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update toy example
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Sophie - Luise Heidig authored and Sophie - Luise Heidig committed Mar 21, 2024
1 parent 6d9d028 commit 29898cc
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Showing 43 changed files with 1,138 additions and 2,079 deletions.
2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/A0QHY3.dssp → toy_example/data/dssp/A0QHY3.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/A0R756.dssp → toy_example/data/dssp/A0R756.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: L-ERYTHRULOSE-1-PHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/A1RUV7.dssp → toy_example/data/dssp/A1RUV7.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/A5FRB6.dssp → toy_example/data/dssp/A5FRB6.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/P72484.dssp → toy_example/data/dssp/P72484.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/P9WG42.dssp → toy_example/data/dssp/P9WG42.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/Q3KM32.dssp → toy_example/data/dssp/Q3KM32.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/Q4JCD8.dssp → toy_example/data/dssp/Q4JCD8.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/Q8Z2Y2.dssp → toy_example/data/dssp/Q8Z2Y2.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/Q8ZJK9.dssp → toy_example/data/dssp/Q8ZJK9.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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2 changes: 1 addition & 1 deletion ...mple_2023_12_07_20_58_09/dssp/Q97VM8.dssp → toy_example/data/dssp/Q97VM8.dssp
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==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2023-12-07 .
==== Secondary Structure Definition by the program DSSP, CMBI version 2.0 ==== DATE=2024-03-21 .
REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 .
HEADER 01-JUN-22 .
COMPND MOL_ID: 1; MOLECULE: TRIOSEPHOSPHATE ISOMERASE; CHAIN: A .
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