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ID of heme	Distortion Sort by saddling ruffling doming breathing	Axial ligands on heme		Function & structure
9he7-C-403	`sad. -0.30 ruf. +0.19 dom. -0.08 bre. +0.02`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 401.0 Å³ d(Fe-oop): 0.146 Å
9he7-C-403	`sad. -0.30 ruf. +0.19 dom. -0.08 bre. +0.02`	Not assigned.
9he9-A-405	`sad. -0.32 ruf. +0.10 dom. -0.13 bre. +0.01`	CYS	chainID: A, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 417.0 Å³ d(Fe-oop): 0.167 Å
9he9-A-405	`sad. -0.32 ruf. +0.10 dom. -0.13 bre. +0.01`	DAO	chainID: A, resSeq: 401, molecule: LAURIC ACID
9he9-B-404	`sad. -0.27 ruf. +0.21 dom. -0.14 bre. +0.06`	CYS	chainID: B, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 408.0 Å³ d(Fe-oop): 0.162 Å
9he9-B-404	`sad. -0.27 ruf. +0.21 dom. -0.14 bre. +0.06`	Not assigned.
9he9-C-402	`sad. -0.27 ruf. +0.19 dom. -0.08 bre. -0.00`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 389.0 Å³ d(Fe-oop): 0.136 Å
9he9-C-402	`sad. -0.27 ruf. +0.19 dom. -0.08 bre. -0.00`	Not assigned.
9hea-A-401	`sad. -0.29 ruf. +0.13 dom. -0.04 bre. +0.01`	CYS	chainID: A, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 429.0 Å³ d(Fe-oop): 0.104 Å
9hea-A-401	`sad. -0.29 ruf. +0.13 dom. -0.04 bre. +0.01`	Not assigned.
9hea-B-401	`sad. -0.27 ruf. +0.11 dom. -0.04 bre. +0.09`	CYS	chainID: B, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 433.0 Å³ d(Fe-oop): 0.100 Å
9hea-B-401	`sad. -0.27 ruf. +0.11 dom. -0.04 bre. +0.09`	Not assigned.
9hea-C-401	`sad. -0.23 ruf. +0.21 dom. -0.04 bre. +0.03`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 435.0 Å³ d(Fe-oop): 0.081 Å
9hea-C-401	`sad. -0.23 ruf. +0.21 dom. -0.04 bre. +0.03`	ACT	chainID: C, resSeq: 404, molecule: ACETATE ION
9heb-A-401	`sad. -0.24 ruf. -0.03 dom. -0.09 bre. +0.04`	CYS	chainID: A, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 446.0 Å³ d(Fe-oop): 0.118 Å
9heb-A-401	`sad. -0.24 ruf. -0.03 dom. -0.09 bre. +0.04`	C14	chainID: A, resSeq: 404, molecule: TETRADECANE
9heb-B-401	`sad. -0.20 ruf. +0.13 dom. +0.01 bre. +0.08`	CYS	chainID: B, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 447.0 Å³ d(Fe-oop): 0.062 Å
9heb-B-401	`sad. -0.20 ruf. +0.13 dom. +0.01 bre. +0.08`	Not assigned.
9heb-C-401	`sad. -0.25 ruf. +0.33 dom. +0.07 bre. +0.07`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 450.0 Å³ d(Fe-oop): 0.061 Å
9heb-C-401	`sad. -0.25 ruf. +0.33 dom. +0.07 bre. +0.07`	ACT	chainID: C, resSeq: 403, molecule: ACETATE ION
9hec-A-404	`sad. -0.38 ruf. +0.20 dom. -0.14 bre. +0.03`	CYS	chainID: A, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 411.0 Å³ d(Fe-oop): 0.185 Å
9hec-A-404	`sad. -0.38 ruf. +0.20 dom. -0.14 bre. +0.03`	A1IUB	chainID: A, resSeq: 401, molecule: alpha-ionone
9hec-B-404	`sad. -0.32 ruf. +0.21 dom. -0.06 bre. +0.11`	CYS	chainID: B, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 422.0 Å³ d(Fe-oop): 0.135 Å
9hec-B-404	`sad. -0.32 ruf. +0.21 dom. -0.06 bre. +0.11`	ACT	chainID: B, resSeq: 403, molecule: ACETATE ION
9hec-C-404	`sad. -0.30 ruf. +0.29 dom. -0.02 bre. +0.04`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 407.0 Å³ d(Fe-oop): 0.142 Å
9hec-C-404	`sad. -0.30 ruf. +0.29 dom. -0.02 bre. +0.04`	A1IUB	chainID: C, resSeq: 401, molecule: alpha-ionone
9hed-A-401	`sad. -0.28 ruf. +0.15 dom. -0.10 bre. +0.00`	CYS	chainID: A, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 411.0 Å³ d(Fe-oop): 0.166 Å
9hed-A-401	`sad. -0.28 ruf. +0.15 dom. -0.10 bre. +0.00`	Not assigned.
9hed-B-401	`sad. -0.31 ruf. +0.13 dom. -0.07 bre. +0.06`	CYS	chainID: B, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 410.0 Å³ d(Fe-oop): 0.142 Å
9hed-B-401	`sad. -0.31 ruf. +0.13 dom. -0.07 bre. +0.06`	Not assigned.
9hed-C-401	`sad. -0.28 ruf. +0.20 dom. -0.07 bre. +0.04`	CYS	chainID: C, resSeq: 52, molecule: Heme-thiolate peroxidase	oxidoreductase oligomeric count: 1 pocket vol.: 397.0 Å³ d(Fe-oop): 0.154 Å
9hed-C-401	`sad. -0.28 ruf. +0.20 dom. -0.07 bre. +0.04`	Not assigned.
9hej-D-201	`sad. +0.40 ruf. -0.27 dom. -0.33 bre. -0.13`	HIS	chainID: D, resSeq: 88, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 6 pocket vol.: 566.0 Å³ d(Fe-oop): 0.104 Å
9hej-D-201	`sad. +0.40 ruf. -0.27 dom. -0.33 bre. -0.13`	Not assigned.
9hej-E-201	`sad. +0.42 ruf. -0.23 dom. -0.32 bre. -0.14`	HIS	chainID: E, resSeq: 93, molecule: Hemoglobin subunit beta	oxygen carrier oligomeric count: 6 pocket vol.: 587.0 Å³ d(Fe-oop): 0.135 Å
9hej-E-201	`sad. +0.42 ruf. -0.23 dom. -0.32 bre. -0.14`	Not assigned.
9hek-D-201	`sad. +0.21 ruf. -0.39 dom. -0.37 bre. -0.16`	HIS	chainID: D, resSeq: 88, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 6 pocket vol.: 559.0 Å³ d(Fe-oop): 0.074 Å
9hek-D-201	`sad. +0.21 ruf. -0.39 dom. -0.37 bre. -0.16`	Not assigned.
9hek-E-201	`sad. -0.05 ruf. -0.47 dom. -0.47 bre. -0.18`	HIS	chainID: E, resSeq: 93, molecule: Hemoglobin subunit beta	oxygen carrier oligomeric count: 6 pocket vol.: 510.0 Å³ d(Fe-oop): 0.135 Å
9hek-E-201	`sad. -0.05 ruf. -0.47 dom. -0.47 bre. -0.18`	Not assigned.

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