NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
654452 | 7a2d | 34552 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 126 |
data_7a2d_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_7a2d _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_7a2d 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_7a2d _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7a2d "Master copy" parsed_7a2d stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_7a2d _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 7a2d.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 2 peak "Not applicable" "Not applicable" 0 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 126 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 4 distance NOE simple 2965 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 5 distance "hydrogen bond" simple 126 parsed_7a2d 1 1 7a2d.mr . . XEASY 6 "chemical shift" "Not applicable" "Not applicable" 0 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 7 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_7a2d 1 1 7a2d.mr . . DYANA/DIANA 8 peak "Not applicable" "Not applicable" 0 parsed_7a2d 1 1 7a2d.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_7a2d 1 stop_ save_ save_DYANA/DIANA_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_7a2d _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 5 _Distance_constraint_list.Details "Generated by Wattos" 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 . . . parsed_7a2d 1 2 1 . . . parsed_7a2d 1 3 1 . . . parsed_7a2d 1 4 1 . . . parsed_7a2d 1 5 1 . . . parsed_7a2d 1 6 1 . . . parsed_7a2d 1 7 1 . . . parsed_7a2d 1 8 1 . . . parsed_7a2d 1 9 1 . . . parsed_7a2d 1 10 1 . . . parsed_7a2d 1 11 1 . . . parsed_7a2d 1 12 1 . . . parsed_7a2d 1 13 1 . . . parsed_7a2d 1 14 1 . . . parsed_7a2d 1 15 1 . . . parsed_7a2d 1 16 1 . . . parsed_7a2d 1 17 1 . . . parsed_7a2d 1 18 1 . . . parsed_7a2d 1 19 1 . . . parsed_7a2d 1 20 1 . . . parsed_7a2d 1 21 1 . . . parsed_7a2d 1 22 1 . . . parsed_7a2d 1 23 1 . . . parsed_7a2d 1 24 1 . . . parsed_7a2d 1 25 1 . . . parsed_7a2d 1 26 1 . . . parsed_7a2d 1 27 1 . . . parsed_7a2d 1 28 1 . . . parsed_7a2d 1 29 1 . . . parsed_7a2d 1 30 1 . . . parsed_7a2d 1 31 1 . . . parsed_7a2d 1 32 1 . . . parsed_7a2d 1 33 1 . . . parsed_7a2d 1 34 1 . . . parsed_7a2d 1 35 1 . . . parsed_7a2d 1 36 1 . . . parsed_7a2d 1 37 1 . . . parsed_7a2d 1 38 1 . . . parsed_7a2d 1 39 1 . . . parsed_7a2d 1 40 1 . . . parsed_7a2d 1 41 1 . . . parsed_7a2d 1 42 1 . . . parsed_7a2d 1 43 1 . . . parsed_7a2d 1 44 1 . . . parsed_7a2d 1 45 1 . . . parsed_7a2d 1 46 1 . . . parsed_7a2d 1 47 1 . . . parsed_7a2d 1 48 1 . . . parsed_7a2d 1 49 1 . . . parsed_7a2d 1 50 1 . . . parsed_7a2d 1 51 1 . . . parsed_7a2d 1 52 1 . . . parsed_7a2d 1 53 1 . . . parsed_7a2d 1 54 1 . . . parsed_7a2d 1 55 1 . . . parsed_7a2d 1 56 1 . . . parsed_7a2d 1 57 1 . . . parsed_7a2d 1 58 1 . . . parsed_7a2d 1 59 1 . . . parsed_7a2d 1 60 1 . . . parsed_7a2d 1 61 1 . . . parsed_7a2d 1 62 1 . . . parsed_7a2d 1 63 1 . . . parsed_7a2d 1 64 1 . . . parsed_7a2d 1 65 1 . . . parsed_7a2d 1 66 1 . . . parsed_7a2d 1 67 1 . . . parsed_7a2d 1 68 1 . . . parsed_7a2d 1 69 1 . . . parsed_7a2d 1 70 1 . . . parsed_7a2d 1 71 1 . . . parsed_7a2d 1 72 1 . . . parsed_7a2d 1 73 1 . . . parsed_7a2d 1 74 1 . . . parsed_7a2d 1 75 1 . . . parsed_7a2d 1 76 1 . . . parsed_7a2d 1 77 1 . . . parsed_7a2d 1 78 1 . . . parsed_7a2d 1 79 1 . . . parsed_7a2d 1 80 1 . . . parsed_7a2d 1 81 1 . . . parsed_7a2d 1 82 1 . . . parsed_7a2d 1 83 1 . . . parsed_7a2d 1 84 1 . . . parsed_7a2d 1 85 1 . . . parsed_7a2d 1 86 1 . . . parsed_7a2d 1 87 1 . . . parsed_7a2d 1 88 1 . . . parsed_7a2d 1 89 1 . . . parsed_7a2d 1 90 1 . . . parsed_7a2d 1 91 1 . . . parsed_7a2d 1 92 1 . . . parsed_7a2d 1 93 1 . . . parsed_7a2d 1 94 1 . . . parsed_7a2d 1 95 1 . . . parsed_7a2d 1 96 1 . . . parsed_7a2d 1 97 1 . . . parsed_7a2d 1 98 1 . . . parsed_7a2d 1 99 1 . . . parsed_7a2d 1 100 1 . . . parsed_7a2d 1 101 1 . . . parsed_7a2d 1 102 1 . . . parsed_7a2d 1 103 1 . . . parsed_7a2d 1 104 1 . . . parsed_7a2d 1 105 1 . . . parsed_7a2d 1 106 1 . . . parsed_7a2d 1 107 1 . . . parsed_7a2d 1 108 1 . . . parsed_7a2d 1 109 1 . . . parsed_7a2d 1 110 1 . . . parsed_7a2d 1 111 1 . . . parsed_7a2d 1 112 1 . . . parsed_7a2d 1 113 1 . . . parsed_7a2d 1 114 1 . . . parsed_7a2d 1 115 1 . . . parsed_7a2d 1 116 1 . . . parsed_7a2d 1 117 1 . . . parsed_7a2d 1 118 1 . . . parsed_7a2d 1 119 1 . . . parsed_7a2d 1 120 1 . . . parsed_7a2d 1 121 1 . . . parsed_7a2d 1 122 1 . . . parsed_7a2d 1 123 1 . . . parsed_7a2d 1 124 1 . . . parsed_7a2d 1 125 1 . . . parsed_7a2d 1 126 1 . . . parsed_7a2d 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.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_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 . . . . . . . . . 47 ASP O parsed_7a2d 1 1 1 2 . . . . . . . . . 51 GLU H parsed_7a2d 1 2 1 1 . . . . . . . . . 47 ASP O parsed_7a2d 1 2 1 2 . . . . . . . . . 51 GLU N parsed_7a2d 1 3 1 1 . . . . . . . . . 48 GLY O parsed_7a2d 1 3 1 2 . . . . . . . . . 52 VAL H parsed_7a2d 1 4 1 1 . . . . . . . . . 48 GLY O parsed_7a2d 1 4 1 2 . . . . . . . . . 52 VAL N parsed_7a2d 1 5 1 1 . . . . . . . . . 49 THR O parsed_7a2d 1 5 1 2 . . . . . . . . . 53 ARG H parsed_7a2d 1 6 1 1 . . . . . . . . . 49 THR O parsed_7a2d 1 6 1 2 . . . . . . . . . 53 ARG N parsed_7a2d 1 7 1 1 . . . . . . . . . 50 LEU O parsed_7a2d 1 7 1 2 . . . . . . . . . 54 VAL H parsed_7a2d 1 8 1 1 . . . . . . . . . 50 LEU O parsed_7a2d 1 8 1 2 . . . . . . . . . 54 VAL N parsed_7a2d 1 9 1 1 . . . . . . . . . 51 GLU O parsed_7a2d 1 9 1 2 . . . . . . . . . 55 ASN H parsed_7a2d 1 10 1 1 . . . . . . . . . 51 GLU O parsed_7a2d 1 10 1 2 . . . . . . . . . 55 ASN N parsed_7a2d 1 11 1 1 . . . . . . . . . 52 VAL O parsed_7a2d 1 11 1 2 . . . . . . . . . 56 SER H parsed_7a2d 1 12 1 1 . . . . . . . . . 52 VAL O parsed_7a2d 1 12 1 2 . . . . . . . . . 56 SER N parsed_7a2d 1 13 1 1 . . . . . . . . . 53 ARG O parsed_7a2d 1 13 1 2 . . . . . . . . . 57 ALA H parsed_7a2d 1 14 1 1 . . . . . . . . . 53 ARG O parsed_7a2d 1 14 1 2 . . . . . . . . . 57 ALA N parsed_7a2d 1 15 1 1 . . . . . . . . . 54 VAL O parsed_7a2d 1 15 1 2 . . . . . . . . . 58 LEU H parsed_7a2d 1 16 1 1 . . . . . . . . . 54 VAL O parsed_7a2d 1 16 1 2 . . . . . . . . . 58 LEU N parsed_7a2d 1 17 1 1 . . . . . . . . . 55 ASN O parsed_7a2d 1 17 1 2 . . . . . . . . . 59 SER H parsed_7a2d 1 18 1 1 . . . . . . . . . 55 ASN O parsed_7a2d 1 18 1 2 . . . . . . . . . 59 SER N parsed_7a2d 1 19 1 1 . . . . . . . . . 63 GLN O parsed_7a2d 1 19 1 2 . . . . . . . . . 67 GLU H parsed_7a2d 1 20 1 1 . . . . . . . . . 63 GLN O parsed_7a2d 1 20 1 2 . . . . . . . . . 67 GLU N parsed_7a2d 1 21 1 1 . . . . . . . . . 82 VAL O parsed_7a2d 1 21 1 2 . . . . . . . . . 71 ASN H parsed_7a2d 1 22 1 1 . . . . . . . . . 82 VAL O parsed_7a2d 1 22 1 2 . . . . . . . . . 71 ASN N parsed_7a2d 1 23 1 1 . . . . . . . . . 80 LEU O parsed_7a2d 1 23 1 2 . . . . . . . . . 73 THR H parsed_7a2d 1 24 1 1 . . . . . . . . . 80 LEU O parsed_7a2d 1 24 1 2 . . . . . . . . . 73 THR N parsed_7a2d 1 25 1 1 . . . . . . . . . 78 LYS O parsed_7a2d 1 25 1 2 . . . . . . . . . 75 TYR H parsed_7a2d 1 26 1 1 . . . . . . . . . 78 LYS O parsed_7a2d 1 26 1 2 . . . . . . . . . 75 TYR N parsed_7a2d 1 27 1 1 . . . . . . . . . 75 TYR O parsed_7a2d 1 27 1 2 . . . . . . . . . 78 LYS H parsed_7a2d 1 28 1 1 . . . . . . . . . 75 TYR O parsed_7a2d 1 28 1 2 . . . . . . . . . 78 LYS N parsed_7a2d 1 29 1 1 . . . . . . . . . 106 GLU O parsed_7a2d 1 29 1 2 . . . . . . . . . 79 VAL H parsed_7a2d 1 30 1 1 . . . . . . . . . 106 GLU O parsed_7a2d 1 30 1 2 . . . . . . . . . 79 VAL N parsed_7a2d 1 31 1 1 . . . . . . . . . 73 THR O parsed_7a2d 1 31 1 2 . . . . . . . . . 80 LEU H parsed_7a2d 1 32 1 1 . . . . . . . . . 73 THR O parsed_7a2d 1 32 1 2 . . . . . . . . . 80 LEU N parsed_7a2d 1 33 1 1 . . . . . . . . . 108 TYR O parsed_7a2d 1 33 1 2 . . . . . . . . . 81 LEU H parsed_7a2d 1 34 1 1 . . . . . . . . . 108 TYR O parsed_7a2d 1 34 1 2 . . . . . . . . . 81 LEU N parsed_7a2d 1 35 1 1 . . . . . . . . . 71 ASN O parsed_7a2d 1 35 1 2 . . . . . . . . . 82 VAL H parsed_7a2d 1 36 1 1 . . . . . . . . . 71 ASN O parsed_7a2d 1 36 1 2 . . . . . . . . . 82 VAL N parsed_7a2d 1 37 1 1 . . . . . . . . . 110 GLU O parsed_7a2d 1 37 1 2 . . . . . . . . . 83 GLY H parsed_7a2d 1 38 1 1 . . . . . . . . . 110 GLU O parsed_7a2d 1 38 1 2 . . . . . . . . . 83 GLY N parsed_7a2d 1 39 1 1 . . . . . . . . . 69 ARG O parsed_7a2d 1 39 1 2 . . . . . . . . . 84 GLN H parsed_7a2d 1 40 1 1 . . . . . . . . . 69 ARG O parsed_7a2d 1 40 1 2 . . . . . . . . . 84 GLN N parsed_7a2d 1 41 1 1 . . . . . . . . . 88 ALA O parsed_7a2d 1 41 1 2 . . . . . . . . . 92 ALA H parsed_7a2d 1 42 1 1 . . . . . . . . . 88 ALA O parsed_7a2d 1 42 1 2 . . . . . . . . . 92 ALA N parsed_7a2d 1 43 1 1 . . . . . . . . . 89 GLU O parsed_7a2d 1 43 1 2 . . . . . . . . . 93 ARG H parsed_7a2d 1 44 1 1 . . . . . . . . . 89 GLU O parsed_7a2d 1 44 1 2 . . . . . . . . . 93 ARG N parsed_7a2d 1 45 1 1 . . . . . . . . . 90 LEU O parsed_7a2d 1 45 1 2 . . . . . . . . . 94 ALA H parsed_7a2d 1 46 1 1 . . . . . . . . . 90 LEU O parsed_7a2d 1 46 1 2 . . . . . . . . . 94 ALA N parsed_7a2d 1 47 1 1 . . . . . . . . . 91 SER O parsed_7a2d 1 47 1 2 . . . . . . . . . 95 LYS H parsed_7a2d 1 48 1 1 . . . . . . . . . 91 SER O parsed_7a2d 1 48 1 2 . . . . . . . . . 95 LYS N parsed_7a2d 1 49 1 1 . . . . . . . . . 92 ALA O parsed_7a2d 1 49 1 2 . . . . . . . . . 96 GLN H parsed_7a2d 1 50 1 1 . . . . . . . . . 92 ALA O parsed_7a2d 1 50 1 2 . . . . . . . . . 96 GLN N parsed_7a2d 1 51 1 1 . . . . . . . . . 93 ARG O parsed_7a2d 1 51 1 2 . . . . . . . . . 97 ILE H parsed_7a2d 1 52 1 1 . . . . . . . . . 93 ARG O parsed_7a2d 1 52 1 2 . . . . . . . . . 97 ILE N parsed_7a2d 1 53 1 1 . . . . . . . . . 94 ALA O parsed_7a2d 1 53 1 2 . . . . . . . . . 98 ALA H parsed_7a2d 1 54 1 1 . . . . . . . . . 94 ALA O parsed_7a2d 1 54 1 2 . . . . . . . . . 98 ALA N parsed_7a2d 1 55 1 1 . . . . . . . . . 95 LYS O parsed_7a2d 1 55 1 2 . . . . . . . . . 99 MET H parsed_7a2d 1 56 1 1 . . . . . . . . . 95 LYS O parsed_7a2d 1 56 1 2 . . . . . . . . . 99 MET N parsed_7a2d 1 57 1 1 . . . . . . . . . 96 GLN O parsed_7a2d 1 57 1 2 . . . . . . . . . 100 GLY H parsed_7a2d 1 58 1 1 . . . . . . . . . 96 GLN O parsed_7a2d 1 58 1 2 . . . . . . . . . 100 GLY N parsed_7a2d 1 59 1 1 . . . . . . . . . 97 ILE O parsed_7a2d 1 59 1 2 . . . . . . . . . 101 VAL H parsed_7a2d 1 60 1 1 . . . . . . . . . 97 ILE O parsed_7a2d 1 60 1 2 . . . . . . . . . 101 VAL N parsed_7a2d 1 61 1 1 . . . . . . . . . 101 VAL O parsed_7a2d 1 61 1 2 . . . . . . . . . 104 ALA H parsed_7a2d 1 62 1 1 . . . . . . . . . 101 VAL O parsed_7a2d 1 62 1 2 . . . . . . . . . 104 ALA N parsed_7a2d 1 63 1 1 . . . . . . . . . 81 LEU O parsed_7a2d 1 63 1 2 . . . . . . . . . 110 GLU H parsed_7a2d 1 64 1 1 . . . . . . . . . 81 LEU O parsed_7a2d 1 64 1 2 . . . . . . . . . 110 GLU N parsed_7a2d 1 65 1 1 . . . . . . . . . 83 GLY O parsed_7a2d 1 65 1 2 . . . . . . . . . 112 ARG H parsed_7a2d 1 66 1 1 . . . . . . . . . 83 GLY O parsed_7a2d 1 66 1 2 . . . . . . . . . 112 ARG N parsed_7a2d 1 67 1 1 . . . . . . . . . 120 GLY O parsed_7a2d 1 67 1 2 . . . . . . . . . 124 ASN H parsed_7a2d 1 68 1 1 . . . . . . . . . 120 GLY O parsed_7a2d 1 68 1 2 . . . . . . . . . 124 ASN N parsed_7a2d 1 69 1 1 . . . . . . . . . 124 ASN O parsed_7a2d 1 69 1 2 . . . . . . . . . 128 ILE H parsed_7a2d 1 70 1 1 . . . . . . . . . 124 ASN O parsed_7a2d 1 70 1 2 . . . . . . . . . 128 ILE N parsed_7a2d 1 71 1 1 . . . . . . . . . 125 ASP O parsed_7a2d 1 71 1 2 . . . . . . . . . 129 THR H parsed_7a2d 1 72 1 1 . . . . . . . . . 125 ASP O parsed_7a2d 1 72 1 2 . . . . . . . . . 129 THR N parsed_7a2d 1 73 1 1 . . . . . . . . . 126 THR O parsed_7a2d 1 73 1 2 . . . . . . . . . 130 THR H parsed_7a2d 1 74 1 1 . . . . . . . . . 126 THR O parsed_7a2d 1 74 1 2 . . . . . . . . . 130 THR N parsed_7a2d 1 75 1 1 . . . . . . . . . 127 TRP O parsed_7a2d 1 75 1 2 . . . . . . . . . 131 LYS H parsed_7a2d 1 76 1 1 . . . . . . . . . 127 TRP O parsed_7a2d 1 76 1 2 . . . . . . . . . 131 LYS N parsed_7a2d 1 77 1 1 . . . . . . . . . 128 ILE O parsed_7a2d 1 77 1 2 . . . . . . . . . 132 VAL H parsed_7a2d 1 78 1 1 . . . . . . . . . 128 ILE O parsed_7a2d 1 78 1 2 . . . . . . . . . 132 VAL N parsed_7a2d 1 79 1 1 . . . . . . . . . 129 THR O parsed_7a2d 1 79 1 2 . . . . . . . . . 133 ARG H parsed_7a2d 1 80 1 1 . . . . . . . . . 129 THR O parsed_7a2d 1 80 1 2 . . . . . . . . . 133 ARG N parsed_7a2d 1 81 1 1 . . . . . . . . . 130 THR O parsed_7a2d 1 81 1 2 . . . . . . . . . 134 SER H parsed_7a2d 1 82 1 1 . . . . . . . . . 130 THR O parsed_7a2d 1 82 1 2 . . . . . . . . . 134 SER N parsed_7a2d 1 83 1 1 . . . . . . . . . 131 LYS O parsed_7a2d 1 83 1 2 . . . . . . . . . 135 GLN H parsed_7a2d 1 84 1 1 . . . . . . . . . 131 LYS O parsed_7a2d 1 84 1 2 . . . . . . . . . 135 GLN N parsed_7a2d 1 85 1 1 . . . . . . . . . 132 VAL O parsed_7a2d 1 85 1 2 . . . . . . . . . 136 LEU H parsed_7a2d 1 86 1 1 . . . . . . . . . 132 VAL O parsed_7a2d 1 86 1 2 . . . . . . . . . 136 LEU N parsed_7a2d 1 87 1 1 . . . . . . . . . 133 ARG O parsed_7a2d 1 87 1 2 . . . . . . . . . 137 LEU H parsed_7a2d 1 88 1 1 . . . . . . . . . 133 ARG O parsed_7a2d 1 88 1 2 . . . . . . . . . 137 LEU N parsed_7a2d 1 89 1 1 . . . . . . . . . 159 MET O parsed_7a2d 1 89 1 2 . . . . . . . . . 148 LYS H parsed_7a2d 1 90 1 1 . . . . . . . . . 159 MET O parsed_7a2d 1 90 1 2 . . . . . . . . . 148 LYS N parsed_7a2d 1 91 1 1 . . . . . . . . . 157 PHE O parsed_7a2d 1 91 1 2 . . . . . . . . . 150 THR H parsed_7a2d 1 92 1 1 . . . . . . . . . 157 PHE O parsed_7a2d 1 92 1 2 . . . . . . . . . 150 THR N parsed_7a2d 1 93 1 1 . . . . . . . . . 152 GLU O parsed_7a2d 1 93 1 2 . . . . . . . . . 155 GLU H parsed_7a2d 1 94 1 1 . . . . . . . . . 152 GLU O parsed_7a2d 1 94 1 2 . . . . . . . . . 155 GLU N parsed_7a2d 1 95 1 1 . . . . . . . . . 182 ARG O parsed_7a2d 1 95 1 2 . . . . . . . . . 156 VAL H parsed_7a2d 1 96 1 1 . . . . . . . . . 182 ARG O parsed_7a2d 1 96 1 2 . . . . . . . . . 156 VAL N parsed_7a2d 1 97 1 1 . . . . . . . . . 150 THR O parsed_7a2d 1 97 1 2 . . . . . . . . . 157 PHE H parsed_7a2d 1 98 1 1 . . . . . . . . . 150 THR O parsed_7a2d 1 98 1 2 . . . . . . . . . 157 PHE N parsed_7a2d 1 99 1 1 . . . . . . . . . 184 THR O parsed_7a2d 1 99 1 2 . . . . . . . . . 158 LEU H parsed_7a2d 1 100 1 1 . . . . . . . . . 184 THR O parsed_7a2d 1 100 1 2 . . . . . . . . . 158 LEU N parsed_7a2d 1 101 1 1 . . . . . . . . . 148 LYS O parsed_7a2d 1 101 1 2 . . . . . . . . . 159 MET H parsed_7a2d 1 102 1 1 . . . . . . . . . 148 LYS O parsed_7a2d 1 102 1 2 . . . . . . . . . 159 MET N parsed_7a2d 1 103 1 1 . . . . . . . . . 163 THR O parsed_7a2d 1 103 1 2 . . . . . . . . . 167 ALA H parsed_7a2d 1 104 1 1 . . . . . . . . . 163 THR O parsed_7a2d 1 104 1 2 . . . . . . . . . 167 ALA N parsed_7a2d 1 105 1 1 . . . . . . . . . 164 GLU O parsed_7a2d 1 105 1 2 . . . . . . . . . 168 LYS H parsed_7a2d 1 106 1 1 . . . . . . . . . 164 GLU O parsed_7a2d 1 106 1 2 . . . . . . . . . 168 LYS N parsed_7a2d 1 107 1 1 . . . . . . . . . 165 ARG O parsed_7a2d 1 107 1 2 . . . . . . . . . 169 ALA H parsed_7a2d 1 108 1 1 . . . . . . . . . 165 ARG O parsed_7a2d 1 108 1 2 . . . . . . . . . 169 ALA N parsed_7a2d 1 109 1 1 . . . . . . . . . 166 GLU O parsed_7a2d 1 109 1 2 . . . . . . . . . 170 ALA H parsed_7a2d 1 110 1 1 . . . . . . . . . 166 GLU O parsed_7a2d 1 110 1 2 . . . . . . . . . 170 ALA N parsed_7a2d 1 111 1 1 . . . . . . . . . 167 ALA O parsed_7a2d 1 111 1 2 . . . . . . . . . 171 ALA H parsed_7a2d 1 112 1 1 . . . . . . . . . 167 ALA O parsed_7a2d 1 112 1 2 . . . . . . . . . 171 ALA N parsed_7a2d 1 113 1 1 . . . . . . . . . 168 LYS O parsed_7a2d 1 113 1 2 . . . . . . . . . 172 ASP H parsed_7a2d 1 114 1 1 . . . . . . . . . 168 LYS O parsed_7a2d 1 114 1 2 . . . . . . . . . 172 ASP N parsed_7a2d 1 115 1 1 . . . . . . . . . 169 ALA O parsed_7a2d 1 115 1 2 . . . . . . . . . 173 ILE H parsed_7a2d 1 116 1 1 . . . . . . . . . 169 ALA O parsed_7a2d 1 116 1 2 . . . . . . . . . 173 ILE N parsed_7a2d 1 117 1 1 . . . . . . . . . 170 ALA O parsed_7a2d 1 117 1 2 . . . . . . . . . 174 ALA H parsed_7a2d 1 118 1 1 . . . . . . . . . 170 ALA O parsed_7a2d 1 118 1 2 . . . . . . . . . 174 ALA N parsed_7a2d 1 119 1 1 . . . . . . . . . 171 ALA O parsed_7a2d 1 119 1 2 . . . . . . . . . 175 SER H parsed_7a2d 1 120 1 1 . . . . . . . . . 171 ALA O parsed_7a2d 1 120 1 2 . . . . . . . . . 175 SER N parsed_7a2d 1 121 1 1 . . . . . . . . . 172 ASP O parsed_7a2d 1 121 1 2 . . . . . . . . . 176 ARG H parsed_7a2d 1 122 1 1 . . . . . . . . . 172 ASP O parsed_7a2d 1 122 1 2 . . . . . . . . . 176 ARG N parsed_7a2d 1 123 1 1 . . . . . . . . . 173 ILE O parsed_7a2d 1 123 1 2 . . . . . . . . . 177 VAL H parsed_7a2d 1 124 1 1 . . . . . . . . . 173 ILE O parsed_7a2d 1 124 1 2 . . . . . . . . . 177 VAL N parsed_7a2d 1 125 1 1 . . . . . . . . . 156 VAL O parsed_7a2d 1 125 1 2 . . . . . . . . . 184 THR H parsed_7a2d 1 126 1 1 . . . . . . . . . 156 VAL O parsed_7a2d 1 126 1 2 . . . . . . . . . 184 THR N parsed_7a2d 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 . . . . . . . 2.00 parsed_7a2d 1 2 1 . . . . . . . 3.00 parsed_7a2d 1 3 1 . . . . . . . 2.00 parsed_7a2d 1 4 1 . . . . . . . 3.00 parsed_7a2d 1 5 1 . . . . . . . 2.00 parsed_7a2d 1 6 1 . . . . . . . 3.00 parsed_7a2d 1 7 1 . . . . . . . 2.00 parsed_7a2d 1 8 1 . . . . . . . 3.00 parsed_7a2d 1 9 1 . . . . . . . 2.00 parsed_7a2d 1 10 1 . . . . . . . 3.00 parsed_7a2d 1 11 1 . . . . . . . 2.00 parsed_7a2d 1 12 1 . . . . . . . 3.00 parsed_7a2d 1 13 1 . . . . . . . 2.00 parsed_7a2d 1 14 1 . . . . . . . 3.00 parsed_7a2d 1 15 1 . . . . . . . 2.00 parsed_7a2d 1 16 1 . . . . . . . 3.00 parsed_7a2d 1 17 1 . . . . . . . 2.00 parsed_7a2d 1 18 1 . . . . . . . 3.00 parsed_7a2d 1 19 1 . . . . . . . 2.00 parsed_7a2d 1 20 1 . . . . . . . 3.00 parsed_7a2d 1 21 1 . . . . . . . 2.00 parsed_7a2d 1 22 1 . . . . . . . 3.00 parsed_7a2d 1 23 1 . . . . . . . 2.00 parsed_7a2d 1 24 1 . . . . . . . 3.00 parsed_7a2d 1 25 1 . . . . . . . 2.00 parsed_7a2d 1 26 1 . . . . . . . 3.00 parsed_7a2d 1 27 1 . . . . . . . 2.00 parsed_7a2d 1 28 1 . . . . . . . 3.00 parsed_7a2d 1 29 1 . . . . . . . 2.00 parsed_7a2d 1 30 1 . . . . . . . 3.00 parsed_7a2d 1 31 1 . . . . . . . 2.00 parsed_7a2d 1 32 1 . . . . . . . 3.00 parsed_7a2d 1 33 1 . . . . . . . 2.00 parsed_7a2d 1 34 1 . . . . . . . 3.00 parsed_7a2d 1 35 1 . . . . . . . 2.00 parsed_7a2d 1 36 1 . . . . . . . 3.00 parsed_7a2d 1 37 1 . . . . . . . 2.00 parsed_7a2d 1 38 1 . . . . . . . 3.00 parsed_7a2d 1 39 1 . . . . . . . 2.00 parsed_7a2d 1 40 1 . . . . . . . 3.00 parsed_7a2d 1 41 1 . . . . . . . 2.00 parsed_7a2d 1 42 1 . . . . . . . 3.00 parsed_7a2d 1 43 1 . . . . . . . 2.00 parsed_7a2d 1 44 1 . . . . . . . 3.00 parsed_7a2d 1 45 1 . . . . . . . 2.00 parsed_7a2d 1 46 1 . . . . . . . 3.00 parsed_7a2d 1 47 1 . . . . . . . 2.00 parsed_7a2d 1 48 1 . . . . . . . 3.00 parsed_7a2d 1 49 1 . . . . . . . 2.00 parsed_7a2d 1 50 1 . . . . . . . 3.00 parsed_7a2d 1 51 1 . . . . . . . 2.00 parsed_7a2d 1 52 1 . . . . . . . 3.00 parsed_7a2d 1 53 1 . . . . . . . 2.00 parsed_7a2d 1 54 1 . . . . . . . 3.00 parsed_7a2d 1 55 1 . . . . . . . 2.00 parsed_7a2d 1 56 1 . . . . . . . 3.00 parsed_7a2d 1 57 1 . . . . . . . 2.00 parsed_7a2d 1 58 1 . . . . . . . 3.00 parsed_7a2d 1 59 1 . . . . . . . 2.00 parsed_7a2d 1 60 1 . . . . . . . 3.00 parsed_7a2d 1 61 1 . . . . . . . 2.00 parsed_7a2d 1 62 1 . . . . . . . 3.00 parsed_7a2d 1 63 1 . . . . . . . 2.00 parsed_7a2d 1 64 1 . . . . . . . 3.00 parsed_7a2d 1 65 1 . . . . . . . 2.00 parsed_7a2d 1 66 1 . . . . . . . 3.00 parsed_7a2d 1 67 1 . . . . . . . 2.00 parsed_7a2d 1 68 1 . . . . . . . 3.00 parsed_7a2d 1 69 1 . . . . . . . 2.00 parsed_7a2d 1 70 1 . . . . . . . 3.00 parsed_7a2d 1 71 1 . . . . . . . 2.00 parsed_7a2d 1 72 1 . . . . . . . 3.00 parsed_7a2d 1 73 1 . . . . . . . 2.00 parsed_7a2d 1 74 1 . . . . . . . 3.00 parsed_7a2d 1 75 1 . . . . . . . 2.00 parsed_7a2d 1 76 1 . . . . . . . 3.00 parsed_7a2d 1 77 1 . . . . . . . 2.00 parsed_7a2d 1 78 1 . . . . . . . 3.00 parsed_7a2d 1 79 1 . . . . . . . 2.00 parsed_7a2d 1 80 1 . . . . . . . 3.00 parsed_7a2d 1 81 1 . . . . . . . 2.00 parsed_7a2d 1 82 1 . . . . . . . 3.00 parsed_7a2d 1 83 1 . . . . . . . 2.00 parsed_7a2d 1 84 1 . . . . . . . 3.00 parsed_7a2d 1 85 1 . . . . . . . 2.00 parsed_7a2d 1 86 1 . . . . . . . 3.00 parsed_7a2d 1 87 1 . . . . . . . 2.00 parsed_7a2d 1 88 1 . . . . . . . 3.00 parsed_7a2d 1 89 1 . . . . . . . 2.00 parsed_7a2d 1 90 1 . . . . . . . 3.00 parsed_7a2d 1 91 1 . . . . . . . 2.00 parsed_7a2d 1 92 1 . . . . . . . 3.00 parsed_7a2d 1 93 1 . . . . . . . 2.00 parsed_7a2d 1 94 1 . . . . . . . 3.00 parsed_7a2d 1 95 1 . . . . . . . 2.00 parsed_7a2d 1 96 1 . . . . . . . 3.00 parsed_7a2d 1 97 1 . . . . . . . 2.00 parsed_7a2d 1 98 1 . . . . . . . 3.00 parsed_7a2d 1 99 1 . . . . . . . 2.00 parsed_7a2d 1 100 1 . . . . . . . 3.00 parsed_7a2d 1 101 1 . . . . . . . 2.00 parsed_7a2d 1 102 1 . . . . . . . 3.00 parsed_7a2d 1 103 1 . . . . . . . 2.00 parsed_7a2d 1 104 1 . . . . . . . 3.00 parsed_7a2d 1 105 1 . . . . . . . 2.00 parsed_7a2d 1 106 1 . . . . . . . 3.00 parsed_7a2d 1 107 1 . . . . . . . 2.00 parsed_7a2d 1 108 1 . . . . . . . 3.00 parsed_7a2d 1 109 1 . . . . . . . 2.00 parsed_7a2d 1 110 1 . . . . . . . 3.00 parsed_7a2d 1 111 1 . . . . . . . 2.00 parsed_7a2d 1 112 1 . . . . . . . 3.00 parsed_7a2d 1 113 1 . . . . . . . 2.00 parsed_7a2d 1 114 1 . . . . . . . 3.00 parsed_7a2d 1 115 1 . . . . . . . 2.00 parsed_7a2d 1 116 1 . . . . . . . 3.00 parsed_7a2d 1 117 1 . . . . . . . 2.00 parsed_7a2d 1 118 1 . . . . . . . 3.00 parsed_7a2d 1 119 1 . . . . . . . 2.00 parsed_7a2d 1 120 1 . . . . . . . 3.00 parsed_7a2d 1 121 1 . . . . . . . 2.00 parsed_7a2d 1 122 1 . . . . . . . 3.00 parsed_7a2d 1 123 1 . . . . . . . 2.00 parsed_7a2d 1 124 1 . . . . . . . 3.00 parsed_7a2d 1 125 1 . . . . . . . 2.00 parsed_7a2d 1 126 1 . . . . . . . 3.00 parsed_7a2d 1 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 "Restraints file 4: hbonds.upl" 1 1 1 31 parsed_7a2d 1 2 "61 ASP O 65 LYS H 2.00" 20 1 20 36 parsed_7a2d 1 3 "61 ASP O 65 LYS N 3.00" 21 1 21 36 parsed_7a2d 1 4 "64 ILE O 68 ALA H 2.00" 24 1 24 37 parsed_7a2d 1 5 "64 ILE O 68 ALA N 3.00" 25 1 25 37 parsed_7a2d 1 6 "84 GLN O 69 ARG H 2.00" 26 1 26 36 parsed_7a2d 1 7 "84 GLN O 69 ARG N 3.00" 27 1 27 36 parsed_7a2d 1 8 parallel 36 37 36 45 parsed_7a2d 1 9 parallel 37 37 37 45 parsed_7a2d 1 10 parallel 40 37 40 45 parsed_7a2d 1 11 parallel 41 37 41 45 parsed_7a2d 1 12 parallel 44 37 44 47 parsed_7a2d 1 13 parallel 45 37 45 46 parsed_7a2d 1 14 "112 ARG O 85 SER H 2.00 #weakened as this is a parallel b-sheet" 48 1 48 77 parsed_7a2d 1 15 "112 ARG O 85 SER H 3.00 #weakened as this is a parallel b-sheet" 49 1 49 77 parsed_7a2d 1 16 "weakened slightly" 56 37 56 54 parsed_7a2d 1 17 "weakened slightly" 57 37 57 55 parsed_7a2d 1 18 "weakened slightly" 60 37 60 54 parsed_7a2d 1 19 "weakened slightly" 61 37 61 54 parsed_7a2d 1 20 "weakened slightly" 66 37 66 54 parsed_7a2d 1 21 "weakened slightly" 67 37 67 54 parsed_7a2d 1 22 "weakened slightly" 68 37 68 54 parsed_7a2d 1 23 "weakened slightly" 69 37 69 54 parsed_7a2d 1 24 "79 VAL O 108 TYR N 2.00 #parallel" 72 1 72 46 parsed_7a2d 1 25 "79 VAL O 108 TYR H 3.00 #parallel" 73 1 73 46 parsed_7a2d 1 26 parallel 74 37 74 45 parsed_7a2d 1 27 parallel 75 37 75 45 parsed_7a2d 1 28 parallel 76 37 76 45 parsed_7a2d 1 29 parallel 77 37 77 45 parsed_7a2d 1 30 "152 GLU O 154 GLY H 2.00" 104 1 104 37 parsed_7a2d 1 31 "152 GLU O 154 GLY N 3.00" 105 1 105 36 parsed_7a2d 1 stop_ save_
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