NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
30955 | 1dmd | cing | 2-parsed | STAR | entry | full | 203 |
data_1dmd_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1dmd _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_1dmd 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1dmd _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 1dmd "Master copy" parsed_1dmd stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1dmd _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 1dmd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1dmd 1 1 1dmd.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1dmd 1 1 1dmd.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 36 parsed_1dmd 1 1 1dmd.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1dmd 1 1 1dmd.mr . . XPLOR/CNS 5 distance NOE simple 167 parsed_1dmd 1 1 1dmd.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1dmd 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_1dmd _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 METALLOTHIONEIN 22-NOV-94 1DMD *COMPND CD-6 METALLOTHIONEIN-1 (CD-6 MT) (ALPHA DOMAIN) *COMPND 2 (NMR, 18 STRUCTURES) *SOURCE CRAB (CALLINECTES SAPIDUS) *AUTHOR S.S.NARULA,M.BROUWER,Y.HUA,I.M.ARMITAGE *REVDAT 1 07-FEB-95 1DMD 0 !ct_dihe.tbl, numbered 1,2, 3 etc. !Dihedral angle of Lys 38 and Ala 40 is changed from -120+-40 to -20+-140 !to consider type I and II turn, July 15 !Dihedral angles for C-terminal cluster, Feb 18, 1993 !The force constant is 2 !The range of the side chain angles is +-30 !The Values are based on the following arguments: ! ! for J> 9.0 Hz, phi= -120+-30; ! ! for J between 9.0 and 8.0 Hz, phi= -120+-40; ! ! for J between 8.0 and 5.0 Hz, phi= -105+-55; ! ! for J less than 5 Hz, phi= -60+-30 ! ! For all Gly and Pro, phi= -105+-55; (Maximum Range). ! ; save_ save_MR_file_comment_2 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1dmd _Org_constr_file_comment.ID 2 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 2 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; set message=off echo=off end !set message=on echo=on end restraints dihedral reset ! Changed for XPLOR3.1, May 26 ; save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1dmd _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 3 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 1 . c . 2 . n . 2 . ca . 2 . c parsed_1dmd 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 2 . c . 3 . n . 3 . ca . 3 . c parsed_1dmd 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 3 . c . 4 . n . 4 . ca . 4 . c parsed_1dmd 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 4 . c . 5 . n . 5 . ca . 5 . c parsed_1dmd 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1dmd 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1dmd 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_1dmd 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1dmd 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1dmd 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 120.0 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1dmd 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1dmd 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 120.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1dmd 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_1dmd 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 14 . c . 15 . n . 15 . ca . 15 . c parsed_1dmd 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1dmd 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_1dmd 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1dmd 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1dmd 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1dmd 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1dmd 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1dmd 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 22 . c . 23 . n . 23 . ca . 23 . c parsed_1dmd 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1dmd 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 24 . c . 25 . n . 25 . ca . 25 . c parsed_1dmd 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1dmd 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1dmd 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 27 . c . 28 . n . 28 . ca . 28 . c parsed_1dmd 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1dmd 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_1dmd 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1dmd 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 3 . n . 3 . ca . 3 . cb . 3 . sg parsed_1dmd 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 6 . n . 6 . ca . 6 . cb . 6 . sg parsed_1dmd 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 18 . n . 18 . ca . 18 . cb . 18 . sg parsed_1dmd 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 22 . n . 22 . ca . 22 . cb . 22 . sg parsed_1dmd 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 26 . n . 26 . ca . 26 . cb . 26 . sg parsed_1dmd 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 29 . n . 29 . ca . 29 . cb . 29 . sg parsed_1dmd 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 "! 29, Pro," 1 1 2 18 parsed_1dmd 1 2 "Cys 30, 7.7" 4 1 4 13 parsed_1dmd 1 3 "Glu 31, 5?" 6 1 6 12 parsed_1dmd 1 4 "Lys 32, 7.8" 8 1 8 13 parsed_1dmd 1 5 "Cys 33, 9.6" 10 1 10 13 parsed_1dmd 1 6 "Thr 34, 5.9" 12 1 12 13 parsed_1dmd 1 7 "Ser 35, 9.1" 14 1 14 13 parsed_1dmd 1 8 "Gly 36, 9.3" 16 1 16 13 parsed_1dmd 1 9 "Cys 37, 6.8" 18 1 18 13 parsed_1dmd 1 10 "Lys 38, 8.4, value changed from -120+-40 to -20+-140 to consider type I and II turn together." 20 1 20 95 parsed_1dmd 1 11 "Cys39, 7.0" 22 1 22 12 parsed_1dmd 1 12 "Ala 40, 6.5, value changed from -105+-55 to -20+-140 to consider type I and II turn together." 24 1 24 95 parsed_1dmd 1 13 "Thr 41, 8.4" 26 1 26 13 parsed_1dmd 1 14 "Lys 42, 3.9" 28 1 28 13 parsed_1dmd 1 15 "Glu 43, 6.8" 30 1 30 13 parsed_1dmd 1 16 "Glu 44, 6.4" 32 1 32 13 parsed_1dmd 1 17 "Cys 45, 4.1" 34 1 34 13 parsed_1dmd 1 18 "Ser 46, 4.1" 36 1 36 13 parsed_1dmd 1 19 "Lys 47, 8.0" 38 1 38 13 parsed_1dmd 1 20 "Thr 48, could not be measured" 40 1 40 31 parsed_1dmd 1 21 "Cys 49, 9.0" 42 1 42 13 parsed_1dmd 1 22 "Thr 50, 5.5" 44 1 44 13 parsed_1dmd 1 23 "Lys 51, 6.5" 46 1 46 13 parsed_1dmd 1 24 "Pro 52," 48 1 48 9 parsed_1dmd 1 25 "Cys 53, 7.0" 50 1 50 13 parsed_1dmd 1 26 "Ser 54, 3.6" 52 1 52 13 parsed_1dmd 1 27 "Cys 55, 7.2" 54 1 54 13 parsed_1dmd 1 28 "Cys 56, 5.9" 56 1 56 13 parsed_1dmd 1 29 "Pro 57" 58 1 58 8 parsed_1dmd 1 30 "Lys 58, 7.0" 60 1 60 13 parsed_1dmd 1 31 ; Chi angles around Calpha-Cbeta bond Bridged Cys are Cys 33, Cys 49 and Cys 56; Feb. 18, 1993 ! Cys 30, terminal ; 62 1 65 20 parsed_1dmd 1 32 "! Cys 33, bridged" 67 1 67 19 parsed_1dmd 1 33 ; March 1, July 15 Cys 37, terminal, could not be determined. Cys 39, terminal, could not be determined !Cys 45, terminal ; 68 117 71 19 parsed_1dmd 1 34 "Cys 49, bridged," 73 1 73 19 parsed_1dmd 1 35 ; July 19, Sunday ! Cys 53, terminal ; 74 121 75 20 parsed_1dmd 1 36 ; Cys 55, terminal, could not be determined Cys 56, bridged ; 77 1 78 17 parsed_1dmd 1 stop_ save_ save_MR_file_comment_4 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1dmd _Org_constr_file_comment.ID 3 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 4 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; end set message=on echo=on end ---------- X-Sun-Data-Type: default X-Sun-Data-Name: ct_noe.tbl.a X-Sun-Content-Lines: 196 !ct_noe.tbl; July 9,1993, numbered 1,2, 3 etc. !Some of the NOEs are corrected Feb 23, 24, 26, July 8,9 !For C-terminal metal cluster !Reference for NOE is JMB 196, 611-39 (1987). ! ! Strong NOEs have range 1.8 0.0 0.9 ! Medium NOEs have range 1.8 0.0 1.4 ! Weak NOEs have range 1.8 0.0 1.8 ! Very weak NOEs have range 1.8 0.0 2.7 (Those appearing in higher mixing time ! NOESY spectra. ! Add 2.4 for Val methyl groups. set message=off echo=off end !set message=on echo=on end ! ; save_ save_CNS/XPLOR_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1dmd _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _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_1dmd 1 2 1 . . . parsed_1dmd 1 3 1 . . . parsed_1dmd 1 4 1 . . . parsed_1dmd 1 5 1 . . . parsed_1dmd 1 6 1 . . . parsed_1dmd 1 7 1 . . . parsed_1dmd 1 8 1 . . . parsed_1dmd 1 9 1 . . . parsed_1dmd 1 10 1 . . . parsed_1dmd 1 11 1 . . . parsed_1dmd 1 12 1 . . . parsed_1dmd 1 13 1 . . . parsed_1dmd 1 14 1 . . . parsed_1dmd 1 15 1 . . . parsed_1dmd 1 16 1 . . . parsed_1dmd 1 17 1 . . . parsed_1dmd 1 18 1 . . . parsed_1dmd 1 19 1 . . . parsed_1dmd 1 20 1 . . . parsed_1dmd 1 21 1 . . . parsed_1dmd 1 22 1 . . . parsed_1dmd 1 23 1 . . . parsed_1dmd 1 24 1 . . . parsed_1dmd 1 25 1 . . . parsed_1dmd 1 26 1 . . . parsed_1dmd 1 27 1 . . . parsed_1dmd 1 28 1 . . . parsed_1dmd 1 29 1 . . . parsed_1dmd 1 30 1 . . . parsed_1dmd 1 31 1 . . . parsed_1dmd 1 32 1 . . . parsed_1dmd 1 33 1 . . . parsed_1dmd 1 34 1 . . . parsed_1dmd 1 35 1 . . . parsed_1dmd 1 36 1 . . . parsed_1dmd 1 37 1 . . . parsed_1dmd 1 38 1 . . . parsed_1dmd 1 39 1 . . . parsed_1dmd 1 40 1 . . . parsed_1dmd 1 41 1 . . . parsed_1dmd 1 42 1 . . . parsed_1dmd 1 43 1 . . . parsed_1dmd 1 44 1 . . . parsed_1dmd 1 45 1 . . . parsed_1dmd 1 46 1 . . . parsed_1dmd 1 47 1 . . . parsed_1dmd 1 48 1 . . . parsed_1dmd 1 49 1 . . . parsed_1dmd 1 50 1 . . . parsed_1dmd 1 51 1 . . . parsed_1dmd 1 52 1 . . . parsed_1dmd 1 53 1 . . . parsed_1dmd 1 54 1 . . . parsed_1dmd 1 55 1 . . . parsed_1dmd 1 56 1 . . . parsed_1dmd 1 57 1 . . . parsed_1dmd 1 58 1 . . . parsed_1dmd 1 59 1 . . . parsed_1dmd 1 60 1 . . . parsed_1dmd 1 61 1 . . . parsed_1dmd 1 62 1 . . . parsed_1dmd 1 63 1 . . . parsed_1dmd 1 64 1 . . . parsed_1dmd 1 65 1 . . . parsed_1dmd 1 66 1 . . . parsed_1dmd 1 67 1 . . . parsed_1dmd 1 68 1 . . . parsed_1dmd 1 69 1 . . . parsed_1dmd 1 70 1 . . . parsed_1dmd 1 71 1 . . . parsed_1dmd 1 72 1 . . . parsed_1dmd 1 73 1 . . . parsed_1dmd 1 74 1 . . . parsed_1dmd 1 75 1 . . . parsed_1dmd 1 76 1 . . . parsed_1dmd 1 77 1 . . . parsed_1dmd 1 78 1 . . . parsed_1dmd 1 79 1 . . . parsed_1dmd 1 80 1 . . . parsed_1dmd 1 81 1 . . . parsed_1dmd 1 82 1 . . . parsed_1dmd 1 83 1 . . . parsed_1dmd 1 84 1 . . . parsed_1dmd 1 85 1 . . . parsed_1dmd 1 86 1 . . . parsed_1dmd 1 87 1 . . . parsed_1dmd 1 88 1 . . . parsed_1dmd 1 89 1 . . . parsed_1dmd 1 90 1 . . . parsed_1dmd 1 91 1 . . . parsed_1dmd 1 92 1 . . . parsed_1dmd 1 93 1 . . . parsed_1dmd 1 94 1 . . . parsed_1dmd 1 95 1 . . . parsed_1dmd 1 96 1 . . . parsed_1dmd 1 97 1 . . . parsed_1dmd 1 98 1 . . . parsed_1dmd 1 99 1 . . . parsed_1dmd 1 100 1 . . . parsed_1dmd 1 101 1 . . . parsed_1dmd 1 102 1 . . . parsed_1dmd 1 103 1 . . . parsed_1dmd 1 104 1 . . . parsed_1dmd 1 105 1 . . . parsed_1dmd 1 106 1 . . . parsed_1dmd 1 107 1 . . . parsed_1dmd 1 108 1 . . . parsed_1dmd 1 109 1 . . . parsed_1dmd 1 110 1 . . . parsed_1dmd 1 111 1 . . . parsed_1dmd 1 112 1 . . . parsed_1dmd 1 113 1 . . . parsed_1dmd 1 114 1 . . . parsed_1dmd 1 115 1 . . . parsed_1dmd 1 116 1 . . . parsed_1dmd 1 117 1 . . . parsed_1dmd 1 118 1 . . . parsed_1dmd 1 119 1 . . . parsed_1dmd 1 120 1 . . . parsed_1dmd 1 121 1 . . . parsed_1dmd 1 122 1 . . . parsed_1dmd 1 123 1 . . . parsed_1dmd 1 124 1 . . . parsed_1dmd 1 125 1 . . . parsed_1dmd 1 126 1 . . . parsed_1dmd 1 127 1 . . . parsed_1dmd 1 128 1 . . . parsed_1dmd 1 129 1 . . . parsed_1dmd 1 130 1 . . . parsed_1dmd 1 131 1 . . . parsed_1dmd 1 132 1 . . . parsed_1dmd 1 133 1 . . . parsed_1dmd 1 134 1 . . . parsed_1dmd 1 135 1 . . . parsed_1dmd 1 136 1 . . . parsed_1dmd 1 137 1 . . . parsed_1dmd 1 138 1 . . . parsed_1dmd 1 139 1 . . . parsed_1dmd 1 140 1 . . . parsed_1dmd 1 141 1 . . . parsed_1dmd 1 142 1 . . . parsed_1dmd 1 143 1 . . . parsed_1dmd 1 144 1 . . . parsed_1dmd 1 145 1 . . . parsed_1dmd 1 146 1 . . . parsed_1dmd 1 147 1 . . . parsed_1dmd 1 148 1 . . . parsed_1dmd 1 149 1 . . . parsed_1dmd 1 150 1 . . . parsed_1dmd 1 151 1 . . . parsed_1dmd 1 152 1 . . . parsed_1dmd 1 153 1 . . . parsed_1dmd 1 154 1 . . . parsed_1dmd 1 155 1 . . . parsed_1dmd 1 156 1 . . . parsed_1dmd 1 157 1 . . . parsed_1dmd 1 158 1 . . . parsed_1dmd 1 159 1 . . . parsed_1dmd 1 160 1 . . . parsed_1dmd 1 161 1 . . . parsed_1dmd 1 162 1 . . . parsed_1dmd 1 163 1 . . . parsed_1dmd 1 164 1 . . . parsed_1dmd 1 165 1 . . . parsed_1dmd 1 166 1 . . . parsed_1dmd 1 167 1 . . . parsed_1dmd 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 . HA parsed_1dmd 1 1 1 2 . . . . . . . . . 2 . HG# parsed_1dmd 1 2 1 1 . . . . . . . . . 1 . HA parsed_1dmd 1 2 1 2 . . . . . . . . . 2 . HG# parsed_1dmd 1 3 1 1 . . . . . . . . . 1 . HT# parsed_1dmd 1 3 1 2 . . . . . . . . . 1 . HB# parsed_1dmd 1 4 1 1 . . . . . . . . . 2 . HA parsed_1dmd 1 4 1 2 . . . . . . . . . 3 . HN parsed_1dmd 1 5 1 1 . . . . . . . . . 2 . HB# parsed_1dmd 1 5 1 2 . . . . . . . . . 3 . HN parsed_1dmd 1 6 1 1 . . . . . . . . . 2 . HA parsed_1dmd 1 6 1 2 . . . . . . . . . 6 . HB2 parsed_1dmd 1 7 1 1 . . . . . . . . . 2 . HA parsed_1dmd 1 7 1 2 . . . . . . . . . 6 . HB1 parsed_1dmd 1 8 1 1 . . . . . . . . . 2 . HA parsed_1dmd 1 8 1 2 . . . . . . . . . 26 . HA parsed_1dmd 1 9 1 1 . . . . . . . . . 2 . HA parsed_1dmd 1 9 1 2 . . . . . . . . . 26 . HB1 parsed_1dmd 1 10 1 1 . . . . . . . . . 2 . HG# parsed_1dmd 1 10 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 11 1 1 . . . . . . . . . 3 . HA parsed_1dmd 1 11 1 2 . . . . . . . . . 4 . HN parsed_1dmd 1 12 1 1 . . . . . . . . . 3 . HA parsed_1dmd 1 12 1 2 . . . . . . . . . 4 . HA parsed_1dmd 1 13 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 13 1 2 . . . . . . . . . 4 . HN parsed_1dmd 1 14 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 14 1 2 . . . . . . . . . 3 . HB1 parsed_1dmd 1 15 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 15 1 2 . . . . . . . . . 3 . HB2 parsed_1dmd 1 16 1 1 . . . . . . . . . 3 . HB1 parsed_1dmd 1 16 1 2 . . . . . . . . . 4 . HN parsed_1dmd 1 17 1 1 . . . . . . . . . 3 . HB2 parsed_1dmd 1 17 1 2 . . . . . . . . . 4 . HN parsed_1dmd 1 18 1 1 . . . . . . . . . 3 . HB1 parsed_1dmd 1 18 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 19 1 1 . . . . . . . . . 3 . HB2 parsed_1dmd 1 19 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 20 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 20 1 2 . . . . . . . . . 6 . HN parsed_1dmd 1 21 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 21 1 2 . . . . . . . . . 6 . HB1 parsed_1dmd 1 22 1 1 . . . . . . . . . 3 . HN parsed_1dmd 1 22 1 2 . . . . . . . . . 6 . HB2 parsed_1dmd 1 23 1 1 . . . . . . . . . 3 . HB2 parsed_1dmd 1 23 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 24 1 1 . . . . . . . . . 4 . HN parsed_1dmd 1 24 1 2 . . . . . . . . . 4 . HB# parsed_1dmd 1 25 1 1 . . . . . . . . . 4 . HN parsed_1dmd 1 25 1 2 . . . . . . . . . 4 . HG# parsed_1dmd 1 26 1 1 . . . . . . . . . 4 . HA parsed_1dmd 1 26 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 27 1 1 . . . . . . . . . 4 . HN parsed_1dmd 1 27 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 28 1 1 . . . . . . . . . 4 . HB# parsed_1dmd 1 28 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 29 1 1 . . . . . . . . . 4 . HG# parsed_1dmd 1 29 1 2 . . . . . . . . . 5 . HN parsed_1dmd 1 30 1 1 . . . . . . . . . 5 . HN parsed_1dmd 1 30 1 2 . . . . . . . . . 5 . HB# parsed_1dmd 1 31 1 1 . . . . . . . . . 5 . HN parsed_1dmd 1 31 1 2 . . . . . . . . . 5 . HG# parsed_1dmd 1 32 1 1 . . . . . . . . . 5 . HN parsed_1dmd 1 32 1 2 . . . . . . . . . 6 . HN parsed_1dmd 1 33 1 1 . . . . . . . . . 5 . HA parsed_1dmd 1 33 1 2 . . . . . . . . . 6 . HN parsed_1dmd 1 34 1 1 . . . . . . . . . 5 . HN parsed_1dmd 1 34 1 2 . . . . . . . . . 6 . HB2 parsed_1dmd 1 35 1 1 . . . . . . . . . 5 . HN parsed_1dmd 1 35 1 2 . . . . . . . . . 7 . HN parsed_1dmd 1 36 1 1 . . . . . . . . . 5 . HB# parsed_1dmd 1 36 1 2 . . . . . . . . . 6 . HN parsed_1dmd 1 37 1 1 . . . . . . . . . 6 . HN parsed_1dmd 1 37 1 2 . . . . . . . . . 6 . HB1 parsed_1dmd 1 38 1 1 . . . . . . . . . 6 . HN parsed_1dmd 1 38 1 2 . . . . . . . . . 6 . HB2 parsed_1dmd 1 39 1 1 . . . . . . . . . 6 . HN parsed_1dmd 1 39 1 2 . . . . . . . . . 7 . HN parsed_1dmd 1 40 1 1 . . . . . . . . . 6 . HA parsed_1dmd 1 40 1 2 . . . . . . . . . 7 . HN parsed_1dmd 1 41 1 1 . . . . . . . . . 6 . HB2 parsed_1dmd 1 41 1 2 . . . . . . . . . 7 . HN parsed_1dmd 1 42 1 1 . . . . . . . . . 6 . HA parsed_1dmd 1 42 1 2 . . . . . . . . . 10 . HA parsed_1dmd 1 43 1 1 . . . . . . . . . 6 . HA parsed_1dmd 1 43 1 2 . . . . . . . . . 11 . HN parsed_1dmd 1 44 1 1 . . . . . . . . . 7 . HN parsed_1dmd 1 44 1 2 . . . . . . . . . 8 . HN parsed_1dmd 1 45 1 1 . . . . . . . . . 7 . HA parsed_1dmd 1 45 1 2 . . . . . . . . . 8 . HN parsed_1dmd 1 46 1 1 . . . . . . . . . 7 . HN parsed_1dmd 1 46 1 2 . . . . . . . . . 7 . HB parsed_1dmd 1 47 1 1 . . . . . . . . . 7 . HN parsed_1dmd 1 47 1 2 . . . . . . . . . 7 . HG# parsed_1dmd 1 48 1 1 . . . . . . . . . 7 . HA parsed_1dmd 1 48 1 2 . . . . . . . . . 9 . HN parsed_1dmd 1 49 1 1 . . . . . . . . . 7 . HG# parsed_1dmd 1 49 1 2 . . . . . . . . . 8 . HN parsed_1dmd 1 50 1 1 . . . . . . . . . 8 . HN parsed_1dmd 1 50 1 2 . . . . . . . . . 9 . HN parsed_1dmd 1 51 1 1 . . . . . . . . . 8 . HA parsed_1dmd 1 51 1 2 . . . . . . . . . 9 . HN parsed_1dmd 1 52 1 1 . . . . . . . . . 8 . HB# parsed_1dmd 1 52 1 2 . . . . . . . . . 8 . HN parsed_1dmd 1 53 1 1 . . . . . . . . . 8 . HB# parsed_1dmd 1 53 1 2 . . . . . . . . . 9 . HN parsed_1dmd 1 54 1 1 . . . . . . . . . 9 . HN parsed_1dmd 1 54 1 2 . . . . . . . . . 10 . HN parsed_1dmd 1 55 1 1 . . . . . . . . . 9 . HA# parsed_1dmd 1 55 1 2 . . . . . . . . . 10 . HN parsed_1dmd 1 56 1 1 . . . . . . . . . 10 . HN parsed_1dmd 1 56 1 2 . . . . . . . . . 10 . HB# parsed_1dmd 1 57 1 1 . . . . . . . . . 10 . HA parsed_1dmd 1 57 1 2 . . . . . . . . . 11 . HN parsed_1dmd 1 58 1 1 . . . . . . . . . 10 . HA parsed_1dmd 1 58 1 2 . . . . . . . . . 12 . HN parsed_1dmd 1 59 1 1 . . . . . . . . . 11 . HN parsed_1dmd 1 59 1 2 . . . . . . . . . 11 . HB# parsed_1dmd 1 60 1 1 . . . . . . . . . 11 . HN parsed_1dmd 1 60 1 2 . . . . . . . . . 12 . HN parsed_1dmd 1 61 1 1 . . . . . . . . . 11 . HA parsed_1dmd 1 61 1 2 . . . . . . . . . 12 . HN parsed_1dmd 1 62 1 1 . . . . . . . . . 12 . HN parsed_1dmd 1 62 1 2 . . . . . . . . . 12 . HB1 parsed_1dmd 1 63 1 1 . . . . . . . . . 12 . HN parsed_1dmd 1 63 1 2 . . . . . . . . . 12 . HB2 parsed_1dmd 1 64 1 1 . . . . . . . . . 12 . HA parsed_1dmd 1 64 1 2 . . . . . . . . . 13 . HN parsed_1dmd 1 65 1 1 . . . . . . . . . 12 . HB1 parsed_1dmd 1 65 1 2 . . . . . . . . . 13 . HN parsed_1dmd 1 66 1 1 . . . . . . . . . 12 . HB1 parsed_1dmd 1 66 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 67 1 1 . . . . . . . . . 12 . HB2 parsed_1dmd 1 67 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 68 1 1 . . . . . . . . . 12 . HB1 parsed_1dmd 1 68 1 2 . . . . . . . . . 18 . HA parsed_1dmd 1 69 1 1 . . . . . . . . . 12 . HB2 parsed_1dmd 1 69 1 2 . . . . . . . . . 18 . HA parsed_1dmd 1 70 1 1 . . . . . . . . . 12 . HB2 parsed_1dmd 1 70 1 2 . . . . . . . . . 29 . HA parsed_1dmd 1 71 1 1 . . . . . . . . . 12 . HB1 parsed_1dmd 1 71 1 2 . . . . . . . . . 30 . HD# parsed_1dmd 1 72 1 1 . . . . . . . . . 12 . HB2 parsed_1dmd 1 72 1 2 . . . . . . . . . 30 . HD# parsed_1dmd 1 73 1 1 . . . . . . . . . 13 . HN parsed_1dmd 1 73 1 2 . . . . . . . . . 13 . HB# parsed_1dmd 1 74 1 1 . . . . . . . . . 13 . HA parsed_1dmd 1 74 1 2 . . . . . . . . . 14 . HN parsed_1dmd 1 75 1 1 . . . . . . . . . 13 . HN parsed_1dmd 1 75 1 2 . . . . . . . . . 14 . HN parsed_1dmd 1 76 1 1 . . . . . . . . . 13 . HB# parsed_1dmd 1 76 1 2 . . . . . . . . . 14 . HN parsed_1dmd 1 77 1 1 . . . . . . . . . 13 . HN parsed_1dmd 1 77 1 2 . . . . . . . . . 17 . HB# parsed_1dmd 1 78 1 1 . . . . . . . . . 14 . HN parsed_1dmd 1 78 1 2 . . . . . . . . . 14 . HB# parsed_1dmd 1 79 1 1 . . . . . . . . . 14 . HN parsed_1dmd 1 79 1 2 . . . . . . . . . 15 . HN parsed_1dmd 1 80 1 1 . . . . . . . . . 14 . HA parsed_1dmd 1 80 1 2 . . . . . . . . . 15 . HN parsed_1dmd 1 81 1 1 . . . . . . . . . 14 . HA parsed_1dmd 1 81 1 2 . . . . . . . . . 15 . HA parsed_1dmd 1 82 1 1 . . . . . . . . . 14 . HB# parsed_1dmd 1 82 1 2 . . . . . . . . . 15 . HN parsed_1dmd 1 83 1 1 . . . . . . . . . 14 . HN parsed_1dmd 1 83 1 2 . . . . . . . . . 17 . HB# parsed_1dmd 1 84 1 1 . . . . . . . . . 14 . HN parsed_1dmd 1 84 1 2 . . . . . . . . . 17 . HG# parsed_1dmd 1 85 1 1 . . . . . . . . . 14 . HN parsed_1dmd 1 85 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 86 1 1 . . . . . . . . . 15 . HN parsed_1dmd 1 86 1 2 . . . . . . . . . 16 . HN parsed_1dmd 1 87 1 1 . . . . . . . . . 15 . HA parsed_1dmd 1 87 1 2 . . . . . . . . . 16 . HN parsed_1dmd 1 88 1 1 . . . . . . . . . 15 . HA parsed_1dmd 1 88 1 2 . . . . . . . . . 18 . HB2 parsed_1dmd 1 89 1 1 . . . . . . . . . 15 . HA parsed_1dmd 1 89 1 2 . . . . . . . . . 18 . HB1 parsed_1dmd 1 90 1 1 . . . . . . . . . 15 . HN parsed_1dmd 1 90 1 2 . . . . . . . . . 15 . HB# parsed_1dmd 1 91 1 1 . . . . . . . . . 15 . HN parsed_1dmd 1 91 1 2 . . . . . . . . . 15 . HG# parsed_1dmd 1 92 1 1 . . . . . . . . . 15 . HA parsed_1dmd 1 92 1 2 . . . . . . . . . 18 . HA parsed_1dmd 1 93 1 1 . . . . . . . . . 16 . HN parsed_1dmd 1 93 1 2 . . . . . . . . . 16 . HB# parsed_1dmd 1 94 1 1 . . . . . . . . . 16 . HN parsed_1dmd 1 94 1 2 . . . . . . . . . 16 . HG# parsed_1dmd 1 95 1 1 . . . . . . . . . 16 . HN parsed_1dmd 1 95 1 2 . . . . . . . . . 17 . HN parsed_1dmd 1 96 1 1 . . . . . . . . . 16 . HB# parsed_1dmd 1 96 1 2 . . . . . . . . . 17 . HN parsed_1dmd 1 97 1 1 . . . . . . . . . 17 . HN parsed_1dmd 1 97 1 2 . . . . . . . . . 17 . HB# parsed_1dmd 1 98 1 1 . . . . . . . . . 17 . HN parsed_1dmd 1 98 1 2 . . . . . . . . . 17 . HG# parsed_1dmd 1 99 1 1 . . . . . . . . . 17 . HN parsed_1dmd 1 99 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 100 1 1 . . . . . . . . . 17 . HA parsed_1dmd 1 100 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 101 1 1 . . . . . . . . . 17 . HB# parsed_1dmd 1 101 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 102 1 1 . . . . . . . . . 17 . HG# parsed_1dmd 1 102 1 2 . . . . . . . . . 18 . HN parsed_1dmd 1 103 1 1 . . . . . . . . . 18 . HN parsed_1dmd 1 103 1 2 . . . . . . . . . 18 . HB1 parsed_1dmd 1 104 1 1 . . . . . . . . . 18 . HN parsed_1dmd 1 104 1 2 . . . . . . . . . 18 . HB2 parsed_1dmd 1 105 1 1 . . . . . . . . . 18 . HN parsed_1dmd 1 105 1 2 . . . . . . . . . 19 . HN parsed_1dmd 1 106 1 1 . . . . . . . . . 18 . HA parsed_1dmd 1 106 1 2 . . . . . . . . . 19 . HN parsed_1dmd 1 107 1 1 . . . . . . . . . 18 . HB1 parsed_1dmd 1 107 1 2 . . . . . . . . . 19 . HN parsed_1dmd 1 108 1 1 . . . . . . . . . 18 . HB2 parsed_1dmd 1 108 1 2 . . . . . . . . . 19 . HN parsed_1dmd 1 109 1 1 . . . . . . . . . 18 . HA parsed_1dmd 1 109 1 2 . . . . . . . . . 21 . HN parsed_1dmd 1 110 1 1 . . . . . . . . . 18 . HA parsed_1dmd 1 110 1 2 . . . . . . . . . 21 . HG# parsed_1dmd 1 111 1 1 . . . . . . . . . 18 . HA parsed_1dmd 1 111 1 2 . . . . . . . . . 21 . HN parsed_1dmd 1 112 1 1 . . . . . . . . . 18 . HA parsed_1dmd 1 112 1 2 . . . . . . . . . 22 . HN parsed_1dmd 1 113 1 1 . . . . . . . . . 19 . HN parsed_1dmd 1 113 1 2 . . . . . . . . . 19 . HB# parsed_1dmd 1 114 1 1 . . . . . . . . . 19 . HN parsed_1dmd 1 114 1 2 . . . . . . . . . 20 . HB# parsed_1dmd 1 115 1 1 . . . . . . . . . 19 . HN parsed_1dmd 1 115 1 2 . . . . . . . . . 20 . HN parsed_1dmd 1 116 1 1 . . . . . . . . . 19 . HB# parsed_1dmd 1 116 1 2 . . . . . . . . . 20 . HN parsed_1dmd 1 117 1 1 . . . . . . . . . 20 . HN parsed_1dmd 1 117 1 2 . . . . . . . . . 20 . HB# parsed_1dmd 1 118 1 1 . . . . . . . . . 20 . HN parsed_1dmd 1 118 1 2 . . . . . . . . . 20 . HG# parsed_1dmd 1 119 1 1 . . . . . . . . . 20 . HN parsed_1dmd 1 119 1 2 . . . . . . . . . 21 . HN parsed_1dmd 1 120 1 1 . . . . . . . . . 20 . HA parsed_1dmd 1 120 1 2 . . . . . . . . . 21 . HN parsed_1dmd 1 121 1 1 . . . . . . . . . 20 . HA parsed_1dmd 1 121 1 2 . . . . . . . . . 22 . HN parsed_1dmd 1 122 1 1 . . . . . . . . . 21 . HN parsed_1dmd 1 122 1 2 . . . . . . . . . 21 . HB# parsed_1dmd 1 123 1 1 . . . . . . . . . 21 . HN parsed_1dmd 1 123 1 2 . . . . . . . . . 22 . HN parsed_1dmd 1 124 1 1 . . . . . . . . . 21 . HA parsed_1dmd 1 124 1 2 . . . . . . . . . 22 . HN parsed_1dmd 1 125 1 1 . . . . . . . . . 21 . HB# parsed_1dmd 1 125 1 2 . . . . . . . . . 22 . HN parsed_1dmd 1 126 1 1 . . . . . . . . . 22 . HN parsed_1dmd 1 126 1 2 . . . . . . . . . 22 . HB1 parsed_1dmd 1 127 1 1 . . . . . . . . . 22 . HN parsed_1dmd 1 127 1 2 . . . . . . . . . 22 . HB2 parsed_1dmd 1 128 1 1 . . . . . . . . . 22 . HA parsed_1dmd 1 128 1 2 . . . . . . . . . 23 . HN parsed_1dmd 1 129 1 1 . . . . . . . . . 22 . HB1 parsed_1dmd 1 129 1 2 . . . . . . . . . 23 . HN parsed_1dmd 1 130 1 1 . . . . . . . . . 22 . HB2 parsed_1dmd 1 130 1 2 . . . . . . . . . 23 . HN parsed_1dmd 1 131 1 1 . . . . . . . . . 22 . HB1 parsed_1dmd 1 131 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 132 1 1 . . . . . . . . . 22 . HB2 parsed_1dmd 1 132 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 133 1 1 . . . . . . . . . 23 . HN parsed_1dmd 1 133 1 2 . . . . . . . . . 23 . HB parsed_1dmd 1 134 1 1 . . . . . . . . . 23 . HN parsed_1dmd 1 134 1 2 . . . . . . . . . 23 . HG# parsed_1dmd 1 135 1 1 . . . . . . . . . 23 . HN parsed_1dmd 1 135 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 136 1 1 . . . . . . . . . 23 . HA parsed_1dmd 1 136 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 137 1 1 . . . . . . . . . 23 . HB parsed_1dmd 1 137 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 138 1 1 . . . . . . . . . 23 . HG# parsed_1dmd 1 138 1 2 . . . . . . . . . 24 . HN parsed_1dmd 1 139 1 1 . . . . . . . . . 24 . HA parsed_1dmd 1 139 1 2 . . . . . . . . . 25 . HD# parsed_1dmd 1 140 1 1 . . . . . . . . . 25 . HA parsed_1dmd 1 140 1 2 . . . . . . . . . 26 . HN parsed_1dmd 1 141 1 1 . . . . . . . . . 25 . HA parsed_1dmd 1 141 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 142 1 1 . . . . . . . . . 25 . HA parsed_1dmd 1 142 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 143 1 1 . . . . . . . . . 26 . HN parsed_1dmd 1 143 1 2 . . . . . . . . . 26 . HB1 parsed_1dmd 1 144 1 1 . . . . . . . . . 26 . HN parsed_1dmd 1 144 1 2 . . . . . . . . . 26 . HB2 parsed_1dmd 1 145 1 1 . . . . . . . . . 26 . HA parsed_1dmd 1 145 1 2 . . . . . . . . . 27 . HN parsed_1dmd 1 146 1 1 . . . . . . . . . 26 . HB1 parsed_1dmd 1 146 1 2 . . . . . . . . . 27 . HN parsed_1dmd 1 147 1 1 . . . . . . . . . 26 . HB2 parsed_1dmd 1 147 1 2 . . . . . . . . . 27 . HN parsed_1dmd 1 148 1 1 . . . . . . . . . 26 . HN parsed_1dmd 1 148 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 149 1 1 . . . . . . . . . 26 . HN parsed_1dmd 1 149 1 2 . . . . . . . . . 29 . HB2 parsed_1dmd 1 150 1 1 . . . . . . . . . 26 . HB1 parsed_1dmd 1 150 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 151 1 1 . . . . . . . . . 26 . HB2 parsed_1dmd 1 151 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 152 1 1 . . . . . . . . . 26 . HB1 parsed_1dmd 1 152 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 153 1 1 . . . . . . . . . 26 . HB2 parsed_1dmd 1 153 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 154 1 1 . . . . . . . . . 27 . HN parsed_1dmd 1 154 1 2 . . . . . . . . . 27 . HB# parsed_1dmd 1 155 1 1 . . . . . . . . . 27 . HA parsed_1dmd 1 155 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 156 1 1 . . . . . . . . . 27 . HN parsed_1dmd 1 156 1 2 . . . . . . . . . 28 . HN parsed_1dmd 1 157 1 1 . . . . . . . . . 28 . HA parsed_1dmd 1 157 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 158 1 1 . . . . . . . . . 28 . HN parsed_1dmd 1 158 1 2 . . . . . . . . . 29 . HN parsed_1dmd 1 159 1 1 . . . . . . . . . 29 . HN parsed_1dmd 1 159 1 2 . . . . . . . . . 29 . HB1 parsed_1dmd 1 160 1 1 . . . . . . . . . 29 . HN parsed_1dmd 1 160 1 2 . . . . . . . . . 29 . HB2 parsed_1dmd 1 161 1 1 . . . . . . . . . 29 . HA parsed_1dmd 1 161 1 2 . . . . . . . . . 30 . HD# parsed_1dmd 1 162 1 1 . . . . . . . . . 29 . HA parsed_1dmd 1 162 1 2 . . . . . . . . . 30 . HA parsed_1dmd 1 163 1 1 . . . . . . . . . 29 . HB2 parsed_1dmd 1 163 1 2 . . . . . . . . . 30 . HG# parsed_1dmd 1 164 1 1 . . . . . . . . . 29 . HB2 parsed_1dmd 1 164 1 2 . . . . . . . . . 30 . HD# parsed_1dmd 1 165 1 1 . . . . . . . . . 30 . HA parsed_1dmd 1 165 1 2 . . . . . . . . . 31 . HN parsed_1dmd 1 166 1 1 . . . . . . . . . 30 . HB# parsed_1dmd 1 166 1 2 . . . . . . . . . 31 . HN parsed_1dmd 1 167 1 1 . . . . . . . . . 31 . HN parsed_1dmd 1 167 1 2 . . . . . . . . . 31 . HB# parsed_1dmd 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 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 2 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 3 1 . . . . . 1.8 1.8 3.4 parsed_1dmd 1 4 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 5 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 6 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 7 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 8 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 9 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 10 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 11 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 12 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 13 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 14 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 15 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 16 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 17 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 18 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 19 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 20 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 21 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 22 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 23 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 24 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 25 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 26 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 27 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 28 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 29 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 30 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 31 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 32 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 33 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 34 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 35 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 36 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 37 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 38 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 39 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 40 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 41 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 42 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 43 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 44 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 45 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 46 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 47 1 . . . . . 1.8 1.8 4.7 parsed_1dmd 1 48 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 49 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 50 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 51 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 52 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 53 1 . . . . . 1.8 1.8 5.5 parsed_1dmd 1 54 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 55 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 56 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 57 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 58 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 59 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 60 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 61 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 62 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 63 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 64 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 65 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 66 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 67 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 68 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 69 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 70 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 71 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 72 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 73 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 74 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 75 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 76 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 77 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 78 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 79 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 80 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 81 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 82 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 83 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 84 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 85 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 86 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 87 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 88 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 89 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 90 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 91 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 92 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 93 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 94 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 95 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 96 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 97 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 98 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 99 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 100 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 101 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 102 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 103 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 104 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 105 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 106 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 107 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 108 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 109 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 110 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 111 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 112 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 113 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 114 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 115 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 116 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 117 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 118 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 119 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 120 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 121 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 122 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 123 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 124 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 125 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 126 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 127 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 128 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 129 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 130 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 131 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 132 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 133 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 134 1 . . . . . 1.8 1.8 4.2 parsed_1dmd 1 135 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 136 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 137 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 138 1 . . . . . 1.8 1.8 4.6 parsed_1dmd 1 139 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 140 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 141 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 142 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 143 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 144 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 145 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 146 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 147 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 148 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 149 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 150 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 151 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 152 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 153 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 154 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 155 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 156 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 157 1 . . . . . 1.8 1.8 3.6 parsed_1dmd 1 158 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 159 1 . . . . . 1.8 1.8 3.2 parsed_1dmd 1 160 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 161 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 162 1 . . . . . 1.8 1.8 4.5 parsed_1dmd 1 163 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 164 1 . . . . . 1.8 1.8 5.5 parsed_1dmd 1 165 1 . . . . . 1.8 1.8 2.7 parsed_1dmd 1 166 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 1 167 1 . . . . . 1.8 1.8 3.7 parsed_1dmd 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 "July 9" 1 76 1 84 parsed_1dmd 1 2 "July 8" 2 76 2 84 parsed_1dmd 1 3 "0.6 added" 3 77 3 87 parsed_1dmd 1 4 "1.4 to 1.8 23 24,July 8" 6 77 6 101 parsed_1dmd 1 5 ; 19 24, July 8 assign (resid 2 and name HD# )(resid 19 and name HA ) 1.8 0.0 2.8 !Careful ; 7 77 8 87 parsed_1dmd 1 6 19 9 77 9 80 parsed_1dmd 1 7 ; 0.9 to 1.4 23 assign (resid 2 and name HA )(resid 27 and name HN ) 1.8 0.0 1.8 ! Feb 20, 23,July 9 ; 10 78 11 96 parsed_1dmd 1 8 "July 9, D to G" 12 77 12 93 parsed_1dmd 1 9 19 14 76 14 79 parsed_1dmd 1 10 "July 8" 16 77 16 85 parsed_1dmd 1 11 "July 8" 17 77 17 86 parsed_1dmd 1 12 19 20 77 20 80 parsed_1dmd 1 13 19 21 77 21 80 parsed_1dmd 1 14 19 23 77 23 80 parsed_1dmd 1 15 ; 0.9 to 1.4 26, July 8 assign (resid 3 and name HA )(resid 16 and name HN ) 1.8 0.0 1.4 ! Feb 20,23, July 9 assign (resid 3 and name HA )(resid 17 and name HN ) 1.8 0.0 1.8 ! Feb 20, July 9 ; 24 77 26 93 parsed_1dmd 1 16 "July 8" 27 76 27 84 parsed_1dmd 1 17 "July 8" 32 76 32 84 parsed_1dmd 1 18 "July 8" 33 76 33 84 parsed_1dmd 1 19 19 38 77 38 80 parsed_1dmd 1 20 "July 8" 40 76 40 84 parsed_1dmd 1 21 "1.4 to 1.8 26" 45 77 45 91 parsed_1dmd 1 22 19 46 77 46 80 parsed_1dmd 1 23 "Feb 20, July 8" 47 76 47 92 parsed_1dmd 1 24 "(0.5 added)" 51 77 51 89 parsed_1dmd 1 25 "assign (resid 7 and name HN )(resid 13 and name HA ) 1.8 0.0 2.7 !19 , 23" 53 1 53 86 parsed_1dmd 1 26 "July 8" 54 77 54 85 parsed_1dmd 1 27 ; assign (resid 10 and name HB# )(resid 28 and name HA ) 1.8 0.0 2.7 !19, 23, July 9 assign (resid 10 and name HB# )(resid 19 and name HA ) 1.8 0.0 3.7 !19, 23 ; 64 1 65 87 parsed_1dmd 1 28 "19, 1.4 to 1.8 23, July 8" 73 79 73 105 parsed_1dmd 1 29 "19,23, July 8" 74 79 74 93 parsed_1dmd 1 30 "19, 9 to 1.4 23" 75 79 75 95 parsed_1dmd 1 31 ; 19 assign (resid 12 and name HB1 )(resid 29 and name HA ) 1.8 0.0 2.7 !19, could be SD, July 9 ; 76 79 77 104 parsed_1dmd 1 32 19 78 79 78 82 parsed_1dmd 1 33 19 79 80 79 83 parsed_1dmd 1 34 19 80 80 80 83 parsed_1dmd 1 35 19 85 79 85 82 parsed_1dmd 1 36 19 89 78 89 81 parsed_1dmd 1 37 19 91 79 91 82 parsed_1dmd 1 38 19 92 79 92 82 parsed_1dmd 1 39 19 96 79 96 82 parsed_1dmd 1 40 19 97 79 97 82 parsed_1dmd 1 41 "19, corrected 23" 100 78 100 95 parsed_1dmd 1 42 19 102 78 102 81 parsed_1dmd 1 43 19 106 79 106 82 parsed_1dmd 1 44 19 110 79 110 82 parsed_1dmd 1 45 "0.9 to 1.4 24" 115 79 115 93 parsed_1dmd 1 46 "assign (resid 18 and name HA )(resid 21 and name HA ) 1.8 0.0 1.4 !Careful, July 9" 117 1 117 95 parsed_1dmd 1 47 "July 8" 118 78 118 86 parsed_1dmd 1 48 19 119 79 119 82 parsed_1dmd 1 49 "July 8" 120 78 120 86 parsed_1dmd 1 50 19 123 79 123 82 parsed_1dmd 1 51 19 127 79 127 82 parsed_1dmd 1 52 ; 23, July 8 assign (resid 20 and name HN )(resid 22 and name HN ) 1.8 0.0 1.8 ! Feb 20, July 8 ; 130 78 131 94 parsed_1dmd 1 53 "0.9 to 1.4 24" 133 78 133 92 parsed_1dmd 1 54 19 141 79 141 82 parsed_1dmd 1 55 19 142 79 142 82 parsed_1dmd 1 56 ; assign (resid 23 and name HA )(resid 26 and name HN ) 1.8 0.0 2.7 !19, SD? assign (resid 23 and name HN )(resid 29 and name HN ) 1.8 0.0 2.7 !careful, 23 ; 149 1 150 91 parsed_1dmd 1 57 "assign (resid 25 and name HA )(resid 27 and name HN ) 1.8 0.0 1.8 ! careful" 153 1 153 88 parsed_1dmd 1 58 19 154 78 154 81 parsed_1dmd 1 59 19 155 78 155 81 parsed_1dmd 1 60 "0.9 to 1.4 23" 158 78 158 92 parsed_1dmd 1 61 "0.9 to 1.8 23" 159 79 159 93 parsed_1dmd 1 62 "19, 9 to 1.4 23" 162 79 162 95 parsed_1dmd 1 63 19 163 79 163 82 parsed_1dmd 1 64 19 164 79 164 83 parsed_1dmd 1 65 "Feb 20" 165 78 165 86 parsed_1dmd 1 66 "Feb 20" 166 78 166 87 parsed_1dmd 1 67 "assign (resid 29 and name HA )(resid 30 and name HG# ) 1.8 0.0 1.9 !19 (or 3.7) Careful" 174 1 174 100 parsed_1dmd 1 68 19 176 78 176 81 parsed_1dmd 1 69 19 177 80 177 83 parsed_1dmd 1 70 19 178 80 178 83 parsed_1dmd 1 stop_ save_
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