NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
647170 |
6szc   |
34439 | cing | 2-parsed | STAR | dihedral angle | 120 |
data_6szc_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6szc
_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_6szc 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6szc
_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 6szc "Master copy" parsed_6szc
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6szc
_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 6szc.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6szc 1
1 6szc.mr . . XPLOR/CNS 2 distance NOE ambi 1800 parsed_6szc 1
1 6szc.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 29 parsed_6szc 1
1 6szc.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 120 parsed_6szc 1
1 6szc.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6szc 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6szc
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -2.34 . " A" 2055 . C " A" 2056 . N " A" 2056 . CA " A" 2056 . C parsed_6szc 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 211.66 . " A" 2056 . N " A" 2056 . CA " A" 2056 . C " A" 2057 . N parsed_6szc 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -34.42 . " A" 2056 . C " A" 2057 . N " A" 2057 . CA " A" 2057 . C parsed_6szc 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 4.72 . " A" 2057 . N " A" 2057 . CA " A" 2057 . C " A" 2058 . N parsed_6szc 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -32.62 . " A" 2057 . C " A" 2058 . N " A" 2058 . CA " A" 2058 . C parsed_6szc 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 21.72 . " A" 2058 . N " A" 2058 . CA " A" 2058 . C " A" 2059 . N parsed_6szc 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -5.86 . " A" 2058 . C " A" 2059 . N " A" 2059 . CA " A" 2059 . C parsed_6szc 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.00 217.94 . " A" 2059 . N " A" 2059 . CA " A" 2059 . C " A" 2060 . N parsed_6szc 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -43.62 . " A" 2062 . C " A" 2063 . N " A" 2063 . CA " A" 2063 . C parsed_6szc 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 27.74 . " A" 2063 . N " A" 2063 . CA " A" 2063 . C " A" 2064 . N parsed_6szc 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -49.70 . " A" 2063 . C " A" 2064 . N " A" 2064 . CA " A" 2064 . C parsed_6szc 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 32.34 . " A" 2064 . N " A" 2064 . CA " A" 2064 . C " A" 2065 . N parsed_6szc 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -33.36 . " A" 2064 . C " A" 2065 . N " A" 2065 . CA " A" 2065 . C parsed_6szc 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 185.04 . " A" 2065 . N " A" 2065 . CA " A" 2065 . C " A" 2066 . N parsed_6szc 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -12.42 . " A" 2066 . C " A" 2067 . N " A" 2067 . CA " A" 2067 . C parsed_6szc 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 165.36 . " A" 2067 . N " A" 2067 . CA " A" 2067 . C " A" 2068 . N parsed_6szc 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -95.62 . " A" 2067 . C " A" 2068 . N " A" 2068 . CA " A" 2068 . C parsed_6szc 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 193.66 . " A" 2068 . N " A" 2068 . CA " A" 2068 . C " A" 2069 . N parsed_6szc 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -32.22 . " A" 2068 . C " A" 2069 . N " A" 2069 . CA " A" 2069 . C parsed_6szc 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 178.60 . " A" 2069 . N " A" 2069 . CA " A" 2069 . C " A" 2070 . N parsed_6szc 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -32.14 . " A" 2069 . C " A" 2070 . N " A" 2070 . CA " A" 2070 . C parsed_6szc 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 7.78 . " A" 2070 . N " A" 2070 . CA " A" 2070 . C " A" 2071 . N parsed_6szc 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -52.62 . " A" 2070 . C " A" 2071 . N " A" 2071 . CA " A" 2071 . C parsed_6szc 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 37.86 . " A" 2071 . N " A" 2071 . CA " A" 2071 . C " A" 2072 . N parsed_6szc 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.00 90.58 . " A" 2071 . C " A" 2072 . N " A" 2072 . CA " A" 2072 . C parsed_6szc 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.00 29.52 . " A" 2072 . N " A" 2072 . CA " A" 2072 . C " A" 2073 . N parsed_6szc 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -27.40 . " A" 2072 . C " A" 2073 . N " A" 2073 . CA " A" 2073 . C parsed_6szc 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 183.70 . " A" 2073 . N " A" 2073 . CA " A" 2073 . C " A" 2074 . N parsed_6szc 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -88.52 . " A" 2074 . C " A" 2075 . N " A" 2075 . CA " A" 2075 . C parsed_6szc 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 189.42 . " A" 2075 . N " A" 2075 . CA " A" 2075 . C " A" 2076 . N parsed_6szc 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -92.48 . " A" 2075 . C " A" 2076 . N " A" 2076 . CA " A" 2076 . C parsed_6szc 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.50 . " A" 2076 . N " A" 2076 . CA " A" 2076 . C " A" 2077 . N parsed_6szc 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -87.68 . " A" 2076 . C " A" 2077 . N " A" 2077 . CA " A" 2077 . C parsed_6szc 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 149.90 . " A" 2077 . N " A" 2077 . CA " A" 2077 . C " A" 2078 . N parsed_6szc 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -68.56 . " A" 2077 . C " A" 2078 . N " A" 2078 . CA " A" 2078 . C parsed_6szc 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 159.98 . " A" 2078 . N " A" 2078 . CA " A" 2078 . C " A" 2079 . N parsed_6szc 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.46 . " A" 2078 . C " A" 2079 . N " A" 2079 . CA " A" 2079 . C parsed_6szc 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 160.34 . " A" 2079 . N " A" 2079 . CA " A" 2079 . C " A" 2080 . N parsed_6szc 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 107.26 . " A" 2079 . C " A" 2080 . N " A" 2080 . CA " A" 2080 . C parsed_6szc 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 34.86 . " A" 2080 . N " A" 2080 . CA " A" 2080 . C " A" 2081 . N parsed_6szc 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -83.04 . " A" 2082 . C " A" 2083 . N " A" 2083 . CA " A" 2083 . C parsed_6szc 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 166.14 . " A" 2083 . N " A" 2083 . CA " A" 2083 . C " A" 2084 . N parsed_6szc 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -95.02 . " A" 2083 . C " A" 2084 . N " A" 2084 . CA " A" 2084 . C parsed_6szc 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 164.54 . " A" 2084 . N " A" 2084 . CA " A" 2084 . C " A" 2085 . N parsed_6szc 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -89.10 . " A" 2084 . C " A" 2085 . N " A" 2085 . CA " A" 2085 . C parsed_6szc 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 157.76 . " A" 2085 . N " A" 2085 . CA " A" 2085 . C " A" 2086 . N parsed_6szc 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -66.06 . " A" 2085 . C " A" 2086 . N " A" 2086 . CA " A" 2086 . C parsed_6szc 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 184.98 . " A" 2086 . N " A" 2086 . CA " A" 2086 . C " A" 2087 . N parsed_6szc 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 3.42 . " A" 2086 . C " A" 2087 . N " A" 2087 . CA " A" 2087 . C parsed_6szc 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 206.18 . " A" 2087 . N " A" 2087 . CA " A" 2087 . C " A" 2088 . N parsed_6szc 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -30.04 . " A" 2087 . C " A" 2088 . N " A" 2088 . CA " A" 2088 . C parsed_6szc 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 -0.18 . " A" 2088 . N " A" 2088 . CA " A" 2088 . C " A" 2089 . N parsed_6szc 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -50.34 . " A" 2088 . C " A" 2089 . N " A" 2089 . CA " A" 2089 . C parsed_6szc 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 39.90 . " A" 2089 . N " A" 2089 . CA " A" 2089 . C " A" 2090 . N parsed_6szc 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 117.06 . " A" 2089 . C " A" 2090 . N " A" 2090 . CA " A" 2090 . C parsed_6szc 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 37.00 . " A" 2090 . N " A" 2090 . CA " A" 2090 . C " A" 2091 . N parsed_6szc 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -33.68 . " A" 2090 . C " A" 2091 . N " A" 2091 . CA " A" 2091 . C parsed_6szc 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 171.26 . " A" 2091 . N " A" 2091 . CA " A" 2091 . C " A" 2092 . N parsed_6szc 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -78.84 . " A" 2091 . C " A" 2092 . N " A" 2092 . CA " A" 2092 . C parsed_6szc 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 152.92 . " A" 2092 . N " A" 2092 . CA " A" 2092 . C " A" 2093 . N parsed_6szc 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -99.26 . " A" 2092 . C " A" 2093 . N " A" 2093 . CA " A" 2093 . C parsed_6szc 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 168.76 . " A" 2093 . N " A" 2093 . CA " A" 2093 . C " A" 2094 . N parsed_6szc 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -82.82 . " A" 2093 . C " A" 2094 . N " A" 2094 . CA " A" 2094 . C parsed_6szc 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 157.22 . " A" 2094 . N " A" 2094 . CA " A" 2094 . C " A" 2095 . N parsed_6szc 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -74.74 . " A" 2094 . C " A" 2095 . N " A" 2095 . CA " A" 2095 . C parsed_6szc 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 175.58 . " A" 2095 . N " A" 2095 . CA " A" 2095 . C " A" 2096 . N parsed_6szc 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -36.00 . " A" 2095 . C " A" 2096 . N " A" 2096 . CA " A" 2096 . C parsed_6szc 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 182.90 . " A" 2096 . N " A" 2096 . CA " A" 2096 . C " A" 2097 . N parsed_6szc 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.62 . " A" 2097 . C " A" 2098 . N " A" 2098 . CA " A" 2098 . C parsed_6szc 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 26.68 . " A" 2098 . N " A" 2098 . CA " A" 2098 . C " A" 2099 . N parsed_6szc 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -24.30 . " A" 2098 . C " A" 2099 . N " A" 2099 . CA " A" 2099 . C parsed_6szc 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 37.28 . " A" 2099 . N " A" 2099 . CA " A" 2099 . C " A" 2100 . N parsed_6szc 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -75.16 . " A" 2100 . C " A" 2101 . N " A" 2101 . CA " A" 2101 . C parsed_6szc 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 169.38 . " A" 2101 . N " A" 2101 . CA " A" 2101 . C " A" 2102 . N parsed_6szc 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -45.20 . " A" 2103 . C " A" 2104 . N " A" 2104 . CA " A" 2104 . C parsed_6szc 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 173.70 . " A" 2104 . N " A" 2104 . CA " A" 2104 . C " A" 2105 . N parsed_6szc 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -90.70 . " A" 2106 . C " A" 2107 . N " A" 2107 . CA " A" 2107 . C parsed_6szc 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 160.76 . " A" 2107 . N " A" 2107 . CA " A" 2107 . C " A" 2108 . N parsed_6szc 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -75.56 . " A" 2107 . C " A" 2108 . N " A" 2108 . CA " A" 2108 . C parsed_6szc 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.02 . " A" 2108 . N " A" 2108 . CA " A" 2108 . C " A" 2109 . N parsed_6szc 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -92.66 . " A" 2108 . C " A" 2109 . N " A" 2109 . CA " A" 2109 . C parsed_6szc 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 160.62 . " A" 2109 . N " A" 2109 . CA " A" 2109 . C " A" 2110 . N parsed_6szc 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -93.36 . " A" 2109 . C " A" 2110 . N " A" 2110 . CA " A" 2110 . C parsed_6szc 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 162.34 . " A" 2110 . N " A" 2110 . CA " A" 2110 . C " A" 2111 . N parsed_6szc 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -102.60 . " A" 2110 . C " A" 2111 . N " A" 2111 . CA " A" 2111 . C parsed_6szc 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 193.36 . " A" 2111 . N " A" 2111 . CA " A" 2111 . C " A" 2112 . N parsed_6szc 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -99.98 . " A" 2111 . C " A" 2112 . N " A" 2112 . CA " A" 2112 . C parsed_6szc 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 189.76 . " A" 2112 . N " A" 2112 . CA " A" 2112 . C " A" 2113 . N parsed_6szc 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -60.00 . " A" 2112 . C " A" 2113 . N " A" 2113 . CA " A" 2113 . C parsed_6szc 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.00 190.00 . " A" 2113 . N " A" 2113 . CA " A" 2113 . C " A" 2114 . N parsed_6szc 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -41.90 . " A" 2113 . C " A" 2114 . N " A" 2114 . CA " A" 2114 . C parsed_6szc 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 11.72 . " A" 2114 . N " A" 2114 . CA " A" 2114 . C " A" 2115 . N parsed_6szc 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -70.36 . " A" 2114 . C " A" 2115 . N " A" 2115 . CA " A" 2115 . C parsed_6szc 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 34.86 . " A" 2115 . N " A" 2115 . CA " A" 2115 . C " A" 2116 . N parsed_6szc 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 119.38 . " A" 2115 . C " A" 2116 . N " A" 2116 . CA " A" 2116 . C parsed_6szc 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 30.12 . " A" 2116 . N " A" 2116 . CA " A" 2116 . C " A" 2117 . N parsed_6szc 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -18.98 . " A" 2116 . C " A" 2117 . N " A" 2117 . CA " A" 2117 . C parsed_6szc 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 168.86 . " A" 2117 . N " A" 2117 . CA " A" 2117 . C " A" 2118 . N parsed_6szc 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -45.16 . " A" 2117 . C " A" 2118 . N " A" 2118 . CA " A" 2118 . C parsed_6szc 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 167.94 . " A" 2118 . N " A" 2118 . CA " A" 2118 . C " A" 2119 . N parsed_6szc 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -76.04 . " A" 2118 . C " A" 2119 . N " A" 2119 . CA " A" 2119 . C parsed_6szc 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 178.66 . " A" 2119 . N " A" 2119 . CA " A" 2119 . C " A" 2120 . N parsed_6szc 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -98.76 . " A" 2119 . C " A" 2120 . N " A" 2120 . CA " A" 2120 . C parsed_6szc 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 191.28 . " A" 2120 . N " A" 2120 . CA " A" 2120 . C " A" 2121 . N parsed_6szc 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -129.34 . " A" 2120 . C " A" 2121 . N " A" 2121 . CA " A" 2121 . C parsed_6szc 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.00 179.54 . " A" 2121 . N " A" 2121 . CA " A" 2121 . C " A" 2122 . N parsed_6szc 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -92.90 . " A" 2121 . C " A" 2122 . N " A" 2122 . CA " A" 2122 . C parsed_6szc 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 168.50 . " A" 2122 . N " A" 2122 . CA " A" 2122 . C " A" 2123 . N parsed_6szc 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -90.00 . " A" 2122 . C " A" 2123 . N " A" 2123 . CA " A" 2123 . C parsed_6szc 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 151.70 . " A" 2123 . N " A" 2123 . CA " A" 2123 . C " A" 2124 . N parsed_6szc 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -76.44 . " A" 2123 . C " A" 2124 . N " A" 2124 . CA " A" 2124 . C parsed_6szc 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 180.32 . " A" 2124 . N " A" 2124 . CA " A" 2124 . C " A" 2125 . N parsed_6szc 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 18.36 . " A" 2059 . C " A" 2060 . N " A" 2060 . CA " A" 2060 . C parsed_6szc 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 195.58 . " A" 2060 . N " A" 2060 . CA " A" 2060 . C " A" 2061 . N parsed_6szc 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 5.46 . " A" 2060 . C " A" 2061 . N " A" 2061 . CA " A" 2061 . C parsed_6szc 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 204.88 . " A" 2061 . N " A" 2061 . CA " A" 2061 . C " A" 2062 . N parsed_6szc 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 19.20 . " A" 2061 . C " A" 2062 . N " A" 2062 . CA " A" 2062 . C parsed_6szc 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.00 238.30 . " A" 2062 . N " A" 2062 . CA " A" 2062 . C " A" 2063 . N parsed_6szc 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 90.00 . " A" 2107 . N " A" 2107 . CA " A" 2107 . CB " A" 2107 . CG1 parsed_6szc 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190.00 -150.00 . " A" 2109 . N " A" 2109 . CA " A" 2109 . CB " A" 2109 . CG1 parsed_6szc 1
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_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 3: csha_dihedral_restraints.tbl" 1 1 1 49 parsed_6szc 1
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