NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
597163 | 2n8a | 25888 | cing | 2-parsed | STAR | entry | full | 18 |
data_2n8a_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2n8a _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_2n8a 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2n8a _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 2n8a "Master copy" parsed_2n8a stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2n8a _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 2n8a.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n8a 1 1 2n8a.mr . . XPLOR/CNS 2 distance NOE simple 18 parsed_2n8a 1 1 2n8a.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2n8a 1 1 2n8a.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n8a 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_2n8a _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 TRANSFERASE 08-OCT-15 2N8A *TITLE NMR SOLUTION STRUCTURE AND ASSIGNMENTS *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: POLY [ADP-RIBOSE] POLYMERASE 1; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: RESIDUES 1-214; *COMPND 5 SYNONYM: PARP-1, ADP-RIBOSYLTRANSFERASE DIPHTHERIA TOXIN-LIKE 1, *COMPND 6 ARTD1, NAD(+) ADP-RIBOSYLTRANSFERASE 1, ADPRT 1, POLY[ADP-RIBOSE] *COMPND 7 SYNTHASE 1; *COMPND 8 EC: 2.4.2.30; *COMPND 9 ENGINEERED: YES; *COMPND 10 MOL_ID: 2; *COMPND 11 MOLECULE: DNA (45-MER); *COMPND 12 CHAIN: B; *COMPND 13 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 3 ORGANISM_COMMON: HUMAN; *SOURCE 4 ORGANISM_TAXID: 9606; *SOURCE 5 GENE: PARP1, ADPRT, PPOL; *SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; *SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21; *SOURCE 9 EXPRESSION_SYSTEM_VARIANT: DE3; *SOURCE 10 EXPRESSION_SYSTEM_VECTOR: PET13; *SOURCE 11 MOL_ID: 2; *SOURCE 12 SYNTHETIC: YES *KEYWDS TRANSFERASE *EXPDTA SOLUTION NMR *NUMMDL 78 *AUTHOR D.NEUHAUS, S.EUSTERMANN, J.YANG, W.WU *REVDAT 1 02-DEC-15 2N8A 0 ; save_ save_CNS/XPLOR_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2n8a _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _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_2n8a 1 2 1 . . . parsed_2n8a 1 3 1 . . . parsed_2n8a 1 4 1 . . . parsed_2n8a 1 5 1 . . . parsed_2n8a 1 6 1 . . . parsed_2n8a 1 7 1 . . . parsed_2n8a 1 8 1 . . . parsed_2n8a 1 9 1 . . . parsed_2n8a 1 10 1 . . . parsed_2n8a 1 11 1 . . . parsed_2n8a 1 12 1 . . . parsed_2n8a 1 13 1 . . . parsed_2n8a 1 14 1 . . . parsed_2n8a 1 15 1 . . . parsed_2n8a 1 16 1 . . . parsed_2n8a 1 17 1 . . . parsed_2n8a 1 18 1 . . . parsed_2n8a 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 . . . . . . . . "F1 " 48 . HG* parsed_2n8a 1 1 1 2 . . . . . . . . str1 22 . H1' parsed_2n8a 1 2 1 1 . . . . . . . . "F1 " 48 . HG* parsed_2n8a 1 2 1 2 . . . . . . . . str1 22 . H2'* parsed_2n8a 1 3 1 1 . . . . . . . . "F1 " 48 . HG* parsed_2n8a 1 3 1 2 . . . . . . . . str1 22 . H5 parsed_2n8a 1 4 1 1 . . . . . . . . "F1 " 48 . HG* parsed_2n8a 1 4 1 2 . . . . . . . . str1 23 . H6 parsed_2n8a 1 5 1 1 . . . . . . . . "F1 " 48 . HG* parsed_2n8a 1 5 1 2 . . . . . . . . str1 23 . H7* parsed_2n8a 1 6 1 1 . . . . . . . . "F2 " 151 . HD* parsed_2n8a 1 6 1 2 . . . . . . . . str1 45 . H1' parsed_2n8a 1 7 1 1 . . . . . . . . "F2 " 151 . HD* parsed_2n8a 1 7 1 2 . . . . . . . . str1 45 . H2'* parsed_2n8a 1 8 1 1 . . . . . . . . "F2 " 154 . HD1* parsed_2n8a 1 8 1 2 . . . . . . . . str1 45 . H1' parsed_2n8a 1 9 1 1 . . . . . . . . "F2 " 154 . HD1* parsed_2n8a 1 9 1 2 . . . . . . . . str1 45 . H2'* parsed_2n8a 1 10 1 1 . . . . . . . . "F2 " 154 . HD1* parsed_2n8a 1 10 1 2 . . . . . . . . str1 45 . H3' parsed_2n8a 1 11 1 1 . . . . . . . . "F2 " 154 . HD1* parsed_2n8a 1 11 1 2 . . . . . . . . str1 45 . H4' parsed_2n8a 1 12 1 1 . . . . . . . . "F2 " 154 . HD1* parsed_2n8a 1 12 1 2 . . . . . . . . str1 45 . H8 parsed_2n8a 1 13 1 1 . . . . . . . . "F1 " 8 . HD* parsed_2n8a 1 13 1 2 . . . . . . . . "F2 " 149 . HB* parsed_2n8a 1 14 1 1 . . . . . . . . "F1 " 37 . HD* parsed_2n8a 1 14 1 2 . . . . . . . . "F2 " 144 . HG* parsed_2n8a 1 15 1 1 . . . . . . . . "F1 " 37 . HD* parsed_2n8a 1 15 1 2 . . . . . . . . "F2 " 153 . HE* parsed_2n8a 1 16 1 1 . . . . . . . . "F1 " 39 . HG* parsed_2n8a 1 16 1 2 . . . . . . . . "F2 " 149 . HB* parsed_2n8a 1 17 1 1 . . . . . . . . "F1 " 39 . HG* parsed_2n8a 1 17 1 2 . . . . . . . . "F2 " 149 . HG* parsed_2n8a 1 18 1 1 . . . . . . . . "F1 " 60 . HG* parsed_2n8a 1 18 1 2 . . . . . . . . "F2 " 153 . HE* parsed_2n8a 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 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 2 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 3 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 4 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 5 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 6 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 7 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 8 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 9 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 10 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 11 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 12 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 13 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 14 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 15 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 16 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 17 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 18 1 . . . . . 6.0 0.0 6.0 parsed_2n8a 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_3 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID parsed_2n8a _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID 1 _RDC_constraint_list.Block_ID 3 _RDC_constraint_list.Details "Generated by Wattos" loop_ _RDC_constraint_parse_err.ID _RDC_constraint_parse_err.Content _RDC_constraint_parse_err.Begin_line _RDC_constraint_parse_err.Begin_column _RDC_constraint_parse_err.End_line _RDC_constraint_parse_err.End_column _RDC_constraint_parse_err.Entry_ID _RDC_constraint_parse_err.RDC_constraint_list_ID 1 'assign ( resid 12 and name N and segid "F1 " ) ( resid 12 and name HN and segid "F1 " ) -8.353888247 1.000' 1 1 1 122 parsed_2n8a 1 2 'assign ( resid 13 and name N and segid "F1 " ) ( resid 13 and name HN and segid "F1 " ) -9.289946546 1.000' 2 1 2 122 parsed_2n8a 1 3 'assign ( resid 14 and name N and segid "F1 " ) ( resid 14 and name HN and segid "F1 " ) 5.929118638 1.000' 3 1 3 122 parsed_2n8a 1 4 'assign ( resid 17 and name N and segid "F1 " ) ( resid 17 and name HN and segid "F1 " ) -11.85135221 1.000' 4 1 4 122 parsed_2n8a 1 5 'assign ( resid 19 and name N and segid "F1 " ) ( resid 19 and name HN and segid "F1 " ) 2.235849481 1.000' 5 1 5 122 parsed_2n8a 1 6 'assign ( resid 20 and name N and segid "F1 " ) ( resid 20 and name HN and segid "F1 " ) 20.26620178 1.000' 6 1 6 122 parsed_2n8a 1 7 'assign ( resid 21 and name N and segid "F1 " ) ( resid 21 and name HN and segid "F1 " ) 5.191029631 1.000' 7 1 7 122 parsed_2n8a 1 8 'assign ( resid 22 and name N and segid "F1 " ) ( resid 22 and name HN and segid "F1 " ) -5.337774028 1.000' 8 1 8 122 parsed_2n8a 1 9 'assign ( resid 23 and name N and segid "F1 " ) ( resid 23 and name HN and segid "F1 " ) -18.96944643 1.000' 9 1 9 122 parsed_2n8a 1 10 'assign ( resid 25 and name N and segid "F1 " ) ( resid 25 and name HN and segid "F1 " ) 3.679945017 1.000' 10 1 10 122 parsed_2n8a 1 11 'assign ( resid 27 and name N and segid "F1 " ) ( resid 27 and name HN and segid "F1 " ) 3.979538587 1.000' 11 1 11 122 parsed_2n8a 1 12 'assign ( resid 28 and name N and segid "F1 " ) ( resid 28 and name HN and segid "F1 " ) 25.08064262 1.000' 12 1 12 122 parsed_2n8a 1 13 'assign ( resid 30 and name N and segid "F1 " ) ( resid 30 and name HN and segid "F1 " ) 3.207604378 1.000' 13 1 13 122 parsed_2n8a 1 14 'assign ( resid 31 and name N and segid "F1 " ) ( resid 31 and name HN and segid "F1 " ) 19.64303818 1.000' 14 1 14 122 parsed_2n8a 1 15 'assign ( resid 32 and name N and segid "F1 " ) ( resid 32 and name HN and segid "F1 " ) 16.32831156 1.000' 15 1 15 122 parsed_2n8a 1 16 'assign ( resid 33 and name N and segid "F1 " ) ( resid 33 and name HN and segid "F1 " ) 19.84209902 1.000' 16 1 16 122 parsed_2n8a 1 17 'assign ( resid 34 and name N and segid "F1 " ) ( resid 34 and name HN and segid "F1 " ) -15.57773874 1.000' 17 1 17 122 parsed_2n8a 1 18 'assign ( resid 35 and name N and segid "F1 " ) ( resid 35 and name HN and segid "F1 " ) -6.199299715 1.000' 18 1 18 122 parsed_2n8a 1 19 'assign ( resid 36 and name N and segid "F1 " ) ( resid 36 and name HN and segid "F1 " ) -3.090224649 1.000' 19 1 19 122 parsed_2n8a 1 20 'assign ( resid 51 and name N and segid "F1 " ) ( resid 51 and name HN and segid "F1 " ) 18.52783799 1.000' 20 1 20 121 parsed_2n8a 1 21 'assign ( resid 52 and name N and segid "F1 " ) ( resid 52 and name HN and segid "F1 " ) -1.753798965 1.000' 21 1 21 121 parsed_2n8a 1 22 'assign ( resid 55 and name N and segid "F1 " ) ( resid 55 and name HN and segid "F1 " ) -15.31698832 1.000' 22 1 22 121 parsed_2n8a 1 23 'assign ( resid 56 and name N and segid "F1 " ) ( resid 56 and name HN and segid "F1 " ) -22.40269947 1.000' 23 1 23 121 parsed_2n8a 1 24 'assign ( resid 58 and name N and segid "F1 " ) ( resid 58 and name HN and segid "F1 " ) -14.59421357 1.000' 24 1 24 121 parsed_2n8a 1 25 'assign ( resid 66 and name N and segid "F1 " ) ( resid 66 and name HN and segid "F1 " ) 22.98501445 1.000' 25 1 25 121 parsed_2n8a 1 26 'assign ( resid 68 and name N and segid "F1 " ) ( resid 68 and name HN and segid "F1 " ) 9.89558529 1.000' 26 1 26 121 parsed_2n8a 1 27 'assign ( resid 69 and name N and segid "F1 " ) ( resid 69 and name HN and segid "F1 " ) -5.491748529 1.000' 27 1 27 121 parsed_2n8a 1 28 'assign ( resid 71 and name N and segid "F1 " ) ( resid 71 and name HN and segid "F1 " ) 17.46703484 1.000' 28 1 28 121 parsed_2n8a 1 29 'assign ( resid 72 and name N and segid "F1 " ) ( resid 72 and name HN and segid "F1 " ) -3.783606344 1.000' 29 1 29 121 parsed_2n8a 1 30 'assign ( resid 73 and name N and segid "F1 " ) ( resid 73 and name HN and segid "F1 " ) 1.828488936 1.000' 30 1 30 121 parsed_2n8a 1 31 'assign ( resid 74 and name N and segid "F1 " ) ( resid 74 and name HN and segid "F1 " ) -5.107803076 1.000' 31 1 31 121 parsed_2n8a 1 32 'assign ( resid 75 and name N and segid "F1 " ) ( resid 75 and name HN and segid "F1 " ) 13.40635828 1.000' 32 1 32 121 parsed_2n8a 1 33 'assign ( resid 76 and name N and segid "F1 " ) ( resid 76 and name HN and segid "F1 " ) -10.37820508 1.000' 33 1 33 121 parsed_2n8a 1 34 'assign ( resid 77 and name N and segid "F1 " ) ( resid 77 and name HN and segid "F1 " ) -12.39228316 1.000' 34 1 34 121 parsed_2n8a 1 35 'assign ( resid 78 and name N and segid "F1 " ) ( resid 78 and name HN and segid "F1 " ) 2.254720286 1.000' 35 1 35 121 parsed_2n8a 1 36 'assign ( resid 80 and name N and segid "F1 " ) ( resid 80 and name HN and segid "F1 " ) -25.64339632 1.000' 36 1 36 121 parsed_2n8a 1 37 'assign ( resid 81 and name N and segid "F1 " ) ( resid 81 and name HN and segid "F1 " ) -25.77739912 1.000' 37 1 37 121 parsed_2n8a 1 38 'assign ( resid 83 and name N and segid "F1 " ) ( resid 83 and name HN and segid "F1 " ) -25.69342585 1.000' 38 1 38 121 parsed_2n8a 1 39 'assign ( resid 84 and name N and segid "F1 " ) ( resid 84 and name HN and segid "F1 " ) -19.64614137 1.000' 39 1 39 121 parsed_2n8a 1 40 'assign ( resid 86 and name N and segid "F1 " ) ( resid 86 and name HN and segid "F1 " ) -30.82226409 1.000' 40 1 40 121 parsed_2n8a 1 41 'assign ( resid 87 and name N and segid "F1 " ) ( resid 87 and name HN and segid "F1 " ) -28.60555064 1.000' 41 1 41 121 parsed_2n8a 1 42 'assign ( resid 89 and name N and segid "F1 " ) ( resid 89 and name HN and segid "F1 " ) -29.96442217 1.000' 42 1 42 121 parsed_2n8a 1 43 'assign ( resid 114 and name N and segid "F2 " ) ( resid 114 and name HN and segid "F2 " ) 19.84191794 1.000' 43 1 43 123 parsed_2n8a 1 44 'assign ( resid 115 and name N and segid "F2 " ) ( resid 115 and name HN and segid "F2 " ) 11.34659563 1.000' 44 1 44 123 parsed_2n8a 1 45 'assign ( resid 116 and name N and segid "F2 " ) ( resid 116 and name HN and segid "F2 " ) 10.04481353 1.000' 45 1 45 123 parsed_2n8a 1 46 'assign ( resid 117 and name N and segid "F2 " ) ( resid 117 and name HN and segid "F2 " ) 8.168326486 1.000' 46 1 46 123 parsed_2n8a 1 47 'assign ( resid 118 and name N and segid "F2 " ) ( resid 118 and name HN and segid "F2 " ) -9.103819979 1.000' 47 1 47 124 parsed_2n8a 1 48 'assign ( resid 119 and name N and segid "F2 " ) ( resid 119 and name HN and segid "F2 " ) -10.96662609 1.000' 48 1 48 124 parsed_2n8a 1 49 'assign ( resid 120 and name N and segid "F2 " ) ( resid 120 and name HN and segid "F2 " ) -3.237594884 1.000' 49 1 49 124 parsed_2n8a 1 50 'assign ( resid 124 and name N and segid "F2 " ) ( resid 124 and name HN and segid "F2 " ) -24.7776919 1.000' 50 1 50 123 parsed_2n8a 1 51 'assign ( resid 125 and name N and segid "F2 " ) ( resid 125 and name HN and segid "F2 " ) -15.67701374 1.000' 51 1 51 124 parsed_2n8a 1 52 'assign ( resid 126 and name N and segid "F2 " ) ( resid 126 and name HN and segid "F2 " ) 20.41802725 1.000' 52 1 52 123 parsed_2n8a 1 53 'assign ( resid 127 and name N and segid "F2 " ) ( resid 127 and name HN and segid "F2 " ) -2.506737648 1.000' 53 1 53 124 parsed_2n8a 1 54 'assign ( resid 129 and name N and segid "F2 " ) ( resid 129 and name HN and segid "F2 " ) 9.751379655 1.000' 54 1 54 123 parsed_2n8a 1 55 'assign ( resid 130 and name N and segid "F2 " ) ( resid 130 and name HN and segid "F2 " ) 12.85379996 1.000' 55 1 55 123 parsed_2n8a 1 56 'assign ( resid 131 and name N and segid "F2 " ) ( resid 131 and name HN and segid "F2 " ) 3.285278282 1.000' 56 1 56 123 parsed_2n8a 1 57 'assign ( resid 132 and name N and segid "F2 " ) ( resid 132 and name HN and segid "F2 " ) -6.915971783 1.000' 57 1 57 124 parsed_2n8a 1 58 'assign ( resid 133 and name N and segid "F2 " ) ( resid 133 and name HN and segid "F2 " ) 4.144572472 1.000' 58 1 58 123 parsed_2n8a 1 59 'assign ( resid 134 and name N and segid "F2 " ) ( resid 134 and name HN and segid "F2 " ) 0.464670981 1.000' 59 1 59 123 parsed_2n8a 1 60 'assign ( resid 135 and name N and segid "F2 " ) ( resid 135 and name HN and segid "F2 " ) -21.42905049 1.000' 60 1 60 124 parsed_2n8a 1 61 'assign ( resid 136 and name N and segid "F2 " ) ( resid 136 and name HN and segid "F2 " ) 18.05446691 1.000' 61 1 61 123 parsed_2n8a 1 62 'assign ( resid 138 and name N and segid "F2 " ) ( resid 138 and name HN and segid "F2 " ) 4.602803795 1.000' 62 1 62 123 parsed_2n8a 1 63 'assign ( resid 139 and name N and segid "F2 " ) ( resid 139 and name HN and segid "F2 " ) 13.0375573 1.000' 63 1 63 122 parsed_2n8a 1 64 'assign ( resid 140 and name N and segid "F2 " ) ( resid 140 and name HN and segid "F2 " ) 26.52916884 1.000' 64 1 64 123 parsed_2n8a 1 65 'assign ( resid 156 and name N and segid "F2 " ) ( resid 156 and name HN and segid "F2 " ) 15.61223851 1.000' 65 1 65 123 parsed_2n8a 1 66 'assign ( resid 157 and name N and segid "F2 " ) ( resid 157 and name HN and segid "F2 " ) 20.78457646 1.000' 66 1 66 123 parsed_2n8a 1 67 'assign ( resid 158 and name N and segid "F2 " ) ( resid 158 and name HN and segid "F2 " ) 20.33812476 1.000' 67 1 67 123 parsed_2n8a 1 68 'assign ( resid 159 and name N and segid "F2 " ) ( resid 159 and name HN and segid "F2 " ) 17.39446053 1.000' 68 1 68 123 parsed_2n8a 1 69 'assign ( resid 161 and name N and segid "F2 " ) ( resid 161 and name HN and segid "F2 " ) -15.03055609 1.000' 69 1 69 124 parsed_2n8a 1 70 'assign ( resid 162 and name N and segid "F2 " ) ( resid 162 and name HN and segid "F2 " ) -8.098984944 1.000' 70 1 70 124 parsed_2n8a 1 71 'assign ( resid 163 and name N and segid "F2 " ) ( resid 163 and name HN and segid "F2 " ) -13.39195369 1.000' 71 1 71 124 parsed_2n8a 1 72 'assign ( resid 164 and name N and segid "F2 " ) ( resid 164 and name HN and segid "F2 " ) -9.438942894 1.000' 72 1 72 124 parsed_2n8a 1 73 'assign ( resid 166 and name N and segid "F2 " ) ( resid 166 and name HN and segid "F2 " ) 2.035786233 1.000' 73 1 73 123 parsed_2n8a 1 74 'assign ( resid 167 and name N and segid "F2 " ) ( resid 167 and name HN and segid "F2 " ) -24.30686599 1.000' 74 1 74 124 parsed_2n8a 1 75 'assign ( resid 168 and name N and segid "F2 " ) ( resid 168 and name HN and segid "F2 " ) -12.29141114 1.000' 75 1 75 124 parsed_2n8a 1 76 'assign ( resid 187 and name N and segid "F2 " ) ( resid 187 and name HN and segid "F2 " ) -10.00769281 1.000' 76 1 76 124 parsed_2n8a 1 77 'assign ( resid 188 and name N and segid "F2 " ) ( resid 188 and name HN and segid "F2 " ) 24.50686013 1.000' 77 1 77 123 parsed_2n8a 1 78 'assign ( resid 190 and name N and segid "F2 " ) ( resid 190 and name HN and segid "F2 " ) -7.840881022 1.000' 78 1 78 124 parsed_2n8a 1 79 'assign ( resid 191 and name N and segid "F2 " ) ( resid 191 and name HN and segid "F2 " ) 0.573567582 1.000' 79 1 79 123 parsed_2n8a 1 80 'assign ( resid 192 and name N and segid "F2 " ) ( resid 192 and name HN and segid "F2 " ) -0.713015853 1.000' 80 1 80 124 parsed_2n8a 1 81 'assign ( resid 194 and name N and segid "F2 " ) ( resid 194 and name HN and segid "F2 " ) -3.372716438 1.000' 81 1 81 124 parsed_2n8a 1 82 'assign ( resid 195 and name N and segid "F2 " ) ( resid 195 and name HN and segid "F2 " ) -4.492628358 1.000' 82 1 82 124 parsed_2n8a 1 83 'assign ( resid 196 and name N and segid "F2 " ) ( resid 196 and name HN and segid "F2 " ) -6.112441266 1.000' 83 1 83 124 parsed_2n8a 1 84 'assign ( resid 197 and name N and segid "F2 " ) ( resid 197 and name HN and segid "F2 " ) -8.193733756 1.000' 84 1 84 124 parsed_2n8a 1 85 'assign ( resid 198 and name N and segid "F2 " ) ( resid 198 and name HN and segid "F2 " ) -3.327123233 1.000' 85 1 85 124 parsed_2n8a 1 stop_ save_
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