NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
616025 | 5wrx | 36038 | cing | 2-parsed | STAR | entry | full | 125 |
data_5wrx_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5wrx _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_5wrx 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5wrx _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 5wrx "Master copy" parsed_5wrx stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5wrx _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 5wrx.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5wrx 1 1 5wrx.mr . . DYANA/DIANA 2 sequence "Not applicable" "Not applicable" 0 parsed_5wrx 1 1 5wrx.mr . . DYANA/DIANA 3 distance NOE simple 103 parsed_5wrx 1 1 5wrx.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 22 parsed_5wrx 1 1 5wrx.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5wrx 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_5wrx _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER DE NOVO PROTEIN, ANTIMICROBIAL PROTEIN 04-DEC-16 5WRX *TITLE VG13P STRUCTURE IN LPS *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: ANALOGUE PEPTIDE VG13P; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; *SOURCE 4 ORGANISM_TAXID: 32630 *KEYWDS ANTIMICROBIAL PEPTIDE, ENDOTOXIN NEUTRALISATION, TURN AND LOOP-LIKE *KEYWDS 2 STRUCTURE, DE NOVO PROTEIN, ANTIMICROBIAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR A.DATTA,A.BHUNIA *REVDAT 1 10-MAY-17 5WRX 0 ; save_ save_DYANA/DIANA_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_5wrx _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 3 _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_5wrx 1 2 1 . . . parsed_5wrx 1 3 1 . . . parsed_5wrx 1 4 1 . . . parsed_5wrx 1 5 1 . . . parsed_5wrx 1 6 1 . . . parsed_5wrx 1 7 1 . . . parsed_5wrx 1 8 1 . . . parsed_5wrx 1 9 1 . . . parsed_5wrx 1 10 1 . . . parsed_5wrx 1 11 1 . . . parsed_5wrx 1 12 1 . . . parsed_5wrx 1 13 1 . . . parsed_5wrx 1 14 1 . . . parsed_5wrx 1 15 1 . . . parsed_5wrx 1 16 1 . . . parsed_5wrx 1 17 1 . . . parsed_5wrx 1 18 1 . . . parsed_5wrx 1 19 1 . . . parsed_5wrx 1 20 1 . . . parsed_5wrx 1 21 1 . . . parsed_5wrx 1 22 1 . . . parsed_5wrx 1 23 1 . . . parsed_5wrx 1 24 1 . . . parsed_5wrx 1 25 1 . . . parsed_5wrx 1 26 1 . . . parsed_5wrx 1 27 1 . . . parsed_5wrx 1 28 1 . . . parsed_5wrx 1 29 1 . . . parsed_5wrx 1 30 1 . . . parsed_5wrx 1 31 1 . . . parsed_5wrx 1 32 1 . . . parsed_5wrx 1 33 1 . . . parsed_5wrx 1 34 1 . . . parsed_5wrx 1 35 1 . . . parsed_5wrx 1 36 1 . . . parsed_5wrx 1 37 1 . . . parsed_5wrx 1 38 1 . . . parsed_5wrx 1 39 1 . . . parsed_5wrx 1 40 1 . . . parsed_5wrx 1 41 1 . . . parsed_5wrx 1 42 1 . . . parsed_5wrx 1 43 1 . . . parsed_5wrx 1 44 1 . . . parsed_5wrx 1 45 1 . . . parsed_5wrx 1 46 1 . . . parsed_5wrx 1 47 1 . . . parsed_5wrx 1 48 1 . . . parsed_5wrx 1 49 1 . . . parsed_5wrx 1 50 1 . . . parsed_5wrx 1 51 1 . . . parsed_5wrx 1 52 1 . . . parsed_5wrx 1 53 1 . . . parsed_5wrx 1 54 1 . . . parsed_5wrx 1 55 1 . . . parsed_5wrx 1 56 1 . . . parsed_5wrx 1 57 1 . . . parsed_5wrx 1 58 1 . . . parsed_5wrx 1 59 1 . . . parsed_5wrx 1 60 1 . . . parsed_5wrx 1 61 1 . . . parsed_5wrx 1 62 1 . . . parsed_5wrx 1 63 1 . . . parsed_5wrx 1 64 1 . . . parsed_5wrx 1 65 1 . . . parsed_5wrx 1 66 1 . . . parsed_5wrx 1 67 1 . . . parsed_5wrx 1 68 1 . . . parsed_5wrx 1 69 1 . . . parsed_5wrx 1 70 1 . . . parsed_5wrx 1 71 1 . . . parsed_5wrx 1 72 1 . . . parsed_5wrx 1 73 1 . . . parsed_5wrx 1 74 1 . . . parsed_5wrx 1 75 1 . . . parsed_5wrx 1 76 1 . . . parsed_5wrx 1 77 1 . . . parsed_5wrx 1 78 1 . . . parsed_5wrx 1 79 1 . . . parsed_5wrx 1 80 1 . . . parsed_5wrx 1 81 1 . . . parsed_5wrx 1 82 1 . . . parsed_5wrx 1 83 1 . . . parsed_5wrx 1 84 1 . . . parsed_5wrx 1 85 1 . . . parsed_5wrx 1 86 1 . . . parsed_5wrx 1 87 1 . . . parsed_5wrx 1 88 1 . . . parsed_5wrx 1 89 1 . . . parsed_5wrx 1 90 1 . . . parsed_5wrx 1 91 1 . . . parsed_5wrx 1 92 1 . . . parsed_5wrx 1 93 1 . . . parsed_5wrx 1 94 1 . . . parsed_5wrx 1 95 1 . . . parsed_5wrx 1 96 1 . . . parsed_5wrx 1 97 1 . . . parsed_5wrx 1 98 1 . . . parsed_5wrx 1 99 1 . . . parsed_5wrx 1 100 1 . . . parsed_5wrx 1 101 1 . . . parsed_5wrx 1 102 1 . . . parsed_5wrx 1 103 1 . . . parsed_5wrx 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 . . . . . . . . . 1 VAL HB parsed_5wrx 1 1 1 2 . . . . . . . . . 1 VAL H parsed_5wrx 1 2 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 2 1 2 . . . . . . . . . 1 VAL H parsed_5wrx 1 3 1 1 . . . . . . . . . 1 VAL HA parsed_5wrx 1 3 1 2 . . . . . . . . . 2 ALA H parsed_5wrx 1 4 1 1 . . . . . . . . . 1 VAL HB parsed_5wrx 1 4 1 2 . . . . . . . . . 2 ALA H parsed_5wrx 1 5 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 5 1 2 . . . . . . . . . 2 ALA H parsed_5wrx 1 6 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 6 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 7 1 1 . . . . . . . . . 2 ALA QB parsed_5wrx 1 7 1 2 . . . . . . . . . 2 ALA H parsed_5wrx 1 8 1 1 . . . . . . . . . 2 ALA HA parsed_5wrx 1 8 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 9 1 1 . . . . . . . . . 2 ALA QB parsed_5wrx 1 9 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 10 1 1 . . . . . . . . . 3 ARG QB parsed_5wrx 1 10 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 11 1 1 . . . . . . . . . 3 ARG QG parsed_5wrx 1 11 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 12 1 1 . . . . . . . . . 3 ARG QD parsed_5wrx 1 12 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 13 1 1 . . . . . . . . . 3 ARG HA parsed_5wrx 1 13 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 14 1 1 . . . . . . . . . 3 ARG QB parsed_5wrx 1 14 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 15 1 1 . . . . . . . . . 3 ARG QG parsed_5wrx 1 15 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 16 1 1 . . . . . . . . . 3 ARG QD parsed_5wrx 1 16 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 17 1 1 . . . . . . . . . 4 GLY QA parsed_5wrx 1 17 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 18 1 1 . . . . . . . . . 5 TRP QB parsed_5wrx 1 18 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 19 1 1 . . . . . . . . . 5 TRP HA parsed_5wrx 1 19 1 2 . . . . . . . . . 5 TRP HE3 parsed_5wrx 1 20 1 1 . . . . . . . . . 5 TRP HA parsed_5wrx 1 20 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 21 1 1 . . . . . . . . . 5 TRP QB parsed_5wrx 1 21 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 22 1 1 . . . . . . . . . 5 TRP QB parsed_5wrx 1 22 1 2 . . . . . . . . . 5 TRP HE3 parsed_5wrx 1 23 1 1 . . . . . . . . . 5 TRP HA parsed_5wrx 1 23 1 2 . . . . . . . . . 6 GLY H parsed_5wrx 1 24 1 1 . . . . . . . . . 5 TRP QB parsed_5wrx 1 24 1 2 . . . . . . . . . 6 GLY H parsed_5wrx 1 25 1 1 . . . . . . . . . 6 GLY QA parsed_5wrx 1 25 1 2 . . . . . . . . . 7 ARG H parsed_5wrx 1 26 1 1 . . . . . . . . . 7 ARG QB parsed_5wrx 1 26 1 2 . . . . . . . . . 7 ARG H parsed_5wrx 1 27 1 1 . . . . . . . . . 7 ARG QG parsed_5wrx 1 27 1 2 . . . . . . . . . 7 ARG H parsed_5wrx 1 28 1 1 . . . . . . . . . 7 ARG HA parsed_5wrx 1 28 1 2 . . . . . . . . . 8 LYS H parsed_5wrx 1 29 1 1 . . . . . . . . . 8 LYS QB parsed_5wrx 1 29 1 2 . . . . . . . . . 8 LYS H parsed_5wrx 1 30 1 1 . . . . . . . . . 8 LYS QD parsed_5wrx 1 30 1 2 . . . . . . . . . 8 LYS H parsed_5wrx 1 31 1 1 . . . . . . . . . 8 LYS QG parsed_5wrx 1 31 1 2 . . . . . . . . . 8 LYS H parsed_5wrx 1 32 1 1 . . . . . . . . . 8 LYS HA parsed_5wrx 1 32 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 33 1 1 . . . . . . . . . 8 LYS QB parsed_5wrx 1 33 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 34 1 1 . . . . . . . . . 8 LYS QG parsed_5wrx 1 34 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 35 1 1 . . . . . . . . . 8 LYS QD parsed_5wrx 1 35 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 36 1 1 . . . . . . . . . 9 CYS QB parsed_5wrx 1 36 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 37 1 1 . . . . . . . . . 10 PRO QB parsed_5wrx 1 37 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 38 1 1 . . . . . . . . . 10 PRO QG parsed_5wrx 1 38 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 39 1 1 . . . . . . . . . 10 PRO QD parsed_5wrx 1 39 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 40 1 1 . . . . . . . . . 11 LEU QB parsed_5wrx 1 40 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 41 1 1 . . . . . . . . . 11 LEU HG parsed_5wrx 1 41 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 42 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 42 1 2 . . . . . . . . . 11 LEU H parsed_5wrx 1 43 1 1 . . . . . . . . . 11 LEU HA parsed_5wrx 1 43 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 44 1 1 . . . . . . . . . 11 LEU QB parsed_5wrx 1 44 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 45 1 1 . . . . . . . . . 11 LEU HG parsed_5wrx 1 45 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 46 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 46 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 47 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 47 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 48 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 48 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 49 1 1 . . . . . . . . . 11 LEU HG parsed_5wrx 1 49 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 50 1 1 . . . . . . . . . 11 LEU QB parsed_5wrx 1 50 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 51 1 1 . . . . . . . . . 11 LEU QB parsed_5wrx 1 51 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 52 1 1 . . . . . . . . . 11 LEU HA parsed_5wrx 1 52 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 53 1 1 . . . . . . . . . 11 LEU HA parsed_5wrx 1 53 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 54 1 1 . . . . . . . . . 12 PHE QB parsed_5wrx 1 54 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 55 1 1 . . . . . . . . . 12 PHE HA parsed_5wrx 1 55 1 2 . . . . . . . . . 13 GLY H parsed_5wrx 1 56 1 1 . . . . . . . . . 12 PHE HA parsed_5wrx 1 56 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 57 1 1 . . . . . . . . . 12 PHE HA parsed_5wrx 1 57 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 58 1 1 . . . . . . . . . 12 PHE QB parsed_5wrx 1 58 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 59 1 1 . . . . . . . . . 12 PHE QB parsed_5wrx 1 59 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 60 1 1 . . . . . . . . . 12 PHE HA parsed_5wrx 1 60 1 2 . . . . . . . . . 13 GLY H parsed_5wrx 1 61 1 1 . . . . . . . . . 12 PHE QB parsed_5wrx 1 61 1 2 . . . . . . . . . 13 GLY H parsed_5wrx 1 62 1 1 . . . . . . . . . 2 ALA H parsed_5wrx 1 62 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 63 1 1 . . . . . . . . . 3 ARG H parsed_5wrx 1 63 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 64 1 1 . . . . . . . . . 4 GLY H parsed_5wrx 1 64 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 65 1 1 . . . . . . . . . 5 TRP H parsed_5wrx 1 65 1 2 . . . . . . . . . 6 GLY H parsed_5wrx 1 66 1 1 . . . . . . . . . 6 GLY H parsed_5wrx 1 66 1 2 . . . . . . . . . 7 ARG H parsed_5wrx 1 67 1 1 . . . . . . . . . 7 ARG H parsed_5wrx 1 67 1 2 . . . . . . . . . 8 LYS H parsed_5wrx 1 68 1 1 . . . . . . . . . 8 LYS H parsed_5wrx 1 68 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 69 1 1 . . . . . . . . . 11 LEU H parsed_5wrx 1 69 1 2 . . . . . . . . . 12 PHE H parsed_5wrx 1 70 1 1 . . . . . . . . . 12 PHE H parsed_5wrx 1 70 1 2 . . . . . . . . . 13 GLY H parsed_5wrx 1 71 1 1 . . . . . . . . . 11 LEU QG parsed_5wrx 1 71 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 72 1 1 . . . . . . . . . 11 LEU QB parsed_5wrx 1 72 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 73 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 73 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 74 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 74 1 2 . . . . . . . . . 5 TRP HZ3 parsed_5wrx 1 75 1 1 . . . . . . . . . 1 VAL HB parsed_5wrx 1 75 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 76 1 1 . . . . . . . . . 2 ALA HB parsed_5wrx 1 76 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 77 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 77 1 2 . . . . . . . . . 5 TRP HE3 parsed_5wrx 1 78 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 78 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 79 1 1 . . . . . . . . . 1 VAL HB parsed_5wrx 1 79 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 80 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 80 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 81 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 81 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 82 1 1 . . . . . . . . . 2 ALA QB parsed_5wrx 1 82 1 2 . . . . . . . . . 5 TRP H parsed_5wrx 1 83 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 83 1 2 . . . . . . . . . 5 TRP HZ2 parsed_5wrx 1 84 1 1 . . . . . . . . . 10 PRO QG parsed_5wrx 1 84 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 85 1 1 . . . . . . . . . 10 PRO QG parsed_5wrx 1 85 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 86 1 1 . . . . . . . . . 5 TRP HB2 parsed_5wrx 1 86 1 2 . . . . . . . . . 12 PHE HZ parsed_5wrx 1 87 1 1 . . . . . . . . . 1 VAL HB parsed_5wrx 1 87 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 88 1 1 . . . . . . . . . 2 ALA QB parsed_5wrx 1 88 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 89 1 1 . . . . . . . . . 1 VAL QQG parsed_5wrx 1 89 1 2 . . . . . . . . . 12 PHE QE parsed_5wrx 1 90 1 1 . . . . . . . . . 12 PHE QB parsed_5wrx 1 90 1 2 . . . . . . . . . 5 TRP HD1 parsed_5wrx 1 91 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 91 1 2 . . . . . . . . . 1 VAL H parsed_5wrx 1 92 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 92 1 2 . . . . . . . . . 2 ALA H parsed_5wrx 1 93 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 93 1 2 . . . . . . . . . 3 ARG H parsed_5wrx 1 94 1 1 . . . . . . . . . 10 PRO QD parsed_5wrx 1 94 1 2 . . . . . . . . . 5 TRP HZ3 parsed_5wrx 1 95 1 1 . . . . . . . . . 10 PRO HA parsed_5wrx 1 95 1 2 . . . . . . . . . 5 TRP HZ3 parsed_5wrx 1 96 1 1 . . . . . . . . . 10 PRO QG parsed_5wrx 1 96 1 2 . . . . . . . . . 5 TRP HZ3 parsed_5wrx 1 97 1 1 . . . . . . . . . 7 ARG HA parsed_5wrx 1 97 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 98 1 1 . . . . . . . . . 5 TRP HA parsed_5wrx 1 98 1 2 . . . . . . . . . 9 CYS H parsed_5wrx 1 99 1 1 . . . . . . . . . 11 LEU QQD parsed_5wrx 1 99 1 2 . . . . . . . . . 4 GLY H parsed_5wrx 1 100 1 1 . . . . . . . . . 10 PRO HA parsed_5wrx 1 100 1 2 . . . . . . . . . 12 PHE QD parsed_5wrx 1 101 1 1 . . . . . . . . . 9 CYS HB2 parsed_5wrx 1 101 1 2 . . . . . . . . . 5 TRP HZ3 parsed_5wrx 1 102 1 1 . . . . . . . . . 6 GLY QA parsed_5wrx 1 102 1 2 . . . . . . . . . 5 TRP HE3 parsed_5wrx 1 103 1 1 . . . . . . . . . 2 ALA QB parsed_5wrx 1 103 1 2 . . . . . . . . . 12 PHE HZ parsed_5wrx 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.5 parsed_5wrx 1 2 1 . . . . . . . 3.8 parsed_5wrx 1 3 1 . . . . . . . 3.5 parsed_5wrx 1 4 1 . . . . . . . 3.5 parsed_5wrx 1 5 1 . . . . . . . 4.0 parsed_5wrx 1 6 1 . . . . . . . 4.8 parsed_5wrx 1 7 1 . . . . . . . 3.5 parsed_5wrx 1 8 1 . . . . . . . 3.5 parsed_5wrx 1 9 1 . . . . . . . 3.8 parsed_5wrx 1 10 1 . . . . . . . 3.5 parsed_5wrx 1 11 1 . . . . . . . 4.0 parsed_5wrx 1 12 1 . . . . . . . 3.8 parsed_5wrx 1 13 1 . . . . . . . 3.5 parsed_5wrx 1 14 1 . . . . . . . 3.7 parsed_5wrx 1 15 1 . . . . . . . 4.5 parsed_5wrx 1 16 1 . . . . . . . 4.0 parsed_5wrx 1 17 1 . . . . . . . 3.5 parsed_5wrx 1 18 1 . . . . . . . 3.5 parsed_5wrx 1 19 1 . . . . . . . 4.5 parsed_5wrx 1 20 1 . . . . . . . 4.6 parsed_5wrx 1 21 1 . . . . . . . 3.8 parsed_5wrx 1 22 1 . . . . . . . 4.0 parsed_5wrx 1 23 1 . . . . . . . 3.5 parsed_5wrx 1 24 1 . . . . . . . 3.8 parsed_5wrx 1 25 1 . . . . . . . 3.8 parsed_5wrx 1 26 1 . . . . . . . 3.5 parsed_5wrx 1 27 1 . . . . . . . 3.8 parsed_5wrx 1 28 1 . . . . . . . 3.5 parsed_5wrx 1 29 1 . . . . . . . 3.8 parsed_5wrx 1 30 1 . . . . . . . 3.8 parsed_5wrx 1 31 1 . . . . . . . 3.8 parsed_5wrx 1 32 1 . . . . . . . 3.5 parsed_5wrx 1 33 1 . . . . . . . 3.8 parsed_5wrx 1 34 1 . . . . . . . 4.0 parsed_5wrx 1 35 1 . . . . . . . 4.0 parsed_5wrx 1 36 1 . . . . . . . 3.8 parsed_5wrx 1 37 1 . . . . . . . 4.5 parsed_5wrx 1 38 1 . . . . . . . 4.8 parsed_5wrx 1 39 1 . . . . . . . 5.3 parsed_5wrx 1 40 1 . . . . . . . 3.5 parsed_5wrx 1 41 1 . . . . . . . 4.2 parsed_5wrx 1 42 1 . . . . . . . 3.8 parsed_5wrx 1 43 1 . . . . . . . 3.5 parsed_5wrx 1 44 1 . . . . . . . 3.8 parsed_5wrx 1 45 1 . . . . . . . 4.3 parsed_5wrx 1 46 1 . . . . . . . 4.0 parsed_5wrx 1 47 1 . . . . . . . 4.3 parsed_5wrx 1 48 1 . . . . . . . 4.3 parsed_5wrx 1 49 1 . . . . . . . 4.9 parsed_5wrx 1 50 1 . . . . . . . 4.9 parsed_5wrx 1 51 1 . . . . . . . 4.5 parsed_5wrx 1 52 1 . . . . . . . 5.3 parsed_5wrx 1 53 1 . . . . . . . 4.6 parsed_5wrx 1 54 1 . . . . . . . 3.8 parsed_5wrx 1 55 1 . . . . . . . 3.3 parsed_5wrx 1 56 1 . . . . . . . 4.0 parsed_5wrx 1 57 1 . . . . . . . 5.3 parsed_5wrx 1 58 1 . . . . . . . 4.5 parsed_5wrx 1 59 1 . . . . . . . 4.5 parsed_5wrx 1 60 1 . . . . . . . 3.5 parsed_5wrx 1 61 1 . . . . . . . 3.8 parsed_5wrx 1 62 1 . . . . . . . 3.2 parsed_5wrx 1 63 1 . . . . . . . 3.2 parsed_5wrx 1 64 1 . . . . . . . 3.7 parsed_5wrx 1 65 1 . . . . . . . 4.3 parsed_5wrx 1 66 1 . . . . . . . 3.5 parsed_5wrx 1 67 1 . . . . . . . 3.2 parsed_5wrx 1 68 1 . . . . . . . 3.4 parsed_5wrx 1 69 1 . . . . . . . 3.7 parsed_5wrx 1 70 1 . . . . . . . 3.2 parsed_5wrx 1 71 1 . . . . . . . 4.7 parsed_5wrx 1 72 1 . . . . . . . 5.3 parsed_5wrx 1 73 1 . . . . . . . 4.4 parsed_5wrx 1 74 1 . . . . . . . 5.0 parsed_5wrx 1 75 1 . . . . . . . 4.4 parsed_5wrx 1 76 1 . . . . . . . 4.2 parsed_5wrx 1 77 1 . . . . . . . 5.0 parsed_5wrx 1 78 1 . . . . . . . 4.3 parsed_5wrx 1 79 1 . . . . . . . 5.1 parsed_5wrx 1 80 1 . . . . . . . 4.8 parsed_5wrx 1 81 1 . . . . . . . 4.5 parsed_5wrx 1 82 1 . . . . . . . 4.2 parsed_5wrx 1 83 1 . . . . . . . 5.0 parsed_5wrx 1 84 1 . . . . . . . 5.3 parsed_5wrx 1 85 1 . . . . . . . 4.9 parsed_5wrx 1 86 1 . . . . . . . 4.3 parsed_5wrx 1 87 1 . . . . . . . 4.9 parsed_5wrx 1 88 1 . . . . . . . 5.2 parsed_5wrx 1 89 1 . . . . . . . 4.6 parsed_5wrx 1 90 1 . . . . . . . 4.5 parsed_5wrx 1 91 1 . . . . . . . 4.6 parsed_5wrx 1 92 1 . . . . . . . 4.8 parsed_5wrx 1 93 1 . . . . . . . 4.8 parsed_5wrx 1 94 1 . . . . . . . 4.9 parsed_5wrx 1 95 1 . . . . . . . 4.9 parsed_5wrx 1 96 1 . . . . . . . 5.1 parsed_5wrx 1 97 1 . . . . . . . 4.8 parsed_5wrx 1 98 1 . . . . . . . 4.3 parsed_5wrx 1 99 1 . . . . . . . 4.5 parsed_5wrx 1 100 1 . . . . . . . 5.0 parsed_5wrx 1 101 1 . . . . . . . 4.5 parsed_5wrx 1 102 1 . . . . . . . 4.2 parsed_5wrx 1 103 1 . . . . . . . 4.5 parsed_5wrx 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 2: VG13P.upl" 1 1 1 30 parsed_5wrx 1 stop_ save_ save_DYANA/DIANA_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_5wrx _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _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 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 1 VAL . . . . . . . . . . . . . parsed_5wrx 1 2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 2 ALA . . . . . . . . . . . . . parsed_5wrx 1 3 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 2 ALA . . . . . . . . . . . . . parsed_5wrx 1 4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 3 ARG . . . . . . . . . . . . . parsed_5wrx 1 5 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 3 ARG . . . . . . . . . . . . . parsed_5wrx 1 6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 4 GLY . . . . . . . . . . . . . parsed_5wrx 1 7 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 4 GLY . . . . . . . . . . . . . parsed_5wrx 1 8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 5 TRP . . . . . . . . . . . . . parsed_5wrx 1 9 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 5 TRP . . . . . . . . . . . . . parsed_5wrx 1 10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 6 GLY . . . . . . . . . . . . . parsed_5wrx 1 11 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 6 GLY . . . . . . . . . . . . . parsed_5wrx 1 12 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 7 ARG . . . . . . . . . . . . . parsed_5wrx 1 13 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 7 ARG . . . . . . . . . . . . . parsed_5wrx 1 14 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 8 LYS . . . . . . . . . . . . . parsed_5wrx 1 15 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 8 LYS . . . . . . . . . . . . . parsed_5wrx 1 16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 9 CYS . . . . . . . . . . . . . parsed_5wrx 1 17 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 9 CYS . . . . . . . . . . . . . parsed_5wrx 1 18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 11 LEU . . . . . . . . . . . . . parsed_5wrx 1 19 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 11 LEU . . . . . . . . . . . . . parsed_5wrx 1 20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 12 PHE . . . . . . . . . . . . . parsed_5wrx 1 21 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 120 . . 12 PHE . . . . . . . . . . . . . parsed_5wrx 1 22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -30 . . 13 GLY . . . . . . . . . . . . . parsed_5wrx 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 "Restraints file 3: VG13P.aco" 1 1 1 30 parsed_5wrx 1 2 "Torsion angle constraints" 2 1 2 28 parsed_5wrx 1 3 "generated from HA secondary chemical shifts" 3 1 3 64 parsed_5wrx 1 stop_ save_
Contact the webmaster for help, if required. Friday, May 3, 2024 1:08:31 AM GMT (wattos1)