A0A087YHE1_POEFO Loading...

Reactive oxygen species modulator 1

Has antibacterial activity against a variety of bacteria including S.aureus, P.aeruginosa and M.tuberculosis. Acts by inducing bacterial membrane breakage. Induces production of reactive oxygen species (ROS) which are necessary for cell proliferation. May play a role in inducing oxidative DNA damage and replicative senescence. May play a role in the coordination of mitochondrial morphology and cell proliferation.

AlphaFold DB , UniProt , Accession A0A087YHE1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 79 aa.

						>A0A087YHE1_POEFO|A0A087YHE1
MPVAVGPYGQTQPSCFDRVKMGFMMGFAVGMAAGAMFGTFSCLRIGMRGRELMGGIGKTMMQSGGTFGTFMAIGMGIRC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.7	Very low	46.4	Very low	212 Å²	212	129.6 Å²	129.6	100%	1.044	77%	0.769	S	S	*	*				0	107.1	0	52.5	-169	-104.4	0	0	108.6	V3	M1-V3 PolarHBondContact O-N 3.32Å
2	P	57.4	Low	46.3	Very low	130 Å²	130	133.5 Å²	133.5	84%	0.844	77%	0.774	S	S	*	*			trans	-64.8	120.7	168.1	28.7	-30	0	0	0	106.5	A4	P2-A4 PolarHBondContact O-N 2.88Å
3	V	54.2	Low	47.3	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	74%	0.737	S	S	*	*			trans	-64.2	107.1	172.1	178.2	0	0	0	0	105.5	M1 V5	M1-V3 PolarHBondContact O-N 3.32Å; V3-V5 VanDerWaalsContact C-N 3.34Å; V3-V5 PolarHBondContact O-N 3.08Å
4	A	47.2	Very low	48.9	Very low	88 Å²	88	123.7 Å²	123.7	73%	0.727	73%	0.726	S	S	*	*			trans	-58.8	101.1	171.2	0	0	0	0	0	107.3	P2 G6	P2-A4 PolarHBondContact O-N 2.88Å; A4-G6 PolarHBondContact O-N 3.45Å
5	V	53.7	Low	50.7	Low	137 Å²	137	120.5 Å²	120.5	83%	0.83	71%	0.712	S	S	*	*			trans	-61.7	99	155.9	-74.6	0	0	0	0	104.8	V3	V3-V5 VanDerWaalsContact C-N 3.34Å; V3-V5 PolarHBondContact O-N 3.08Å
6	G	38.4	Very low	52.5	Low	56 Å²	56	123.3 Å²	123.3	58%	0.577	71%	0.713	S	S	*	*			trans	-50.7	138.4	-173.2	0	0	0	0	0	110.3	A4 Y8	A4-G6 PolarHBondContact O-N 3.45Å; G6-Y8 PolarHBondContact O-N 2.99Å
7	P	45.2	Very low	54.2	Low	125 Å²	125	120.8 Å²	120.8	81%	0.812	70%	0.696	S	S	*	*			trans	-61.3	104.5	170	24.8	-30.4	0	0	0	107.1	G9	P7-G9 PolarHBondContact O-N 3.29Å
8	Y	44.8	Very low	55.5	Low	194 Å²	194	119.7 Å²	119.7	76%	0.761	68%	0.679	S	S	*	*			trans	-50.5	112.6	164.2	-137	-92.2	0	0	0	105.9	G6 M21	G6-Y8 PolarHBondContact O-N 2.99Å; Y8-M21 HydrophobicContact CD1-CE 4.38Å; Y8-M21 HydrophobicContact CE1-CE 3.56Å; Y8-M21 HydrophobicContact CE2-CE 3.73Å; Y8-M21 WeakPolarHBondContact OH-CE 3.33Å
9	G	43.4	Very low	57	Low	49 Å²	49	115.6 Å²	115.6	51%	0.505	66%	0.656	S	S	.	*			trans	-53	139.4	-158.4	0	0	0	0	0	113.9	P7 T11	P7-G9 PolarHBondContact O-N 3.29Å; G9-T11 PolarHBondContact O-N 3.43Å
10	Q	39.7	Very low	58.3	Low	205 Å²	205	115.8 Å²	115.8	96%	0.958	65%	0.649	S	S	*	*	S	Bend		17.2	26.4	121.8	-71.1	-73.2	-64.8	0	0	121
11	T	44.8	Very low	59.6	Low	111 Å²	111	113.6 Å²	113.6	68%	0.681	64%	0.635	S	S	*	*	S	Bend	trans	-128.3	112.6	157	-95.9	0	0	0	0	103.4	G9 P13	G9-T11 PolarHBondContact O-N 3.43Å; T11-P13 WeakPolarHBondContact O-CD 3.39Å; T11-P13 WeakPolarHBondContact O-CG 3.26Å
12	Q	45.7	Very low	61.8	Low	176 Å²	176	103.8 Å²	103.8	82%	0.822	59%	0.589	S	S	*	*			trans	-57.2	104.3	172	-164.2	173.5	67.8	0	0	106.4	S14	Q12-S14 PolarHBondContact O-N 3.44Å
13	P	58.7	Low	63.2	Low	45 Å²	45	101.5 Å²	101.5	29%	0.292	57%	0.565	S	S	.	*			trans	-67.6	135.9	178.8	-8.6	26.4	0	0	0	105.4	T11 D17	T11-P13 WeakPolarHBondContact O-CD 3.39Å; T11-P13 WeakPolarHBondContact O-CG 3.26Å; P13-D17 HydrophobicContact CB-CB 3.39Å
14	S	70.1	Confident	64.9	Low	85 Å²	85	101.9 Å²	101.9	59%	0.594	56%	0.561	S	S	*	*			trans	-44.9	152.6	175.9	-76.9	0	0	0	0	110.5	Q12 F16 D17 R18	Q12-S14 PolarHBondContact O-N 3.44Å; S14-F16 CarbonylContact O-C 3.27Å; S14-F16 PolarHBondContact O-N 3.05Å; S14-D17 WeakPolarHBondContact O-CA 3.41Å; S14-D17 WeakPolarHBondContact O-CB 3.25Å; S14-D17 PolarHBondContact O-N 3.37Å; S14-R18 PolarHBondContact O-N 2.9Å
15	C	76.1	Confident	66.9	Low	76 Å²	76	103.3 Å²	103.3	51%	0.514	55%	0.554	S	S	.	*	H	α-helix	trans	-45.5	-37.8	179.8	-52.8	0	0	0	0	111.7	R18 V19 C79	C15-R18 PolarHBondContact O-N 3.34Å; C15-V19 VanDerWaalsContact O-CG2 3.24Å; C15-V19 WeakPolarHBondContact O-CG2 3.5Å; C15-V19 PolarHBondContact O-N 3.37Å; C15-C79 WeakPolarHBondContact CA-SG 2.93Å; C15-C79 HydrophobicContact CB-CB 3.49Å; C15-C79 VanDerWaalsContact CB-CB 3.49Å; C15-C79 VanDerWaalsContact CB-SG 3.51Å; C15-C79 PolarHBondContact O-SG 3.4Å; C15-C79 VanDerWaalsContact SG-CB 3.54Å
16	F	78.9	Confident	68.5	Low	165 Å²	165	96.9 Å²	96.9	72%	0.724	52%	0.516	S	S	*	.	H	α-helix	trans	-64.9	-39.1	175.6	-157.1	-99.8	0	0	0	115.4	S14 V19 K20	S14-F16 CarbonylContact O-C 3.27Å; S14-F16 PolarHBondContact O-N 3.05Å; F16-V19 PolarHBondContact O-N 2.82Å; F16-K20 WeakPolarHBondContact O-CB 3.3Å; F16-K20 PolarHBondContact O-N 2.91Å
17	D	81.6	Confident	70.9	Confident	80 Å²	80	97.6 Å²	97.6	43%	0.428	50%	0.503	S	S	.	.	H	α-helix	trans	-68.1	-38	175.5	-106.1	-65	0	0	0	111.7	P13 S14 K20 M21	P13-D17 HydrophobicContact CB-CB 3.39Å; S14-D17 WeakPolarHBondContact O-CA 3.41Å; S14-D17 WeakPolarHBondContact O-CB 3.25Å; S14-D17 PolarHBondContact O-N 3.37Å; D17-K20 PolarHBondContact O-N 3.42Å; D17-M21 WeakPolarHBondContact O-CB 3.33Å; D17-M21 PolarHBondContact O-N 3.24Å
18	R	77.1	Confident	72.9	Confident	102 Å²	102	94.5 Å²	94.5	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-43.9	172.7	-82.8	-170.5	-175.9	178.5	4.1	112	S14 C15 K20 M21 G22 R78	S14-R18 PolarHBondContact O-N 2.9Å; C15-R18 PolarHBondContact O-N 3.34Å; R18-K20 VanDerWaalsContact C-N 3.33Å; R18-K20 PolarHBondContact O-N 3.09Å; R18-M21 PolarHBondContact O-N 2.92Å; R18-G22 PolarHBondContact O-N 2.95Å; R18-R78 PolarHBondContact NH1-O 2.88Å
19	V	84.5	Confident	75.1	Confident	41 Å²	41	89.9 Å²	89.9	25%	0.248	48%	0.48	C	S	.	.	H	α-helix	trans	-60.5	-44.3	175.7	172.3	0	0	0	0	110.7	C15 F16 G22 F23 A72	C15-V19 VanDerWaalsContact O-CG2 3.24Å; C15-V19 WeakPolarHBondContact O-CG2 3.5Å; C15-V19 PolarHBondContact O-N 3.37Å; F16-V19 PolarHBondContact O-N 2.82Å; V19-G22 PolarHBondContact O-N 3.48Å; V19-F23 WeakPolarHBondContact O-CB 3.41Å; V19-F23 PolarHBondContact O-N 3.23Å; V19-A72 HydrophobicContact CG1-CB 3.99Å
20	K	83.5	Confident	77.2	Confident	119 Å²	119	87.6 Å²	87.6	52%	0.517	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-44.2	178.3	-177.1	179.3	171.1	-170.8	0	112.5	F16 D17 R18 F23 M24	F16-K20 WeakPolarHBondContact O-CB 3.3Å; F16-K20 PolarHBondContact O-N 2.91Å; D17-K20 PolarHBondContact O-N 3.42Å; R18-K20 VanDerWaalsContact C-N 3.33Å; R18-K20 PolarHBondContact O-N 3.09Å; K20-F23 PolarHBondContact O-N 2.91Å; K20-M24 PolarHBondContact O-N 2.6Å
21	M	85.4	Confident	79.5	Confident	70 Å²	70	80.9 Å²	80.9	35%	0.345	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-47.1	173	-100.3	-84.8	-175.8	0	0	111.6	Y8 D17 R18 F23 M24 M25	Y8-M21 HydrophobicContact CD1-CE 4.38Å; Y8-M21 HydrophobicContact CE1-CE 3.56Å; Y8-M21 HydrophobicContact CE2-CE 3.73Å; Y8-M21 WeakPolarHBondContact OH-CE 3.33Å; D17-M21 WeakPolarHBondContact O-CB 3.33Å; D17-M21 PolarHBondContact O-N 3.24Å; R18-M21 PolarHBondContact O-N 2.92Å; M21-F23 VanDerWaalsContact C-N 3.35Å; M21-F23 PolarHBondContact O-N 3.4Å; M21-M24 PolarHBondContact O-N 2.8Å; M21-M25 PolarHBondContact O-N 2.63Å; M21-M25 HydrophobicContact SD-CE 4.34Å
22	G	86.5	Confident	81.5	Confident	7 Å²	7	78.2 Å²	78.2	7%	0.072	41%	0.414	C	S	.	.	H	α-helix	trans	-62	-41	177.3	0	0	0	0	0	112.5	R18 V19 G26	R18-G22 PolarHBondContact O-N 2.95Å; V19-G22 PolarHBondContact O-N 3.48Å; G22-G26 PolarHBondContact O-N 2.89Å
23	F	88.1	Confident	83.5	Confident	81 Å²	81	71.5 Å²	71.5	36%	0.355	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-48.5	173.8	-174.6	-97.7	0	0	0	111.6	V19 K20 M21 G26 F27 G68 A72	V19-F23 WeakPolarHBondContact O-CB 3.41Å; V19-F23 PolarHBondContact O-N 3.23Å; K20-F23 PolarHBondContact O-N 2.91Å; M21-F23 VanDerWaalsContact C-N 3.35Å; M21-F23 PolarHBondContact O-N 3.4Å; F23-G26 PolarHBondContact O-N 3.06Å; F23-F27 HydrophobicContact CE1-CB 4.44Å; F23-F27 HydrophobicContact CE1-CD2 4.5Å; F23-F27 HydrophobicContact CZ-CD2 4.31Å; F23-F27 WeakPolarHBondContact O-CB 3.25Å; F23-F27 PolarHBondContact O-N 2.93Å; F23-G68 VanDerWaalsContact CD2-C 3.4Å; F23-G68 WeakPolarHBondContact CD2-O 3.13Å; F23-A72 HydrophobicContact CB-CB 3.81Å; F23-A72 HydrophobicContact CD2-CB 4.03Å; F23-A72 HydrophobicContact CG-CB 4.43Å
24	M	88.6	Confident	84.7	Confident	128 Å²	128	69.6 Å²	69.6	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-63	-44.1	179.9	-84.3	-163.5	157.1	0	0	112.5	K20 M21 A28	K20-M24 PolarHBondContact O-N 2.6Å; M21-M24 PolarHBondContact O-N 2.8Å; M24-A28 WeakPolarHBondContact O-CB 3.26Å; M24-A28 PolarHBondContact O-N 3.44Å
25	M	89.3	Confident	85.4	Confident	117 Å²	117	66.6 Å²	66.6	58%	0.576	36%	0.358	S	S	*	.	H	α-helix	trans	-65.9	-45.5	176.4	-71.5	-157.3	170.9	0	0	111.7	M21 F27 A28 V29	M21-M25 PolarHBondContact O-N 2.63Å; M21-M25 HydrophobicContact SD-CE 4.34Å; M25-F27 VanDerWaalsContact C-N 3.33Å; M25-F27 PolarHBondContact O-N 3.17Å; M25-A28 PolarHBondContact O-N 3.11Å; M25-V29 VanDerWaalsContact O-CG2 3.31Å; M25-V29 WeakPolarHBondContact O-CG2 3.07Å; M25-V29 PolarHBondContact O-N 2.76Å
26	G	88	Confident	85.8	Confident	3 Å²	3	69.7 Å²	69.7	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-64.1	-36.8	177.6	0	0	0	0	0	112.8	G22 F23 G30 F67	G22-G26 PolarHBondContact O-N 2.89Å; F23-G26 PolarHBondContact O-N 3.06Å; G26-G30 PolarHBondContact O-N 3.24Å; G26-F67 WeakPolarHBondContact O-CB 3.29Å
27	F	88.6	Confident	86	Confident	71 Å²	71	69.4 Å²	69.4	31%	0.311	37%	0.365	S	S	.	.	H	α-helix	trans	-68	-44	175.8	-173.2	-94.7	0	0	0	111.4	F23 M25 G30 M31 G64	F23-F27 HydrophobicContact CE1-CB 4.44Å; F23-F27 HydrophobicContact CE1-CD2 4.5Å; F23-F27 HydrophobicContact CZ-CD2 4.31Å; F23-F27 WeakPolarHBondContact O-CB 3.25Å; F23-F27 PolarHBondContact O-N 2.93Å; M25-F27 VanDerWaalsContact C-N 3.33Å; M25-F27 PolarHBondContact O-N 3.17Å; F27-G30 PolarHBondContact O-N 3.45Å; F27-M31 HydrophobicContact CD1-CG 3.92Å; F27-M31 HydrophobicContact CE1-CE 4.16Å; F27-M31 HydrophobicContact CE1-CG 3.6Å; F27-M31 HydrophobicContact CE1-SD 3.99Å; F27-M31 HydrophobicContact CE2-CG 4.41Å; F27-M31 HydrophobicContact CG-CG 4.46Å; F27-M31 HydrophobicContact CZ-CE 4.4Å; F27-M31 HydrophobicContact CZ-CG 3.86Å; F27-M31 HydrophobicContact CZ-SD 3.84Å; F27-M31 VanDerWaalsContact O-CB 3.31Å; F27-M31 WeakPolarHBondContact O-CB 3.35Å; F27-M31 WeakPolarHBondContact O-CG 3.05Å; F27-M31 PolarHBondContact O-N 3.26Å; F27-G64 WeakPolarHBondContact CD2-O 3.16Å
28	A	88.4	Confident	85.8	Confident	60 Å²	60	65.8 Å²	65.8	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-44.9	176.7	0	0	0	0	0	112	M24 M25 M31 A32	M24-A28 WeakPolarHBondContact O-CB 3.26Å; M24-A28 PolarHBondContact O-N 3.44Å; M25-A28 PolarHBondContact O-N 3.11Å; A28-M31 PolarHBondContact O-N 3.41Å; A28-A32 WeakPolarHBondContact O-CB 3.23Å; A28-A32 PolarHBondContact O-N 2.82Å
29	V	89.3	Confident	85.7	Confident	97 Å²	97	63.4 Å²	63.4	59%	0.588	34%	0.344	S	S	*	.	H	α-helix	trans	-66.7	-42.8	176.8	173.9	0	0	0	0	111.2	M25 A32 A33	M25-V29 VanDerWaalsContact O-CG2 3.31Å; M25-V29 WeakPolarHBondContact O-CG2 3.07Å; M25-V29 PolarHBondContact O-N 2.76Å; V29-A32 PolarHBondContact O-N 2.89Å; V29-A33 WeakPolarHBondContact O-CB 3.42Å; V29-A33 PolarHBondContact O-N 3.46Å
30	G	89.5	Confident	85.4	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-42.2	176.8	0	0	0	0	0	112.5	G26 F27 G34 S63	G26-G30 PolarHBondContact O-N 3.24Å; F27-G30 PolarHBondContact O-N 3.45Å; G30-G34 WeakPolarHBondContact O-CA 3.48Å; G30-G34 PolarHBondContact O-N 2.89Å; G30-S63 PolarHBondContact O-OG 2.89Å; G30-S63 VanDerWaalsContact O-OG 3.11Å
31	M	87.4	Confident	84.8	Confident	65 Å²	65	66.1 Å²	66.1	32%	0.32	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-44	173.4	-73.2	-88.9	-76.4	0	0	111.5	F27 A28 A35 M60	F27-M31 HydrophobicContact CD1-CG 3.92Å; F27-M31 HydrophobicContact CE1-CE 4.16Å; F27-M31 HydrophobicContact CE1-CG 3.6Å; F27-M31 HydrophobicContact CE1-SD 3.99Å; F27-M31 HydrophobicContact CE2-CG 4.41Å; F27-M31 HydrophobicContact CG-CG 4.46Å; F27-M31 HydrophobicContact CZ-CE 4.4Å; F27-M31 HydrophobicContact CZ-CG 3.86Å; F27-M31 HydrophobicContact CZ-SD 3.84Å; F27-M31 VanDerWaalsContact O-CB 3.31Å; F27-M31 WeakPolarHBondContact O-CB 3.35Å; F27-M31 WeakPolarHBondContact O-CG 3.05Å; F27-M31 PolarHBondContact O-N 3.26Å; A28-M31 PolarHBondContact O-N 3.41Å; M31-A35 WeakPolarHBondContact O-CB 3.12Å; M31-A35 PolarHBondContact O-N 3.05Å; M31-M60 HydrophobicContact SD-CB 3.74Å
32	A	87.2	Confident	84	Confident	54 Å²	54	63.2 Å²	63.2	45%	0.446	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-44.2	178.7	0	0	0	0	0	112.4	A28 V29 A35 M36	A28-A32 WeakPolarHBondContact O-CB 3.23Å; A28-A32 PolarHBondContact O-N 2.82Å; V29-A32 PolarHBondContact O-N 2.89Å; A32-A35 WeakPolarHBondContact O-CB 3.26Å; A32-A35 PolarHBondContact O-N 3.14Å; A32-M36 WeakPolarHBondContact O-CG 3.24Å; A32-M36 PolarHBondContact O-N 3.41Å
33	A	86.5	Confident	83.3	Confident	35 Å²	35	68.9 Å²	68.9	29%	0.289	38%	0.375	S	S	.	.	H	α-helix	trans	-66.9	-44.7	176.5	0	0	0	0	0	111.4	V29 A35 M36 F37	V29-A33 WeakPolarHBondContact O-CB 3.42Å; V29-A33 PolarHBondContact O-N 3.46Å; A33-A35 VanDerWaalsContact C-N 3.26Å; A33-A35 PolarHBondContact O-N 3.49Å; A33-M36 PolarHBondContact O-N 2.88Å; A33-F37 WeakPolarHBondContact O-CD2 3.29Å; A33-F37 PolarHBondContact O-N 3.35Å
34	G	84.8	Confident	82.4	Confident	6 Å²	6	75.5 Å²	75.5	6%	0.062	40%	0.397	C	S	.	.	H	α-helix	trans	-62.4	-33.8	174.1	0	0	0	0	0	112.8	G30 G38 S63	G30-G34 WeakPolarHBondContact O-CA 3.48Å; G30-G34 PolarHBondContact O-N 2.89Å; G34-G38 VanDerWaalsContact O-CA 3.25Å; G34-G38 WeakPolarHBondContact O-CA 3.33Å; G34-G38 PolarHBondContact O-N 2.78Å; G34-S63 WeakPolarHBondContact CA-OG 3.2Å
35	A	83.7	Confident	81.5	Confident	21 Å²	21	75.2 Å²	75.2	17%	0.174	40%	0.397	C	S	.	.	H	α-helix	trans	-67.6	-47.5	172.4	0	0	0	0	0	111.5	M31 A32 A33 T39 M60	M31-A35 WeakPolarHBondContact O-CB 3.12Å; M31-A35 PolarHBondContact O-N 3.05Å; A32-A35 WeakPolarHBondContact O-CB 3.26Å; A32-A35 PolarHBondContact O-N 3.14Å; A33-A35 VanDerWaalsContact C-N 3.26Å; A33-A35 PolarHBondContact O-N 3.49Å; A35-T39 WeakPolarHBondContact O-CA 3.41Å; A35-T39 WeakPolarHBondContact O-CB 3.5Å; A35-T39 PolarHBondContact O-N 2.9Å; A35-T39 PolarHBondContact O-OG1 2.96Å; A35-M60 HydrophobicContact CB-CE 3.17Å; A35-M60 HydrophobicContact CB-CG 4.1Å; A35-M60 HydrophobicContact CB-SD 4.08Å
36	M	85.3	Confident	80.3	Confident	142 Å²	142	72.4 Å²	72.4	70%	0.7	40%	0.399	S	S	*	.	H	α-helix	trans	-63.6	-52.3	179.8	-72.7	-176	109.6	0	0	111.3	A32 A33 T39 F40	A32-M36 WeakPolarHBondContact O-CG 3.24Å; A32-M36 PolarHBondContact O-N 3.41Å; A33-M36 PolarHBondContact O-N 2.88Å; M36-T39 PolarHBondContact O-N 2.81Å; M36-F40 WeakPolarHBondContact O-CB 3.44Å; M36-F40 PolarHBondContact O-N 3.27Å
37	F	81.9	Confident	78.9	Confident	158 Å²	158	75.2 Å²	75.2	69%	0.693	41%	0.411	S	S	*	.	H	α-helix	trans	-69.1	-36.9	179.6	-78.6	-74	0	0	0	113.1	A33 S41	A33-F37 WeakPolarHBondContact O-CD2 3.29Å; A33-F37 PolarHBondContact O-N 3.35Å; F37-S41 WeakPolarHBondContact O-CB 3.11Å; F37-S41 PolarHBondContact O-N 3.05Å; F37-S41 PolarHBondContact O-OG 2.85Å
38	G	77.6	Confident	77.7	Confident	4 Å²	4	83.1 Å²	83.1	4%	0.041	44%	0.439	C	S	.	.	H	α-helix	trans	-66.4	-44.1	175.2	0	0	0	0	0	112	G34 S41 C42	G34-G38 VanDerWaalsContact O-CA 3.25Å; G34-G38 WeakPolarHBondContact O-CA 3.33Å; G34-G38 PolarHBondContact O-N 2.78Å; G38-S41 PolarHBondContact O-N 2.94Å; G38-C42 WeakPolarHBondContact O-CB 3.43Å; G38-C42 PolarHBondContact O-N 3.34Å; G38-C42 PolarHBondContact O-SG 2.99Å
39	T	75.6	Confident	76.6	Confident	53 Å²	53	82.8 Å²	82.8	33%	0.325	44%	0.442	S	S	.	.	H	α-helix	trans	-67.7	-42.5	178.5	-55.6	0	0	0	0	111	A35 M36 C42 L43	A35-T39 WeakPolarHBondContact O-CA 3.41Å; A35-T39 WeakPolarHBondContact O-CB 3.5Å; A35-T39 PolarHBondContact O-N 2.9Å; A35-T39 PolarHBondContact O-OG1 2.96Å; M36-T39 PolarHBondContact O-N 2.81Å; T39-C42 PolarHBondContact O-N 3.49Å; T39-L43 HydrophobicContact CG2-CD1 3.85Å; T39-L43 VanDerWaalsContact O-CB 3.3Å; T39-L43 WeakPolarHBondContact O-CB 3.39Å; T39-L43 WeakPolarHBondContact O-CG 3.45Å; T39-L43 PolarHBondContact O-N 3.07Å
40	F	78.3	Confident	75.5	Confident	153 Å²	153	89.2 Å²	89.2	67%	0.671	46%	0.456	S	S	*	.	H	α-helix	trans	-62.5	-43.4	175.2	-117.6	-89.8	0	0	0	112.4	M36 R44	M36-F40 WeakPolarHBondContact O-CB 3.44Å; M36-F40 PolarHBondContact O-N 3.27Å; F40-R44 WeakPolarHBondContact O-CB 3.21Å; F40-R44 VanDerWaalsContact O-CG 3.26Å; F40-R44 WeakPolarHBondContact O-CG 3.45Å; F40-R44 PolarHBondContact O-N 3.22Å
41	S	71	Confident	74.4	Confident	64 Å²	64	96.7 Å²	96.7	45%	0.448	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-42.4	177.7	-62.5	0	0	0	0	111.6	F37 G38 R44 I45	F37-S41 WeakPolarHBondContact O-CB 3.11Å; F37-S41 PolarHBondContact O-N 3.05Å; F37-S41 PolarHBondContact O-OG 2.85Å; G38-S41 PolarHBondContact O-N 2.94Å; S41-R44 PolarHBondContact O-N 3.13Å; S41-I45 WeakPolarHBondContact O-CD1 3.45Å; S41-I45 VanDerWaalsContact O-CG1 3.25Å; S41-I45 WeakPolarHBondContact O-CG1 3.46Å; S41-I45 PolarHBondContact O-N 3.23Å; S41-I45 VanDerWaalsContact O-N 3.08Å
42	C	69.6	Low	73.5	Confident	8 Å²	8	95.5 Å²	95.5	5%	0.054	49%	0.485	C	S	.	.	H	α-helix	trans	-71.4	-36.7	-179.4	-64.7	0	0	0	0	112.9	G38 T39 R44 I45 G46 M47 L52 I56	G38-C42 WeakPolarHBondContact O-CB 3.43Å; G38-C42 PolarHBondContact O-N 3.34Å; G38-C42 PolarHBondContact O-SG 2.99Å; T39-C42 PolarHBondContact O-N 3.49Å; C42-R44 VanDerWaalsContact C-N 3.33Å; C42-I45 PolarHBondContact O-N 2.89Å; C42-G46 PolarHBondContact O-N 3.48Å; C42-M47 HydrophobicContact CB-CE 3.74Å; C42-M47 PolarHBondContact O-N 3.48Å; C42-M47 WeakPolarHBondContact SG-CE 3.46Å; C42-L52 HydrophobicContact CB-CB 4.46Å; C42-L52 HydrophobicContact CB-CD1 3.36Å; C42-L52 HydrophobicContact CB-CG 3.56Å; C42-I56 HydrophobicContact CB-CD1 4.16Å; C42-I56 HydrophobicContact CB-CG1 4.21Å; C42-I56 VanDerWaalsContact SG-CG1 3.56Å
43	L	71.4	Confident	72.7	Confident	127 Å²	127	100 Å²	100	67%	0.665	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-38.3	171.4	-86.7	162.5	0	0	0	111.8	T39 G46	T39-L43 HydrophobicContact CG2-CD1 3.85Å; T39-L43 VanDerWaalsContact O-CB 3.3Å; T39-L43 WeakPolarHBondContact O-CB 3.39Å; T39-L43 WeakPolarHBondContact O-CG 3.45Å; T39-L43 PolarHBondContact O-N 3.07Å; L43-G46 PolarHBondContact O-N 2.91Å
44	R	68.8	Low	72.2	Confident	219 Å²	219	100.2 Å²	100.2	83%	0.826	50%	0.504	S	S	*	.	H	α-helix	trans	-69.7	-32.4	178	-77.9	-78.2	-83.2	-175.6	-5.6	113.5	F40 S41 C42 G46	F40-R44 WeakPolarHBondContact O-CB 3.21Å; F40-R44 VanDerWaalsContact O-CG 3.26Å; F40-R44 WeakPolarHBondContact O-CG 3.45Å; F40-R44 PolarHBondContact O-N 3.22Å; S41-R44 PolarHBondContact O-N 3.13Å; C42-R44 VanDerWaalsContact C-N 3.33Å; R44-G46 VanDerWaalsContact C-N 3.3Å
45	I	69.3	Low	71.9	Confident	123 Å²	123	101.1 Å²	101.1	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-84.7	-6.6	-179.8	-61.3	163.8	0	0	0	111.5	S41 C42 M47	S41-I45 WeakPolarHBondContact O-CD1 3.45Å; S41-I45 VanDerWaalsContact O-CG1 3.25Å; S41-I45 WeakPolarHBondContact O-CG1 3.46Å; S41-I45 PolarHBondContact O-N 3.23Å; S41-I45 VanDerWaalsContact O-N 3.08Å; C42-I45 PolarHBondContact O-N 2.89Å; I45-M47 HydrophobicContact CB-CG 4.15Å; I45-M47 HydrophobicContact CG2-CG 3.74Å; I45-M47 HydrophobicContact CG2-SD 4.27Å; I45-M47 PolarHBondContact O-N 2.88Å
46	G	63.6	Low	71.6	Confident	58 Å²	58	100.7 Å²	100.7	60%	0.598	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	17.9	178.4	0	0	0	0	0	113.7	C42 L43 R44 R48	C42-G46 PolarHBondContact O-N 3.48Å; L43-G46 PolarHBondContact O-N 2.91Å; R44-G46 VanDerWaalsContact C-N 3.3Å; G46-R48 PolarHBondContact O-N 2.9Å
47	M	60.1	Low	71.5	Confident	61 Å²	61	95.6 Å²	95.6	30%	0.3	49%	0.492	S	S	.	.			trans	-65.3	127.3	179.5	-64.6	-166.6	-68.8	0	0	109.7	C42 I45 L52	C42-M47 HydrophobicContact CB-CE 3.74Å; C42-M47 PolarHBondContact O-N 3.48Å; C42-M47 WeakPolarHBondContact SG-CE 3.46Å; I45-M47 HydrophobicContact CB-CG 4.15Å; I45-M47 HydrophobicContact CG2-CG 3.74Å; I45-M47 HydrophobicContact CG2-SD 4.27Å; I45-M47 PolarHBondContact O-N 2.88Å; M47-L52 HydrophobicContact CB-CB 4.2Å; M47-L52 HydrophobicContact CB-CD1 4.41Å; M47-L52 WeakPolarHBondContact O-CD1 3.32Å
48	R	61.6	Low	71.5	Confident	237 Å²	237	95.8 Å²	95.8	89%	0.894	49%	0.492	S	S	*	.			trans	-102.7	129.6	-176.6	-87.9	179	149.1	169	-5.6	111.6	G46 R50	G46-R48 PolarHBondContact O-N 2.9Å; R48-R50 PolarHBondContact O-N 3.37Å
49	G	65.9	Low	71.8	Confident	54 Å²	54	98.4 Å²	98.4	56%	0.557	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-110.1	163.4	0	0	0	0	0	115	L52 M53	G49-L52 PolarHBondContact O-N 3.4Å; G49-M53 PolarHBondContact O-N 2.98Å; G49-M53 VanDerWaalsContact O-N 3.14Å
50	R	65.8	Low	72.2	Confident	232 Å²	232	98.2 Å²	98.2	88%	0.875	50%	0.504	S	S	*	.	H	α-helix	trans	-75.9	-33.5	-162.6	-160.3	166.6	68.1	169.3	2.1	113.9	R48 G54	R48-R50 PolarHBondContact O-N 3.37Å; R50-G54 PolarHBondContact O-N 2.81Å
51	E	66.6	Low	72.6	Confident	156 Å²	156	97.8 Å²	97.8	73%	0.729	51%	0.506	S	S	*	.	H	α-helix	trans	-72.1	-33.5	173.1	-93	170.7	82.2	0	0	112.4	G54 G55	E51-G54 PolarHBondContact O-N 2.93Å; E51-G55 PolarHBondContact O-N 2.83Å
52	L	68.5	Low	73.3	Confident	40 Å²	40	101.6 Å²	101.6	21%	0.209	52%	0.517	C	S	.	.	H	α-helix	trans	-65.2	-48.9	175.3	-178.3	137.5	0	0	0	110.6	C42 M47 G49 G54 G55 I56	C42-L52 HydrophobicContact CB-CB 4.46Å; C42-L52 HydrophobicContact CB-CD1 3.36Å; C42-L52 HydrophobicContact CB-CG 3.56Å; M47-L52 HydrophobicContact CB-CB 4.2Å; M47-L52 HydrophobicContact CB-CD1 4.41Å; M47-L52 WeakPolarHBondContact O-CD1 3.32Å; G49-L52 PolarHBondContact O-N 3.4Å; L52-G54 VanDerWaalsContact C-N 3.35Å; L52-G54 PolarHBondContact O-N 3.07Å; L52-G55 PolarHBondContact O-N 3.41Å; L52-I56 HydrophobicContact CD2-CD1 3.44Å; L52-I56 VanDerWaalsContact CD2-CD1 3.44Å; L52-I56 HydrophobicContact CG-CD1 3.69Å; L52-I56 WeakPolarHBondContact O-CB 3.31Å; L52-I56 WeakPolarHBondContact O-CD1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.22Å; L52-I56 PolarHBondContact O-N 3.44Å
53	M	71	Confident	74.2	Confident	150 Å²	150	102 Å²	102	74%	0.739	52%	0.52	S	S	*	.	H	α-helix	trans	-67.6	-35.1	178.7	-157.4	179.8	-80	0	0	112.2	G49 G57	G49-M53 PolarHBondContact O-N 2.98Å; G49-M53 VanDerWaalsContact O-N 3.14Å; M53-G57 PolarHBondContact O-N 3.34Å
54	G	76.6	Confident	75	Confident	38 Å²	38	96 Å²	96	39%	0.392	49%	0.488	S	S	.	.	H	α-helix	trans	-70.5	-38.7	174.9	0	0	0	0	0	113.9	R50 E51 L52 K58	R50-G54 PolarHBondContact O-N 2.81Å; E51-G54 PolarHBondContact O-N 2.93Å; L52-G54 VanDerWaalsContact C-N 3.35Å; L52-G54 PolarHBondContact O-N 3.07Å; G54-K58 PolarHBondContact O-N 3.5Å; G54-K58 VanDerWaalsContact O-N 3.07Å
55	G	77.8	Confident	76	Confident	25 Å²	25	86.8 Å²	86.8	26%	0.258	46%	0.461	S	S	.	.	H	α-helix	trans	-68.2	-49.6	175.1	0	0	0	0	0	111.8	E51 L52 G57 K58 T59	E51-G55 PolarHBondContact O-N 2.83Å; L52-G55 PolarHBondContact O-N 3.41Å; G55-G57 VanDerWaalsContact C-N 3.33Å; G55-G57 PolarHBondContact O-N 2.84Å; G55-K58 PolarHBondContact O-N 2.86Å; G55-T59 PolarHBondContact O-N 2.93Å; G55-T59 PolarHBondContact O-OG1 3.25Å; G55-T59 VanDerWaalsContact O-OG1 3.06Å
56	I	78.3	Confident	76.9	Confident	13 Å²	13	84.5 Å²	84.5	7%	0.067	45%	0.453	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175.8	-63.6	167.2	0	0	0	110.4	C42 L52 K58 T59 M60	C42-I56 HydrophobicContact CB-CD1 4.16Å; C42-I56 HydrophobicContact CB-CG1 4.21Å; C42-I56 VanDerWaalsContact SG-CG1 3.56Å; L52-I56 HydrophobicContact CD2-CD1 3.44Å; L52-I56 VanDerWaalsContact CD2-CD1 3.44Å; L52-I56 HydrophobicContact CG-CD1 3.69Å; L52-I56 WeakPolarHBondContact O-CB 3.31Å; L52-I56 WeakPolarHBondContact O-CD1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.22Å; L52-I56 PolarHBondContact O-N 3.44Å; I56-K58 PolarHBondContact O-N 2.96Å; I56-T59 PolarHBondContact O-N 2.64Å; I56-M60 HydrophobicContact CG2-CE 3.29Å; I56-M60 HydrophobicContact CG2-CG 4Å; I56-M60 HydrophobicContact CG2-SD 4.14Å; I56-M60 VanDerWaalsContact O-CB 3.26Å; I56-M60 WeakPolarHBondContact O-CB 3.14Å; I56-M60 VanDerWaalsContact O-CG 3.29Å; I56-M60 WeakPolarHBondContact O-CG 3.31Å; I56-M60 PolarHBondContact O-N 2.84Å
57	G	81.7	Confident	78.1	Confident	35 Å²	35	87.1 Å²	87.1	36%	0.361	45%	0.448	S	S	.	.	H	α-helix	trans	-59.5	-43.2	177	0	0	0	0	0	112.8	M53 G55 M61	M53-G57 PolarHBondContact O-N 3.34Å; G55-G57 VanDerWaalsContact C-N 3.33Å; G55-G57 PolarHBondContact O-N 2.84Å; G57-M61 VanDerWaalsContact O-CB 3.31Å; G57-M61 WeakPolarHBondContact O-CB 3.25Å; G57-M61 PolarHBondContact O-N 3.34Å
58	K	82.2	Confident	79.4	Confident	161 Å²	161	84.2 Å²	84.2	70%	0.7	43%	0.434	S	S	*	.	H	α-helix	trans	-63.1	-47.1	173	-82.2	177.6	-170.6	162.5	0	112	G54 G55 I56 M60 M61 Q62	G54-K58 PolarHBondContact O-N 3.5Å; G54-K58 VanDerWaalsContact O-N 3.07Å; G55-K58 PolarHBondContact O-N 2.86Å; I56-K58 PolarHBondContact O-N 2.96Å; K58-M60 PolarHBondContact O-N 3.4Å; K58-M61 PolarHBondContact O-N 2.97Å; K58-Q62 WeakPolarHBondContact O-CB 3.47Å; K58-Q62 PolarHBondContact O-N 3.42Å
59	T	83.5	Confident	80.7	Confident	60 Å²	60	76.1 Å²	76.1	37%	0.368	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-40.9	179.9	-55	0	0	0	0	111.6	G55 I56 S63	G55-T59 PolarHBondContact O-N 2.93Å; G55-T59 PolarHBondContact O-OG1 3.25Å; G55-T59 VanDerWaalsContact O-OG1 3.06Å; I56-T59 PolarHBondContact O-N 2.64Å; T59-S63 VanDerWaalsContact O-CB 3.24Å; T59-S63 WeakPolarHBondContact O-CB 3.25Å; T59-S63 PolarHBondContact O-N 3.09Å; T59-S63 PolarHBondContact O-OG 3.09Å
60	M	84.3	Confident	81.8	Confident	48 Å²	48	81.4 Å²	81.4	24%	0.236	42%	0.419	C	S	.	.	H	α-helix	trans	-62.2	-47.5	174.3	-79.9	-170.9	-163.9	0	0	111.4	M31 A35 I56 K58 S63 G64	M31-M60 HydrophobicContact SD-CB 3.74Å; A35-M60 HydrophobicContact CB-CE 3.17Å; A35-M60 HydrophobicContact CB-CG 4.1Å; A35-M60 HydrophobicContact CB-SD 4.08Å; I56-M60 HydrophobicContact CG2-CE 3.29Å; I56-M60 HydrophobicContact CG2-CG 4Å; I56-M60 HydrophobicContact CG2-SD 4.14Å; I56-M60 VanDerWaalsContact O-CB 3.26Å; I56-M60 WeakPolarHBondContact O-CB 3.14Å; I56-M60 VanDerWaalsContact O-CG 3.29Å; I56-M60 WeakPolarHBondContact O-CG 3.31Å; I56-M60 PolarHBondContact O-N 2.84Å; K58-M60 PolarHBondContact O-N 3.4Å; M60-S63 PolarHBondContact O-OG 3.36Å; M60-G64 WeakPolarHBondContact O-CA 3.47Å; M60-G64 PolarHBondContact O-N 2.91Å
61	M	86.2	Confident	82.7	Confident	145 Å²	145	75 Å²	75	71%	0.714	40%	0.4	S	S	*	.	H	α-helix	trans	-67.5	-39.7	-179.6	-171	171	-175.1	0	0	112	G57 K58 G65	G57-M61 VanDerWaalsContact O-CB 3.31Å; G57-M61 WeakPolarHBondContact O-CB 3.25Å; G57-M61 PolarHBondContact O-N 3.34Å; K58-M61 PolarHBondContact O-N 2.97Å; M61-G65 PolarHBondContact O-N 2.84Å
62	Q	87.6	Confident	83.6	Confident	144 Å²	144	68 Å²	68	67%	0.673	37%	0.369	S	S	*	.	H	α-helix	trans	-66.2	-49.7	177.2	-175.6	175.5	4.1	0	0	111.4	K58 T66	K58-Q62 WeakPolarHBondContact O-CB 3.47Å; K58-Q62 PolarHBondContact O-N 3.42Å; Q62-T66 PolarHBondContact O-N 2.87Å; Q62-T66 VanDerWaalsContact O-N 3.13Å; Q62-T66 PolarHBondContact O-OG1 3.36Å; Q62-T66 VanDerWaalsContact O-OG1 3.05Å
63	S	86.9	Confident	84.5	Confident	17 Å²	17	70.6 Å²	70.6	12%	0.119	38%	0.382	C	S	.	.	H	α-helix	trans	-67.1	-46.7	179.3	56.1	0	0	0	0	112	G30 G34 T59 M60 G65 T66 F67	G30-S63 PolarHBondContact O-OG 2.89Å; G30-S63 VanDerWaalsContact O-OG 3.11Å; G34-S63 WeakPolarHBondContact CA-OG 3.2Å; T59-S63 VanDerWaalsContact O-CB 3.24Å; T59-S63 WeakPolarHBondContact O-CB 3.25Å; T59-S63 PolarHBondContact O-N 3.09Å; T59-S63 PolarHBondContact O-OG 3.09Å; M60-S63 PolarHBondContact O-OG 3.36Å; S63-G65 VanDerWaalsContact C-N 3.32Å; S63-G65 PolarHBondContact O-N 3.34Å; S63-T66 PolarHBondContact O-N 3.01Å; S63-T66 PolarHBondContact O-OG1 2.85Å; S63-F67 WeakPolarHBondContact O-CB 3.49Å; S63-F67 VanDerWaalsContact O-CD2 3.23Å; S63-F67 WeakPolarHBondContact O-CD2 3.43Å; S63-F67 PolarHBondContact O-N 2.78Å
64	G	88.4	Confident	85.1	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-56.5	-44.1	175.1	0	0	0	0	0	112.4	F27 M60 G68	F27-G64 WeakPolarHBondContact CD2-O 3.16Å; M60-G64 WeakPolarHBondContact O-CA 3.47Å; M60-G64 PolarHBondContact O-N 2.91Å; G64-G68 PolarHBondContact O-N 2.93Å
65	G	89.3	Confident	85.2	Confident	25 Å²	25	66.9 Å²	66.9	26%	0.258	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-47.7	175.7	0	0	0	0	0	112.6	M61 S63 T69	M61-G65 PolarHBondContact O-N 2.84Å; S63-G65 VanDerWaalsContact C-N 3.32Å; S63-G65 PolarHBondContact O-N 3.34Å; G65-T69 VanDerWaalsContact O-CB 3.25Å; G65-T69 WeakPolarHBondContact O-CB 3.36Å; G65-T69 PolarHBondContact O-N 3.28Å; G65-T69 PolarHBondContact O-OG1 2.96Å
66	T	89	Confident	85.2	Confident	75 Å²	75	67.4 Å²	67.4	46%	0.46	37%	0.367	S	S	.	.	H	α-helix	trans	-69.4	-46.2	-179.8	44.3	0	0	0	0	113.1	Q62 S63 T69 F70	Q62-T66 PolarHBondContact O-N 2.87Å; Q62-T66 VanDerWaalsContact O-N 3.13Å; Q62-T66 PolarHBondContact O-OG1 3.36Å; Q62-T66 VanDerWaalsContact O-OG1 3.05Å; S63-T66 PolarHBondContact O-N 3.01Å; S63-T66 PolarHBondContact O-OG1 2.85Å; T66-T69 PolarHBondContact O-N 3.49Å; T66-F70 WeakPolarHBondContact O-CB 3.24Å; T66-F70 PolarHBondContact O-N 3.48Å
67	F	88	Confident	85.3	Confident	114 Å²	114	73.3 Å²	73.3	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-68.4	-39.8	-179	-81.5	-72.4	0	0	0	111.9	G26 S63 M71	G26-F67 WeakPolarHBondContact O-CB 3.29Å; S63-F67 WeakPolarHBondContact O-CB 3.49Å; S63-F67 VanDerWaalsContact O-CD2 3.23Å; S63-F67 WeakPolarHBondContact O-CD2 3.43Å; S63-F67 PolarHBondContact O-N 2.78Å; F67-M71 PolarHBondContact O-N 2.88Å
68	G	88.8	Confident	84.6	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-60.4	-47.6	172.1	0	0	0	0	0	111.8	F23 G64 M71 A72	F23-G68 VanDerWaalsContact CD2-C 3.4Å; F23-G68 WeakPolarHBondContact CD2-O 3.13Å; G64-G68 PolarHBondContact O-N 2.93Å; G68-M71 PolarHBondContact O-N 2.98Å; G68-A72 WeakPolarHBondContact O-CB 3.35Å; G68-A72 PolarHBondContact O-N 3.02Å
69	T	88.8	Confident	83.6	Confident	66 Å²	66	77.6 Å²	77.6	41%	0.405	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-41.1	-179.5	-53.4	0	0	0	0	112.2	G65 T66 A72 I73	G65-T69 VanDerWaalsContact O-CB 3.25Å; G65-T69 WeakPolarHBondContact O-CB 3.36Å; G65-T69 PolarHBondContact O-N 3.28Å; G65-T69 PolarHBondContact O-OG1 2.96Å; T66-T69 PolarHBondContact O-N 3.49Å; T69-A72 PolarHBondContact O-N 3.29Å; T69-I73 HydrophobicContact CG2-CD1 3.81Å; T69-I73 HydrophobicContact CG2-CG1 4.41Å; T69-I73 WeakPolarHBondContact O-CB 3.34Å; T69-I73 VanDerWaalsContact O-CG1 3.25Å; T69-I73 WeakPolarHBondContact O-CG1 3.48Å; T69-I73 PolarHBondContact O-N 3.43Å
70	F	88.7	Confident	83.6	Confident	166 Å²	166	78.5 Å²	78.5	73%	0.728	41%	0.412	S	S	*	.	H	α-helix	trans	-63	-46.1	176.4	-103.8	-80.7	0	0	0	112.5	T66 A72 I73 G74	T66-F70 WeakPolarHBondContact O-CB 3.24Å; T66-F70 PolarHBondContact O-N 3.48Å; F70-A72 VanDerWaalsContact C-N 3.35Å; F70-I73 PolarHBondContact O-N 3.41Å; F70-G74 PolarHBondContact O-N 2.83Å
71	M	85	Confident	83.6	Confident	97 Å²	97	80.1 Å²	80.1	48%	0.478	42%	0.422	S	S	.	.	H	α-helix	trans	-68	-35.5	176.1	-100.7	-147.3	170.6	0	0	112.2	F67 G68 G74 M75	F67-M71 PolarHBondContact O-N 2.88Å; G68-M71 PolarHBondContact O-N 2.98Å; M71-G74 PolarHBondContact O-N 2.87Å; M71-M75 WeakPolarHBondContact O-CB 3.35Å; M71-M75 VanDerWaalsContact O-CG 3.29Å; M71-M75 WeakPolarHBondContact O-CG 3.4Å; M71-M75 PolarHBondContact O-N 3.49Å
72	A	85.6	Confident	83.5	Confident	10 Å²	10	76.4 Å²	76.4	8%	0.083	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175.4	0	0	0	0	0	111.8	V19 F23 G68 T69 F70 M75 G76	V19-A72 HydrophobicContact CG1-CB 3.99Å; F23-A72 HydrophobicContact CB-CB 3.81Å; F23-A72 HydrophobicContact CD2-CB 4.03Å; F23-A72 HydrophobicContact CG-CB 4.43Å; G68-A72 WeakPolarHBondContact O-CB 3.35Å; G68-A72 PolarHBondContact O-N 3.02Å; T69-A72 PolarHBondContact O-N 3.29Å; F70-A72 VanDerWaalsContact C-N 3.35Å; A72-M75 PolarHBondContact O-N 3.38Å; A72-G76 PolarHBondContact O-N 3.05Å
73	I	86.9	Confident	83.2	Confident	93 Å²	93	72.5 Å²	72.5	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-65.3	-44.3	175	-67.6	165.7	0	0	0	110.3	T69 F70 M75 G76 I77	T69-I73 HydrophobicContact CG2-CD1 3.81Å; T69-I73 HydrophobicContact CG2-CG1 4.41Å; T69-I73 WeakPolarHBondContact O-CB 3.34Å; T69-I73 VanDerWaalsContact O-CG1 3.25Å; T69-I73 WeakPolarHBondContact O-CG1 3.48Å; T69-I73 PolarHBondContact O-N 3.43Å; F70-I73 PolarHBondContact O-N 3.41Å; I73-M75 VanDerWaalsContact C-N 3.29Å; I73-M75 PolarHBondContact O-N 2.93Å; I73-G76 PolarHBondContact O-N 3.42Å; I73-G76 VanDerWaalsContact O-N 3.09Å; I73-I77 HydrophobicContact CG2-CD1 3.52Å; I73-I77 HydrophobicContact CG2-CG1 4.11Å; I73-I77 VanDerWaalsContact O-CG1 3.22Å; I73-I77 WeakPolarHBondContact O-CG1 3.08Å; I73-I77 PolarHBondContact O-N 3.19Å
74	G	83.6	Confident	83	Confident	34 Å²	34	75.9 Å²	75.9	35%	0.351	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-40.4	177	0	0	0	0	0	112.6	F70 M71 R78	F70-G74 PolarHBondContact O-N 2.83Å; M71-G74 PolarHBondContact O-N 2.87Å; G74-R78 WeakPolarHBondContact O-CB 3.45Å; G74-R78 PolarHBondContact O-N 2.67Å
75	M	78.3	Confident	82.6	Confident	77 Å²	77	81 Å²	81	38%	0.379	43%	0.434	S	S	.	.	H	α-helix	trans	-72.9	-37	173.9	-66.6	-59.8	149.1	0	0	112.1	M71 A72 I73 R78 C79	M71-M75 WeakPolarHBondContact O-CB 3.35Å; M71-M75 VanDerWaalsContact O-CG 3.29Å; M71-M75 WeakPolarHBondContact O-CG 3.4Å; M71-M75 PolarHBondContact O-N 3.49Å; A72-M75 PolarHBondContact O-N 3.38Å; I73-M75 VanDerWaalsContact C-N 3.29Å; I73-M75 PolarHBondContact O-N 2.93Å; M75-R78 CarbonylContact O-C 3.54Å; M75-R78 VanDerWaalsContact O-C 3.27Å; M75-R78 WeakPolarHBondContact O-CA 3.48Å; M75-R78 PolarHBondContact O-N 2.96Å; M75-R78 VanDerWaalsContact O-N 3.09Å; M75-C79 PolarHBondContact O-N 2.73Å; M75-C79 PolarHBondContact O-SG 3.42Å
76	G	78.2	Confident	82.2	Confident	35 Å²	35	85 Å²	85	36%	0.361	45%	0.446	S	S	.	.	H	α-helix	trans	-65.9	-37.2	177.6	0	0	0	0	0	113.9	A72 I73 R78	A72-G76 PolarHBondContact O-N 3.05Å; I73-G76 PolarHBondContact O-N 3.42Å; I73-G76 VanDerWaalsContact O-N 3.09Å; G76-R78 VanDerWaalsContact C-N 3.26Å
77	I	81.2	Confident	81.6	Confident	137 Å²	137	85.8 Å²	85.8	70%	0.703	45%	0.445	S	S	*	.	H	α-helix	trans	-71.7	-25.8	172.2	-58	162.4	0	0	0	110.7	I73	I73-I77 HydrophobicContact CG2-CD1 3.52Å; I73-I77 HydrophobicContact CG2-CG1 4.11Å; I73-I77 VanDerWaalsContact O-CG1 3.22Å; I73-I77 WeakPolarHBondContact O-CG1 3.08Å; I73-I77 PolarHBondContact O-N 3.19Å
78	R	65.6	Low	81.1	Confident	204 Å²	204	83.4 Å²	83.4	77%	0.77	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	12.9	-178	-150.1	118.2	-176.8	115.5	-3	113.8	R18 G74 M75 G76	R18-R78 PolarHBondContact NH1-O 2.88Å; G74-R78 WeakPolarHBondContact O-CB 3.45Å; G74-R78 PolarHBondContact O-N 2.67Å; M75-R78 CarbonylContact O-C 3.54Å; M75-R78 VanDerWaalsContact O-C 3.27Å; M75-R78 WeakPolarHBondContact O-CA 3.48Å; M75-R78 PolarHBondContact O-N 2.96Å; M75-R78 VanDerWaalsContact O-N 3.09Å; G76-R78 VanDerWaalsContact C-N 3.26Å
79	C	62.6	Low	80.4	Confident	82 Å²	82	91 Å²	91	55%	0.554	48%	0.481	S	S	*	.			trans	-74.9	0	168.4	-71.9	0	0	0	0	110.6	C15 M75	C15-C79 WeakPolarHBondContact CA-SG 2.93Å; C15-C79 HydrophobicContact CB-CB 3.49Å; C15-C79 VanDerWaalsContact CB-CB 3.49Å; C15-C79 VanDerWaalsContact CB-SG 3.51Å; C15-C79 PolarHBondContact O-SG 3.4Å; C15-C79 VanDerWaalsContact SG-CB 3.54Å; M75-C79 PolarHBondContact O-N 2.73Å; M75-C79 PolarHBondContact O-SG 3.42Å

Retrieved 79 of 79 residues in 48.5 ms (Link to these results)

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