 -11.960 1.837 1.00 . A A . 99 TYR H 1 1 1 1499 1 1 99 TYR HA H 14.474 -10.970 4.397 1.00 . A A . 99 TYR HA 1 1 1 1500 1 1 99 TYR HB2 H 17.389 -11.122 3.586 1.00 . A A . 99 TYR HB2 1 1 1 1501 1 1 99 TYR HB3 H 16.774 -10.313 5.026 1.00 . A A . 99 TYR HB3 1 1 1 1502 1 1 99 TYR HD1 H 17.221 -13.582 3.366 1.00 . A A . 99 TYR HD1 1 1 1 1503 1 1 99 TYR HD2 H 15.966 -11.551 6.935 1.00 . A A . 99 TYR HD2 1 1 1 1504 1 1 99 TYR HE1 H 17.209 -15.738 4.590 1.00 . A A . 99 TYR HE1 1 1 1 1505 1 1 99 TYR HE2 H 15.953 -13.708 8.160 1.00 . A A . 99 TYR HE2 1 1 1 1506 1 1 99 TYR HH H 15.962 -15.983 7.868 1.00 . A A . 99 TYR HH 1 1 1 1507 1 1 99 TYR N N 15.044 -11.958 2.642 1.00 . A A . 99 TYR N 1 1 1 1508 1 1 99 TYR O O 15.749 -9.342 1.919 1.00 . A A . 99 TYR O 1 1 1 1509 1 1 99 TYR OH O 16.574 -16.063 7.134 1.00 . A A . 99 TYR OH 1 1 1 1510 1 1 100 ILE C C 15.468 -6.312 3.775 1.00 . A A . 100 ILE C 1 1 1 1511 1 1 100 ILE CA C 14.442 -7.232 3.130 1.00 . A A . 100 ILE CA 1 1 1 1512 1 1 100 ILE CB C 13.040 -6.690 3.404 1.00 . A A . 100 ILE CB 1 1 1 1513 1 1 100 ILE CD1 C 10.605 -7.221 3.209 1.00 . A A . 100 ILE CD1 1 1 1 1514 1 1 100 ILE CG1 C 12.006 -7.570 2.701 1.00 . A A . 100 ILE CG1 1 1 1 1515 1 1 100 ILE CG2 C 12.932 -5.258 2.883 1.00 . A A . 100 ILE CG2 1 1 1 1516 1 1 100 ILE H H 14.160 -8.805 4.531 1.00 . A A . 100 ILE H 1 1 1 1517 1 1 100 ILE HA H 14.604 -7.244 2.060 1.00 . A A . 100 ILE HA 1 1 1 1518 1 1 100 ILE HB H 12.859 -6.698 4.466 1.00 . A A . 100 ILE HB 1 1 1 1519 1 1 100 ILE HD11 H 10.423 -6.166 3.066 1.00 . A A . 100 ILE HD11 1 1 1 1520 1 1 100 ILE HD12 H 10.533 -7.461 4.260 1.00 . A A . 100 ILE HD12 1 1 1 1521 1 1 100 ILE HD13 H 9.871 -7.790 2.658 1.00 . A A . 100 ILE HD13 1 1 1 1522 1 1 100 ILE HG12 H 12.056 -7.400 1.635 1.00 . A A . 100 ILE HG12 1 1 1 1523 1 1 100 ILE HG13 H 12.216 -8.606 2.910 1.00 . A A . 100 ILE HG13 1 1 1 1524 1 1 100 ILE HG21 H 11.899 -4.945 2.906 1.00 . A A . 100 ILE HG21 1 1 1 1525 1 1 100 ILE HG22 H 13.300 -5.216 1.868 1.00 . A A . 100 ILE HG22 1 1 1 1526 1 1 100 ILE HG23 H 13.521 -4.605 3.507 1.00 . A A . 100 ILE HG23 1 1 1 1527 1 1 100 ILE N N 14.555 -8.592 3.660 1.00 . A A . 100 ILE N 1 1 1 1528 1 1 100 ILE O O 15.462 -6.118 4.993 1.00 . A A . 100 ILE O 1 1 1 1529 1 1 101 SER C C 16.907 -3.393 3.325 1.00 . A A . 101 SER C 1 1 1 1530 1 1 101 SER CA C 17.386 -4.839 3.416 1.00 . A A . 101 SER CA 1 1 1 1531 1 1 101 SER CB C 18.660 -5.012 2.588 1.00 . A A . 101 SER CB 1 1 1 1532 1 1 101 SER H H 16.295 -5.952 1.984 1.00 . A A . 101 SER H 1 1 1 1533 1 1 101 SER HA H 17.609 -5.065 4.451 1.00 . A A . 101 SER HA 1 1 1 1534 1 1 101 SER HB2 H 19.513 -4.692 3.164 1.00 . A A . 101 SER HB2 1 1 1 1535 1 1 101 SER HB3 H 18.777 -6.054 2.324 1.00 . A A . 101 SER HB3 1 1 1 1536 1 1 101 SER HG H 17.666 -3.898 1.342 1.00 . A A . 101 SER HG 1 1 1 1537 1 1 101 SER N N 16.348 -5.752 2.943 1.00 . A A . 101 SER N 1 1 1 1538 1 1 101 SER O O 15.875 -3.108 2.716 1.00 . A A . 101 SER O 1 1 1 1539 1 1 101 SER OG O 18.568 -4.218 1.414 1.00 . A A . 101 SER OG 1 1 1 1540 1 1 102 ALA C C 17.405 -0.512 2.487 1.00 . A A . 102 ALA C 1 1 1 1541 1 1 102 ALA CA C 17.320 -1.069 3.902 1.00 . A A . 102 ALA CA 1 1 1 1542 1 1 102 ALA CB C 18.266 -0.285 4.812 1.00 . A A . 102 ALA CB 1 1 1 1543 1 1 102 ALA H H 18.482 -2.773 4.389 1.00 . A A . 102 ALA H 1 1 1 1544 1 1 102 ALA HA H 16.311 -0.944 4.259 1.00 . A A . 102 ALA HA 1 1 1 1545 1 1 102 ALA HB1 H 18.111 -0.581 5.839 1.00 . A A . 102 ALA HB1 1 1 1 1546 1 1 102 ALA HB2 H 18.073 0.772 4.707 1.00 . A A . 102 ALA HB2 1 1 1 1547 1 1 102 ALA HB3 H 19.287 -0.493 4.529 1.00 . A A . 102 ALA HB3 1 1 1 1548 1 1 102 ALA N N 17.667 -2.486 3.927 1.00 . A A . 102 ALA N 1 1 1 1549 1 1 102 ALA O O 16.575 0.299 2.079 1.00 . A A . 102 ALA O 1 1 1 1550 1 1 103 ALA C C 17.362 -0.757 -0.462 1.00 . A A . 103 ALA C 1 1 1 1551 1 1 103 ALA CA C 18.601 -0.478 0.379 1.00 . A A . 103 ALA CA 1 1 1 1552 1 1 103 ALA CB C 19.808 -1.175 -0.252 1.00 . A A . 103 ALA CB 1 1 1 1553 1 1 103 ALA H H 19.049 -1.595 2.122 1.00 . A A . 103 ALA H 1 1 1 1554 1 1 103 ALA HA H 18.783 0.586 0.395 1.00 . A A . 103 ALA HA 1 1 1 1555 1 1 103 ALA HB1 H 19.941 -0.819 -1.262 1.00 . A A . 103 ALA HB1 1 1 1 1556 1 1 103 ALA HB2 H 19.639 -2.242 -0.265 1.00 . A A . 103 ALA HB2 1 1 1 1557 1 1 103 ALA HB3 H 20.693 -0.957 0.327 1.00 . A A . 103 ALA HB3 1 1 1 1558 1 1 103 ALA N N 18.416 -0.949 1.744 1.00 . A A . 103 ALA N 1 1 1 1559 1 1 103 ALA O O 16.866 0.126 -1.166 1.00 . A A . 103 ALA O 1 1 1 1560 1 1 104 GLU C C 14.458 -1.617 -0.665 1.00 . A A . 104 GLU C 1 1 1 1561 1 1 104 GLU CA C 15.688 -2.360 -1.163 1.00 . A A . 104 GLU CA 1 1 1 1562 1 1 104 GLU CB C 15.451 -3.863 -1.045 1.00 . A A . 104 GLU CB 1 1 1 1563 1 1 104 GLU CD C 16.388 -6.117 -1.571 1.00 . A A . 104 GLU CD 1 1 1 1564 1 1 104 GLU CG C 16.583 -4.616 -1.745 1.00 . A A . 104 GLU CG 1 1 1 1565 1 1 104 GLU H H 17.300 -2.652 0.181 1.00 . A A . 104 GLU H 1 1 1 1566 1 1 104 GLU HA H 15.853 -2.112 -2.200 1.00 . A A . 104 GLU HA 1 1 1 1567 1 1 104 GLU HB2 H 15.422 -4.141 -0.001 1.00 . A A . 104 GLU HB2 1 1 1 1568 1 1 104 GLU HB3 H 14.512 -4.113 -1.510 1.00 . A A . 104 GLU HB3 1 1 1 1569 1 1 104 GLU HG2 H 16.579 -4.373 -2.796 1.00 . A A . 104 GLU HG2 1 1 1 1570 1 1 104 GLU HG3 H 17.528 -4.327 -1.312 1.00 . A A . 104 GLU HG3 1 1 1 1571 1 1 104 GLU N N 16.866 -1.988 -0.392 1.00 . A A . 104 GLU N 1 1 1 1572 1 1 104 GLU O O 13.805 -0.907 -1.422 1.00 . A A . 104 GLU O 1 1 1 1573 1 1 104 GLU OE1 O 15.389 -6.496 -0.986 1.00 . A A . 104 GLU OE1 1 1 1 1574 1 1 104 GLU OE2 O 17.239 -6.864 -2.026 1.00 . A A . 104 GLU OE2 1 1 1 1575 1 1 105 LEU C C 12.968 0.339 0.859 1.00 . A A . 105 LEU C 1 1 1 1576 1 1 105 LEU CA C 12.963 -1.152 1.174 1.00 . A A . 105 LEU CA 1 1 1 1577 1 1 105 LEU CB C 12.952 -1.355 2.686 1.00 . A A . 105 LEU CB 1 1 1 1578 1 1 105 LEU CD1 C 11.099 -1.720 4.363 1.00 . A A . 105 LEU CD1 1 1 1 1579 1 1 105 LEU CD2 C 11.937 0.598 3.940 1.00 . A A . 105 LEU CD2 1 1 1 1580 1 1 105 LEU CG C 11.649 -0.768 3.297 1.00 . A A . 105 LEU CG 1 1 1 1581 1 1 105 LEU H H 14.670 -2.401 1.166 1.00 . A A . 105 LEU H 1 1 1 1582 1 1 105 LEU HA H 12.075 -1.606 0.762 1.00 . A A . 105 LEU HA 1 1 1 1583 1 1 105 LEU HB2 H 13.017 -2.416 2.891 1.00 . A A . 105 LEU HB2 1 1 1 1584 1 1 105 LEU HB3 H 13.814 -0.859 3.111 1.00 . A A . 105 LEU HB3 1 1 1 1585 1 1 105 LEU HD11 H 10.652 -2.575 3.879 1.00 . A A . 105 LEU HD11 1 1 1 1586 1 1 105 LEU HD12 H 10.356 -1.210 4.951 1.00 . A A . 105 LEU HD12 1 1 1 1587 1 1 105 LEU HD13 H 11.904 -2.048 5.003 1.00 . A A . 105 LEU HD13 1 1 1 1588 1 1 105 LEU HD21 H 12.438 0.452 4.886 1.00 . A A . 105 LEU HD21 1 1 1 1589 1 1 105 LEU HD22 H 11.011 1.126 4.101 1.00 . A A . 105 LEU HD22 1 1 1 1590 1 1 105 LEU HD23 H 12.571 1.176 3.284 1.00 . A A . 105 LEU HD23 1 1 1 1591 1 1 105 LEU HG H 10.899 -0.646 2.524 1.00 . A A . 105 LEU HG 1 1 1 1592 1 1 105 LEU N N 14.135 -1.798 0.608 1.00 . A A . 105 LEU N 1 1 1 1593 1 1 105 LEU O O 11.944 0.913 0.486 1.00 . A A . 105 LEU O 1 1 1 1594 1 1 106 ARG C C 14.005 2.665 -0.743 1.00 . A A . 106 ARG C 1 1 1 1595 1 1 106 ARG CA C 14.261 2.381 0.735 1.00 . A A . 106 ARG CA 1 1 1 1596 1 1 106 ARG CB C 15.666 2.859 1.104 1.00 . A A . 106 ARG CB 1 1 1 1597 1 1 106 ARG CD C 17.163 4.852 1.297 1.00 . A A . 106 ARG CD 1 1 1 1598 1 1 106 ARG CG C 15.764 4.376 0.908 1.00 . A A . 106 ARG CG 1 1 1 1599 1 1 106 ARG CZ C 19.456 4.490 0.581 1.00 . A A . 106 ARG CZ 1 1 1 1600 1 1 106 ARG H H 14.904 0.452 1.322 1.00 . A A . 106 ARG H 1 1 1 1601 1 1 106 ARG HA H 13.541 2.926 1.328 1.00 . A A . 106 ARG HA 1 1 1 1602 1 1 106 ARG HB2 H 15.869 2.615 2.137 1.00 . A A . 106 ARG HB2 1 1 1 1603 1 1 106 ARG HB3 H 16.388 2.371 0.469 1.00 . A A . 106 ARG HB3 1 1 1 1604 1 1 106 ARG HD2 H 17.201 5.929 1.241 1.00 . A A . 106 ARG HD2 1 1 1 1605 1 1 106 ARG HD3 H 17.379 4.539 2.307 1.00 . A A . 106 ARG HD3 1 1 1 1606 1 1 106 ARG HE H 17.860 3.751 -0.376 1.00 . A A . 106 ARG HE 1 1 1 1607 1 1 106 ARG HG2 H 15.577 4.622 -0.127 1.00 . A A . 106 ARG HG2 1 1 1 1608 1 1 106 ARG HG3 H 15.033 4.868 1.533 1.00 . A A . 106 ARG HG3 1 1 1 1609 1 1 106 ARG HH11 H 19.194 5.599 2.226 1.00 . A A . 106 ARG HH11 1 1 1 1610 1 1 106 ARG HH12 H 20.838 5.356 1.740 1.00 . A A . 106 ARG HH12 1 1 1 1611 1 1 106 ARG HH21 H 20.015 3.427 -1.020 1.00 . A A . 106 ARG HH21 1 1 1 1612 1 1 106 ARG HH22 H 21.303 4.126 -0.098 1.00 . A A . 106 ARG HH22 1 1 1 1613 1 1 106 ARG N N 14.126 0.959 1.011 1.00 . A A . 106 ARG N 1 1 1 1614 1 1 106 ARG NE N 18.157 4.289 0.389 1.00 . A A . 106 ARG NE 1 1 1 1615 1 1 106 ARG NH1 N 19.861 5.204 1.594 1.00 . A A . 106 ARG NH1 1 1 1 1616 1 1 106 ARG NH2 N 20.326 3.974 -0.243 1.00 . A A . 106 ARG NH2 1 1 1 1617 1 1 106 ARG O O 13.440 3.700 -1.093 1.00 . A A . 106 ARG O 1 1 1 1618 1 1 107 HIS C C 12.773 1.940 -3.419 1.00 . A A . 107 HIS C 1 1 1 1619 1 1 107 HIS CA C 14.253 1.923 -3.044 1.00 . A A . 107 HIS CA 1 1 1 1620 1 1 107 HIS CB C 14.952 0.785 -3.792 1.00 . A A . 107 HIS CB 1 1 1 1621 1 1 107 HIS CD2 C 15.554 1.631 -6.201 1.00 . A A . 107 HIS CD2 1 1 1 1622 1 1 107 HIS CE1 C 13.850 0.809 -7.258 1.00 . A A . 107 HIS CE1 1 1 1 1623 1 1 107 HIS CG C 14.786 0.979 -5.271 1.00 . A A . 107 HIS CG 1 1 1 1624 1 1 107 HIS H H 14.873 0.931 -1.277 1.00 . A A . 107 HIS H 1 1 1 1625 1 1 107 HIS HA H 14.703 2.859 -3.341 1.00 . A A . 107 HIS HA 1 1 1 1626 1 1 107 HIS HB2 H 16.003 0.781 -3.544 1.00 . A A . 107 HIS HB2 1 1 1 1627 1 1 107 HIS HB3 H 14.512 -0.158 -3.505 1.00 . A A . 107 HIS HB3 1 1 1 1628 1 1 107 HIS HD2 H 16.479 2.147 -5.992 1.00 . A A . 107 HIS HD2 1 1 1 1629 1 1 107 HIS HE1 H 13.153 0.543 -8.039 1.00 . A A . 107 HIS HE1 1 1 1 1630 1 1 107 HIS HE2 H 15.289 1.890 -8.302 1.00 . A A . 107 HIS HE2 1 1 1 1631 1 1 107 HIS N N 14.436 1.746 -1.606 1.00 . A A . 107 HIS N 1 1 1 1632 1 1 107 HIS ND1 N 13.704 0.463 -5.966 1.00 . A A . 107 HIS ND1 1 1 1 1633 1 1 107 HIS NE2 N 14.962 1.522 -7.455 1.00 . A A . 107 HIS NE2 1 1 1 1634 1 1 107 HIS O O 12.305 2.853 -4.100 1.00 . A A . 107 HIS O 1 1 1 1635 1 1 108 VAL C C 9.868 2.012 -2.652 1.00 . A A . 108 VAL C 1 1 1 1636 1 1 108 VAL CA C 10.617 0.837 -3.267 1.00 . A A . 108 VAL CA 1 1 1 1637 1 1 108 VAL CB C 10.048 -0.482 -2.737 1.00 . A A . 108 VAL CB 1 1 1 1638 1 1 108 VAL CG1 C 10.605 -1.649 -3.556 1.00 . A A . 108 VAL CG1 1 1 1 1639 1 1 108 VAL CG2 C 10.458 -0.658 -1.277 1.00 . A A . 108 VAL CG2 1 1 1 1640 1 1 108 VAL H H 12.472 0.231 -2.432 1.00 . A A . 108 VAL H 1 1 1 1641 1 1 108 VAL HA H 10.484 0.867 -4.339 1.00 . A A . 108 VAL HA 1 1 1 1642 1 1 108 VAL HB H 8.970 -0.467 -2.812 1.00 . A A . 108 VAL HB 1 1 1 1643 1 1 108 VAL HG11 H 10.480 -1.444 -4.609 1.00 . A A . 108 VAL HG11 1 1 1 1644 1 1 108 VAL HG12 H 10.075 -2.554 -3.302 1.00 . A A . 108 VAL HG12 1 1 1 1645 1 1 108 VAL HG13 H 11.656 -1.774 -3.337 1.00 . A A . 108 VAL HG13 1 1 1 1646 1 1 108 VAL HG21 H 11.529 -0.620 -1.209 1.00 . A A . 108 VAL HG21 1 1 1 1647 1 1 108 VAL HG22 H 10.108 -1.612 -0.913 1.00 . A A . 108 VAL HG22 1 1 1 1648 1 1 108 VAL HG23 H 10.030 0.135 -0.682 1.00 . A A . 108 VAL HG23 1 1 1 1649 1 1 108 VAL N N 12.043 0.928 -2.970 1.00 . A A . 108 VAL N 1 1 1 1650 1 1 108 VAL O O 8.951 2.560 -3.261 1.00 . A A . 108 VAL O 1 1 1 1651 1 1 109 MET C C 9.833 4.803 -1.543 1.00 . A A . 109 MET C 1 1 1 1652 1 1 109 MET CA C 9.617 3.509 -0.766 1.00 . A A . 109 MET CA 1 1 1 1653 1 1 109 MET CB C 10.191 3.652 0.647 1.00 . A A . 109 MET CB 1 1 1 1654 1 1 109 MET CE C 7.817 2.649 3.634 1.00 . A A . 109 MET CE 1 1 1 1655 1 1 109 MET CG C 9.600 2.578 1.560 1.00 . A A . 109 MET CG 1 1 1 1656 1 1 109 MET H H 10.999 1.925 -1.003 1.00 . A A . 109 MET H 1 1 1 1657 1 1 109 MET HA H 8.559 3.315 -0.701 1.00 . A A . 109 MET HA 1 1 1 1658 1 1 109 MET HB2 H 11.264 3.539 0.612 1.00 . A A . 109 MET HB2 1 1 1 1659 1 1 109 MET HB3 H 9.944 4.626 1.037 1.00 . A A . 109 MET HB3 1 1 1 1660 1 1 109 MET HE1 H 6.803 2.438 3.954 1.00 . A A . 109 MET HE1 1 1 1 1661 1 1 109 MET HE2 H 8.177 3.529 4.142 1.00 . A A . 109 MET HE2 1 1 1 1662 1 1 109 MET HE3 H 8.456 1.813 3.875 1.00 . A A . 109 MET HE3 1 1 1 1663 1 1 109 MET HG2 H 9.706 1.611 1.090 1.00 . A A . 109 MET HG2 1 1 1 1664 1 1 109 MET HG3 H 10.132 2.583 2.498 1.00 . A A . 109 MET HG3 1 1 1 1665 1 1 109 MET N N 10.262 2.395 -1.445 1.00 . A A . 109 MET N 1 1 1 1666 1 1 109 MET O O 8.923 5.623 -1.665 1.00 . A A . 109 MET O 1 1 1 1667 1 1 109 MET SD S 7.841 2.925 1.844 1.00 . A A . 109 MET SD 1 1 1 1668 1 1 110 THR C C 10.576 6.189 -4.145 1.00 . A A . 110 THR C 1 1 1 1669 1 1 110 THR CA C 11.365 6.165 -2.840 1.00 . A A . 110 THR CA 1 1 1 1670 1 1 110 THR CB C 12.863 6.207 -3.141 1.00 . A A . 110 THR CB 1 1 1 1671 1 1 110 THR CG2 C 13.175 7.429 -4.006 1.00 . A A . 110 THR CG2 1 1 1 1672 1 1 110 THR H H 11.721 4.281 -1.945 1.00 . A A . 110 THR H 1 1 1 1673 1 1 110 THR HA H 11.103 7.037 -2.261 1.00 . A A . 110 THR HA 1 1 1 1674 1 1 110 THR HB H 13.151 5.313 -3.671 1.00 . A A . 110 THR HB 1 1 1 1675 1 1 110 THR HG1 H 13.077 5.838 -1.244 1.00 . A A . 110 THR HG1 1 1 1 1676 1 1 110 THR HG21 H 12.831 7.254 -5.015 1.00 . A A . 110 THR HG21 1 1 1 1677 1 1 110 THR HG22 H 14.241 7.602 -4.015 1.00 . A A . 110 THR HG22 1 1 1 1678 1 1 110 THR HG23 H 12.674 8.296 -3.601 1.00 . A A . 110 THR HG23 1 1 1 1679 1 1 110 THR N N 11.039 4.974 -2.069 1.00 . A A . 110 THR N 1 1 1 1680 1 1 110 THR O O 10.248 7.254 -4.666 1.00 . A A . 110 THR O 1 1 1 1681 1 1 110 THR OG1 O 13.585 6.290 -1.921 1.00 . A A . 110 THR OG1 1 1 1 1682 1 1 111 ASN C C 8.144 5.509 -5.761 1.00 . A A . 111 ASN C 1 1 1 1683 1 1 111 ASN CA C 9.532 4.894 -5.916 1.00 . A A . 111 ASN CA 1 1 1 1684 1 1 111 ASN CB C 9.403 3.424 -6.320 1.00 . A A . 111 ASN CB 1 1 1 1685 1 1 111 ASN CG C 10.784 2.788 -6.418 1.00 . A A . 111 ASN CG 1 1 1 1686 1 1 111 ASN H H 10.567 4.185 -4.209 1.00 . A A . 111 ASN H 1 1 1 1687 1 1 111 ASN HA H 10.064 5.423 -6.691 1.00 . A A . 111 ASN HA 1 1 1 1688 1 1 111 ASN HB2 H 8.816 2.897 -5.583 1.00 . A A . 111 ASN HB2 1 1 1 1689 1 1 111 ASN HB3 H 8.917 3.360 -7.279 1.00 . A A . 111 ASN HB3 1 1 1 1690 1 1 111 ASN HD21 H 11.751 4.514 -6.261 1.00 . A A . 111 ASN HD21 1 1 1 1691 1 1 111 ASN HD22 H 12.737 3.142 -6.426 1.00 . A A . 111 ASN HD22 1 1 1 1692 1 1 111 ASN N N 10.279 5.003 -4.669 1.00 . A A . 111 ASN N 1 1 1 1693 1 1 111 ASN ND2 N 11.845 3.544 -6.363 1.00 . A A . 111 ASN ND2 1 1 1 1694 1 1 111 ASN O O 7.619 6.125 -6.688 1.00 . A A . 111 ASN O 1 1 1 1695 1 1 111 ASN OD1 O 10.899 1.569 -6.547 1.00 . A A . 111 ASN OD1 1 1 1 1696 1 1 112 LEU C C 6.282 7.396 -4.185 1.00 . A A . 112 LEU C 1 1 1 1697 1 1 112 LEU CA C 6.228 5.882 -4.315 1.00 . A A . 112 LEU CA 1 1 1 1698 1 1 112 LEU CB C 5.666 5.277 -3.028 1.00 . A A . 112 LEU CB 1 1 1 1699 1 1 112 LEU CD1 C 4.975 3.143 -1.912 1.00 . A A . 112 LEU CD1 1 1 1 1700 1 1 112 LEU CD2 C 4.175 3.643 -4.253 1.00 . A A . 112 LEU CD2 1 1 1 1701 1 1 112 LEU CG C 5.345 3.792 -3.252 1.00 . A A . 112 LEU CG 1 1 1 1702 1 1 112 LEU H H 8.022 4.841 -3.880 1.00 . A A . 112 LEU H 1 1 1 1703 1 1 112 LEU HA H 5.577 5.631 -5.136 1.00 . A A . 112 LEU HA 1 1 1 1704 1 1 112 LEU HB2 H 6.398 5.372 -2.240 1.00 . A A . 112 LEU HB2 1 1 1 1705 1 1 112 LEU HB3 H 4.766 5.802 -2.745 1.00 . A A . 112 LEU HB3 1 1 1 1706 1 1 112 LEU HD11 H 4.956 2.070 -2.027 1.00 . A A . 112 LEU HD11 1 1 1 1707 1 1 112 LEU HD12 H 3.999 3.488 -1.604 1.00 . A A . 112 LEU HD12 1 1 1 1708 1 1 112 LEU HD13 H 5.706 3.413 -1.165 1.00 . A A . 112 LEU HD13 1 1 1 1709 1 1 112 LEU HD21 H 4.574 3.541 -5.251 1.00 . A A . 112 LEU HD21 1 1 1 1710 1 1 112 LEU HD22 H 3.537 4.515 -4.214 1.00 . A A . 112 LEU HD22 1 1 1 1711 1 1 112 LEU HD23 H 3.591 2.766 -4.015 1.00 . A A . 112 LEU HD23 1 1 1 1712 1 1 112 LEU HG H 6.219 3.301 -3.650 1.00 . A A . 112 LEU HG 1 1 1 1713 1 1 112 LEU N N 7.556 5.339 -4.583 1.00 . A A . 112 LEU N 1 1 1 1714 1 1 112 LEU O O 5.262 8.047 -3.959 1.00 . A A . 112 LEU O 1 1 1 1715 1 1 113 GLY C C 7.853 9.817 -2.779 1.00 . A A . 113 GLY C 1 1 1 1716 1 1 113 GLY CA C 7.660 9.395 -4.229 1.00 . A A . 113 GLY CA 1 1 1 1717 1 1 113 GLY H H 8.254 7.382 -4.510 1.00 . A A . 113 GLY H 1 1 1 1718 1 1 113 GLY HA2 H 8.528 9.685 -4.803 1.00 . A A . 113 GLY HA2 1 1 1 1719 1 1 113 GLY HA3 H 6.789 9.894 -4.627 1.00 . A A . 113 GLY HA3 1 1 1 1720 1 1 113 GLY N N 7.478 7.952 -4.329 1.00 . A A . 113 GLY N 1 1 1 1721 1 1 113 GLY O O 7.863 11.007 -2.466 1.00 . A A . 113 GLY O 1 1 1 1722 1 1 114 GLU C C 9.685 9.353 -0.194 1.00 . A A . 114 GLU C 1 1 1 1723 1 1 114 GLU CA C 8.209 9.116 -0.477 1.00 . A A . 114 GLU CA 1 1 1 1724 1 1 114 GLU CB C 7.702 7.947 0.367 1.00 . A A . 114 GLU CB 1 1 1 1725 1 1 114 GLU CD C 6.596 9.383 2.094 1.00 . A A . 114 GLU CD 1 1 1 1726 1 1 114 GLU CG C 7.690 8.348 1.843 1.00 . A A . 114 GLU CG 1 1 1 1727 1 1 114 GLU H H 7.997 7.904 -2.204 1.00 . A A . 114 GLU H 1 1 1 1728 1 1 114 GLU HA H 7.656 10.006 -0.213 1.00 . A A . 114 GLU HA 1 1 1 1729 1 1 114 GLU HB2 H 6.702 7.687 0.054 1.00 . A A . 114 GLU HB2 1 1 1 1730 1 1 114 GLU HB3 H 8.354 7.097 0.231 1.00 . A A . 114 GLU HB3 1 1 1 1731 1 1 114 GLU HG2 H 7.504 7.474 2.449 1.00 . A A . 114 GLU HG2 1 1 1 1732 1 1 114 GLU HG3 H 8.646 8.771 2.108 1.00 . A A . 114 GLU HG3 1 1 1 1733 1 1 114 GLU N N 8.011 8.834 -1.896 1.00 . A A . 114 GLU N 1 1 1 1734 1 1 114 GLU O O 10.534 8.542 -0.561 1.00 . A A . 114 GLU O 1 1 1 1735 1 1 114 GLU OE1 O 5.827 9.642 1.183 1.00 . A A . 114 GLU OE1 1 1 1 1736 1 1 114 GLU OE2 O 6.544 9.902 3.197 1.00 . A A . 114 GLU OE2 1 1 1 1737 1 1 115 LYS C C 11.731 10.345 2.183 1.00 . A A . 115 LYS C 1 1 1 1738 1 1 115 LYS CA C 11.369 10.810 0.779 1.00 . A A . 115 LYS CA 1 1 1 1739 1 1 115 LYS CB C 11.564 12.328 0.678 1.00 . A A . 115 LYS CB 1 1 1 1740 1 1 115 LYS CD C 11.250 12.219 -1.806 1.00 . A A . 115 LYS CD 1 1 1 1741 1 1 115 LYS CE C 10.543 12.860 -2.997 1.00 . A A . 115 LYS CE 1 1 1 1742 1 1 115 LYS CG C 10.769 12.878 -0.512 1.00 . A A . 115 LYS CG 1 1 1 1743 1 1 115 LYS H H 9.267 11.077 0.729 1.00 . A A . 115 LYS H 1 1 1 1744 1 1 115 LYS HA H 12.036 10.329 0.077 1.00 . A A . 115 LYS HA 1 1 1 1745 1 1 115 LYS HB2 H 11.221 12.801 1.587 1.00 . A A . 115 LYS HB2 1 1 1 1746 1 1 115 LYS HB3 H 12.612 12.547 0.534 1.00 . A A . 115 LYS HB3 1 1 1 1747 1 1 115 LYS HD2 H 12.317 12.350 -1.904 1.00 . A A . 115 LYS HD2 1 1 1 1748 1 1 115 LYS HD3 H 11.015 11.166 -1.783 1.00 . A A . 115 LYS HD3 1 1 1 1749 1 1 115 LYS HE2 H 10.750 12.288 -3.888 1.00 . A A . 115 LYS HE2 1 1 1 1750 1 1 115 LYS HE3 H 9.478 12.877 -2.817 1.00 . A A . 115 LYS HE3 1 1 1 1751 1 1 115 LYS HG2 H 9.716 12.673 -0.371 1.00 . A A . 115 LYS HG2 1 1 1 1752 1 1 115 LYS HG3 H 10.918 13.945 -0.579 1.00 . A A . 115 LYS HG3 1 1 1 1753 1 1 115 LYS HZ1 H 11.109 14.470 -4.187 1.00 . A A . 115 LYS HZ1 1 1 1 1754 1 1 115 LYS HZ2 H 11.979 14.342 -2.732 1.00 . A A . 115 LYS HZ2 1 1 1 1755 1 1 115 LYS HZ3 H 10.379 14.916 -2.722 1.00 . A A . 115 LYS HZ3 1 1 1 1756 1 1 115 LYS N N 9.987 10.470 0.457 1.00 . A A . 115 LYS N 1 1 1 1757 1 1 115 LYS NZ N 11.040 14.252 -3.173 1.00 . A A . 115 LYS NZ 1 1 1 1758 1 1 115 LYS O O 11.485 11.049 3.163 1.00 . A A . 115 LYS O 1 1 1 1759 1 1 116 LEU C C 14.218 8.619 3.702 1.00 . A A . 116 LEU C 1 1 1 1760 1 1 116 LEU CA C 12.704 8.598 3.572 1.00 . A A . 116 LEU CA 1 1 1 1761 1 1 116 LEU CB C 12.203 7.158 3.699 1.00 . A A . 116 LEU CB 1 1 1 1762 1 1 116 LEU CD1 C 10.198 5.665 3.557 1.00 . A A . 116 LEU CD1 1 1 1 1763 1 1 116 LEU CD2 C 9.937 8.032 4.350 1.00 . A A . 116 LEU CD2 1 1 1 1764 1 1 116 LEU CG C 10.701 7.104 3.393 1.00 . A A . 116 LEU CG 1 1 1 1765 1 1 116 LEU H H 12.462 8.629 1.462 1.00 . A A . 116 LEU H 1 1 1 1766 1 1 116 LEU HA H 12.279 9.190 4.370 1.00 . A A . 116 LEU HA 1 1 1 1767 1 1 116 LEU HB2 H 12.736 6.528 3.002 1.00 . A A . 116 LEU HB2 1 1 1 1768 1 1 116 LEU HB3 H 12.374 6.805 4.705 1.00 . A A . 116 LEU HB3 1 1 1 1769 1 1 116 LEU HD11 H 9.244 5.560 3.061 1.00 . A A . 116 LEU HD11 1 1 1 1770 1 1 116 LEU HD12 H 10.082 5.442 4.607 1.00 . A A . 116 LEU HD12 1 1 1 1771 1 1 116 LEU HD13 H 10.909 4.979 3.120 1.00 . A A . 116 LEU HD13 1 1 1 1772 1 1 116 LEU HD21 H 8.899 7.733 4.395 1.00 . A A . 116 LEU HD21 1 1 1 1773 1 1 116 LEU HD22 H 9.999 9.049 3.992 1.00 . A A . 116 LEU HD22 1 1 1 1774 1 1 116 LEU HD23 H 10.370 7.972 5.338 1.00 . A A . 116 LEU HD23 1 1 1 1775 1 1 116 LEU HG H 10.537 7.423 2.373 1.00 . A A . 116 LEU HG 1 1 1 1776 1 1 116 LEU N N 12.317 9.155 2.277 1.00 . A A . 116 LEU N 1 1 1 1777 1 1 116 LEU O O 14.941 8.379 2.736 1.00 . A A . 116 LEU O 1 1 1 1778 1 1 117 THR C C 16.632 7.642 5.690 1.00 . A A . 117 THR C 1 1 1 1779 1 1 117 THR CA C 16.122 8.983 5.178 1.00 . A A . 117 THR CA 1 1 1 1780 1 1 117 THR CB C 16.415 10.072 6.211 1.00 . A A . 117 THR CB 1 1 1 1781 1 1 117 THR CG2 C 15.556 11.303 5.915 1.00 . A A . 117 THR CG2 1 1 1 1782 1 1 117 THR H H 14.055 9.093 5.637 1.00 . A A . 117 THR H 1 1 1 1783 1 1 117 THR HA H 16.645 9.228 4.263 1.00 . A A . 117 THR HA 1 1 1 1784 1 1 117 THR HB H 17.457 10.346 6.159 1.00 . A A . 117 THR HB 1 1 1 1785 1 1 117 THR HG1 H 15.587 8.787 7.412 1.00 . A A . 117 THR HG1 1 1 1 1786 1 1 117 THR HG21 H 14.515 11.061 6.072 1.00 . A A . 117 THR HG21 1 1 1 1787 1 1 117 THR HG22 H 15.705 11.608 4.890 1.00 . A A . 117 THR HG22 1 1 1 1788 1 1 117 THR HG23 H 15.843 12.108 6.575 1.00 . A A . 117 THR HG23 1 1 1 1789 1 1 117 THR N N 14.688 8.919 4.910 1.00 . A A . 117 THR N 1 1 1 1790 1 1 117 THR O O 15.848 6.747 6.001 1.00 . A A . 117 THR O 1 1 1 1791 1 1 117 THR OG1 O 16.116 9.583 7.510 1.00 . A A . 117 THR OG1 1 1 1 1792 1 1 118 ASP C C 18.119 5.985 7.669 1.00 . A A . 118 ASP C 1 1 1 1793 1 1 118 ASP CA C 18.556 6.269 6.235 1.00 . A A . 118 ASP CA 1 1 1 1794 1 1 118 ASP CB C 20.088 6.384 6.167 1.00 . A A . 118 ASP CB 1 1 1 1795 1 1 118 ASP CG C 20.587 6.112 4.747 1.00 . A A . 118 ASP CG 1 1 1 1796 1 1 118 ASP H H 18.527 8.251 5.496 1.00 . A A . 118 ASP H 1 1 1 1797 1 1 118 ASP HA H 18.229 5.455 5.608 1.00 . A A . 118 ASP HA 1 1 1 1798 1 1 118 ASP HB2 H 20.384 7.379 6.462 1.00 . A A . 118 ASP HB2 1 1 1 1799 1 1 118 ASP HB3 H 20.535 5.666 6.841 1.00 . A A . 118 ASP HB3 1 1 1 1800 1 1 118 ASP N N 17.949 7.508 5.768 1.00 . A A . 118 ASP N 1 1 1 1801 1 1 118 ASP O O 17.930 4.831 8.053 1.00 . A A . 118 ASP O 1 1 1 1802 1 1 118 ASP OD1 O 19.844 5.530 3.976 1.00 . A A . 118 ASP OD1 1 1 1 1803 1 1 118 ASP OD2 O 21.708 6.495 4.454 1.00 . A A . 118 ASP OD2 1 1 1 1804 1 1 119 GLU C C 16.113 6.347 9.910 1.00 . A A . 119 GLU C 1 1 1 1805 1 1 119 GLU CA C 17.540 6.885 9.843 1.00 . A A . 119 GLU CA 1 1 1 1806 1 1 119 GLU CB C 17.616 8.231 10.565 1.00 . A A . 119 GLU CB 1 1 1 1807 1 1 119 GLU CD C 17.411 9.363 12.787 1.00 . A A . 119 GLU CD 1 1 1 1808 1 1 119 GLU CG C 17.272 8.040 12.044 1.00 . A A . 119 GLU CG 1 1 1 1809 1 1 119 GLU H H 18.117 7.940 8.098 1.00 . A A . 119 GLU H 1 1 1 1810 1 1 119 GLU HA H 18.202 6.187 10.331 1.00 . A A . 119 GLU HA 1 1 1 1811 1 1 119 GLU HB2 H 18.616 8.630 10.477 1.00 . A A . 119 GLU HB2 1 1 1 1812 1 1 119 GLU HB3 H 16.913 8.919 10.121 1.00 . A A . 119 GLU HB3 1 1 1 1813 1 1 119 GLU HG2 H 16.255 7.686 12.134 1.00 . A A . 119 GLU HG2 1 1 1 1814 1 1 119 GLU HG3 H 17.943 7.315 12.478 1.00 . A A . 119 GLU HG3 1 1 1 1815 1 1 119 GLU N N 17.958 7.042 8.457 1.00 . A A . 119 GLU N 1 1 1 1816 1 1 119 GLU O O 15.811 5.466 10.713 1.00 . A A . 119 GLU O 1 1 1 1817 1 1 119 GLU OE1 O 18.011 10.271 12.233 1.00 . A A . 119 GLU OE1 1 1 1 1818 1 1 119 GLU OE2 O 16.917 9.452 13.899 1.00 . A A . 119 GLU OE2 1 1 1 1819 1 1 120 GLU C C 13.754 4.994 8.565 1.00 . A A . 120 GLU C 1 1 1 1820 1 1 120 GLU CA C 13.848 6.442 9.034 1.00 . A A . 120 GLU CA 1 1 1 1821 1 1 120 GLU CB C 13.037 7.342 8.101 1.00 . A A . 120 GLU CB 1 1 1 1822 1 1 120 GLU CD C 12.211 9.677 7.742 1.00 . A A . 120 GLU CD 1 1 1 1823 1 1 120 GLU CG C 12.933 8.744 8.706 1.00 . A A . 120 GLU CG 1 1 1 1824 1 1 120 GLU H H 15.537 7.578 8.439 1.00 . A A . 120 GLU H 1 1 1 1825 1 1 120 GLU HA H 13.441 6.514 10.031 1.00 . A A . 120 GLU HA 1 1 1 1826 1 1 120 GLU HB2 H 13.527 7.398 7.140 1.00 . A A . 120 GLU HB2 1 1 1 1827 1 1 120 GLU HB3 H 12.046 6.932 7.976 1.00 . A A . 120 GLU HB3 1 1 1 1828 1 1 120 GLU HG2 H 12.383 8.693 9.635 1.00 . A A . 120 GLU HG2 1 1 1 1829 1 1 120 GLU HG3 H 13.925 9.126 8.898 1.00 . A A . 120 GLU HG3 1 1 1 1830 1 1 120 GLU N N 15.241 6.880 9.059 1.00 . A A . 120 GLU N 1 1 1 1831 1 1 120 GLU O O 12.982 4.202 9.109 1.00 . A A . 120 GLU O 1 1 1 1832 1 1 120 GLU OE1 O 11.844 9.219 6.674 1.00 . A A . 120 GLU OE1 1 1 1 1833 1 1 120 GLU OE2 O 12.034 10.834 8.085 1.00 . A A . 120 GLU OE2 1 1 1 1834 1 1 121 VAL C C 15.052 2.314 8.077 1.00 . A A . 121 VAL C 1 1 1 1835 1 1 121 VAL CA C 14.552 3.298 7.023 1.00 . A A . 121 VAL CA 1 1 1 1836 1 1 121 VAL CB C 15.445 3.224 5.781 1.00 . A A . 121 VAL CB 1 1 1 1837 1 1 121 VAL CG1 C 15.547 1.771 5.311 1.00 . A A . 121 VAL CG1 1 1 1 1838 1 1 121 VAL CG2 C 14.835 4.077 4.666 1.00 . A A . 121 VAL CG2 1 1 1 1839 1 1 121 VAL H H 15.141 5.331 7.169 1.00 . A A . 121 VAL H 1 1 1 1840 1 1 121 VAL HA H 13.544 3.029 6.743 1.00 . A A . 121 VAL HA 1 1 1 1841 1 1 121 VAL HB H 16.429 3.594 6.024 1.00 . A A . 121 VAL HB 1 1 1 1842 1 1 121 VAL HG11 H 14.562 1.330 5.291 1.00 . A A . 121 VAL HG11 1 1 1 1843 1 1 121 VAL HG12 H 16.175 1.216 5.992 1.00 . A A . 121 VAL HG12 1 1 1 1844 1 1 121 VAL HG13 H 15.975 1.742 4.320 1.00 . A A . 121 VAL HG13 1 1 1 1845 1 1 121 VAL HG21 H 15.569 4.231 3.889 1.00 . A A . 121 VAL HG21 1 1 1 1846 1 1 121 VAL HG22 H 14.532 5.032 5.068 1.00 . A A . 121 VAL HG22 1 1 1 1847 1 1 121 VAL HG23 H 13.975 3.571 4.254 1.00 . A A . 121 VAL HG23 1 1 1 1848 1 1 121 VAL N N 14.547 4.654 7.556 1.00 . A A . 121 VAL N 1 1 1 1849 1 1 121 VAL O O 14.487 1.235 8.251 1.00 . A A . 121 VAL O 1 1 1 1850 1 1 122 ASP C C 15.666 1.579 10.910 1.00 . A A . 122 ASP C 1 1 1 1851 1 1 122 ASP CA C 16.688 1.837 9.808 1.00 . A A . 122 ASP CA 1 1 1 1852 1 1 122 ASP CB C 17.934 2.498 10.404 1.00 . A A . 122 ASP CB 1 1 1 1853 1 1 122 ASP CG C 19.080 2.455 9.398 1.00 . A A . 122 ASP CG 1 1 1 1854 1 1 122 ASP H H 16.527 3.566 8.593 1.00 . A A . 122 ASP H 1 1 1 1855 1 1 122 ASP HA H 16.970 0.895 9.365 1.00 . A A . 122 ASP HA 1 1 1 1856 1 1 122 ASP HB2 H 17.710 3.525 10.650 1.00 . A A . 122 ASP HB2 1 1 1 1857 1 1 122 ASP HB3 H 18.225 1.970 11.301 1.00 . A A . 122 ASP HB3 1 1 1 1858 1 1 122 ASP N N 16.118 2.695 8.776 1.00 . A A . 122 ASP N 1 1 1 1859 1 1 122 ASP O O 15.523 0.454 11.387 1.00 . A A . 122 ASP O 1 1 1 1860 1 1 122 ASP OD1 O 18.972 1.714 8.436 1.00 . A A . 122 ASP OD1 1 1 1 1861 1 1 122 ASP OD2 O 20.049 3.166 9.607 1.00 . A A . 122 ASP OD2 1 1 1 1862 1 1 123 GLU C C 12.820 1.576 11.889 1.00 . A A . 123 GLU C 1 1 1 1863 1 1 123 GLU CA C 13.942 2.499 12.349 1.00 . A A . 123 GLU CA 1 1 1 1864 1 1 123 GLU CB C 13.369 3.876 12.695 1.00 . A A . 123 GLU CB 1 1 1 1865 1 1 123 GLU CD C 14.677 4.111 14.816 1.00 . A A . 123 GLU CD 1 1 1 1866 1 1 123 GLU CG C 14.422 4.704 13.435 1.00 . A A . 123 GLU CG 1 1 1 1867 1 1 123 GLU H H 15.112 3.500 10.890 1.00 . A A . 123 GLU H 1 1 1 1868 1 1 123 GLU HA H 14.399 2.077 13.231 1.00 . A A . 123 GLU HA 1 1 1 1869 1 1 123 GLU HB2 H 13.086 4.386 11.784 1.00 . A A . 123 GLU HB2 1 1 1 1870 1 1 123 GLU HB3 H 12.499 3.758 13.325 1.00 . A A . 123 GLU HB3 1 1 1 1871 1 1 123 GLU HG2 H 15.343 4.698 12.870 1.00 . A A . 123 GLU HG2 1 1 1 1872 1 1 123 GLU HG3 H 14.074 5.720 13.540 1.00 . A A . 123 GLU HG3 1 1 1 1873 1 1 123 GLU N N 14.953 2.628 11.306 1.00 . A A . 123 GLU N 1 1 1 1874 1 1 123 GLU O O 12.318 0.760 12.662 1.00 . A A . 123 GLU O 1 1 1 1875 1 1 123 GLU OE1 O 13.811 3.401 15.302 1.00 . A A . 123 GLU OE1 1 1 1 1876 1 1 123 GLU OE2 O 15.733 4.373 15.367 1.00 . A A . 123 GLU OE2 1 1 1 1877 1 1 124 MET C C 11.760 -0.595 10.156 1.00 . A A . 124 MET C 1 1 1 1878 1 1 124 MET CA C 11.367 0.876 10.077 1.00 . A A . 124 MET CA 1 1 1 1879 1 1 124 MET CB C 11.104 1.264 8.618 1.00 . A A . 124 MET CB 1 1 1 1880 1 1 124 MET CE C 8.084 -0.051 6.136 1.00 . A A . 124 MET CE 1 1 1 1881 1 1 124 MET CG C 9.890 0.495 8.092 1.00 . A A . 124 MET CG 1 1 1 1882 1 1 124 MET H H 12.867 2.372 10.052 1.00 . A A . 124 MET H 1 1 1 1883 1 1 124 MET HA H 10.466 1.032 10.649 1.00 . A A . 124 MET HA 1 1 1 1884 1 1 124 MET HB2 H 10.913 2.325 8.557 1.00 . A A . 124 MET HB2 1 1 1 1885 1 1 124 MET HB3 H 11.969 1.020 8.020 1.00 . A A . 124 MET HB3 1 1 1 1886 1 1 124 MET HE1 H 8.344 -1.097 6.075 1.00 . A A . 124 MET HE1 1 1 1 1887 1 1 124 MET HE2 H 7.581 0.240 5.229 1.00 . A A . 124 MET HE2 1 1 1 1888 1 1 124 MET HE3 H 7.429 0.116 6.973 1.00 . A A . 124 MET HE3 1 1 1 1889 1 1 124 MET HG2 H 10.075 -0.564 8.167 1.00 . A A . 124 MET HG2 1 1 1 1890 1 1 124 MET HG3 H 9.025 0.754 8.682 1.00 . A A . 124 MET HG3 1 1 1 1891 1 1 124 MET N N 12.431 1.708 10.625 1.00 . A A . 124 MET N 1 1 1 1892 1 1 124 MET O O 10.978 -1.434 10.603 1.00 . A A . 124 MET O 1 1 1 1893 1 1 124 MET SD S 9.588 0.935 6.360 1.00 . A A . 124 MET SD 1 1 1 1894 1 1 125 ILE C C 13.705 -2.726 11.207 1.00 . A A . 125 ILE C 1 1 1 1895 1 1 125 ILE CA C 13.468 -2.276 9.770 1.00 . A A . 125 ILE CA 1 1 1 1896 1 1 125 ILE CB C 14.771 -2.397 8.975 1.00 . A A . 125 ILE CB 1 1 1 1897 1 1 125 ILE CD1 C 15.775 -2.109 6.694 1.00 . A A . 125 ILE CD1 1 1 1 1898 1 1 125 ILE CG1 C 14.470 -2.284 7.477 1.00 . A A . 125 ILE CG1 1 1 1 1899 1 1 125 ILE CG2 C 15.452 -3.743 9.262 1.00 . A A . 125 ILE CG2 1 1 1 1900 1 1 125 ILE H H 13.566 -0.192 9.387 1.00 . A A . 125 ILE H 1 1 1 1901 1 1 125 ILE HA H 12.727 -2.920 9.321 1.00 . A A . 125 ILE HA 1 1 1 1902 1 1 125 ILE HB H 15.436 -1.596 9.265 1.00 . A A . 125 ILE HB 1 1 1 1903 1 1 125 ILE HD11 H 16.601 -2.550 7.239 1.00 . A A . 125 ILE HD11 1 1 1 1904 1 1 125 ILE HD12 H 15.961 -1.057 6.549 1.00 . A A . 125 ILE HD12 1 1 1 1905 1 1 125 ILE HD13 H 15.680 -2.593 5.735 1.00 . A A . 125 ILE HD13 1 1 1 1906 1 1 125 ILE HG12 H 13.970 -3.180 7.144 1.00 . A A . 125 ILE HG12 1 1 1 1907 1 1 125 ILE HG13 H 13.832 -1.431 7.301 1.00 . A A . 125 ILE HG13 1 1 1 1908 1 1 125 ILE HG21 H 16.166 -3.967 8.483 1.00 . A A . 125 ILE HG21 1 1 1 1909 1 1 125 ILE HG22 H 14.708 -4.521 9.302 1.00 . A A . 125 ILE HG22 1 1 1 1910 1 1 125 ILE HG23 H 15.964 -3.689 10.211 1.00 . A A . 125 ILE HG23 1 1 1 1911 1 1 125 ILE N N 12.981 -0.901 9.726 1.00 . A A . 125 ILE N 1 1 1 1912 1 1 125 ILE O O 13.300 -3.816 11.596 1.00 . A A . 125 ILE O 1 1 1 1913 1 1 126 ARG C C 13.396 -2.435 14.155 1.00 . A A . 126 ARG C 1 1 1 1914 1 1 126 ARG CA C 14.679 -2.221 13.367 1.00 . A A . 126 ARG CA 1 1 1 1915 1 1 126 ARG CB C 15.498 -1.097 14.006 1.00 . A A . 126 ARG CB 1 1 1 1916 1 1 126 ARG CD C 16.712 -0.369 16.066 1.00 . A A . 126 ARG CD 1 1 1 1917 1 1 126 ARG CG C 15.898 -1.494 15.430 1.00 . A A . 126 ARG CG 1 1 1 1918 1 1 126 ARG CZ C 16.484 -0.707 18.462 1.00 . A A . 126 ARG CZ 1 1 1 1919 1 1 126 ARG H H 14.686 -1.030 11.614 1.00 . A A . 126 ARG H 1 1 1 1920 1 1 126 ARG HA H 15.263 -3.131 13.387 1.00 . A A . 126 ARG HA 1 1 1 1921 1 1 126 ARG HB2 H 16.387 -0.919 13.418 1.00 . A A . 126 ARG HB2 1 1 1 1922 1 1 126 ARG HB3 H 14.904 -0.196 14.041 1.00 . A A . 126 ARG HB3 1 1 1 1923 1 1 126 ARG HD2 H 17.539 -0.116 15.419 1.00 . A A . 126 ARG HD2 1 1 1 1924 1 1 126 ARG HD3 H 16.081 0.500 16.194 1.00 . A A . 126 ARG HD3 1 1 1 1925 1 1 126 ARG HE H 18.138 -1.151 17.425 1.00 . A A . 126 ARG HE 1 1 1 1926 1 1 126 ARG HG2 H 15.011 -1.671 16.020 1.00 . A A . 126 ARG HG2 1 1 1 1927 1 1 126 ARG HG3 H 16.495 -2.393 15.399 1.00 . A A . 126 ARG HG3 1 1 1 1928 1 1 126 ARG HH11 H 14.898 0.057 17.510 1.00 . A A . 126 ARG HH11 1 1 1 1929 1 1 126 ARG HH12 H 14.708 -0.172 19.216 1.00 . A A . 126 ARG HH12 1 1 1 1930 1 1 126 ARG HH21 H 17.899 -1.455 19.664 1.00 . A A . 126 ARG HH21 1 1 1 1931 1 1 126 ARG HH22 H 16.408 -1.029 20.435 1.00 . A A . 126 ARG HH22 1 1 1 1932 1 1 126 ARG N N 14.377 -1.884 11.983 1.00 . A A . 126 ARG N 1 1 1 1933 1 1 126 ARG NE N 17.227 -0.794 17.363 1.00 . A A . 126 ARG NE 1 1 1 1934 1 1 126 ARG NH1 N 15.269 -0.237 18.390 1.00 . A A . 126 ARG NH1 1 1 1 1935 1 1 126 ARG NH2 N 16.968 -1.093 19.609 1.00 . A A . 126 ARG NH2 1 1 1 1936 1 1 126 ARG O O 13.278 -3.394 14.920 1.00 . A A . 126 ARG O 1 1 1 1937 1 1 127 GLU C C 10.382 -2.852 14.174 1.00 . A A . 127 GLU C 1 1 1 1938 1 1 127 GLU CA C 11.164 -1.639 14.657 1.00 . A A . 127 GLU CA 1 1 1 1939 1 1 127 GLU CB C 10.340 -0.371 14.430 1.00 . A A . 127 GLU CB 1 1 1 1940 1 1 127 GLU CD C 8.283 0.859 15.140 1.00 . A A . 127 GLU CD 1 1 1 1941 1 1 127 GLU CG C 9.033 -0.465 15.221 1.00 . A A . 127 GLU CG 1 1 1 1942 1 1 127 GLU H H 12.590 -0.800 13.337 1.00 . A A . 127 GLU H 1 1 1 1943 1 1 127 GLU HA H 11.351 -1.746 15.714 1.00 . A A . 127 GLU HA 1 1 1 1944 1 1 127 GLU HB2 H 10.903 0.490 14.763 1.00 . A A . 127 GLU HB2 1 1 1 1945 1 1 127 GLU HB3 H 10.115 -0.271 13.379 1.00 . A A . 127 GLU HB3 1 1 1 1946 1 1 127 GLU HG2 H 8.418 -1.251 14.806 1.00 . A A . 127 GLU HG2 1 1 1 1947 1 1 127 GLU HG3 H 9.252 -0.688 16.254 1.00 . A A . 127 GLU HG3 1 1 1 1948 1 1 127 GLU N N 12.438 -1.540 13.962 1.00 . A A . 127 GLU N 1 1 1 1949 1 1 127 GLU O O 9.566 -3.407 14.908 1.00 . A A . 127 GLU O 1 1 1 1950 1 1 127 GLU OE1 O 8.706 1.709 14.375 1.00 . A A . 127 GLU OE1 1 1 1 1951 1 1 127 GLU OE2 O 7.295 1.003 15.841 1.00 . A A . 127 GLU OE2 1 1 1 1952 1 1 128 ALA C C 10.759 -5.692 12.570 1.00 . A A . 128 ALA C 1 1 1 1953 1 1 128 ALA CA C 9.948 -4.418 12.359 1.00 . A A . 128 ALA CA 1 1 1 1954 1 1 128 ALA CB C 9.740 -4.195 10.864 1.00 . A A . 128 ALA CB 1 1 1 1955 1 1 128 ALA H H 11.303 -2.793 12.391 1.00 . A A . 128 ALA H 1 1 1 1956 1 1 128 ALA HA H 8.984 -4.536 12.831 1.00 . A A . 128 ALA HA 1 1 1 1957 1 1 128 ALA HB1 H 10.690 -4.253 10.355 1.00 . A A . 128 ALA HB1 1 1 1 1958 1 1 128 ALA HB2 H 9.306 -3.220 10.708 1.00 . A A . 128 ALA HB2 1 1 1 1959 1 1 128 ALA HB3 H 9.078 -4.955 10.476 1.00 . A A . 128 ALA HB3 1 1 1 1960 1 1 128 ALA N N 10.637 -3.264 12.934 1.00 . A A . 128 ALA N 1 1 1 1961 1 1 128 ALA O O 10.214 -6.796 12.556 1.00 . A A . 128 ALA O 1 1 1 1962 1 1 129 ASP C C 13.014 -7.041 14.445 1.00 . A A . 129 ASP C 1 1 1 1963 1 1 129 ASP CA C 12.948 -6.678 12.967 1.00 . A A . 129 ASP CA 1 1 1 1964 1 1 129 ASP CB C 14.351 -6.354 12.455 1.00 . A A . 129 ASP CB 1 1 1 1965 1 1 129 ASP CG C 15.177 -7.626 12.378 1.00 . A A . 129 ASP CG 1 1 1 1966 1 1 129 ASP H H 12.446 -4.630 12.757 1.00 . A A . 129 ASP H 1 1 1 1967 1 1 129 ASP HA H 12.565 -7.524 12.416 1.00 . A A . 129 ASP HA 1 1 1 1968 1 1 129 ASP HB2 H 14.284 -5.916 11.472 1.00 . A A . 129 ASP HB2 1 1 1 1969 1 1 129 ASP HB3 H 14.830 -5.658 13.129 1.00 . A A . 129 ASP HB3 1 1 1 1970 1 1 129 ASP N N 12.065 -5.533 12.760 1.00 . A A . 129 ASP N 1 1 1 1971 1 1 129 ASP O O 13.609 -6.319 15.245 1.00 . A A . 129 ASP O 1 1 1 1972 1 1 129 ASP OD1 O 14.595 -8.694 12.460 1.00 . A A . 129 ASP OD1 1 1 1 1973 1 1 129 ASP OD2 O 16.377 -7.512 12.234 1.00 . A A . 129 ASP OD2 1 1 1 1974 1 1 130 ILE C C 13.786 -9.004 16.637 1.00 . A A . 130 ILE C 1 1 1 1975 1 1 130 ILE CA C 12.384 -8.604 16.187 1.00 . A A . 130 ILE CA 1 1 1 1976 1 1 130 ILE CB C 11.434 -9.799 16.341 1.00 . A A . 130 ILE CB 1 1 1 1977 1 1 130 ILE CD1 C 10.991 -12.148 15.571 1.00 . A A . 130 ILE CD1 1 1 1 1978 1 1 130 ILE CG1 C 12.034 -11.029 15.639 1.00 . A A . 130 ILE CG1 1 1 1 1979 1 1 130 ILE CG2 C 10.080 -9.458 15.711 1.00 . A A . 130 ILE CG2 1 1 1 1980 1 1 130 ILE H H 11.935 -8.695 14.119 1.00 . A A . 130 ILE H 1 1 1 1981 1 1 130 ILE HA H 12.030 -7.796 16.811 1.00 . A A . 130 ILE HA 1 1 1 1982 1 1 130 ILE HB H 11.298 -10.012 17.391 1.00 . A A . 130 ILE HB 1 1 1 1983 1 1 130 ILE HD11 H 11.480 -13.079 15.330 1.00 . A A . 130 ILE HD11 1 1 1 1984 1 1 130 ILE HD12 H 10.261 -11.914 14.810 1.00 . A A . 130 ILE HD12 1 1 1 1985 1 1 130 ILE HD13 H 10.498 -12.237 16.528 1.00 . A A . 130 ILE HD13 1 1 1 1986 1 1 130 ILE HG12 H 12.344 -10.762 14.642 1.00 . A A . 130 ILE HG12 1 1 1 1987 1 1 130 ILE HG13 H 12.888 -11.381 16.198 1.00 . A A . 130 ILE HG13 1 1 1 1988 1 1 130 ILE HG21 H 9.782 -8.464 16.009 1.00 . A A . 130 ILE HG21 1 1 1 1989 1 1 130 ILE HG22 H 9.340 -10.171 16.044 1.00 . A A . 130 ILE HG22 1 1 1 1990 1 1 130 ILE HG23 H 10.162 -9.503 14.635 1.00 . A A . 130 ILE HG23 1 1 1 1991 1 1 130 ILE N N 12.395 -8.161 14.801 1.00 . A A . 130 ILE N 1 1 1 1992 1 1 130 ILE O O 14.197 -8.702 17.757 1.00 . A A . 130 ILE O 1 1 1 1993 1 1 131 ASP C C 16.845 -8.976 16.007 1.00 . A A . 131 ASP C 1 1 1 1994 1 1 131 ASP CA C 15.860 -10.136 16.086 1.00 . A A . 131 ASP CA 1 1 1 1995 1 1 131 ASP CB C 16.288 -11.243 15.119 1.00 . A A . 131 ASP CB 1 1 1 1996 1 1 131 ASP CG C 16.176 -10.757 13.676 1.00 . A A . 131 ASP CG 1 1 1 1997 1 1 131 ASP H H 14.136 -9.914 14.884 1.00 . A A . 131 ASP H 1 1 1 1998 1 1 131 ASP HA H 15.864 -10.531 17.090 1.00 . A A . 131 ASP HA 1 1 1 1999 1 1 131 ASP HB2 H 17.312 -11.520 15.324 1.00 . A A . 131 ASP HB2 1 1 1 2000 1 1 131 ASP HB3 H 15.651 -12.103 15.255 1.00 . A A . 131 ASP HB3 1 1 1 2001 1 1 131 ASP N N 14.510 -9.692 15.761 1.00 . A A . 131 ASP N 1 1 1 2002 1 1 131 ASP O O 17.870 -8.974 16.689 1.00 . A A . 131 ASP O 1 1 1 2003 1 1 131 ASP OD1 O 16.523 -9.618 13.429 1.00 . A A . 131 ASP OD1 1 1 1 2004 1 1 131 ASP OD2 O 15.743 -11.534 12.839 1.00 . A A . 131 ASP OD2 1 1 1 2005 1 1 132 GLY C C 18.634 -7.173 14.191 1.00 . A A . 132 GLY C 1 1 1 2006 1 1 132 GLY CA C 17.400 -6.829 15.022 1.00 . A A . 132 GLY CA 1 1 1 2007 1 1 132 GLY H H 15.701 -8.036 14.654 1.00 . A A . 132 GLY H 1 1 1 2008 1 1 132 GLY HA2 H 16.850 -6.040 14.530 1.00 . A A . 132 GLY HA2 1 1 1 2009 1 1 132 GLY HA3 H 17.713 -6.488 15.997 1.00 . A A . 132 GLY HA3 1 1 1 2010 1 1 132 GLY N N 16.529 -7.987 15.176 1.00 . A A . 132 GLY N 1 1 1 2011 1 1 132 GLY O O 19.719 -6.644 14.428 1.00 . A A . 132 GLY O 1 1 1 2012 1 1 133 ASP C C 19.792 -7.444 11.252 1.00 . A A . 133 ASP C 1 1 1 2013 1 1 133 ASP CA C 19.563 -8.472 12.356 1.00 . A A . 133 ASP CA 1 1 1 2014 1 1 133 ASP CB C 19.258 -9.839 11.732 1.00 . A A . 133 ASP CB 1 1 1 2015 1 1 133 ASP CG C 18.124 -9.723 10.714 1.00 . A A . 133 ASP CG 1 1 1 2016 1 1 133 ASP H H 17.573 -8.446 13.073 1.00 . A A . 133 ASP H 1 1 1 2017 1 1 133 ASP HA H 20.461 -8.554 12.949 1.00 . A A . 133 ASP HA 1 1 1 2018 1 1 133 ASP HB2 H 20.143 -10.209 11.237 1.00 . A A . 133 ASP HB2 1 1 1 2019 1 1 133 ASP HB3 H 18.969 -10.529 12.509 1.00 . A A . 133 ASP HB3 1 1 1 2020 1 1 133 ASP N N 18.462 -8.062 13.218 1.00 . A A . 133 ASP N 1 1 1 2021 1 1 133 ASP O O 20.630 -7.640 10.373 1.00 . A A . 133 ASP O 1 1 1 2022 1 1 133 ASP OD1 O 17.574 -8.645 10.586 1.00 . A A . 133 ASP OD1 1 1 1 2023 1 1 133 ASP OD2 O 17.818 -10.721 10.081 1.00 . A A . 133 ASP OD2 1 1 1 2024 1 1 134 GLY C C 18.375 -5.616 9.057 1.00 . A A . 134 GLY C 1 1 1 2025 1 1 134 GLY CA C 19.176 -5.288 10.308 1.00 . A A . 134 GLY CA 1 1 1 2026 1 1 134 GLY H H 18.394 -6.233 12.033 1.00 . A A . 134 GLY H 1 1 1 2027 1 1 134 GLY HA2 H 18.818 -4.358 10.726 1.00 . A A . 134 GLY HA2 1 1 1 2028 1 1 134 GLY HA3 H 20.217 -5.179 10.041 1.00 . A A . 134 GLY HA3 1 1 1 2029 1 1 134 GLY N N 19.043 -6.345 11.307 1.00 . A A . 134 GLY N 1 1 1 2030 1 1 134 GLY O O 18.528 -4.966 8.023 1.00 . A A . 134 GLY O 1 1 1 2031 1 1 135 GLN C C 15.354 -7.549 8.492 1.00 . A A . 135 GLN C 1 1 1 2032 1 1 135 GLN CA C 16.703 -7.040 8.014 1.00 . A A . 135 GLN CA 1 1 1 2033 1 1 135 GLN CB C 17.409 -8.141 7.225 1.00 . A A . 135 GLN CB 1 1 1 2034 1 1 135 GLN CD C 19.357 -8.636 5.731 1.00 . A A . 135 GLN CD 1 1 1 2035 1 1 135 GLN CG C 18.706 -7.590 6.627 1.00 . A A . 135 GLN CG 1 1 1 2036 1 1 135 GLN H H 17.444 -7.112 9.999 1.00 . A A . 135 GLN H 1 1 1 2037 1 1 135 GLN HA H 16.542 -6.192 7.363 1.00 . A A . 135 GLN HA 1 1 1 2038 1 1 135 GLN HB2 H 17.636 -8.968 7.883 1.00 . A A . 135 GLN HB2 1 1 1 2039 1 1 135 GLN HB3 H 16.764 -8.479 6.431 1.00 . A A . 135 GLN HB3 1 1 1 2040 1 1 135 GLN HE21 H 21.054 -8.671 6.761 1.00 . A A . 135 GLN HE21 1 1 1 2041 1 1 135 GLN HE22 H 20.995 -9.712 5.421 1.00 . A A . 135 GLN HE22 1 1 1 2042 1 1 135 GLN HG2 H 18.487 -6.706 6.047 1.00 . A A . 135 GLN HG2 1 1 1 2043 1 1 135 GLN HG3 H 19.388 -7.334 7.424 1.00 . A A . 135 GLN HG3 1 1 1 2044 1 1 135 GLN N N 17.525 -6.631 9.151 1.00 . A A . 135 GLN N 1 1 1 2045 1 1 135 GLN NE2 N 20.569 -9.039 5.992 1.00 . A A . 135 GLN NE2 1 1 1 2046 1 1 135 GLN O O 15.189 -7.887 9.666 1.00 . A A . 135 GLN O 1 1 1 2047 1 1 135 GLN OE1 O 18.746 -9.099 4.769 1.00 . A A . 135 GLN OE1 1 1 1 2048 1 1 136 VAL C C 12.696 -9.334 7.134 1.00 . A A . 136 VAL C 1 1 1 2049 1 1 136 VAL CA C 13.038 -8.071 7.911 1.00 . A A . 136 VAL CA 1 1 1 2050 1 1 136 VAL CB C 12.008 -6.983 7.591 1.00 . A A . 136 VAL CB 1 1 1 2051 1 1 136 VAL CG1 C 10.699 -7.282 8.324 1.00 . A A . 136 VAL CG1 1 1 1 2052 1 1 136 VAL CG2 C 12.544 -5.629 8.057 1.00 . A A . 136 VAL CG2 1 1 1 2053 1 1 136 VAL H H 14.581 -7.312 6.656 1.00 . A A . 136 VAL H 1 1 1 2054 1 1 136 VAL HA H 12.987 -8.293 8.966 1.00 . A A . 136 VAL HA 1 1 1 2055 1 1 136 VAL HB H 11.826 -6.956 6.528 1.00 . A A . 136 VAL HB 1 1 1 2056 1 1 136 VAL HG11 H 9.961 -6.538 8.062 1.00 . A A . 136 VAL HG11 1 1 1 2057 1 1 136 VAL HG12 H 10.869 -7.261 9.390 1.00 . A A . 136 VAL HG12 1 1 1 2058 1 1 136 VAL HG13 H 10.341 -8.260 8.035 1.00 . A A . 136 VAL HG13 1 1 1 2059 1 1 136 VAL HG21 H 12.710 -5.659 9.123 1.00 . A A . 136 VAL HG21 1 1 1 2060 1 1 136 VAL HG22 H 11.827 -4.857 7.826 1.00 . A A . 136 VAL HG22 1 1 1 2061 1 1 136 VAL HG23 H 13.473 -5.417 7.551 1.00 . A A . 136 VAL HG23 1 1 1 2062 1 1 136 VAL N N 14.386 -7.600 7.576 1.00 . A A . 136 VAL N 1 1 1 2063 1 1 136 VAL O O 12.728 -9.346 5.904 1.00 . A A . 136 VAL O 1 1 1 2064 1 1 137 ASN C C 10.498 -11.782 7.083 1.00 . A A . 137 ASN C 1 1 1 2065 1 1 137 ASN CA C 12.010 -11.670 7.237 1.00 . A A . 137 ASN CA 1 1 1 2066 1 1 137 ASN CB C 12.528 -12.834 8.082 1.00 . A A . 137 ASN CB 1 1 1 2067 1 1 137 ASN CG C 12.263 -14.152 7.360 1.00 . A A . 137 ASN CG 1 1 1 2068 1 1 137 ASN H H 12.360 -10.326 8.840 1.00 . A A . 137 ASN H 1 1 1 2069 1 1 137 ASN HA H 12.465 -11.725 6.258 1.00 . A A . 137 ASN HA 1 1 1 2070 1 1 137 ASN HB2 H 13.590 -12.717 8.239 1.00 . A A . 137 ASN HB2 1 1 1 2071 1 1 137 ASN HB3 H 12.022 -12.840 9.036 1.00 . A A . 137 ASN HB3 1 1 1 2072 1 1 137 ASN HD21 H 13.556 -13.781 5.898 1.00 . A A . 137 ASN HD21 1 1 1 2073 1 1 137 ASN HD22 H 12.741 -15.267 5.789 1.00 . A A . 137 ASN HD22 1 1 1 2074 1 1 137 ASN N N 12.363 -10.397 7.863 1.00 . A A . 137 ASN N 1 1 1 2075 1 1 137 ASN ND2 N 12.907 -14.422 6.258 1.00 . A A . 137 ASN ND2 1 1 1 2076 1 1 137 ASN O O 9.755 -10.898 7.510 1.00 . A A . 137 ASN O 1 1 1 2077 1 1 137 ASN OD1 O 11.445 -14.953 7.812 1.00 . A A . 137 ASN OD1 1 1 1 2078 1 1 138 TYR C C 7.886 -13.133 7.605 1.00 . A A . 138 TYR C 1 1 1 2079 1 1 138 TYR CA C 8.619 -13.081 6.265 1.00 . A A . 138 TYR CA 1 1 1 2080 1 1 138 TYR CB C 8.395 -14.392 5.506 1.00 . A A . 138 TYR CB 1 1 1 2081 1 1 138 TYR CD1 C 6.197 -14.097 4.308 1.00 . A A . 138 TYR CD1 1 1 1 2082 1 1 138 TYR CD2 C 6.257 -15.448 6.320 1.00 . A A . 138 TYR CD2 1 1 1 2083 1 1 138 TYR CE1 C 4.823 -14.336 4.188 1.00 . A A . 138 TYR CE1 1 1 1 2084 1 1 138 TYR CE2 C 4.884 -15.687 6.201 1.00 . A A . 138 TYR CE2 1 1 1 2085 1 1 138 TYR CG C 6.914 -14.652 5.374 1.00 . A A . 138 TYR CG 1 1 1 2086 1 1 138 TYR CZ C 4.166 -15.131 5.134 1.00 . A A . 138 TYR CZ 1 1 1 2087 1 1 138 TYR H H 10.685 -13.541 6.148 1.00 . A A . 138 TYR H 1 1 1 2088 1 1 138 TYR HA H 8.224 -12.266 5.678 1.00 . A A . 138 TYR HA 1 1 1 2089 1 1 138 TYR HB2 H 8.837 -14.318 4.523 1.00 . A A . 138 TYR HB2 1 1 1 2090 1 1 138 TYR HB3 H 8.855 -15.205 6.048 1.00 . A A . 138 TYR HB3 1 1 1 2091 1 1 138 TYR HD1 H 6.704 -13.483 3.577 1.00 . A A . 138 TYR HD1 1 1 1 2092 1 1 138 TYR HD2 H 6.811 -15.876 7.143 1.00 . A A . 138 TYR HD2 1 1 1 2093 1 1 138 TYR HE1 H 4.270 -13.908 3.365 1.00 . A A . 138 TYR HE1 1 1 1 2094 1 1 138 TYR HE2 H 4.377 -16.300 6.931 1.00 . A A . 138 TYR HE2 1 1 1 2095 1 1 138 TYR HH H 2.391 -14.549 4.743 1.00 . A A . 138 TYR HH 1 1 1 2096 1 1 138 TYR N N 10.048 -12.870 6.470 1.00 . A A . 138 TYR N 1 1 1 2097 1 1 138 TYR O O 6.860 -12.473 7.792 1.00 . A A . 138 TYR O 1 1 1 2098 1 1 138 TYR OH O 2.812 -15.367 5.016 1.00 . A A . 138 TYR OH 1 1 1 2099 1 1 139 GLU C C 7.759 -12.686 10.544 1.00 . A A . 139 GLU C 1 1 1 2100 1 1 139 GLU CA C 7.809 -14.047 9.854 1.00 . A A . 139 GLU CA 1 1 1 2101 1 1 139 GLU CB C 8.611 -15.033 10.706 1.00 . A A . 139 GLU CB 1 1 1 2102 1 1 139 GLU CD C 8.664 -16.267 12.880 1.00 . A A . 139 GLU CD 1 1 1 2103 1 1 139 GLU CG C 7.910 -15.236 12.049 1.00 . A A . 139 GLU CG 1 1 1 2104 1 1 139 GLU H H 9.239 -14.418 8.333 1.00 . A A . 139 GLU H 1 1 1 2105 1 1 139 GLU HA H 6.803 -14.421 9.738 1.00 . A A . 139 GLU HA 1 1 1 2106 1 1 139 GLU HB2 H 8.683 -15.979 10.188 1.00 . A A . 139 GLU HB2 1 1 1 2107 1 1 139 GLU HB3 H 9.602 -14.639 10.875 1.00 . A A . 139 GLU HB3 1 1 1 2108 1 1 139 GLU HG2 H 7.880 -14.299 12.583 1.00 . A A . 139 GLU HG2 1 1 1 2109 1 1 139 GLU HG3 H 6.902 -15.584 11.877 1.00 . A A . 139 GLU HG3 1 1 1 2110 1 1 139 GLU N N 8.421 -13.918 8.536 1.00 . A A . 139 GLU N 1 1 1 2111 1 1 139 GLU O O 6.769 -12.329 11.183 1.00 . A A . 139 GLU O 1 1 1 2112 1 1 139 GLU OE1 O 9.776 -16.600 12.508 1.00 . A A . 139 GLU OE1 1 1 1 2113 1 1 139 GLU OE2 O 8.117 -16.708 13.878 1.00 . A A . 139 GLU OE2 1 1 1 2114 1 1 140 GLU C C 7.918 -9.665 10.342 1.00 . A A . 140 GLU C 1 1 1 2115 1 1 140 GLU CA C 8.898 -10.609 11.029 1.00 . A A . 140 GLU CA 1 1 1 2116 1 1 140 GLU CB C 10.313 -10.042 10.932 1.00 . A A . 140 GLU CB 1 1 1 2117 1 1 140 GLU CD C 12.667 -10.325 11.733 1.00 . A A . 140 GLU CD 1 1 1 2118 1 1 140 GLU CG C 11.245 -10.869 11.817 1.00 . A A . 140 GLU CG 1 1 1 2119 1 1 140 GLU H H 9.605 -12.265 9.910 1.00 . A A . 140 GLU H 1 1 1 2120 1 1 140 GLU HA H 8.626 -10.694 12.071 1.00 . A A . 140 GLU HA 1 1 1 2121 1 1 140 GLU HB2 H 10.650 -10.090 9.905 1.00 . A A . 140 GLU HB2 1 1 1 2122 1 1 140 GLU HB3 H 10.317 -9.016 11.267 1.00 . A A . 140 GLU HB3 1 1 1 2123 1 1 140 GLU HG2 H 10.900 -10.821 12.837 1.00 . A A . 140 GLU HG2 1 1 1 2124 1 1 140 GLU HG3 H 11.238 -11.895 11.482 1.00 . A A . 140 GLU HG3 1 1 1 2125 1 1 140 GLU N N 8.838 -11.928 10.417 1.00 . A A . 140 GLU N 1 1 1 2126 1 1 140 GLU O O 7.344 -8.780 10.977 1.00 . A A . 140 GLU O 1 1 1 2127 1 1 140 GLU OE1 O 12.878 -9.382 10.995 1.00 . A A . 140 GLU OE1 1 1 1 2128 1 1 140 GLU OE2 O 13.525 -10.860 12.415 1.00 . A A . 140 GLU OE2 1 1 1 2129 1 1 141 PHE C C 5.416 -9.089 8.853 1.00 . A A . 141 PHE C 1 1 1 2130 1 1 141 PHE CA C 6.826 -9.004 8.282 1.00 . A A . 141 PHE CA 1 1 1 2131 1 1 141 PHE CB C 6.805 -9.453 6.814 1.00 . A A . 141 PHE CB 1 1 1 2132 1 1 141 PHE CD1 C 4.851 -8.055 6.029 1.00 . A A . 141 PHE CD1 1 1 1 2133 1 1 141 PHE CD2 C 7.038 -7.643 5.069 1.00 . A A . 141 PHE CD2 1 1 1 2134 1 1 141 PHE CE1 C 4.311 -7.040 5.238 1.00 . A A . 141 PHE CE1 1 1 1 2135 1 1 141 PHE CE2 C 6.493 -6.628 4.277 1.00 . A A . 141 PHE CE2 1 1 1 2136 1 1 141 PHE CG C 6.218 -8.358 5.948 1.00 . A A . 141 PHE CG 1 1 1 2137 1 1 141 PHE CZ C 5.130 -6.325 4.363 1.00 . A A . 141 PHE CZ 1 1 1 2138 1 1 141 PHE H H 8.220 -10.568 8.576 1.00 . A A . 141 PHE H 1 1 1 2139 1 1 141 PHE HA H 7.172 -7.984 8.332 1.00 . A A . 141 PHE HA 1 1 1 2140 1 1 141 PHE HB2 H 7.815 -9.667 6.491 1.00 . A A . 141 PHE HB2 1 1 1 2141 1 1 141 PHE HB3 H 6.204 -10.346 6.721 1.00 . A A . 141 PHE HB3 1 1 1 2142 1 1 141 PHE HD1 H 4.213 -8.605 6.697 1.00 . A A . 141 PHE HD1 1 1 1 2143 1 1 141 PHE HD2 H 8.091 -7.873 5.004 1.00 . A A . 141 PHE HD2 1 1 1 2144 1 1 141 PHE HE1 H 3.259 -6.804 5.305 1.00 . A A . 141 PHE HE1 1 1 1 2145 1 1 141 PHE HE2 H 7.126 -6.075 3.600 1.00 . A A . 141 PHE HE2 1 1 1 2146 1 1 141 PHE HZ H 4.709 -5.541 3.754 1.00 . A A . 141 PHE HZ 1 1 1 2147 1 1 141 PHE N N 7.735 -9.855 9.037 1.00 . A A . 141 PHE N 1 1 1 2148 1 1 141 PHE O O 4.792 -8.068 9.145 1.00 . A A . 141 PHE O 1 1 1 2149 1 1 142 VAL C C 3.517 -10.027 11.003 1.00 . A A . 142 VAL C 1 1 1 2150 1 1 142 VAL CA C 3.579 -10.512 9.559 1.00 . A A . 142 VAL CA 1 1 1 2151 1 1 142 VAL CB C 3.192 -11.993 9.478 1.00 . A A . 142 VAL CB 1 1 1 2152 1 1 142 VAL CG1 C 4.277 -12.840 10.133 1.00 . A A . 142 VAL CG1 1 1 1 2153 1 1 142 VAL CG2 C 1.864 -12.216 10.206 1.00 . A A . 142 VAL CG2 1 1 1 2154 1 1 142 VAL H H 5.463 -11.091 8.768 1.00 . A A . 142 VAL H 1 1 1 2155 1 1 142 VAL HA H 2.877 -9.937 8.971 1.00 . A A . 142 VAL HA 1 1 1 2156 1 1 142 VAL HB H 3.089 -12.284 8.445 1.00 . A A . 142 VAL HB 1 1 1 2157 1 1 142 VAL HG11 H 5.192 -12.732 9.572 1.00 . A A . 142 VAL HG11 1 1 1 2158 1 1 142 VAL HG12 H 3.975 -13.877 10.132 1.00 . A A . 142 VAL HG12 1 1 1 2159 1 1 142 VAL HG13 H 4.433 -12.511 11.147 1.00 . A A . 142 VAL HG13 1 1 1 2160 1 1 142 VAL HG21 H 2.026 -12.174 11.273 1.00 . A A . 142 VAL HG21 1 1 1 2161 1 1 142 VAL HG22 H 1.464 -13.183 9.939 1.00 . A A . 142 VAL HG22 1 1 1 2162 1 1 142 VAL HG23 H 1.163 -11.445 9.919 1.00 . A A . 142 VAL HG23 1 1 1 2163 1 1 142 VAL N N 4.919 -10.311 9.015 1.00 . A A . 142 VAL N 1 1 1 2164 1 1 142 VAL O O 2.503 -9.489 11.446 1.00 . A A . 142 VAL O 1 1 1 2165 1 1 143 GLN C C 4.616 -8.284 13.215 1.00 . A A . 143 GLN C 1 1 1 2166 1 1 143 GLN CA C 4.665 -9.804 13.121 1.00 . A A . 143 GLN CA 1 1 1 2167 1 1 143 GLN CB C 5.948 -10.324 13.775 1.00 . A A . 143 GLN CB 1 1 1 2168 1 1 143 GLN CD C 4.820 -10.767 15.966 1.00 . A A . 143 GLN CD 1 1 1 2169 1 1 143 GLN CG C 5.941 -9.999 15.273 1.00 . A A . 143 GLN CG 1 1 1 2170 1 1 143 GLN H H 5.389 -10.658 11.325 1.00 . A A . 143 GLN H 1 1 1 2171 1 1 143 GLN HA H 3.814 -10.213 13.642 1.00 . A A . 143 GLN HA 1 1 1 2172 1 1 143 GLN HB2 H 6.010 -11.393 13.639 1.00 . A A . 143 GLN HB2 1 1 1 2173 1 1 143 GLN HB3 H 6.803 -9.852 13.312 1.00 . A A . 143 GLN HB3 1 1 1 2174 1 1 143 GLN HE21 H 4.301 -9.248 17.133 1.00 . A A . 143 GLN HE21 1 1 1 2175 1 1 143 GLN HE22 H 3.389 -10.665 17.338 1.00 . A A . 143 GLN HE22 1 1 1 2176 1 1 143 GLN HG2 H 6.890 -10.284 15.705 1.00 . A A . 143 GLN HG2 1 1 1 2177 1 1 143 GLN HG3 H 5.789 -8.940 15.416 1.00 . A A . 143 GLN HG3 1 1 1 2178 1 1 143 GLN N N 4.608 -10.222 11.731 1.00 . A A . 143 GLN N 1 1 1 2179 1 1 143 GLN NE2 N 4.111 -10.178 16.889 1.00 . A A . 143 GLN NE2 1 1 1 2180 1 1 143 GLN O O 4.030 -7.727 14.143 1.00 . A A . 143 GLN O 1 1 1 2181 1 1 143 GLN OE1 O 4.580 -11.933 15.652 1.00 . A A . 143 GLN OE1 1 1 1 2182 1 1 144 MET C C 3.915 -5.613 11.797 1.00 . A A . 144 MET C 1 1 1 2183 1 1 144 MET CA C 5.261 -6.164 12.244 1.00 . A A . 144 MET CA 1 1 1 2184 1 1 144 MET CB C 6.361 -5.658 11.300 1.00 . A A . 144 MET CB 1 1 1 2185 1 1 144 MET CE C 6.486 -1.652 12.234 1.00 . A A . 144 MET CE 1 1 1 2186 1 1 144 MET CG C 6.283 -4.129 11.161 1.00 . A A . 144 MET CG 1 1 1 2187 1 1 144 MET H H 5.696 -8.114 11.540 1.00 . A A . 144 MET H 1 1 1 2188 1 1 144 MET HA H 5.470 -5.816 13.243 1.00 . A A . 144 MET HA 1 1 1 2189 1 1 144 MET HB2 H 7.326 -5.929 11.703 1.00 . A A . 144 MET HB2 1 1 1 2190 1 1 144 MET HB3 H 6.237 -6.114 10.329 1.00 . A A . 144 MET HB3 1 1 1 2191 1 1 144 MET HE1 H 5.621 -1.458 11.617 1.00 . A A . 144 MET HE1 1 1 1 2192 1 1 144 MET HE2 H 7.381 -1.482 11.659 1.00 . A A . 144 MET HE2 1 1 1 2193 1 1 144 MET HE3 H 6.481 -0.993 13.091 1.00 . A A . 144 MET HE3 1 1 1 2194 1 1 144 MET HG2 H 7.084 -3.787 10.526 1.00 . A A . 144 MET HG2 1 1 1 2195 1 1 144 MET HG3 H 5.339 -3.842 10.719 1.00 . A A . 144 MET HG3 1 1 1 2196 1 1 144 MET N N 5.241 -7.619 12.253 1.00 . A A . 144 MET N 1 1 1 2197 1 1 144 MET O O 3.567 -4.485 12.132 1.00 . A A . 144 MET O 1 1 1 2198 1 1 144 MET SD S 6.445 -3.369 12.795 1.00 . A A . 144 MET SD 1 1 1 2199 1 1 145 MET C C 0.896 -5.773 11.686 1.00 . A A . 145 MET C 1 1 1 2200 1 1 145 MET CA C 1.875 -5.973 10.534 1.00 . A A . 145 MET CA 1 1 1 2201 1 1 145 MET CB C 1.325 -7.015 9.545 1.00 . A A . 145 MET CB 1 1 1 2202 1 1 145 MET CE C 2.442 -4.271 7.129 1.00 . A A . 145 MET CE 1 1 1 2203 1 1 145 MET CG C 1.883 -6.752 8.144 1.00 . A A . 145 MET CG 1 1 1 2204 1 1 145 MET H H 3.512 -7.294 10.794 1.00 . A A . 145 MET H 1 1 1 2205 1 1 145 MET HA H 1.999 -5.029 10.023 1.00 . A A . 145 MET HA 1 1 1 2206 1 1 145 MET HB2 H 1.622 -8.001 9.866 1.00 . A A . 145 MET HB2 1 1 1 2207 1 1 145 MET HB3 H 0.245 -6.960 9.513 1.00 . A A . 145 MET HB3 1 1 1 2208 1 1 145 MET HE1 H 2.112 -3.307 6.761 1.00 . A A . 145 MET HE1 1 1 1 2209 1 1 145 MET HE2 H 3.092 -4.728 6.403 1.00 . A A . 145 MET HE2 1 1 1 2210 1 1 145 MET HE3 H 2.978 -4.144 8.059 1.00 . A A . 145 MET HE3 1 1 1 2211 1 1 145 MET HG2 H 2.939 -6.537 8.215 1.00 . A A . 145 MET HG2 1 1 1 2212 1 1 145 MET HG3 H 1.734 -7.627 7.528 1.00 . A A . 145 MET HG3 1 1 1 2213 1 1 145 MET N N 3.174 -6.406 11.036 1.00 . A A . 145 MET N 1 1 1 2214 1 1 145 MET O O -0.205 -5.257 11.492 1.00 . A A . 145 MET O 1 1 1 2215 1 1 145 MET SD S 1.007 -5.339 7.410 1.00 . A A . 145 MET SD 1 1 1 2216 1 1 146 THR C C -0.182 -4.644 14.081 1.00 . A A . 146 THR C 1 1 1 2217 1 1 146 THR CA C 0.455 -6.030 14.055 1.00 . A A . 146 THR CA 1 1 1 2218 1 1 146 THR CB C 1.285 -6.246 15.325 1.00 . A A . 146 THR CB 1 1 1 2219 1 1 146 THR CG2 C 1.548 -7.744 15.521 1.00 . A A . 146 THR CG2 1 1 1 2220 1 1 146 THR H H 2.195 -6.573 12.979 1.00 . A A . 146 THR H 1 1 1 2221 1 1 146 THR HA H -0.327 -6.772 14.015 1.00 . A A . 146 THR HA 1 1 1 2222 1 1 146 THR HB H 0.745 -5.867 16.179 1.00 . A A . 146 THR HB 1 1 1 2223 1 1 146 THR HG1 H 2.344 -4.616 15.264 1.00 . A A . 146 THR HG1 1 1 1 2224 1 1 146 THR HG21 H 1.781 -8.199 14.569 1.00 . A A . 146 THR HG21 1 1 1 2225 1 1 146 THR HG22 H 0.670 -8.211 15.938 1.00 . A A . 146 THR HG22 1 1 1 2226 1 1 146 THR HG23 H 2.381 -7.876 16.196 1.00 . A A . 146 THR HG23 1 1 1 2227 1 1 146 THR N N 1.305 -6.175 12.880 1.00 . A A . 146 THR N 1 1 1 2228 1 1 146 THR O O 0.513 -3.630 14.016 1.00 . A A . 146 THR O 1 1 1 2229 1 1 146 THR OG1 O 2.521 -5.557 15.202 1.00 . A A . 146 THR OG1 1 1 1 2230 1 1 147 ALA C C -2.029 -2.642 15.536 1.00 . A A . 147 ALA C 1 1 1 2231 1 1 147 ALA CA C -2.225 -3.344 14.198 1.00 . A A . 147 ALA CA 1 1 1 2232 1 1 147 ALA CB C -3.716 -3.588 13.964 1.00 . A A . 147 ALA CB 1 1 1 2233 1 1 147 ALA H H -2.012 -5.449 14.224 1.00 . A A . 147 ALA H 1 1 1 2234 1 1 147 ALA HA H -1.850 -2.709 13.411 1.00 . A A . 147 ALA HA 1 1 1 2235 1 1 147 ALA HB1 H -3.856 -4.083 13.015 1.00 . A A . 147 ALA HB1 1 1 1 2236 1 1 147 ALA HB2 H -4.240 -2.643 13.958 1.00 . A A . 147 ALA HB2 1 1 1 2237 1 1 147 ALA HB3 H -4.108 -4.210 14.756 1.00 . A A . 147 ALA HB3 1 1 1 2238 1 1 147 ALA N N -1.507 -4.610 14.171 1.00 . A A . 147 ALA N 1 1 1 2239 1 1 147 ALA O O -2.637 -1.605 15.797 1.00 . A A . 147 ALA O 1 1 1 2240 1 1 148 LYS C C 0.528 -2.923 18.125 1.00 . A A . 148 LYS C 1 1 1 2241 1 1 148 LYS CA C -0.905 -2.628 17.696 1.00 . A A . 148 LYS CA 1 1 1 2242 1 1 148 LYS CB C -1.873 -3.198 18.732 1.00 . A A . 148 LYS CB 1 1 1 2243 1 1 148 LYS CD C -4.232 -3.114 19.568 1.00 . A A . 148 LYS CD 1 1 1 2244 1 1 148 LYS CE C -4.412 -4.636 19.598 1.00 . A A . 148 LYS CE 1 1 1 2245 1 1 148 LYS CG C -3.294 -2.719 18.424 1.00 . A A . 148 LYS CG 1 1 1 2246 1 1 148 LYS H H -0.718 -4.039 16.123 1.00 . A A . 148 LYS H 1 1 1 2247 1 1 148 LYS HA H -1.039 -1.557 17.646 1.00 . A A . 148 LYS HA 1 1 1 2248 1 1 148 LYS HB2 H -1.837 -4.277 18.693 1.00 . A A . 148 LYS HB2 1 1 1 2249 1 1 148 LYS HB3 H -1.587 -2.863 19.718 1.00 . A A . 148 LYS HB3 1 1 1 2250 1 1 148 LYS HD2 H -3.806 -2.786 20.506 1.00 . A A . 148 LYS HD2 1 1 1 2251 1 1 148 LYS HD3 H -5.192 -2.642 19.426 1.00 . A A . 148 LYS HD3 1 1 1 2252 1 1 148 LYS HE2 H -4.559 -5.005 18.594 1.00 . A A . 148 LYS HE2 1 1 1 2253 1 1 148 LYS HE3 H -3.535 -5.096 20.026 1.00 . A A . 148 LYS HE3 1 1 1 2254 1 1 148 LYS HG2 H -3.293 -1.644 18.312 1.00 . A A . 148 LYS HG2 1 1 1 2255 1 1 148 LYS HG3 H -3.637 -3.174 17.506 1.00 . A A . 148 LYS HG3 1 1 1 2256 1 1 148 LYS HZ1 H -6.322 -5.426 19.831 1.00 . A A . 148 LYS HZ1 1 1 1 2257 1 1 148 LYS HZ2 H -5.987 -4.109 20.851 1.00 . A A . 148 LYS HZ2 1 1 1 2258 1 1 148 LYS HZ3 H -5.317 -5.635 21.181 1.00 . A A . 148 LYS HZ3 1 1 1 2259 1 1 148 LYS N N -1.176 -3.212 16.383 1.00 . A A . 148 LYS N 1 1 1 2260 1 1 148 LYS NZ N -5.599 -4.978 20.427 1.00 . A A . 148 LYS NZ 1 1 1 2261 1 1 148 LYS O O 0.917 -2.455 19.182 1.00 . A A . 148 LYS O 1 1 1 2262 1 1 148 LYS OXT O 1.216 -3.613 17.389 1.00 . A A . 148 LYS OXT 1 1 1 2263 2 2 1 ALA C C 5.671 2.861 11.053 1.00 . B B . 299 ALA C 1 1 1 2264 2 2 1 ALA CA C 6.631 3.918 11.588 1.00 . B B . 299 ALA CA 1 1 1 2265 2 2 1 ALA CB C 7.525 3.309 12.669 1.00 . B B . 299 ALA CB 1 1 1 2266 2 2 1 ALA H1 H 5.238 4.687 12.929 1.00 . B B . 299 ALA H1 1 1 1 2267 2 2 1 ALA H2 H 5.266 5.479 11.426 1.00 . B B . 299 ALA H2 1 1 1 2268 2 2 1 ALA H3 H 6.504 5.753 12.558 1.00 . B B . 299 ALA H3 1 1 1 2269 2 2 1 ALA HA H 7.244 4.285 10.779 1.00 . B B . 299 ALA HA 1 1 1 2270 2 2 1 ALA HB1 H 6.912 2.937 13.477 1.00 . B B . 299 ALA HB1 1 1 1 2271 2 2 1 ALA HB2 H 8.197 4.066 13.049 1.00 . B B . 299 ALA HB2 1 1 1 2272 2 2 1 ALA HB3 H 8.098 2.498 12.248 1.00 . B B . 299 ALA HB3 1 1 1 2273 2 2 1 ALA N N 5.851 5.044 12.169 1.00 . B B . 299 ALA N 1 1 1 2274 2 2 1 ALA O O 5.803 2.407 9.917 1.00 . B B . 299 ALA O 1 1 1 2275 2 2 2 LYS C C 2.933 1.950 10.285 1.00 . B B . 300 LYS C 1 1 1 2276 2 2 2 LYS CA C 3.748 1.450 11.483 1.00 . B B . 300 LYS CA 1 1 1 2277 2 2 2 LYS CB C 2.815 1.130 12.668 1.00 . B B . 300 LYS CB 1 1 1 2278 2 2 2 LYS CD C 1.713 -0.640 11.269 1.00 . B B . 300 LYS CD 1 1 1 2279 2 2 2 LYS CE C 0.858 -1.902 11.388 1.00 . B B . 300 LYS CE 1 1 1 2280 2 2 2 LYS CG C 2.378 -0.339 12.614 1.00 . B B . 300 LYS CG 1 1 1 2281 2 2 2 LYS H H 4.660 2.854 12.780 1.00 . B B . 300 LYS H 1 1 1 2282 2 2 2 LYS HA H 4.279 0.558 11.194 1.00 . B B . 300 LYS HA 1 1 1 2283 2 2 2 LYS HB2 H 3.334 1.316 13.595 1.00 . B B . 300 LYS HB2 1 1 1 2284 2 2 2 LYS HB3 H 1.936 1.761 12.620 1.00 . B B . 300 LYS HB3 1 1 1 2285 2 2 2 LYS HD2 H 1.096 0.192 10.970 1.00 . B B . 300 LYS HD2 1 1 1 2286 2 2 2 LYS HD3 H 2.476 -0.807 10.528 1.00 . B B . 300 LYS HD3 1 1 1 2287 2 2 2 LYS HE2 H 0.118 -1.768 12.164 1.00 . B B . 300 LYS HE2 1 1 1 2288 2 2 2 LYS HE3 H 0.365 -2.095 10.446 1.00 . B B . 300 LYS HE3 1 1 1 2289 2 2 2 LYS HG2 H 3.252 -0.965 12.724 1.00 . B B . 300 LYS HG2 1 1 1 2290 2 2 2 LYS HG3 H 1.688 -0.540 13.417 1.00 . B B . 300 LYS HG3 1 1 1 2291 2 2 2 LYS HZ1 H 2.143 -3.448 10.866 1.00 . B B . 300 LYS HZ1 1 1 1 2292 2 2 2 LYS HZ2 H 1.166 -3.782 12.215 1.00 . B B . 300 LYS HZ2 1 1 1 2293 2 2 2 LYS HZ3 H 2.494 -2.733 12.364 1.00 . B B . 300 LYS HZ3 1 1 1 2294 2 2 2 LYS N N 4.714 2.465 11.882 1.00 . B B . 300 LYS N 1 1 1 2295 2 2 2 LYS NZ N 1.730 -3.052 11.734 1.00 . B B . 300 LYS NZ 1 1 1 2296 2 2 2 LYS O O 2.563 1.181 9.399 1.00 . B B . 300 LYS O 1 1 1 2297 2 2 3 SER C C 2.574 3.562 7.844 1.00 . B B . 301 SER C 1 1 1 2298 2 2 3 SER CA C 1.888 3.827 9.178 1.00 . B B . 301 SER CA 1 1 1 2299 2 2 3 SER CB C 1.740 5.333 9.391 1.00 . B B . 301 SER CB 1 1 1 2300 2 2 3 SER H H 2.980 3.819 10.993 1.00 . B B . 301 SER H 1 1 1 2301 2 2 3 SER HA H 0.908 3.377 9.164 1.00 . B B . 301 SER HA 1 1 1 2302 2 2 3 SER HB2 H 1.017 5.518 10.168 1.00 . B B . 301 SER HB2 1 1 1 2303 2 2 3 SER HB3 H 2.695 5.749 9.683 1.00 . B B . 301 SER HB3 1 1 1 2304 2 2 3 SER HG H 1.858 6.693 8.006 1.00 . B B . 301 SER HG 1 1 1 2305 2 2 3 SER N N 2.659 3.245 10.266 1.00 . B B . 301 SER N 1 1 1 2306 2 2 3 SER O O 1.925 3.204 6.867 1.00 . B B . 301 SER O 1 1 1 2307 2 2 3 SER OG O 1.294 5.937 8.184 1.00 . B B . 301 SER OG 1 1 1 2308 2 2 4 LYS C C 4.502 2.066 6.116 1.00 . B B . 302 LYS C 1 1 1 2309 2 2 4 LYS CA C 4.652 3.512 6.586 1.00 . B B . 302 LYS CA 1 1 1 2310 2 2 4 LYS CB C 6.129 3.818 6.843 1.00 . B B . 302 LYS CB 1 1 1 2311 2 2 4 LYS CD C 5.922 6.237 6.169 1.00 . B B . 302 LYS CD 1 1 1 2312 2 2 4 LYS CE C 6.519 7.615 6.448 1.00 . B B . 302 LYS CE 1 1 1 2313 2 2 4 LYS CG C 6.291 5.272 7.304 1.00 . B B . 302 LYS CG 1 1 1 2314 2 2 4 LYS H H 4.358 4.017 8.626 1.00 . B B . 302 LYS H 1 1 1 2315 2 2 4 LYS HA H 4.283 4.165 5.815 1.00 . B B . 302 LYS HA 1 1 1 2316 2 2 4 LYS HB2 H 6.506 3.154 7.608 1.00 . B B . 302 LYS HB2 1 1 1 2317 2 2 4 LYS HB3 H 6.689 3.669 5.933 1.00 . B B . 302 LYS HB3 1 1 1 2318 2 2 4 LYS HD2 H 6.306 5.864 5.232 1.00 . B B . 302 LYS HD2 1 1 1 2319 2 2 4 LYS HD3 H 4.849 6.332 6.108 1.00 . B B . 302 LYS HD3 1 1 1 2320 2 2 4 LYS HE2 H 7.588 7.527 6.575 1.00 . B B . 302 LYS HE2 1 1 1 2321 2 2 4 LYS HE3 H 6.308 8.272 5.617 1.00 . B B . 302 LYS HE3 1 1 1 2322 2 2 4 LYS HG2 H 5.640 5.448 8.149 1.00 . B B . 302 LYS HG2 1 1 1 2323 2 2 4 LYS HG3 H 7.316 5.440 7.603 1.00 . B B . 302 LYS HG3 1 1 1 2324 2 2 4 LYS HZ1 H 6.282 7.663 8.515 1.00 . B B . 302 LYS HZ1 1 1 1 2325 2 2 4 LYS HZ2 H 4.876 8.064 7.647 1.00 . B B . 302 LYS HZ2 1 1 1 2326 2 2 4 LYS HZ3 H 6.152 9.181 7.769 1.00 . B B . 302 LYS HZ3 1 1 1 2327 2 2 4 LYS N N 3.889 3.734 7.812 1.00 . B B . 302 LYS N 1 1 1 2328 2 2 4 LYS NZ N 5.911 8.174 7.688 1.00 . B B . 302 LYS NZ 1 1 1 2329 2 2 4 LYS O O 4.361 1.797 4.918 1.00 . B B . 302 LYS O 1 1 1 2330 2 2 5 TRP C C 3.049 -0.508 6.031 1.00 . B B . 303 TRP C 1 1 1 2331 2 2 5 TRP CA C 4.383 -0.272 6.725 1.00 . B B . 303 TRP CA 1 1 1 2332 2 2 5 TRP CB C 4.476 -1.127 7.999 1.00 . B B . 303 TRP CB 1 1 1 2333 2 2 5 TRP CD1 C 6.565 -0.732 9.304 1.00 . B B . 303 TRP CD1 1 1 1 2334 2 2 5 TRP CD2 C 6.815 -2.316 7.758 1.00 . B B . 303 TRP CD2 1 1 1 2335 2 2 5 TRP CE2 C 8.063 -2.202 8.407 1.00 . B B . 303 TRP CE2 1 1 1 2336 2 2 5 TRP CE3 C 6.680 -3.243 6.733 1.00 . B B . 303 TRP CE3 1 1 1 2337 2 2 5 TRP CG C 5.894 -1.375 8.349 1.00 . B B . 303 TRP CG 1 1 1 2338 2 2 5 TRP CH2 C 9.003 -3.918 7.008 1.00 . B B . 303 TRP CH2 1 1 1 2339 2 2 5 TRP CZ2 C 9.150 -2.994 8.041 1.00 . B B . 303 TRP CZ2 1 1 1 2340 2 2 5 TRP CZ3 C 7.771 -4.044 6.354 1.00 . B B . 303 TRP CZ3 1 1 1 2341 2 2 5 TRP H H 4.635 1.405 7.997 1.00 . B B . 303 TRP H 1 1 1 2342 2 2 5 TRP HA H 5.177 -0.552 6.046 1.00 . B B . 303 TRP HA 1 1 1 2343 2 2 5 TRP HB2 H 4.013 -0.606 8.804 1.00 . B B . 303 TRP HB2 1 1 1 2344 2 2 5 TRP HB3 H 3.986 -2.065 7.855 1.00 . B B . 303 TRP HB3 1 1 1 2345 2 2 5 TRP HD1 H 6.151 0.030 9.926 1.00 . B B . 303 TRP HD1 1 1 1 2346 2 2 5 TRP HE1 H 8.558 -0.917 9.966 1.00 . B B . 303 TRP HE1 1 1 1 2347 2 2 5 TRP HE3 H 5.725 -3.336 6.238 1.00 . B B . 303 TRP HE3 1 1 1 2348 2 2 5 TRP HH2 H 9.836 -4.535 6.709 1.00 . B B . 303 TRP HH2 1 1 1 2349 2 2 5 TRP HZ2 H 10.097 -2.888 8.546 1.00 . B B . 303 TRP HZ2 1 1 1 2350 2 2 5 TRP HZ3 H 7.664 -4.755 5.560 1.00 . B B . 303 TRP HZ3 1 1 1 2351 2 2 5 TRP N N 4.526 1.139 7.061 1.00 . B B . 303 TRP N 1 1 1 2352 2 2 5 TRP NE1 N 7.860 -1.220 9.351 1.00 . B B . 303 TRP NE1 1 1 1 2353 2 2 5 TRP O O 2.994 -1.179 5.005 1.00 . B B . 303 TRP O 1 1 1 2354 2 2 6 LYS C C 0.621 0.464 4.585 1.00 . B B . 304 LYS C 1 1 1 2355 2 2 6 LYS CA C 0.656 -0.099 6.001 1.00 . B B . 304 LYS CA 1 1 1 2356 2 2 6 LYS CB C -0.394 0.615 6.855 1.00 . B B . 304 LYS CB 1 1 1 2357 2 2 6 LYS CD C -1.719 0.511 8.963 1.00 . B B . 304 LYS CD 1 1 1 2358 2 2 6 LYS CE C -2.011 -0.313 10.218 1.00 . B B . 304 LYS CE 1 1 1 2359 2 2 6 LYS CG C -0.613 -0.163 8.152 1.00 . B B . 304 LYS CG 1 1 1 2360 2 2 6 LYS H H 2.090 0.591 7.412 1.00 . B B . 304 LYS H 1 1 1 2361 2 2 6 LYS HA H 0.411 -1.149 5.966 1.00 . B B . 304 LYS HA 1 1 1 2362 2 2 6 LYS HB2 H -0.045 1.612 7.086 1.00 . B B . 304 LYS HB2 1 1 1 2363 2 2 6 LYS HB3 H -1.324 0.677 6.310 1.00 . B B . 304 LYS HB3 1 1 1 2364 2 2 6 LYS HD2 H -1.399 1.502 9.249 1.00 . B B . 304 LYS HD2 1 1 1 2365 2 2 6 LYS HD3 H -2.611 0.578 8.361 1.00 . B B . 304 LYS HD3 1 1 1 2366 2 2 6 LYS HE2 H -2.289 -1.317 9.936 1.00 . B B . 304 LYS HE2 1 1 1 2367 2 2 6 LYS HE3 H -1.132 -0.345 10.835 1.00 . B B . 304 LYS HE3 1 1 1 2368 2 2 6 LYS HG2 H -0.902 -1.178 7.920 1.00 . B B . 304 LYS HG2 1 1 1 2369 2 2 6 LYS HG3 H 0.300 -0.170 8.727 1.00 . B B . 304 LYS HG3 1 1 1 2370 2 2 6 LYS HZ1 H -3.517 1.105 10.442 1.00 . B B . 304 LYS HZ1 1 1 1 2371 2 2 6 LYS HZ2 H -2.761 0.657 11.896 1.00 . B B . 304 LYS HZ2 1 1 1 2372 2 2 6 LYS HZ3 H -3.868 -0.394 11.152 1.00 . B B . 304 LYS HZ3 1 1 1 2373 2 2 6 LYS N N 1.982 0.058 6.590 1.00 . B B . 304 LYS N 1 1 1 2374 2 2 6 LYS NZ N -3.122 0.312 10.984 1.00 . B B . 304 LYS NZ 1 1 1 2375 2 2 6 LYS O O 0.008 -0.119 3.691 1.00 . B B . 304 LYS O 1 1 1 2376 2 2 7 GLN C C 1.825 1.267 2.018 1.00 . B B . 305 GLN C 1 1 1 2377 2 2 7 GLN CA C 1.311 2.230 3.077 1.00 . B B . 305 GLN CA 1 1 1 2378 2 2 7 GLN CB C 2.211 3.463 3.110 1.00 . B B . 305 GLN CB 1 1 1 2379 2 2 7 GLN CD C 2.454 5.785 4.014 1.00 . B B . 305 GLN CD 1 1 1 2380 2 2 7 GLN CG C 1.535 4.572 3.914 1.00 . B B . 305 GLN CG 1 1 1 2381 2 2 7 GLN H H 1.745 2.021 5.140 1.00 . B B . 305 GLN H 1 1 1 2382 2 2 7 GLN HA H 0.313 2.539 2.812 1.00 . B B . 305 GLN HA 1 1 1 2383 2 2 7 GLN HB2 H 3.150 3.204 3.572 1.00 . B B . 305 GLN HB2 1 1 1 2384 2 2 7 GLN HB3 H 2.388 3.808 2.102 1.00 . B B . 305 GLN HB3 1 1 1 2385 2 2 7 GLN HE21 H 0.967 7.099 3.984 1.00 . B B . 305 GLN HE21 1 1 1 2386 2 2 7 GLN HE22 H 2.523 7.768 4.097 1.00 . B B . 305 GLN HE22 1 1 1 2387 2 2 7 GLN HG2 H 0.620 4.856 3.424 1.00 . B B . 305 GLN HG2 1 1 1 2388 2 2 7 GLN HG3 H 1.311 4.211 4.902 1.00 . B B . 305 GLN HG3 1 1 1 2389 2 2 7 GLN N N 1.277 1.599 4.389 1.00 . B B . 305 GLN N 1 1 1 2390 2 2 7 GLN NE2 N 1.939 6.984 4.033 1.00 . B B . 305 GLN NE2 1 1 1 2391 2 2 7 GLN O O 1.074 0.832 1.148 1.00 . B B . 305 GLN O 1 1 1 2392 2 2 7 GLN OE1 O 3.675 5.637 4.079 1.00 . B B . 305 GLN OE1 1 1 1 2393 2 2 8 ALA C C 3.005 -1.316 1.124 1.00 . B B . 306 ALA C 1 1 1 2394 2 2 8 ALA CA C 3.707 0.036 1.116 1.00 . B B . 306 ALA CA 1 1 1 2395 2 2 8 ALA CB C 5.190 -0.163 1.433 1.00 . B B . 306 ALA CB 1 1 1 2396 2 2 8 ALA H H 3.668 1.325 2.807 1.00 . B B . 306 ALA H 1 1 1 2397 2 2 8 ALA HA H 3.620 0.471 0.132 1.00 . B B . 306 ALA HA 1 1 1 2398 2 2 8 ALA HB1 H 5.628 -0.835 0.709 1.00 . B B . 306 ALA HB1 1 1 1 2399 2 2 8 ALA HB2 H 5.293 -0.585 2.422 1.00 . B B . 306 ALA HB2 1 1 1 2400 2 2 8 ALA HB3 H 5.698 0.789 1.394 1.00 . B B . 306 ALA HB3 1 1 1 2401 2 2 8 ALA N N 3.111 0.942 2.092 1.00 . B B . 306 ALA N 1 1 1 2402 2 2 8 ALA O O 2.764 -1.907 0.070 1.00 . B B . 306 ALA O 1 1 1 2403 2 2 9 PHE C C 0.669 -3.086 1.712 1.00 . B B . 307 PHE C 1 1 1 2404 2 2 9 PHE CA C 2.016 -3.093 2.436 1.00 . B B . 307 PHE CA 1 1 1 2405 2 2 9 PHE CB C 1.792 -3.422 3.915 1.00 . B B . 307 PHE CB 1 1 1 2406 2 2 9 PHE CD1 C 1.390 -5.882 3.573 1.00 . B B . 307 PHE CD1 1 1 1 2407 2 2 9 PHE CD2 C -0.347 -4.558 4.633 1.00 . B B . 307 PHE CD2 1 1 1 2408 2 2 9 PHE CE1 C 0.585 -7.017 3.683 1.00 . B B . 307 PHE CE1 1 1 1 2409 2 2 9 PHE CE2 C -1.148 -5.694 4.743 1.00 . B B . 307 PHE CE2 1 1 1 2410 2 2 9 PHE CG C 0.925 -4.653 4.046 1.00 . B B . 307 PHE CG 1 1 1 2411 2 2 9 PHE CZ C -0.683 -6.922 4.267 1.00 . B B . 307 PHE CZ 1 1 1 2412 2 2 9 PHE H H 2.904 -1.295 3.122 1.00 . B B . 307 PHE H 1 1 1 2413 2 2 9 PHE HA H 2.652 -3.851 2.005 1.00 . B B . 307 PHE HA 1 1 1 2414 2 2 9 PHE HB2 H 2.741 -3.604 4.391 1.00 . B B . 307 PHE HB2 1 1 1 2415 2 2 9 PHE HB3 H 1.301 -2.593 4.391 1.00 . B B . 307 PHE HB3 1 1 1 2416 2 2 9 PHE HD1 H 2.368 -5.955 3.121 1.00 . B B . 307 PHE HD1 1 1 1 2417 2 2 9 PHE HD2 H -0.705 -3.607 5.005 1.00 . B B . 307 PHE HD2 1 1 1 2418 2 2 9 PHE HE1 H 0.941 -7.969 3.317 1.00 . B B . 307 PHE HE1 1 1 1 2419 2 2 9 PHE HE2 H -2.126 -5.625 5.194 1.00 . B B . 307 PHE HE2 1 1 1 2420 2 2 9 PHE HZ H -1.303 -7.793 4.348 1.00 . B B . 307 PHE HZ 1 1 1 2421 2 2 9 PHE N N 2.683 -1.804 2.314 1.00 . B B . 307 PHE N 1 1 1 2422 2 2 9 PHE O O 0.391 -3.955 0.883 1.00 . B B . 307 PHE O 1 1 1 2423 2 2 10 ASN C C -1.380 -1.710 -0.054 1.00 . B B . 308 ASN C 1 1 1 2424 2 2 10 ASN CA C -1.485 -1.995 1.436 1.00 . B B . 308 ASN CA 1 1 1 2425 2 2 10 ASN CB C -2.276 -0.880 2.110 1.00 . B B . 308 ASN CB 1 1 1 2426 2 2 10 ASN CG C -2.591 -1.261 3.550 1.00 . B B . 308 ASN CG 1 1 1 2427 2 2 10 ASN H H 0.111 -1.452 2.716 1.00 . B B . 308 ASN H 1 1 1 2428 2 2 10 ASN HA H -2.018 -2.920 1.574 1.00 . B B . 308 ASN HA 1 1 1 2429 2 2 10 ASN HB2 H -1.706 0.035 2.086 1.00 . B B . 308 ASN HB2 1 1 1 2430 2 2 10 ASN HB3 H -3.198 -0.738 1.579 1.00 . B B . 308 ASN HB3 1 1 1 2431 2 2 10 ASN HD21 H -3.168 0.569 4.051 1.00 . B B . 308 ASN HD21 1 1 1 2432 2 2 10 ASN HD22 H -3.245 -0.583 5.296 1.00 . B B . 308 ASN HD22 1 1 1 2433 2 2 10 ASN N N -0.165 -2.108 2.043 1.00 . B B . 308 ASN N 1 1 1 2434 2 2 10 ASN ND2 N -3.039 -0.351 4.368 1.00 . B B . 308 ASN ND2 1 1 1 2435 2 2 10 ASN O O -2.144 -2.251 -0.849 1.00 . B B . 308 ASN O 1 1 1 2436 2 2 10 ASN OD1 O -2.443 -2.421 3.936 1.00 . B B . 308 ASN OD1 1 1 1 2437 2 2 11 ALA C C -0.031 -1.732 -2.689 1.00 . B B . 309 ALA C 1 1 1 2438 2 2 11 ALA CA C -0.245 -0.494 -1.822 1.00 . B B . 309 ALA CA 1 1 1 2439 2 2 11 ALA CB C 0.961 0.436 -1.962 1.00 . B B . 309 ALA CB 1 1 1 2440 2 2 11 ALA H H 0.140 -0.449 0.262 1.00 . B B . 309 ALA H 1 1 1 2441 2 2 11 ALA HA H -1.122 0.028 -2.168 1.00 . B B . 309 ALA HA 1 1 1 2442 2 2 11 ALA HB1 H 0.961 1.149 -1.153 1.00 . B B . 309 ALA HB1 1 1 1 2443 2 2 11 ALA HB2 H 0.901 0.961 -2.901 1.00 . B B . 309 ALA HB2 1 1 1 2444 2 2 11 ALA HB3 H 1.874 -0.145 -1.930 1.00 . B B . 309 ALA HB3 1 1 1 2445 2 2 11 ALA N N -0.435 -0.854 -0.422 1.00 . B B . 309 ALA N 1 1 1 2446 2 2 11 ALA O O -0.649 -1.890 -3.737 1.00 . B B . 309 ALA O 1 1 1 2447 2 2 12 THR C C -0.032 -4.790 -2.945 1.00 . B B . 310 THR C 1 1 1 2448 2 2 12 THR CA C 1.134 -3.811 -3.019 1.00 . B B . 310 THR CA 1 1 1 2449 2 2 12 THR CB C 2.393 -4.485 -2.476 1.00 . B B . 310 THR CB 1 1 1 2450 2 2 12 THR CG2 C 3.604 -3.594 -2.747 1.00 . B B . 310 THR CG2 1 1 1 2451 2 2 12 THR H H 1.339 -2.434 -1.421 1.00 . B B . 310 THR H 1 1 1 2452 2 2 12 THR HA H 1.301 -3.545 -4.052 1.00 . B B . 310 THR HA 1 1 1 2453 2 2 12 THR HB H 2.533 -5.436 -2.967 1.00 . B B . 310 THR HB 1 1 1 2454 2 2 12 THR HG1 H 2.536 -3.885 -0.631 1.00 . B B . 310 THR HG1 1 1 1 2455 2 2 12 THR HG21 H 3.694 -3.421 -3.809 1.00 . B B . 310 THR HG21 1 1 1 2456 2 2 12 THR HG22 H 4.496 -4.083 -2.386 1.00 . B B . 310 THR HG22 1 1 1 2457 2 2 12 THR HG23 H 3.479 -2.651 -2.237 1.00 . B B . 310 THR HG23 1 1 1 2458 2 2 12 THR N N 0.858 -2.604 -2.258 1.00 . B B . 310 THR N 1 1 1 2459 2 2 12 THR O O -0.355 -5.457 -3.932 1.00 . B B . 310 THR O 1 1 1 2460 2 2 12 THR OG1 O 2.252 -4.687 -1.077 1.00 . B B . 310 THR OG1 1 1 1 2461 2 2 13 ALA C C -2.989 -5.387 -2.410 1.00 . B B . 311 ALA C 1 1 1 2462 2 2 13 ALA CA C -1.775 -5.789 -1.575 1.00 . B B . 311 ALA CA 1 1 1 2463 2 2 13 ALA CB C -2.165 -5.806 -0.097 1.00 . B B . 311 ALA CB 1 1 1 2464 2 2 13 ALA H H -0.346 -4.320 -1.024 1.00 . B B . 311 ALA H 1 1 1 2465 2 2 13 ALA HA H -1.466 -6.784 -1.854 1.00 . B B . 311 ALA HA 1 1 1 2466 2 2 13 ALA HB1 H -2.170 -4.799 0.282 1.00 . B B . 311 ALA HB1 1 1 1 2467 2 2 13 ALA HB2 H -1.451 -6.395 0.456 1.00 . B B . 311 ALA HB2 1 1 1 2468 2 2 13 ALA HB3 H -3.150 -6.236 0.014 1.00 . B B . 311 ALA HB3 1 1 1 2469 2 2 13 ALA N N -0.653 -4.877 -1.772 1.00 . B B . 311 ALA N 1 1 1 2470 2 2 13 ALA O O -3.591 -6.208 -3.100 1.00 . B B . 311 ALA O 1 1 1 2471 2 2 14 VAL C C -4.268 -3.729 -4.574 1.00 . B B . 312 VAL C 1 1 1 2472 2 2 14 VAL CA C -4.510 -3.642 -3.078 1.00 . B B . 312 VAL CA 1 1 1 2473 2 2 14 VAL CB C -4.808 -2.196 -2.691 1.00 . B B . 312 VAL CB 1 1 1 2474 2 2 14 VAL CG1 C -3.697 -1.288 -3.227 1.00 . B B . 312 VAL CG1 1 1 1 2475 2 2 14 VAL CG2 C -6.157 -1.771 -3.280 1.00 . B B . 312 VAL CG2 1 1 1 2476 2 2 14 VAL H H -2.856 -3.505 -1.761 1.00 . B B . 312 VAL H 1 1 1 2477 2 2 14 VAL HA H -5.362 -4.253 -2.835 1.00 . B B . 312 VAL HA 1 1 1 2478 2 2 14 VAL HB H -4.842 -2.122 -1.617 1.00 . B B . 312 VAL HB 1 1 1 2479 2 2 14 VAL HG11 H -3.745 -0.326 -2.746 1.00 . B B . 312 VAL HG11 1 1 1 2480 2 2 14 VAL HG12 H -3.813 -1.165 -4.293 1.00 . B B . 312 VAL HG12 1 1 1 2481 2 2 14 VAL HG13 H -2.747 -1.741 -3.020 1.00 . B B . 312 VAL HG13 1 1 1 2482 2 2 14 VAL HG21 H -6.509 -0.896 -2.765 1.00 . B B . 312 VAL HG21 1 1 1 2483 2 2 14 VAL HG22 H -6.878 -2.566 -3.159 1.00 . B B . 312 VAL HG22 1 1 1 2484 2 2 14 VAL HG23 H -6.038 -1.551 -4.329 1.00 . B B . 312 VAL HG23 1 1 1 2485 2 2 14 VAL N N -3.358 -4.123 -2.334 1.00 . B B . 312 VAL N 1 1 1 2486 2 2 14 VAL O O -5.185 -4.012 -5.340 1.00 . B B . 312 VAL O 1 1 1 2487 2 2 15 VAL C C -2.966 -4.912 -6.974 1.00 . B B . 313 VAL C 1 1 1 2488 2 2 15 VAL CA C -2.706 -3.526 -6.403 1.00 . B B . 313 VAL CA 1 1 1 2489 2 2 15 VAL CB C -1.230 -3.158 -6.600 1.00 . B B . 313 VAL CB 1 1 1 2490 2 2 15 VAL CG1 C -0.774 -3.547 -8.019 1.00 . B B . 313 VAL CG1 1 1 1 2491 2 2 15 VAL CG2 C -1.041 -1.645 -6.397 1.00 . B B . 313 VAL CG2 1 1 1 2492 2 2 15 VAL H H -2.336 -3.249 -4.334 1.00 . B B . 313 VAL H 1 1 1 2493 2 2 15 VAL HA H -3.315 -2.809 -6.925 1.00 . B B . 313 VAL HA 1 1 1 2494 2 2 15 VAL HB H -0.636 -3.694 -5.875 1.00 . B B . 313 VAL HB 1 1 1 2495 2 2 15 VAL HG11 H -0.593 -4.611 -8.060 1.00 . B B . 313 VAL HG11 1 1 1 2496 2 2 15 VAL HG12 H 0.130 -3.018 -8.266 1.00 . B B . 313 VAL HG12 1 1 1 2497 2 2 15 VAL HG13 H -1.547 -3.286 -8.728 1.00 . B B . 313 VAL HG13 1 1 1 2498 2 2 15 VAL HG21 H -1.216 -1.128 -7.328 1.00 . B B . 313 VAL HG21 1 1 1 2499 2 2 15 VAL HG22 H -0.033 -1.453 -6.066 1.00 . B B . 313 VAL HG22 1 1 1 2500 2 2 15 VAL HG23 H -1.734 -1.283 -5.651 1.00 . B B . 313 VAL HG23 1 1 1 2501 2 2 15 VAL N N -3.034 -3.478 -4.988 1.00 . B B . 313 VAL N 1 1 1 2502 2 2 15 VAL O O -3.591 -5.048 -8.025 1.00 . B B . 313 VAL O 1 1 1 2503 2 2 16 ARG C C -4.126 -7.712 -6.664 1.00 . B B . 314 ARG C 1 1 1 2504 2 2 16 ARG CA C -2.668 -7.295 -6.750 1.00 . B B . 314 ARG CA 1 1 1 2505 2 2 16 ARG CB C -1.812 -8.258 -5.929 1.00 . B B . 314 ARG CB 1 1 1 2506 2 2 16 ARG CD C -1.499 -9.237 -3.656 1.00 . B B . 314 ARG CD 1 1 1 2507 2 2 16 ARG CG C -2.172 -8.127 -4.448 1.00 . B B . 314 ARG CG 1 1 1 2508 2 2 16 ARG CZ C -1.568 -11.658 -3.543 1.00 . B B . 314 ARG CZ 1 1 1 2509 2 2 16 ARG H H -1.983 -5.763 -5.452 1.00 . B B . 314 ARG H 1 1 1 2510 2 2 16 ARG HA H -2.354 -7.352 -7.775 1.00 . B B . 314 ARG HA 1 1 1 2511 2 2 16 ARG HB2 H -1.986 -9.273 -6.261 1.00 . B B . 314 ARG HB2 1 1 1 2512 2 2 16 ARG HB3 H -0.770 -8.011 -6.066 1.00 . B B . 314 ARG HB3 1 1 1 2513 2 2 16 ARG HD2 H -0.438 -9.192 -3.813 1.00 . B B . 314 ARG HD2 1 1 1 2514 2 2 16 ARG HD3 H -1.713 -9.103 -2.606 1.00 . B B . 314 ARG HD3 1 1 1 2515 2 2 16 ARG HE H -2.672 -10.573 -4.808 1.00 . B B . 314 ARG HE 1 1 1 2516 2 2 16 ARG HG2 H -1.821 -7.178 -4.090 1.00 . B B . 314 ARG HG2 1 1 1 2517 2 2 16 ARG HG3 H -3.237 -8.191 -4.311 1.00 . B B . 314 ARG HG3 1 1 1 2518 2 2 16 ARG HH11 H -0.329 -10.735 -2.271 1.00 . B B . 314 ARG HH11 1 1 1 2519 2 2 16 ARG HH12 H -0.353 -12.464 -2.172 1.00 . B B . 314 ARG HH12 1 1 1 2520 2 2 16 ARG HH21 H -2.709 -12.840 -4.690 1.00 . B B . 314 ARG HH21 1 1 1 2521 2 2 16 ARG HH22 H -1.701 -13.656 -3.542 1.00 . B B . 314 ARG HH22 1 1 1 2522 2 2 16 ARG N N -2.480 -5.931 -6.284 1.00 . B B . 314 ARG N 1 1 1 2523 2 2 16 ARG NE N -2.004 -10.533 -4.092 1.00 . B B . 314 ARG NE 1 1 1 2524 2 2 16 ARG NH1 N -0.681 -11.615 -2.588 1.00 . B B . 314 ARG NH1 1 1 1 2525 2 2 16 ARG NH2 N -2.029 -12.808 -3.958 1.00 . B B . 314 ARG NH2 1 1 1 2526 2 2 16 ARG O O -4.599 -8.508 -7.467 1.00 . B B . 314 ARG O 1 1 1 2527 2 2 17 HIS C C -7.138 -6.824 -6.441 1.00 . B B . 315 HIS C 1 1 1 2528 2 2 17 HIS CA C -6.220 -7.544 -5.467 1.00 . B B . 315 HIS CA 1 1 1 2529 2 2 17 HIS CB C -6.631 -7.197 -4.033 1.00 . B B . 315 HIS CB 1 1 1 2530 2 2 17 HIS CD2 C -9.111 -6.374 -3.740 1.00 . B B . 315 HIS CD2 1 1 1 2531 2 2 17 HIS CE1 C -10.091 -8.306 -3.737 1.00 . B B . 315 HIS CE1 1 1 1 2532 2 2 17 HIS CG C -8.127 -7.320 -3.881 1.00 . B B . 315 HIS CG 1 1 1 2533 2 2 17 HIS H H -4.386 -6.578 -5.039 1.00 . B B . 315 HIS H 1 1 1 2534 2 2 17 HIS HA H -6.333 -8.600 -5.609 1.00 . B B . 315 HIS HA 1 1 1 2535 2 2 17 HIS HB2 H -6.143 -7.872 -3.346 1.00 . B B . 315 HIS HB2 1 1 1 2536 2 2 17 HIS HB3 H -6.331 -6.181 -3.811 1.00 . B B . 315 HIS HB3 1 1 1 2537 2 2 17 HIS HD2 H -8.945 -5.303 -3.705 1.00 . B B . 315 HIS HD2 1 1 1 2538 2 2 17 HIS HE1 H -10.846 -9.078 -3.705 1.00 . B B . 315 HIS HE1 1 1 1 2539 2 2 17 HIS HE2 H -11.227 -6.571 -3.549 1.00 . B B . 315 HIS HE2 1 1 1 2540 2 2 17 HIS N N -4.825 -7.193 -5.667 1.00 . B B . 315 HIS N 1 1 1 2541 2 2 17 HIS ND1 N -8.774 -8.544 -3.875 1.00 . B B . 315 HIS ND1 1 1 1 2542 2 2 17 HIS NE2 N -10.350 -6.998 -3.649 1.00 . B B . 315 HIS NE2 1 1 1 2543 2 2 17 HIS O O -7.942 -7.453 -7.124 1.00 . B B . 315 HIS O 1 1 1 2544 2 2 18 MET C C -7.643 -5.091 -8.816 1.00 . B B . 316 MET C 1 1 1 2545 2 2 18 MET CA C -7.876 -4.726 -7.359 1.00 . B B . 316 MET CA 1 1 1 2546 2 2 18 MET CB C -7.574 -3.243 -7.148 1.00 . B B . 316 MET CB 1 1 1 2547 2 2 18 MET CE C -10.096 -1.375 -7.394 1.00 . B B . 316 MET CE 1 1 1 2548 2 2 18 MET CG C -8.268 -2.727 -5.888 1.00 . B B . 316 MET CG 1 1 1 2549 2 2 18 MET H H -6.379 -5.064 -5.903 1.00 . B B . 316 MET H 1 1 1 2550 2 2 18 MET HA H -8.909 -4.914 -7.111 1.00 . B B . 316 MET HA 1 1 1 2551 2 2 18 MET HB2 H -6.514 -3.128 -7.037 1.00 . B B . 316 MET HB2 1 1 1 2552 2 2 18 MET HB3 H -7.915 -2.674 -8.001 1.00 . B B . 316 MET HB3 1 1 1 2553 2 2 18 MET HE1 H -10.065 -1.809 -8.383 1.00 . B B . 316 MET HE1 1 1 1 2554 2 2 18 MET HE2 H -9.244 -0.727 -7.265 1.00 . B B . 316 MET HE2 1 1 1 2555 2 2 18 MET HE3 H -11.003 -0.798 -7.276 1.00 . B B . 316 MET HE3 1 1 1 2556 2 2 18 MET HG2 H -8.038 -3.380 -5.057 1.00 . B B . 316 MET HG2 1 1 1 2557 2 2 18 MET HG3 H -7.920 -1.729 -5.667 1.00 . B B . 316 MET HG3 1 1 1 2558 2 2 18 MET N N -7.029 -5.513 -6.482 1.00 . B B . 316 MET N 1 1 1 2559 2 2 18 MET O O -8.593 -5.201 -9.590 1.00 . B B . 316 MET O 1 1 1 2560 2 2 18 MET SD S -10.059 -2.697 -6.153 1.00 . B B . 316 MET SD 1 1 1 2561 2 2 19 ARG C C -6.560 -7.026 -10.895 1.00 . B B . 317 ARG C 1 1 1 2562 2 2 19 ARG CA C -6.063 -5.617 -10.560 1.00 . B B . 317 ARG CA 1 1 1 2563 2 2 19 ARG CB C -4.545 -5.532 -10.780 1.00 . B B . 317 ARG CB 1 1 1 2564 2 2 19 ARG CD C -2.339 -6.617 -10.299 1.00 . B B . 317 ARG CD 1 1 1 2565 2 2 19 ARG CG C -3.850 -6.799 -10.250 1.00 . B B . 317 ARG CG 1 1 1 2566 2 2 19 ARG CZ C -1.706 -7.267 -12.554 1.00 . B B . 317 ARG CZ 1 1 1 2567 2 2 19 ARG H H -5.664 -5.168 -8.532 1.00 . B B . 317 ARG H 1 1 1 2568 2 2 19 ARG HA H -6.545 -4.903 -11.213 1.00 . B B . 317 ARG HA 1 1 1 2569 2 2 19 ARG HB2 H -4.343 -5.429 -11.837 1.00 . B B . 317 ARG HB2 1 1 1 2570 2 2 19 ARG HB3 H -4.161 -4.670 -10.259 1.00 . B B . 317 ARG HB3 1 1 1 2571 2 2 19 ARG HD2 H -2.047 -5.816 -9.639 1.00 . B B . 317 ARG HD2 1 1 1 2572 2 2 19 ARG HD3 H -1.863 -7.535 -9.985 1.00 . B B . 317 ARG HD3 1 1 1 2573 2 2 19 ARG HE H -1.807 -5.370 -11.925 1.00 . B B . 317 ARG HE 1 1 1 2574 2 2 19 ARG HG2 H -4.156 -6.974 -9.230 1.00 . B B . 317 ARG HG2 1 1 1 2575 2 2 19 ARG HG3 H -4.121 -7.648 -10.857 1.00 . B B . 317 ARG HG3 1 1 1 2576 2 2 19 ARG HH11 H -2.161 -8.756 -11.293 1.00 . B B . 317 ARG HH11 1 1 1 2577 2 2 19 ARG HH12 H -1.703 -9.241 -12.892 1.00 . B B . 317 ARG HH12 1 1 1 2578 2 2 19 ARG HH21 H -1.207 -5.999 -14.017 1.00 . B B . 317 ARG HH21 1 1 1 2579 2 2 19 ARG HH22 H -1.163 -7.679 -14.435 1.00 . B B . 317 ARG HH22 1 1 1 2580 2 2 19 ARG N N -6.385 -5.272 -9.189 1.00 . B B . 317 ARG N 1 1 1 2581 2 2 19 ARG NE N -1.926 -6.306 -11.662 1.00 . B B . 317 ARG NE 1 1 1 2582 2 2 19 ARG NH1 N -1.870 -8.520 -12.220 1.00 . B B . 317 ARG NH1 1 1 1 2583 2 2 19 ARG NH2 N -1.329 -6.959 -13.763 1.00 . B B . 317 ARG NH2 1 1 1 2584 2 2 19 ARG O O -6.974 -7.306 -12.016 1.00 . B B . 317 ARG O 1 1 1 2585 2 2 20 LYS C C -8.385 -9.368 -10.426 1.00 . B B . 318 LYS C 1 1 1 2586 2 2 20 LYS CA C -6.900 -9.293 -10.113 1.00 . B B . 318 LYS CA 1 1 1 2587 2 2 20 LYS CB C -6.590 -10.131 -8.867 1.00 . B B . 318 LYS CB 1 1 1 2588 2 2 20 LYS CD C -6.483 -12.220 -10.252 1.00 . B B . 318 LYS CD 1 1 1 2589 2 2 20 LYS CE C -6.657 -13.733 -10.169 1.00 . B B . 318 LYS CE 1 1 1 2590 2 2 20 LYS CG C -7.129 -11.559 -9.027 1.00 . B B . 318 LYS CG 1 1 1 2591 2 2 20 LYS H H -6.125 -7.640 -9.040 1.00 . B B . 318 LYS H 1 1 1 2592 2 2 20 LYS HA H -6.345 -9.690 -10.945 1.00 . B B . 318 LYS HA 1 1 1 2593 2 2 20 LYS HB2 H -5.522 -10.179 -8.735 1.00 . B B . 318 LYS HB2 1 1 1 2594 2 2 20 LYS HB3 H -7.041 -9.674 -8.000 1.00 . B B . 318 LYS HB3 1 1 1 2595 2 2 20 LYS HD2 H -6.964 -11.861 -11.149 1.00 . B B . 318 LYS HD2 1 1 1 2596 2 2 20 LYS HD3 H -5.431 -11.980 -10.283 1.00 . B B . 318 LYS HD3 1 1 1 2597 2 2 20 LYS HE2 H -6.139 -14.197 -10.995 1.00 . B B . 318 LYS HE2 1 1 1 2598 2 2 20 LYS HE3 H -6.247 -14.092 -9.238 1.00 . B B . 318 LYS HE3 1 1 1 2599 2 2 20 LYS HG2 H -6.888 -12.129 -8.141 1.00 . B B . 318 LYS HG2 1 1 1 2600 2 2 20 LYS HG3 H -8.203 -11.540 -9.152 1.00 . B B . 318 LYS HG3 1 1 1 2601 2 2 20 LYS HZ1 H -8.235 -14.945 -10.777 1.00 . B B . 318 LYS HZ1 1 1 1 2602 2 2 20 LYS HZ2 H -8.618 -13.291 -10.713 1.00 . B B . 318 LYS HZ2 1 1 1 2603 2 2 20 LYS HZ3 H -8.480 -14.191 -9.278 1.00 . B B . 318 LYS HZ3 1 1 1 2604 2 2 20 LYS N N -6.482 -7.914 -9.911 1.00 . B B . 318 LYS N 1 1 1 2605 2 2 20 LYS NZ N -8.107 -14.065 -10.240 1.00 . B B . 318 LYS NZ 1 1 1 2606 2 2 20 LYS O O -8.807 -10.126 -11.302 1.00 . B B . 318 LYS O 1 1 1 2607 2 2 21 LEU C C -10.954 -8.251 -11.336 1.00 . B B . 319 LEU C 1 1 1 2608 2 2 21 LEU CA C -10.609 -8.589 -9.893 1.00 . B B . 319 LEU CA 1 1 1 2609 2 2 21 LEU CB C -11.258 -7.565 -8.957 1.00 . B B . 319 LEU CB 1 1 1 2610 2 2 21 LEU CD1 C -11.562 -6.911 -6.557 1.00 . B B . 319 LEU CD1 1 1 1 2611 2 2 21 LEU CD2 C -12.030 -9.282 -7.264 1.00 . B B . 319 LEU CD2 1 1 1 2612 2 2 21 LEU CG C -11.138 -8.043 -7.502 1.00 . B B . 319 LEU CG 1 1 1 2613 2 2 21 LEU H H -8.773 -8.018 -9.010 1.00 . B B . 319 LEU H 1 1 1 2614 2 2 21 LEU HA H -10.995 -9.566 -9.665 1.00 . B B . 319 LEU HA 1 1 1 2615 2 2 21 LEU HB2 H -10.752 -6.615 -9.066 1.00 . B B . 319 LEU HB2 1 1 1 2616 2 2 21 LEU HB3 H -12.300 -7.447 -9.216 1.00 . B B . 319 LEU HB3 1 1 1 2617 2 2 21 LEU HD11 H -12.462 -6.447 -6.930 1.00 . B B . 319 LEU HD11 1 1 1 2618 2 2 21 LEU HD12 H -10.775 -6.174 -6.500 1.00 . B B . 319 LEU HD12 1 1 1 2619 2 2 21 LEU HD13 H -11.748 -7.315 -5.573 1.00 . B B . 319 LEU HD13 1 1 1 2620 2 2 21 LEU HD21 H -11.475 -10.177 -7.508 1.00 . B B . 319 LEU HD21 1 1 1 2621 2 2 21 LEU HD22 H -12.913 -9.230 -7.885 1.00 . B B . 319 LEU HD22 1 1 1 2622 2 2 21 LEU HD23 H -12.327 -9.326 -6.224 1.00 . B B . 319 LEU HD23 1 1 1 2623 2 2 21 LEU HG H -10.110 -8.303 -7.301 1.00 . B B . 319 LEU HG 1 1 1 2624 2 2 21 LEU N N -9.169 -8.592 -9.700 1.00 . B B . 319 LEU N 1 1 1 2625 2 2 21 LEU O O -12.032 -8.594 -11.821 1.00 . B B . 319 LEU O 1 1 1 2626 2 2 22 GLN C C -10.195 -8.423 -14.308 1.00 . B B . 320 GLN C 1 1 1 2627 2 2 22 GLN CA C -10.261 -7.197 -13.401 1.00 . B B . 320 GLN CA 1 1 1 2628 2 2 22 GLN CB C -9.201 -6.186 -13.835 1.00 . B B . 320 GLN CB 1 1 1 2629 2 2 22 GLN CD C -8.083 -4.037 -13.227 1.00 . B B . 320 GLN CD 1 1 1 2630 2 2 22 GLN CG C -9.200 -5.007 -12.864 1.00 . B B . 320 GLN CG 1 1 1 2631 2 2 22 GLN H H -9.197 -7.330 -11.575 1.00 . B B . 320 GLN H 1 1 1 2632 2 2 22 GLN HA H -11.236 -6.743 -13.490 1.00 . B B . 320 GLN HA 1 1 1 2633 2 2 22 GLN HB2 H -8.231 -6.657 -13.839 1.00 . B B . 320 GLN HB2 1 1 1 2634 2 2 22 GLN HB3 H -9.431 -5.831 -14.828 1.00 . B B . 320 GLN HB3 1 1 1 2635 2 2 22 GLN HE21 H -8.472 -2.795 -11.729 1.00 . B B . 320 GLN HE21 1 1 1 2636 2 2 22 GLN HE22 H -7.179 -2.341 -12.729 1.00 . B B . 320 GLN HE22 1 1 1 2637 2 2 22 GLN HG2 H -10.151 -4.499 -12.913 1.00 . B B . 320 GLN HG2 1 1 1 2638 2 2 22 GLN HG3 H -9.042 -5.372 -11.863 1.00 . B B . 320 GLN HG3 1 1 1 2639 2 2 22 GLN N N -10.037 -7.577 -12.014 1.00 . B B . 320 GLN N 1 1 1 2640 2 2 22 GLN NE2 N -7.897 -2.970 -12.502 1.00 . B B . 320 GLN NE2 1 1 1 2641 2 2 22 GLN O O -10.030 -9.514 -13.784 1.00 . B B . 320 GLN O 1 1 1 2642 2 2 22 GLN OXT O -10.308 -8.254 -15.510 1.00 . B B . 320 GLN OXT 1 1 1 2643 2 2 22 GLN OE1 O -7.362 -4.258 -14.197 1.00 . B B . 320 GLN OE1 1 1 1 2644 3 3 1 CA CA CA -3.475 14.827 -6.760 1.00 . C A . 401 CA CA 1 1 1 2645 4 3 1 CA CA CA -15.164 8.803 -9.485 1.00 . D A . 402 CA CA 1 1 1 2646 5 3 1 CA CA CA 16.447 -8.792 -0.467 1.00 . E A . 403 CA CA 1 1 1 2647 6 3 1 CA CA CA 15.283 -10.327 10.566 1.00 . F A . 404 CA CA 1 1 stop_ save_
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