A0A5K4F5U0_SCHMA Loading...

Mediator of RNA polymerase II transcription subunit 31

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A5K4F5U0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 104 aa.

						>A0A5K4F5U0_SCHMA|A0A5K4F5U0
MQSRSRPQNNLKILAQQGWFEKPNFIKYLKYLLYWKDPAYSRYLIYPYCLHLLDLLQHAEFRSALARGQICRMIDDQILLHWQHYMRKRAALIAKHVEETIQPT
					

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(Predicted Aligned Error values between residue pairs)

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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	43.6	Very low	55.9	Low	241 Å²	241	148.6 Å²	148.6	100%	1.187	75%	0.745	S	S	*	*				0	94.3	0	-72.1	171.9	126.5	0	0	109.9
2	Q	50.3	Low	56.5	Low	193 Å²	193	144.8 Å²	144.8	90%	0.902	72%	0.72	S	S	*	*			trans	-144.8	96.6	151.9	-69.4	-164.9	20.3	0	0	106.4	R4	Q2-R4 PolarHBondContact O-N 3.41Å
3	S	60.4	Low	57.2	Low	117 Å²	117	139.2 Å²	139.2	82%	0.818	69%	0.693	S	S	*	*			trans	-55.9	105.4	168.9	41.4	0	0	0	0	107	S5	S3-S5 PolarHBondContact O-N 3.48Å
4	R	51.3	Low	57.4	Low	238 Å²	238	134.3 Å²	134.3	90%	0.898	67%	0.67	S	S	*	*			trans	-62.7	89.7	160.3	-74.5	-171.1	-175.3	-167.2	2.3	105.2	Q2 R6	Q2-R4 PolarHBondContact O-N 3.41Å; R4-R6 PolarHBondContact O-N 3.26Å
5	S	56.9	Low	57.5	Low	105 Å²	105	126.5 Å²	126.5	73%	0.734	63%	0.634	S	S	*	*			trans	-50.6	97	164.8	-166.8	0	0	0	0	104.7	S3 P7	S3-S5 PolarHBondContact O-N 3.48Å; S5-P7 WeakPolarHBondContact O-CD 3.38Å; S5-P7 VanDerWaalsContact O-N 3.14Å
6	R	56.2	Low	57.8	Low	214 Å²	214	129.2 Å²	129.2	81%	0.808	64%	0.644	S	S	*	*			trans	-58.8	122.2	178.4	-68.8	-174.1	175.5	-171.6	-1.2	103.7	R4 Q8	R4-R6 PolarHBondContact O-N 3.26Å; R6-Q8 VanDerWaalsContact C-N 3.25Å; R6-Q8 PolarHBondContact O-N 2.97Å
7	P	55.4	Low	58.3	Low	116 Å²	116	129.3 Å²	129.3	75%	0.753	64%	0.642	S	S	*	*			trans	-58.9	100.2	178.6	21.6	-29.8	0	0	0	106.5	S5 N9	S5-P7 WeakPolarHBondContact O-CD 3.38Å; S5-P7 VanDerWaalsContact O-N 3.14Å; P7-N9 PolarHBondContact O-N 3.26Å
8	Q	56	Low	58.6	Low	146 Å²	146	124.1 Å²	124.1	68%	0.682	63%	0.627	S	S	*	*			trans	-64.2	111.2	-176.8	-76.8	173.2	4.1	0	0	105.1	R6 N10 I13	R6-Q8 VanDerWaalsContact C-N 3.25Å; R6-Q8 PolarHBondContact O-N 2.97Å; Q8-N10 PolarHBondContact O-N 3.13Å; Q8-I13 HydrophobicContact CB-CD1 4.19Å; Q8-I13 WeakPolarHBondContact O-CD1 3.46Å
9	N	59.9	Low	58.8	Low	63 Å²	63	123.5 Å²	123.5	34%	0.337	62%	0.616	S	S	.	*			trans	-11.7	96.4	175.3	-166.7	-5.4	0	0	0	112.4	P7 L11 K12	P7-N9 PolarHBondContact O-N 3.26Å; N9-L11 PolarHBondContact O-N 2.91Å; N9-K12 HydrophobicContact CB-CD 4.45Å; N9-K12 HydrophobicContact CB-CG 4.33Å; N9-K12 PolarHBondContact O-N 3.26Å
10	N	63.6	Low	59	Low	111 Å²	111	118.2 Å²	118.2	59%	0.594	59%	0.589	S	S	*	*	H	α-helix	trans	-52.5	-30	-170.7	-67.3	-33.5	0	0	0	112.1	Q8 K12 I13 L14	Q8-N10 PolarHBondContact O-N 3.13Å; N10-K12 VanDerWaalsContact C-N 3.35Å; N10-K12 PolarHBondContact O-N 3.49Å; N10-I13 PolarHBondContact O-N 2.89Å; N10-L14 VanDerWaalsContact O-CG 3.25Å; N10-L14 WeakPolarHBondContact O-CG 3.42Å; N10-L14 PolarHBondContact O-N 3.4Å
11	L	61.7	Low	59.5	Low	91 Å²	91	119.4 Å²	119.4	48%	0.476	59%	0.593	S	S	.	*	H	α-helix	trans	-62.4	-37.2	177	-62.2	175.6	0	0	0	113.1	N9 A15	N9-L11 PolarHBondContact O-N 2.91Å; L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.18Å
12	K	62.5	Low	61.1	Low	103 Å²	103	112.6 Å²	112.6	45%	0.448	56%	0.557	S	S	.	*	H	α-helix	trans	-70.4	-40.2	177.6	-70.6	-171.2	176.8	-178	0	111.7	N9 N10 A15 Q16	N9-K12 HydrophobicContact CB-CD 4.45Å; N9-K12 HydrophobicContact CB-CG 4.33Å; N9-K12 PolarHBondContact O-N 3.26Å; N10-K12 VanDerWaalsContact C-N 3.35Å; N10-K12 PolarHBondContact O-N 3.49Å; K12-A15 PolarHBondContact O-N 3.07Å; K12-Q16 WeakPolarHBondContact O-CG 3.18Å; K12-Q16 PolarHBondContact O-N 3.44Å
13	I	65.9	Low	62.6	Low	72 Å²	72	107.7 Å²	107.7	37%	0.369	54%	0.542	S	S	.	.	H	α-helix	trans	-63.8	-45.8	177.6	-61.1	174.8	0	0	0	109.8	Q8 N10 A15 Q16 Q17	Q8-I13 HydrophobicContact CB-CD1 4.19Å; Q8-I13 WeakPolarHBondContact O-CD1 3.46Å; N10-I13 PolarHBondContact O-N 2.89Å; I13-A15 VanDerWaalsContact C-N 3.27Å; I13-A15 PolarHBondContact O-N 3.41Å; I13-Q16 PolarHBondContact O-N 3.15Å; I13-Q17 HydrophobicContact CG2-CG 4.34Å; I13-Q17 WeakPolarHBondContact O-CB 3.29Å; I13-Q17 WeakPolarHBondContact O-CG 3.37Å; I13-Q17 PolarHBondContact O-N 3.35Å
14	L	59.6	Low	63.7	Low	70 Å²	70	108 Å²	108	37%	0.366	53%	0.534	S	S	.	.	H	α-helix	trans	-62.2	-35.6	177.4	-68	170	0	0	0	112.4	N10 W19 F20	N10-L14 VanDerWaalsContact O-CG 3.25Å; N10-L14 WeakPolarHBondContact O-CG 3.42Å; N10-L14 PolarHBondContact O-N 3.4Å; L14-W19 PolarHBondContact O-N 3.28Å; L14-F20 HydrophobicContact CB-CE2 4.11Å; L14-F20 HydrophobicContact CB-CZ 4.13Å
15	A	60.1	Low	65.3	Low	17 Å²	17	99 Å²	99	14%	0.14	50%	0.502	C	S	.	.	H	α-helix	trans	-67.8	-48.9	176.2	0	0	0	0	0	112.5	L11 K12 I13 Q17 G18 F20	L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.18Å; K12-A15 PolarHBondContact O-N 3.07Å; I13-A15 VanDerWaalsContact C-N 3.27Å; I13-A15 PolarHBondContact O-N 3.41Å; A15-Q17 PolarHBondContact O-N 3.45Å; A15-G18 PolarHBondContact O-N 3.15Å; A15-G18 VanDerWaalsContact O-N 3.07Å; A15-F20 VanDerWaalsContact CA-CE2 3.47Å; A15-F20 HydrophobicContact CB-CD2 4.06Å; A15-F20 HydrophobicContact CB-CE2 3.72Å
16	Q	61.1	Low	66.7	Low	170 Å²	170	96 Å²	96	79%	0.794	48%	0.477	S	S	*	.	H	α-helix	trans	-62.4	-28.4	178	-73.1	178.3	-24.3	0	0	112.5	K12 I13 G18	K12-Q16 WeakPolarHBondContact O-CG 3.18Å; K12-Q16 PolarHBondContact O-N 3.44Å; I13-Q16 PolarHBondContact O-N 3.15Å; Q16-G18 VanDerWaalsContact C-N 3.3Å; Q16-G18 PolarHBondContact O-N 2.81Å
17	Q	67	Low	68.3	Low	131 Å²	131	92.9 Å²	92.9	61%	0.612	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.1	177.8	-69.3	-86.9	-40.1	0	0	113.8	I13 A15 W19	I13-Q17 HydrophobicContact CG2-CG 4.34Å; I13-Q17 WeakPolarHBondContact O-CB 3.29Å; I13-Q17 WeakPolarHBondContact O-CG 3.37Å; I13-Q17 PolarHBondContact O-N 3.35Å; A15-Q17 PolarHBondContact O-N 3.45Å; Q17-W19 VanDerWaalsContact C-N 3.32Å; Q17-W19 PolarHBondContact O-N 2.96Å
18	G	63.6	Low	69.9	Low	35 Å²	35	93.4 Å²	93.4	36%	0.361	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	18.7	174.9	0	0	0	0	0	115.5	A15 Q16 F20 E21	A15-G18 PolarHBondContact O-N 3.15Å; A15-G18 VanDerWaalsContact O-N 3.07Å; Q16-G18 VanDerWaalsContact C-N 3.3Å; Q16-G18 PolarHBondContact O-N 2.81Å; G18-F20 VanDerWaalsContact C-N 3.27Å; G18-F20 PolarHBondContact O-N 3.31Å; G18-E21 PolarHBondContact O-N 3.33Å
19	W	62.8	Low	71.5	Confident	113 Å²	113	86.7 Å²	86.7	43%	0.428	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-68	-27	-176.7	-72.4	72.4	0	0	0	113.2	L14 Q17 E21 K22 F25	L14-W19 PolarHBondContact O-N 3.28Å; Q17-W19 VanDerWaalsContact C-N 3.32Å; Q17-W19 PolarHBondContact O-N 2.96Å; W19-E21 PolarHBondContact O-N 3.26Å; W19-K22 PolarHBondContact O-N 3.07Å; W19-F25 WeakPolarHBondContact O-CB 3.3Å
20	F	62.1	Low	72.9	Confident	17 Å²	17	89.9 Å²	89.9	8%	0.075	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-69.7	-16.7	-176.8	-65.4	-65.9	0	0	0	114.5	L14 A15 G18 F25 R62	L14-F20 HydrophobicContact CB-CE2 4.11Å; L14-F20 HydrophobicContact CB-CZ 4.13Å; A15-F20 VanDerWaalsContact CA-CE2 3.47Å; A15-F20 HydrophobicContact CB-CD2 4.06Å; A15-F20 HydrophobicContact CB-CE2 3.72Å; G18-F20 VanDerWaalsContact C-N 3.27Å; G18-F20 PolarHBondContact O-N 3.31Å; F20-F25 HydrophobicContact CD1-CD1 4.09Å; F20-F25 AromaticContact CD1-CE1 3.45Å; F20-F25 HydrophobicContact CD1-CE1 3.45Å; F20-F25 VanDerWaalsContact CD1-CE1 3.45Å; F20-F25 HydrophobicContact CD1-CZ 4.18Å; F20-F25 AromaticContact CE1-CE1 3.72Å; F20-F25 HydrophobicContact CE1-CE1 3.72Å; F20-F25 HydrophobicContact CE1-CZ 4Å; F20-R62 PolarHBondContact O-NH1 3.49Å
21	E	69.7	Low	74.3	Confident	145 Å²	145	91.8 Å²	91.8	68%	0.678	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-93.8	-12.8	177.9	-60	-159.1	165.3	0	0	113	G18 W19	G18-E21 PolarHBondContact O-N 3.33Å; W19-E21 PolarHBondContact O-N 3.26Å
22	K	77.5	Confident	75.7	Confident	98 Å²	98	89.2 Å²	89.2	43%	0.426	42%	0.423	S	S	.	.			trans	-67.4	127	-178.6	-65.8	-173.6	179.3	176.7	0	110.1	W19 N24 F25 I26	W19-K22 PolarHBondContact O-N 3.07Å; K22-N24 PolarHBondContact O-N 3.49Å; K22-N24 VanDerWaalsContact O-N 3.13Å; K22-F25 HydrophobicContact CB-CB 4.31Å; K22-F25 WeakPolarHBondContact O-CB 3.17Å; K22-F25 PolarHBondContact O-N 3.48Å; K22-I26 PolarHBondContact O-N 3.04Å
23	P	81	Confident	77.1	Confident	89 Å²	89	86.9 Å²	86.9	58%	0.578	42%	0.415	S	S	*	.	H	α-helix	trans	-60	-30.4	-179.2	22.8	-33.4	0	0	0	112.8	F25 I26 K27	P23-F25 VanDerWaalsContact C-N 3.33Å; P23-F25 PolarHBondContact O-N 3.37Å; P23-I26 PolarHBondContact O-N 3.4Å; P23-K27 PolarHBondContact O-N 3.26Å
24	N	84.1	Confident	78.3	Confident	124 Å²	124	87.4 Å²	87.4	66%	0.663	41%	0.413	S	S	*	.	H	α-helix	trans	-64	-37.5	174.4	-66.3	-12.4	0	0	0	112.2	K22 K27 Y28	K22-N24 PolarHBondContact O-N 3.49Å; K22-N24 VanDerWaalsContact O-N 3.13Å; N24-K27 PolarHBondContact O-N 3.45Å; N24-Y28 PolarHBondContact O-N 2.96Å
25	F	84	Confident	79.8	Confident	50 Å²	50	87.6 Å²	87.6	22%	0.219	41%	0.409	C	S	.	.	H	α-helix	trans	-68.9	-39.7	177.4	-171.3	-103.7	0	0	0	111.2	W19 F20 K22 P23 K27 Y28 L29	W19-F25 WeakPolarHBondContact O-CB 3.3Å; F20-F25 HydrophobicContact CD1-CD1 4.09Å; F20-F25 AromaticContact CD1-CE1 3.45Å; F20-F25 HydrophobicContact CD1-CE1 3.45Å; F20-F25 VanDerWaalsContact CD1-CE1 3.45Å; F20-F25 HydrophobicContact CD1-CZ 4.18Å; F20-F25 AromaticContact CE1-CE1 3.72Å; F20-F25 HydrophobicContact CE1-CE1 3.72Å; F20-F25 HydrophobicContact CE1-CZ 4Å; K22-F25 HydrophobicContact CB-CB 4.31Å; K22-F25 WeakPolarHBondContact O-CB 3.17Å; K22-F25 PolarHBondContact O-N 3.48Å; P23-F25 VanDerWaalsContact C-N 3.33Å; P23-F25 PolarHBondContact O-N 3.37Å; F25-K27 VanDerWaalsContact C-N 3.32Å; F25-K27 PolarHBondContact O-N 3.28Å; F25-Y28 HydrophobicContact CE2-CD1 4.5Å; F25-Y28 WeakPolarHBondContact O-CB 3.48Å; F25-Y28 PolarHBondContact O-N 3.49Å; F25-Y28 VanDerWaalsContact O-N 3.11Å; F25-L29 HydrophobicContact CD1-CD1 3.88Å; F25-L29 HydrophobicContact CD1-CG 4.06Å; F25-L29 HydrophobicContact CE1-CD1 3.62Å; F25-L29 HydrophobicContact CE1-CD2 3.89Å; F25-L29 HydrophobicContact CE1-CG 3.75Å; F25-L29 HydrophobicContact CZ-CD2 3.98Å; F25-L29 HydrophobicContact CZ-CG 4.25Å; F25-L29 WeakPolarHBondContact O-CG 3.42Å; F25-L29 PolarHBondContact O-N 3.34Å
26	I	86.5	Confident	81.1	Confident	41 Å²	41	91 Å²	91	21%	0.21	42%	0.421	C	S	.	.	H	α-helix	trans	-60.8	-43.3	174.6	-53.9	173.2	0	0	0	110.7	K22 P23 Y28 L29 K30	K22-I26 PolarHBondContact O-N 3.04Å; P23-I26 PolarHBondContact O-N 3.4Å; I26-Y28 VanDerWaalsContact C-N 3.31Å; I26-Y28 PolarHBondContact O-N 3.33Å; I26-L29 PolarHBondContact O-N 3.06Å; I26-K30 WeakPolarHBondContact O-CG 3.35Å; I26-K30 PolarHBondContact O-N 3.3Å
27	K	89.9	Confident	82.5	Confident	149 Å²	149	86.6 Å²	86.6	65%	0.648	40%	0.403	S	S	*	.	H	α-helix	trans	-60.8	-40.3	174	-76.8	-178.3	177.6	178.2	0	111.9	P23 N24 F25 K30 Y31	P23-K27 PolarHBondContact O-N 3.26Å; N24-K27 PolarHBondContact O-N 3.45Å; F25-K27 VanDerWaalsContact C-N 3.32Å; F25-K27 PolarHBondContact O-N 3.28Å; K27-K30 WeakPolarHBondContact O-CB 3.4Å; K27-K30 PolarHBondContact O-N 3.11Å; K27-Y31 PolarHBondContact O-N 2.91Å
28	Y	90.1	Very high	83.5	Confident	127 Å²	127	84.8 Å²	84.8	50%	0.498	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-42.3	175.7	-178	-107.7	0	0	0	112.5	N24 F25 I26 K30 Y31 L32	N24-Y28 PolarHBondContact O-N 2.96Å; F25-Y28 HydrophobicContact CE2-CD1 4.5Å; F25-Y28 WeakPolarHBondContact O-CB 3.48Å; F25-Y28 PolarHBondContact O-N 3.49Å; F25-Y28 VanDerWaalsContact O-N 3.11Å; I26-Y28 VanDerWaalsContact C-N 3.31Å; I26-Y28 PolarHBondContact O-N 3.33Å; Y28-K30 VanDerWaalsContact C-N 3.3Å; Y28-K30 PolarHBondContact O-N 3.43Å; Y28-Y31 HydrophobicContact CE2-CD1 4.43Å; Y28-Y31 WeakPolarHBondContact O-CB 3.49Å; Y28-Y31 PolarHBondContact O-N 3.21Å; Y28-Y31 VanDerWaalsContact O-N 3.14Å; Y28-L32 HydrophobicContact CD1-CD1 4.06Å; Y28-L32 HydrophobicContact CD1-CG 4.49Å; Y28-L32 HydrophobicContact CE1-CD1 3.63Å; Y28-L32 HydrophobicContact CE1-CD2 4.47Å; Y28-L32 HydrophobicContact CE1-CG 4.11Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 3.46Å
29	L	87.9	Confident	84.7	Confident	5 Å²	5	85.5 Å²	85.5	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-60.3	-40.3	173.2	-68.4	176.9	0	0	0	111.8	F25 I26 Y31 L32 L53 L56 Q57	F25-L29 HydrophobicContact CD1-CD1 3.88Å; F25-L29 HydrophobicContact CD1-CG 4.06Å; F25-L29 HydrophobicContact CE1-CD1 3.62Å; F25-L29 HydrophobicContact CE1-CD2 3.89Å; F25-L29 HydrophobicContact CE1-CG 3.75Å; F25-L29 HydrophobicContact CZ-CD2 3.98Å; F25-L29 HydrophobicContact CZ-CG 4.25Å; F25-L29 WeakPolarHBondContact O-CG 3.42Å; F25-L29 PolarHBondContact O-N 3.34Å; I26-L29 PolarHBondContact O-N 3.06Å; L29-Y31 VanDerWaalsContact C-N 3.35Å; L29-L32 PolarHBondContact O-N 2.86Å; L29-L53 HydrophobicContact CB-CD1 4.48Å; L29-L53 HydrophobicContact CD2-CD1 3.99Å; L29-L56 HydrophobicContact CD1-CB 4.18Å; L29-L56 HydrophobicContact CD2-CD1 4.3Å; L29-Q57 PolarHBondContact O-NE2 2.85Å
30	K	90.4	Very high	86	Confident	130 Å²	130	85.4 Å²	85.4	57%	0.565	41%	0.405	S	S	*	.	H	α-helix	trans	-63.8	-40.7	174	-74.1	-176.5	177.6	-172.9	0	111.9	I26 K27 Y28 L32 L33	I26-K30 WeakPolarHBondContact O-CG 3.35Å; I26-K30 PolarHBondContact O-N 3.3Å; K27-K30 WeakPolarHBondContact O-CB 3.4Å; K27-K30 PolarHBondContact O-N 3.11Å; Y28-K30 VanDerWaalsContact C-N 3.3Å; Y28-K30 PolarHBondContact O-N 3.43Å; K30-L32 VanDerWaalsContact C-N 3.32Å; K30-L32 PolarHBondContact O-N 3.36Å; K30-L33 WeakPolarHBondContact O-CB 3.35Å; K30-L33 PolarHBondContact O-N 3.14Å
31	Y	91.9	Very high	87.2	Confident	151 Å²	151	86.4 Å²	86.4	59%	0.592	41%	0.414	S	S	*	.	H	α-helix	trans	-57.8	-46.2	174.5	174.7	-104	0	0	0	110.8	K27 Y28 L29 L33 Y34	K27-Y31 PolarHBondContact O-N 2.91Å; Y28-Y31 HydrophobicContact CE2-CD1 4.43Å; Y28-Y31 WeakPolarHBondContact O-CB 3.49Å; Y28-Y31 PolarHBondContact O-N 3.21Å; Y28-Y31 VanDerWaalsContact O-N 3.14Å; L29-Y31 VanDerWaalsContact C-N 3.35Å; Y31-L33 PolarHBondContact O-N 3.29Å; Y31-Y34 HydrophobicContact CD1-CD1 4.44Å; Y31-Y34 HydrophobicContact CD1-CE1 4.16Å; Y31-Y34 HydrophobicContact CE1-CD1 4.18Å; Y31-Y34 AromaticContact CE1-CE1 3.62Å; Y31-Y34 HydrophobicContact CE1-CE1 3.62Å; Y31-Y34 HydrophobicContact CE2-CD1 4.38Å; Y31-Y34 HydrophobicContact CE2-CE1 4.49Å; Y31-Y34 AromaticContact CZ-CE1 3.81Å; Y31-Y34 WeakPolarHBondContact O-CD1 3.35Å; Y31-Y34 PolarHBondContact O-N 2.93Å
32	L	91.8	Very high	88.1	Confident	36 Å²	36	88.3 Å²	88.3	19%	0.188	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-59.7	-13	179.7	-70.2	174.2	0	0	0	115.2	Y28 L29 K30 Y34 W35 L53	Y28-L32 HydrophobicContact CD1-CD1 4.06Å; Y28-L32 HydrophobicContact CD1-CG 4.49Å; Y28-L32 HydrophobicContact CE1-CD1 3.63Å; Y28-L32 HydrophobicContact CE1-CD2 4.47Å; Y28-L32 HydrophobicContact CE1-CG 4.11Å; Y28-L32 WeakPolarHBondContact O-CG 3.45Å; Y28-L32 PolarHBondContact O-N 3.46Å; L29-L32 PolarHBondContact O-N 2.86Å; K30-L32 VanDerWaalsContact C-N 3.32Å; K30-L32 PolarHBondContact O-N 3.36Å; L32-Y34 PolarHBondContact O-N 2.98Å; L32-Y34 VanDerWaalsContact O-N 3.15Å; L32-W35 WeakPolarHBondContact O-CB 3.21Å; L32-W35 VanDerWaalsContact O-CD1 3.28Å; L32-W35 PolarHBondContact O-N 3.41Å; L32-L53 HydrophobicContact CB-CD1 4.14Å; L32-L53 HydrophobicContact CB-CD2 3.8Å; L32-L53 HydrophobicContact CD1-CD1 4.44Å; L32-L53 WeakPolarHBondContact O-CD2 3.25Å
33	L	91.4	Very high	88.6	Confident	54 Å²	54	91.8 Å²	91.8	28%	0.283	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-63.6	-17.2	177	-67.6	171	0	0	0	113.3	K30 Y31 W35 K36 L53 Q57	K30-L33 WeakPolarHBondContact O-CB 3.35Å; K30-L33 PolarHBondContact O-N 3.14Å; Y31-L33 PolarHBondContact O-N 3.29Å; L33-W35 PolarHBondContact O-N 3.01Å; L33-W35 VanDerWaalsContact O-N 3.17Å; L33-K36 HydrophobicContact CD2-CD 4.16Å; L33-K36 VanDerWaalsContact O-CB 3.3Å; L33-K36 WeakPolarHBondContact O-CB 3.39Å; L33-K36 WeakPolarHBondContact O-CG 3.43Å; L33-K36 PolarHBondContact O-N 3.39Å; L33-K36 VanDerWaalsContact O-N 3.09Å; L33-L53 HydrophobicContact CD2-CD2 4.02Å; L33-L53 HydrophobicContact CD2-CG 4.1Å; L33-Q57 HydrophobicContact CD1-CG 4.44Å; L33-Q57 HydrophobicContact CD2-CG 4.38Å
34	Y	91.6	Very high	88.8	Confident	84 Å²	84	89.9 Å²	89.9	33%	0.329	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-59.5	-26.3	174.6	81.9	-101.7	0	0	0	112.5	Y31 L32 K36 D37 Y40	Y31-Y34 HydrophobicContact CD1-CD1 4.44Å; Y31-Y34 HydrophobicContact CD1-CE1 4.16Å; Y31-Y34 HydrophobicContact CE1-CD1 4.18Å; Y31-Y34 AromaticContact CE1-CE1 3.62Å; Y31-Y34 HydrophobicContact CE1-CE1 3.62Å; Y31-Y34 HydrophobicContact CE2-CD1 4.38Å; Y31-Y34 HydrophobicContact CE2-CE1 4.49Å; Y31-Y34 AromaticContact CZ-CE1 3.81Å; Y31-Y34 WeakPolarHBondContact O-CD1 3.35Å; Y31-Y34 PolarHBondContact O-N 2.93Å; L32-Y34 PolarHBondContact O-N 2.98Å; L32-Y34 VanDerWaalsContact O-N 3.15Å; Y34-K36 PolarHBondContact O-N 3.19Å; Y34-D37 WeakPolarHBondContact O-CB 3.38Å; Y34-D37 PolarHBondContact O-N 3.23Å; Y34-Y40 AromaticContact CD2-CD2 3.65Å; Y34-Y40 HydrophobicContact CD2-CD2 3.65Å; Y34-Y40 AromaticContact CD2-CE2 3.96Å; Y34-Y40 HydrophobicContact CD2-CE2 3.96Å; Y34-Y40 HydrophobicContact CD2-CG 4.03Å; Y34-Y40 HydrophobicContact CE2-CD1 4.37Å; Y34-Y40 HydrophobicContact CE2-CD2 4.19Å; Y34-Y40 HydrophobicContact CE2-CG 4.12Å
35	W	91	Very high	88.8	Confident	74 Å²	74	90.5 Å²	90.5	28%	0.28	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-62.5	-12.9	177.1	-76.5	100.8	0	0	0	114	L32 L33 D37 S41 L44 L50	L32-W35 WeakPolarHBondContact O-CB 3.21Å; L32-W35 VanDerWaalsContact O-CD1 3.28Å; L32-W35 PolarHBondContact O-N 3.41Å; L33-W35 PolarHBondContact O-N 3.01Å; L33-W35 VanDerWaalsContact O-N 3.17Å; W35-D37 VanDerWaalsContact C-N 3.28Å; W35-S41 WeakPolarHBondContact O-CA 3.24Å; W35-S41 WeakPolarHBondContact O-CB 3.11Å; W35-S41 PolarHBondContact O-N 3.42Å; W35-L44 HydrophobicContact CD2-CD2 4.34Å; W35-L44 HydrophobicContact CE3-CD2 3.79Å; W35-L44 HydrophobicContact CE3-CG 4.2Å; W35-L44 HydrophobicContact CZ3-CD2 4.18Å; W35-L50 HydrophobicContact CB-CD2 3.83Å
36	K	88.7	Confident	88.7	Confident	87 Å²	87	94.5 Å²	94.5	38%	0.378	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-71.4	-22.6	174	-69.2	-177.3	153.1	-158.9	0	113.5	L33 Y34 L50 D54	L33-K36 HydrophobicContact CD2-CD 4.16Å; L33-K36 VanDerWaalsContact O-CB 3.3Å; L33-K36 WeakPolarHBondContact O-CB 3.39Å; L33-K36 WeakPolarHBondContact O-CG 3.43Å; L33-K36 PolarHBondContact O-N 3.39Å; L33-K36 VanDerWaalsContact O-N 3.09Å; Y34-K36 PolarHBondContact O-N 3.19Å; K36-L50 HydrophobicContact CG-CD2 4.17Å; K36-D54 WeakPolarHBondContact CE-OD1 3.4Å; K36-D54 VanDerWaalsContact CE-OD2 3.24Å; K36-D54 WeakPolarHBondContact CE-OD2 3.46Å; K36-D54 IonicContact NZ-OD1 3.87Å; K36-D54 PolarHBondContact NZ-OD1 2.99Å; K36-D54 IonicContact NZ-OD2 2.55Å; K36-D54 PolarHBondContact NZ-OD2 3.29Å
37	D	89.8	Confident	88.4	Confident	78 Å²	78	96.4 Å²	96.4	42%	0.417	44%	0.443	S	S	.	.	S	Bend	trans	-59.6	132.3	177.2	-171.5	-38.4	0	0	0	109.6	Y34 W35 A39 Y40 S41	Y34-D37 WeakPolarHBondContact O-CB 3.38Å; Y34-D37 PolarHBondContact O-N 3.23Å; W35-D37 VanDerWaalsContact C-N 3.28Å; D37-A39 PolarHBondContact O-N 3.49Å; D37-A39 VanDerWaalsContact OD1-CB 3.31Å; D37-A39 WeakPolarHBondContact OD1-CB 3.35Å; D37-A39 PolarHBondContact OD1-N 2.96Å; D37-Y40 HydrophobicContact CB-CD2 3.82Å; D37-Y40 HydrophobicContact CB-CE2 4.34Å; D37-Y40 PolarHBondContact O-N 3.08Å; D37-S41 WeakPolarHBondContact O-CB 3.49Å; D37-S41 PolarHBondContact O-N 3.21Å; D37-S41 PolarHBondContact O-OG 3.3Å
38	P	87.8	Confident	88.1	Confident	94 Å²	94	91.9 Å²	91.9	61%	0.61	42%	0.422	S	S	*	.	H	α-helix	trans	-50.9	-26.2	174	21.2	-34.4	0	0	0	114.6	Y40 S41	P38-Y40 VanDerWaalsContact C-N 3.32Å; P38-Y40 PolarHBondContact O-N 3.36Å; P38-S41 WeakPolarHBondContact CA-OG 3.46Å
39	A	89.7	Confident	87.9	Confident	49 Å²	49	89 Å²	89	41%	0.405	42%	0.42	S	S	.	.	H	α-helix	trans	-64.2	-35.3	175.3	0	0	0	0	0	112.7	D37 Y43	D37-A39 PolarHBondContact O-N 3.49Å; D37-A39 VanDerWaalsContact OD1-CB 3.31Å; D37-A39 WeakPolarHBondContact OD1-CB 3.35Å; D37-A39 PolarHBondContact OD1-N 2.96Å; A39-Y43 WeakPolarHBondContact O-CE2 3.3Å
40	Y	88.7	Confident	87.9	Confident	111 Å²	111	90.3 Å²	90.3	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-103.2	-33.6	-177.5	-56.5	-65.8	0	0	0	112.8	Y34 D37 P38 R42 Y43	Y34-Y40 AromaticContact CD2-CD2 3.65Å; Y34-Y40 HydrophobicContact CD2-CD2 3.65Å; Y34-Y40 AromaticContact CD2-CE2 3.96Å; Y34-Y40 HydrophobicContact CD2-CE2 3.96Å; Y34-Y40 HydrophobicContact CD2-CG 4.03Å; Y34-Y40 HydrophobicContact CE2-CD1 4.37Å; Y34-Y40 HydrophobicContact CE2-CD2 4.19Å; Y34-Y40 HydrophobicContact CE2-CG 4.12Å; D37-Y40 HydrophobicContact CB-CD2 3.82Å; D37-Y40 HydrophobicContact CB-CE2 4.34Å; D37-Y40 PolarHBondContact O-N 3.08Å; P38-Y40 VanDerWaalsContact C-N 3.32Å; P38-Y40 PolarHBondContact O-N 3.36Å; Y40-R42 PolarHBondContact O-N 3.37Å; Y40-R42 VanDerWaalsContact O-N 3.14Å; Y40-Y43 WeakPolarHBondContact O-CD2 3.1Å; Y40-Y43 PolarHBondContact O-N 2.7Å; Y40-Y43 VanDerWaalsContact O-N 3.07Å
41	S	88.1	Confident	87.8	Confident	39 Å²	39	88.7 Å²	88.7	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-24.4	-175.1	64.4	0	0	0	0	113.5	W35 D37 P38 Y43 L44	W35-S41 WeakPolarHBondContact O-CA 3.24Å; W35-S41 WeakPolarHBondContact O-CB 3.11Å; W35-S41 PolarHBondContact O-N 3.42Å; D37-S41 WeakPolarHBondContact O-CB 3.49Å; D37-S41 PolarHBondContact O-N 3.21Å; D37-S41 PolarHBondContact O-OG 3.3Å; P38-S41 WeakPolarHBondContact CA-OG 3.46Å; S41-Y43 PolarHBondContact O-N 2.55Å; S41-L44 VanDerWaalsContact O-CB 3.31Å; S41-L44 WeakPolarHBondContact O-CB 3.35Å; S41-L44 PolarHBondContact O-N 3.31Å
42	R	87.6	Confident	87.6	Confident	185 Å²	185	83.4 Å²	83.4	70%	0.698	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.1	174	61.4	176.6	50.5	-164.8	-10.8	114.7	Y40 L44	Y40-R42 PolarHBondContact O-N 3.37Å; Y40-R42 VanDerWaalsContact O-N 3.14Å; R42-L44 VanDerWaalsContact C-N 3.32Å
43	Y	87.8	Confident	87.6	Confident	170 Å²	170	82.4 Å²	82.4	67%	0.667	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-2.7	178.6	-58.6	-70.8	0	0	0	112.7	A39 Y40 S41 I45	A39-Y43 WeakPolarHBondContact O-CE2 3.3Å; Y40-Y43 WeakPolarHBondContact O-CD2 3.1Å; Y40-Y43 PolarHBondContact O-N 2.7Å; Y40-Y43 VanDerWaalsContact O-N 3.07Å; S41-Y43 PolarHBondContact O-N 2.55Å; Y43-I45 PolarHBondContact O-N 2.96Å
44	L	86.7	Confident	87.5	Confident	49 Å²	49	82.4 Å²	82.4	26%	0.257	40%	0.398	S	S	.	.			trans	-80.9	117.3	179.4	-62.7	175	0	0	0	110.6	W35 S41 R42 Y46 L50	W35-L44 HydrophobicContact CD2-CD2 4.34Å; W35-L44 HydrophobicContact CE3-CD2 3.79Å; W35-L44 HydrophobicContact CE3-CG 4.2Å; W35-L44 HydrophobicContact CZ3-CD2 4.18Å; S41-L44 VanDerWaalsContact O-CB 3.31Å; S41-L44 WeakPolarHBondContact O-CB 3.35Å; S41-L44 PolarHBondContact O-N 3.31Å; R42-L44 VanDerWaalsContact C-N 3.32Å; L44-Y46 PolarHBondContact O-N 3.26Å; L44-L50 HydrophobicContact CD1-CD1 3.59Å; L44-L50 HydrophobicContact CD1-CD2 3.74Å; L44-L50 HydrophobicContact CD1-CG 3.56Å
45	I	83.1	Confident	87.4	Confident	138 Å²	138	80.7 Å²	80.7	71%	0.708	39%	0.394	S	S	*	.	S	Bend	trans	-64.9	-33	171.9	-55.7	173	0	0	0	110.4	Y43	Y43-I45 PolarHBondContact O-N 2.96Å
46	Y	82.6	Confident	87.3	Confident	133 Å²	133	78.3 Å²	78.3	52%	0.522	39%	0.387	S	S	.	.			trans	-125	88.2	-174.9	-61.5	-65	0	0	0	110.9	L44 Y48 C49 W82	L44-Y46 PolarHBondContact O-N 3.26Å; Y46-Y48 PolarHBondContact O-N 3.05Å; Y46-C49 VanDerWaalsContact O-CB 3.29Å; Y46-C49 WeakPolarHBondContact O-CB 3.11Å; Y46-C49 PolarHBondContact O-N 3.36Å; Y46-C49 VanDerWaalsContact O-N 3.08Å; Y46-C49 PolarHBondContact O-SG 3.14Å; Y46-C49 VanDerWaalsContact O-SG 3.4Å; Y46-W82 AromaticContact CD1-CH2 3.87Å; Y46-W82 HydrophobicContact CD1-CH2 3.87Å; Y46-W82 AromaticContact CD1-CZ2 3.63Å; Y46-W82 HydrophobicContact CD1-CZ2 3.63Å; Y46-W82 AromaticContact CE1-CH2 3.98Å; Y46-W82 HydrophobicContact CE1-CH2 3.98Å; Y46-W82 AromaticContact CE1-CZ2 3.86Å; Y46-W82 HydrophobicContact CE1-CZ2 3.86Å
47	P	80.3	Confident	87.3	Confident	82 Å²	82	76.4 Å²	76.4	53%	0.532	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.2	-178.2	24.4	-34	0	0	0	113	C49 L50	P47-C49 PolarHBondContact O-N 3.44Å; P47-C49 VanDerWaalsContact O-N 3.14Å; P47-L50 WeakPolarHBondContact O-CB 3.45Å; P47-L50 PolarHBondContact O-N 3.2Å
48	Y	83.8	Confident	87.3	Confident	53 Å²	53	78.3 Å²	78.3	21%	0.208	39%	0.386	C	S	.	.	H	α-helix	trans	-57.3	-27.2	174.4	-173.8	-97	0	0	0	112.9	Y46 L50 H51 L52 I78	Y46-Y48 PolarHBondContact O-N 3.05Å; Y48-L50 PolarHBondContact O-N 3.06Å; Y48-H51 AromaticContact CE2-CD2 3.94Å; Y48-H51 WeakPolarHBondContact O-CB 3.43Å; Y48-H51 PolarHBondContact O-N 3.05Å; Y48-L52 PolarHBondContact O-N 3.06Å; Y48-I78 HydrophobicContact CD1-CD1 3.93Å; Y48-I78 HydrophobicContact CD1-CG1 3.71Å; Y48-I78 HydrophobicContact CE1-CD1 3.53Å; Y48-I78 HydrophobicContact CE1-CG1 3.25Å
49	C	85.7	Confident	87.3	Confident	67 Å²	67	76.5 Å²	76.5	45%	0.453	38%	0.379	S	S	.	.	H	α-helix	trans	-58.8	-30.3	176.1	-64.5	0	0	0	0	112.7	Y46 P47 L52 L53	Y46-C49 VanDerWaalsContact O-CB 3.29Å; Y46-C49 WeakPolarHBondContact O-CB 3.11Å; Y46-C49 PolarHBondContact O-N 3.36Å; Y46-C49 VanDerWaalsContact O-N 3.08Å; Y46-C49 PolarHBondContact O-SG 3.14Å; Y46-C49 VanDerWaalsContact O-SG 3.4Å; P47-C49 PolarHBondContact O-N 3.44Å; P47-C49 VanDerWaalsContact O-N 3.14Å; C49-L52 PolarHBondContact O-N 3.35Å; C49-L53 WeakPolarHBondContact O-CB 3.49Å; C49-L53 PolarHBondContact O-N 3.15Å
50	L	88	Confident	87.2	Confident	32 Å²	32	82.2 Å²	82.2	17%	0.168	40%	0.397	C	S	.	.	H	α-helix	trans	-68.7	-38.3	175.3	-66.2	179.9	0	0	0	111.9	W35 K36 L44 P47 Y48 L53 D54	W35-L50 HydrophobicContact CB-CD2 3.83Å; K36-L50 HydrophobicContact CG-CD2 4.17Å; L44-L50 HydrophobicContact CD1-CD1 3.59Å; L44-L50 HydrophobicContact CD1-CD2 3.74Å; L44-L50 HydrophobicContact CD1-CG 3.56Å; P47-L50 WeakPolarHBondContact O-CB 3.45Å; P47-L50 PolarHBondContact O-N 3.2Å; Y48-L50 PolarHBondContact O-N 3.06Å; L50-L53 WeakPolarHBondContact O-CB 3.31Å; L50-L53 PolarHBondContact O-N 3.26Å; L50-D54 PolarHBondContact O-N 3.17Å
51	H	88.4	Confident	87.1	Confident	97 Å²	97	78.1 Å²	78.1	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-66.5	-41.8	175.1	-174.9	61.4	0	0	0	111.1	Y48 L53 D54 L55	Y48-H51 AromaticContact CE2-CD2 3.94Å; Y48-H51 WeakPolarHBondContact O-CB 3.43Å; Y48-H51 PolarHBondContact O-N 3.05Å; H51-L53 VanDerWaalsContact C-N 3.28Å; H51-L53 PolarHBondContact O-N 3.09Å; H51-D54 WeakPolarHBondContact O-CB 3.44Å; H51-D54 PolarHBondContact O-N 2.94Å; H51-L55 PolarHBondContact O-N 3.37Å; H51-L55 VanDerWaalsContact O-N 3.14Å
52	L	87.5	Confident	87	Confident	39 Å²	39	77.7 Å²	77.7	20%	0.204	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-37.7	173.3	-177.2	61.6	0	0	0	111.9	Y48 C49 D54 L55 L56 F61 I74	Y48-L52 PolarHBondContact O-N 3.06Å; C49-L52 PolarHBondContact O-N 3.35Å; L52-D54 VanDerWaalsContact C-N 3.29Å; L52-D54 PolarHBondContact O-N 3.18Å; L52-L55 PolarHBondContact O-N 3.35Å; L52-L56 HydrophobicContact CG-CD1 4.36Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.32Å; L52-F61 HydrophobicContact CD1-CE1 4.06Å; L52-F61 HydrophobicContact CD1-CZ 3.89Å; L52-I74 HydrophobicContact CD1-CD1 4Å
53	L	90.8	Very high	86.9	Confident	15 Å²	15	71.8 Å²	71.8	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-36.5	175.8	-177.8	63	0	0	0	112	L29 L32 L33 C49 L50 H51 L56 Q57	L29-L53 HydrophobicContact CB-CD1 4.48Å; L29-L53 HydrophobicContact CD2-CD1 3.99Å; L32-L53 HydrophobicContact CB-CD1 4.14Å; L32-L53 HydrophobicContact CB-CD2 3.8Å; L32-L53 HydrophobicContact CD1-CD1 4.44Å; L32-L53 WeakPolarHBondContact O-CD2 3.25Å; L33-L53 HydrophobicContact CD2-CD2 4.02Å; L33-L53 HydrophobicContact CD2-CG 4.1Å; C49-L53 WeakPolarHBondContact O-CB 3.49Å; C49-L53 PolarHBondContact O-N 3.15Å; L50-L53 WeakPolarHBondContact O-CB 3.31Å; L50-L53 PolarHBondContact O-N 3.26Å; H51-L53 VanDerWaalsContact C-N 3.28Å; H51-L53 PolarHBondContact O-N 3.09Å; L53-L56 WeakPolarHBondContact O-CB 3.35Å; L53-L56 PolarHBondContact O-N 3.14Å; L53-Q57 PolarHBondContact O-N 2.94Å
54	D	90.6	Very high	86.8	Confident	54 Å²	54	63.9 Å²	63.9	29%	0.289	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-46.1	173.1	-79.9	-32.7	0	0	0	112.3	K36 L50 H51 L52 L56 Q57 H58	K36-D54 WeakPolarHBondContact CE-OD1 3.4Å; K36-D54 VanDerWaalsContact CE-OD2 3.24Å; K36-D54 WeakPolarHBondContact CE-OD2 3.46Å; K36-D54 IonicContact NZ-OD1 3.87Å; K36-D54 PolarHBondContact NZ-OD1 2.99Å; K36-D54 IonicContact NZ-OD2 2.55Å; K36-D54 PolarHBondContact NZ-OD2 3.29Å; L50-D54 PolarHBondContact O-N 3.17Å; H51-D54 WeakPolarHBondContact O-CB 3.44Å; H51-D54 PolarHBondContact O-N 2.94Å; L52-D54 VanDerWaalsContact C-N 3.29Å; L52-D54 PolarHBondContact O-N 3.18Å; D54-L56 PolarHBondContact O-N 3.32Å; D54-Q57 WeakPolarHBondContact O-CB 3.39Å; D54-Q57 PolarHBondContact O-N 3.4Å; D54-H58 PolarHBondContact O-CD2 2.95Å
55	L	89.4	Confident	86.6	Confident	48 Å²	48	62.4 Å²	62.4	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-39.1	176.4	-63	173.4	0	0	0	111.1	H51 L52 Q57 H58 F61	H51-L55 PolarHBondContact O-N 3.37Å; H51-L55 VanDerWaalsContact O-N 3.14Å; L52-L55 PolarHBondContact O-N 3.35Å; L55-Q57 PolarHBondContact O-N 2.85Å; L55-H58 PolarHBondContact O-N 3.39Å; L55-H58 VanDerWaalsContact O-N 3.08Å; L55-F61 HydrophobicContact CB-CD1 3.77Å; L55-F61 HydrophobicContact CB-CD2 4.11Å; L55-F61 HydrophobicContact CB-CE1 3.52Å; L55-F61 HydrophobicContact CB-CE2 3.91Å; L55-F61 HydrophobicContact CB-CG 4.02Å; L55-F61 HydrophobicContact CB-CZ 3.58Å; L55-F61 HydrophobicContact CD1-CE2 4.04Å; L55-F61 HydrophobicContact CD1-CZ 3.95Å; L55-F61 HydrophobicContact CG-CE2 4.48Å; L55-F61 HydrophobicContact CG-CZ 4.39Å; L55-F61 VanDerWaalsContact O-CB 3.29Å; L55-F61 WeakPolarHBondContact O-CB 3.31Å; L55-F61 WeakPolarHBondContact O-CD1 3.48Å; L55-F61 WeakPolarHBondContact O-CG 3.33Å
56	L	88.5	Confident	86.4	Confident	25 Å²	25	58.8 Å²	58.8	13%	0.131	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-19.5	176.6	-76.4	168.5	0	0	0	114.3	L29 L52 L53 D54 H58 F61 R62 L65	L29-L56 HydrophobicContact CD1-CB 4.18Å; L29-L56 HydrophobicContact CD2-CD1 4.3Å; L52-L56 HydrophobicContact CG-CD1 4.36Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.32Å; L53-L56 WeakPolarHBondContact O-CB 3.35Å; L53-L56 PolarHBondContact O-N 3.14Å; D54-L56 PolarHBondContact O-N 3.32Å; L56-H58 VanDerWaalsContact C-N 3.26Å; L56-H58 PolarHBondContact O-N 3.44Å; L56-F61 HydrophobicContact CD2-CD1 4.31Å; L56-F61 HydrophobicContact CD2-CE1 4.15Å; L56-F61 HydrophobicContact CG-CE1 4.2Å; L56-R62 HydrophobicContact CD2-CG 4.29Å; L56-R62 WeakPolarHBondContact O-CD 3.41Å; L56-R62 VanDerWaalsContact O-CG 3.3Å; L56-R62 WeakPolarHBondContact O-CG 3.24Å; L56-R62 PolarHBondContact O-NE 3.04Å; L56-L65 HydrophobicContact CD2-CD1 3.37Å
57	Q	88.9	Confident	86.3	Confident	46 Å²	46	61.3 Å²	61.3	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-69.5	-27.9	174.2	-60.7	-59	-26.8	0	0	111.9	L29 L33 L53 D54 L55 A59	L29-Q57 PolarHBondContact O-NE2 2.85Å; L33-Q57 HydrophobicContact CD1-CG 4.44Å; L33-Q57 HydrophobicContact CD2-CG 4.38Å; L53-Q57 PolarHBondContact O-N 2.94Å; D54-Q57 WeakPolarHBondContact O-CB 3.39Å; D54-Q57 PolarHBondContact O-N 3.4Å; L55-Q57 PolarHBondContact O-N 2.85Å; Q57-A59 PolarHBondContact O-N 3.02Å
58	H	90.1	Very high	86.1	Confident	118 Å²	118	58.4 Å²	58.4	55%	0.546	31%	0.308	S	S	.	.	S	Bend	trans	-75.9	125.3	178.6	-60.9	-77.4	0	0	0	110.9	D54 L55 L56 E60 F61 R62	D54-H58 PolarHBondContact O-CD2 2.95Å; L55-H58 PolarHBondContact O-N 3.39Å; L55-H58 VanDerWaalsContact O-N 3.08Å; L56-H58 VanDerWaalsContact C-N 3.26Å; L56-H58 PolarHBondContact O-N 3.44Å; H58-E60 VanDerWaalsContact C-N 3.31Å; H58-E60 PolarHBondContact O-N 3.27Å; H58-F61 HydrophobicContact CB-CB 4.1Å; H58-F61 PolarHBondContact O-N 3.02Å; H58-R62 PolarHBondContact O-N 2.95Å; H58-R62 VanDerWaalsContact O-N 3.15Å
59	A	87.4	Confident	86	Confident	57 Å²	57	62.6 Å²	62.6	47%	0.471	33%	0.329	S	S	.	.	H	α-helix	trans	-60.5	-41.7	179.1	0	0	0	0	0	111.9	Q57 F61 R62 S63	Q57-A59 PolarHBondContact O-N 3.02Å; A59-F61 VanDerWaalsContact C-N 3.3Å; A59-F61 PolarHBondContact O-N 3.36Å; A59-R62 PolarHBondContact O-N 3.26Å; A59-R62 VanDerWaalsContact O-N 3.15Å; A59-S63 PolarHBondContact O-N 3.42Å; A59-S63 PolarHBondContact O-OG 3.45Å
60	E	87.4	Confident	85.8	Confident	168 Å²	168	61 Å²	61	79%	0.785	32%	0.316	S	S	*	.	H	α-helix	trans	-57.5	-43.1	177.6	-64.4	176.3	-167.6	0	0	112.2	H58 S63 A64	H58-E60 VanDerWaalsContact C-N 3.31Å; H58-E60 PolarHBondContact O-N 3.27Å; E60-S63 PolarHBondContact O-N 2.87Å; E60-A64 WeakPolarHBondContact O-CB 3.22Å; E60-A64 PolarHBondContact O-N 3.45Å
61	F	87.4	Confident	85.5	Confident	26 Å²	26	60 Å²	60	11%	0.114	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-41.2	177.8	-176.9	-100.2	0	0	0	111.6	L52 L55 L56 H58 A59 A64 L65 I70 I74	L52-F61 HydrophobicContact CD1-CE1 4.06Å; L52-F61 HydrophobicContact CD1-CZ 3.89Å; L55-F61 HydrophobicContact CB-CD1 3.77Å; L55-F61 HydrophobicContact CB-CD2 4.11Å; L55-F61 HydrophobicContact CB-CE1 3.52Å; L55-F61 HydrophobicContact CB-CE2 3.91Å; L55-F61 HydrophobicContact CB-CG 4.02Å; L55-F61 HydrophobicContact CB-CZ 3.58Å; L55-F61 HydrophobicContact CD1-CE2 4.04Å; L55-F61 HydrophobicContact CD1-CZ 3.95Å; L55-F61 HydrophobicContact CG-CE2 4.48Å; L55-F61 HydrophobicContact CG-CZ 4.39Å; L55-F61 VanDerWaalsContact O-CB 3.29Å; L55-F61 WeakPolarHBondContact O-CB 3.31Å; L55-F61 WeakPolarHBondContact O-CD1 3.48Å; L55-F61 WeakPolarHBondContact O-CG 3.33Å; L56-F61 HydrophobicContact CD2-CD1 4.31Å; L56-F61 HydrophobicContact CD2-CE1 4.15Å; L56-F61 HydrophobicContact CG-CE1 4.2Å; H58-F61 HydrophobicContact CB-CB 4.1Å; H58-F61 PolarHBondContact O-N 3.02Å; A59-F61 VanDerWaalsContact C-N 3.3Å; A59-F61 PolarHBondContact O-N 3.36Å; F61-A64 CarbonylContact O-C 3.56Å; F61-A64 PolarHBondContact O-N 2.83Å; F61-L65 HydrophobicContact CD1-CD1 3.78Å; F61-L65 HydrophobicContact CD1-CG 4.13Å; F61-L65 HydrophobicContact CE1-CD1 3.5Å; F61-L65 HydrophobicContact CE1-CD2 4.29Å; F61-L65 HydrophobicContact CE1-CG 3.9Å; F61-L65 HydrophobicContact CZ-CD1 4.3Å; F61-L65 HydrophobicContact CZ-CD2 4.29Å; F61-L65 HydrophobicContact CZ-CG 4.28Å; F61-L65 WeakPolarHBondContact O-CG 3.19Å; F61-L65 PolarHBondContact O-N 2.86Å; F61-I70 HydrophobicContact CD2-CD1 4.1Å; F61-I70 HydrophobicContact CD2-CG2 4.2Å; F61-I70 HydrophobicContact CE2-CD1 4.38Å; F61-I70 HydrophobicContact CE2-CG2 3.55Å; F61-I70 HydrophobicContact CZ-CG2 4.09Å; F61-I74 HydrophobicContact CE2-CD1 4.05Å; F61-I74 HydrophobicContact CZ-CD1 3.53Å; F61-I74 HydrophobicContact CZ-CG1 4.48Å
62	R	85.6	Confident	85.2	Confident	29 Å²	29	63.6 Å²	63.6	11%	0.109	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-45.7	174.8	-72.2	-174.3	-75.8	127.1	-2.7	112.2	F20 L56 H58 A59 A64 L65 A66	F20-R62 PolarHBondContact O-NH1 3.49Å; L56-R62 HydrophobicContact CD2-CG 4.29Å; L56-R62 WeakPolarHBondContact O-CD 3.41Å; L56-R62 VanDerWaalsContact O-CG 3.3Å; L56-R62 WeakPolarHBondContact O-CG 3.24Å; L56-R62 PolarHBondContact O-NE 3.04Å; H58-R62 PolarHBondContact O-N 2.95Å; H58-R62 VanDerWaalsContact O-N 3.15Å; A59-R62 PolarHBondContact O-N 3.26Å; A59-R62 VanDerWaalsContact O-N 3.15Å; R62-A64 VanDerWaalsContact C-N 3.26Å; R62-A64 PolarHBondContact O-N 2.88Å; R62-L65 PolarHBondContact O-N 3.06Å; R62-A66 PolarHBondContact O-N 3.05Å
63	S	84.9	Confident	85.1	Confident	61 Å²	61	66.9 Å²	66.9	43%	0.427	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-33.9	175	-58.7	0	0	0	0	111.8	A59 E60 A66	A59-S63 PolarHBondContact O-N 3.42Å; A59-S63 PolarHBondContact O-OG 3.45Å; E60-S63 PolarHBondContact O-N 2.87Å; S63-A66 WeakPolarHBondContact O-CB 3.38Å; S63-A66 PolarHBondContact O-N 2.85Å
64	A	85.5	Confident	84.8	Confident	4 Å²	4	67 Å²	67	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-77.2	-28.4	178.2	0	0	0	0	0	114	E60 F61 R62 A66 R67 I70	E60-A64 WeakPolarHBondContact O-CB 3.22Å; E60-A64 PolarHBondContact O-N 3.45Å; F61-A64 CarbonylContact O-C 3.56Å; F61-A64 PolarHBondContact O-N 2.83Å; R62-A64 VanDerWaalsContact C-N 3.26Å; R62-A64 PolarHBondContact O-N 2.88Å; A64-A66 VanDerWaalsContact C-N 3.29Å; A64-A66 PolarHBondContact O-N 3.24Å; A64-R67 VanDerWaalsContact CB-NH2 3.25Å; A64-R67 WeakPolarHBondContact O-CB 3.44Å; A64-R67 PolarHBondContact O-N 2.92Å; A64-I70 HydrophobicContact CB-CD1 3.19Å; A64-I70 HydrophobicContact CB-CG1 3.91Å
65	L	83.1	Confident	84.6	Confident	19 Å²	19	68.1 Å²	68.1	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-37.4	167.7	-79.2	172.3	0	0	0	111.8	L56 F61 R62 R67 G68 I70 I74	L56-L65 HydrophobicContact CD2-CD1 3.37Å; F61-L65 HydrophobicContact CD1-CD1 3.78Å; F61-L65 HydrophobicContact CD1-CG 4.13Å; F61-L65 HydrophobicContact CE1-CD1 3.5Å; F61-L65 HydrophobicContact CE1-CD2 4.29Å; F61-L65 HydrophobicContact CE1-CG 3.9Å; F61-L65 HydrophobicContact CZ-CD1 4.3Å; F61-L65 HydrophobicContact CZ-CD2 4.29Å; F61-L65 HydrophobicContact CZ-CG 4.28Å; F61-L65 WeakPolarHBondContact O-CG 3.19Å; F61-L65 PolarHBondContact O-N 2.86Å; R62-L65 PolarHBondContact O-N 3.06Å; L65-R67 PolarHBondContact O-N 3.4Å; L65-G68 PolarHBondContact O-N 3.46Å; L65-I70 HydrophobicContact CD2-CB 4.49Å; L65-I70 HydrophobicContact CD2-CG2 3.92Å; L65-I70 HydrophobicContact CG-CG2 4.47Å; L65-I74 HydrophobicContact CD2-CD1 3.91Å
66	A	79.4	Confident	84.5	Confident	61 Å²	61	70.5 Å²	70.5	50%	0.504	36%	0.356	S	S	.	.	H	α-helix	trans	-59.3	-31.1	175.3	0	0	0	0	0	112.7	R62 S63 A64 G68	R62-A66 PolarHBondContact O-N 3.05Å; S63-A66 WeakPolarHBondContact O-CB 3.38Å; S63-A66 PolarHBondContact O-N 2.85Å; A64-A66 VanDerWaalsContact C-N 3.29Å; A64-A66 PolarHBondContact O-N 3.24Å; A66-G68 VanDerWaalsContact C-N 3.28Å; A66-G68 PolarHBondContact O-N 2.95Å
67	R	79.1	Confident	84.4	Confident	186 Å²	186	74.3 Å²	74.3	70%	0.702	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.7	176.4	-62.5	-176.9	-76.8	156.5	-2.5	113.8	A64 L65 Q69	A64-R67 VanDerWaalsContact CB-NH2 3.25Å; A64-R67 WeakPolarHBondContact O-CB 3.44Å; A64-R67 PolarHBondContact O-N 2.92Å; L65-R67 PolarHBondContact O-N 3.4Å; R67-Q69 PolarHBondContact O-N 3.21Å
68	G	77.2	Confident	84.3	Confident	22 Å²	22	74.2 Å²	74.2	23%	0.227	37%	0.374	C	S	.	.	S	Bend	trans	70.4	-15.2	173.3	0	0	0	0	0	117.2	L65 A66 C71	L65-G68 PolarHBondContact O-N 3.46Å; A66-G68 VanDerWaalsContact C-N 3.28Å; A66-G68 PolarHBondContact O-N 2.95Å; G68-C71 PolarHBondContact O-N 3.2Å
69	Q	81.1	Confident	84.1	Confident	140 Å²	140	73.2 Å²	73.2	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-65.5	-41.3	176.1	-174.5	176.3	9.3	0	0	111.7	R67 C71 R72 M73	R67-Q69 PolarHBondContact O-N 3.21Å; Q69-C71 VanDerWaalsContact C-N 3.28Å; Q69-C71 PolarHBondContact O-N 2.99Å; Q69-R72 PolarHBondContact O-N 3.03Å; Q69-M73 PolarHBondContact O-N 3.14Å
70	I	80.6	Confident	84.1	Confident	33 Å²	33	74.1 Å²	74.1	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-62.3	-36	177.4	-69.4	-156.9	0	0	0	111.5	F61 A64 L65 R72 M73 I74	F61-I70 HydrophobicContact CD2-CD1 4.1Å; F61-I70 HydrophobicContact CD2-CG2 4.2Å; F61-I70 HydrophobicContact CE2-CD1 4.38Å; F61-I70 HydrophobicContact CE2-CG2 3.55Å; F61-I70 HydrophobicContact CZ-CG2 4.09Å; A64-I70 HydrophobicContact CB-CD1 3.19Å; A64-I70 HydrophobicContact CB-CG1 3.91Å; L65-I70 HydrophobicContact CD2-CB 4.49Å; L65-I70 HydrophobicContact CD2-CG2 3.92Å; L65-I70 HydrophobicContact CG-CG2 4.47Å; I70-R72 VanDerWaalsContact C-N 3.29Å; I70-R72 PolarHBondContact O-N 3.08Å; I70-M73 PolarHBondContact O-N 2.96Å; I70-M73 VanDerWaalsContact O-N 3.14Å; I70-I74 HydrophobicContact CG2-CD1 3.5Å; I70-I74 VanDerWaalsContact CG2-CD1 3.5Å; I70-I74 HydrophobicContact CG2-CG1 3.96Å; I70-I74 VanDerWaalsContact O-CG1 3.31Å; I70-I74 WeakPolarHBondContact O-CG1 3.29Å; I70-I74 PolarHBondContact O-N 2.7Å
71	C	81.9	Confident	84	Confident	13 Å²	13	70.2 Å²	70.2	9%	0.088	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-43	179.2	-57.6	0	0	0	0	111.7	G68 Q69 I74 D75	G68-C71 PolarHBondContact O-N 3.2Å; Q69-C71 VanDerWaalsContact C-N 3.28Å; Q69-C71 PolarHBondContact O-N 2.99Å; C71-I74 PolarHBondContact O-N 3.4Å; C71-D75 PolarHBondContact O-N 3.19Å
72	R	82	Confident	83.8	Confident	171 Å²	171	72.8 Å²	72.8	65%	0.645	36%	0.359	S	S	*	.	H	α-helix	trans	-63	-45.2	176.3	-74.1	-170.7	-87.2	-175.6	-4.5	111.8	Q69 I70 I74 D75 D76	Q69-R72 PolarHBondContact O-N 3.03Å; I70-R72 VanDerWaalsContact C-N 3.29Å; I70-R72 PolarHBondContact O-N 3.08Å; R72-I74 VanDerWaalsContact C-N 3.3Å; R72-I74 PolarHBondContact O-N 3.14Å; R72-D75 PolarHBondContact O-N 3.19Å; R72-D76 VanDerWaalsContact O-CG 3.26Å; R72-D76 PolarHBondContact O-N 3.05Å
73	M	85.1	Confident	83.7	Confident	109 Å²	109	75.5 Å²	75.5	54%	0.537	37%	0.373	S	S	.	.	H	α-helix	trans	-61.4	-39.8	177.3	-171.5	-179.3	73.1	0	0	111.9	Q69 I70 D76 Q77	Q69-M73 PolarHBondContact O-N 3.14Å; I70-M73 PolarHBondContact O-N 2.96Å; I70-M73 VanDerWaalsContact O-N 3.14Å; M73-D76 PolarHBondContact O-N 3.07Å; M73-Q77 WeakPolarHBondContact O-CB 3.48Å; M73-Q77 WeakPolarHBondContact O-CG 3.28Å; M73-Q77 PolarHBondContact O-N 3.1Å
74	I	86.4	Confident	83.7	Confident	16 Å²	16	78.1 Å²	78.1	8%	0.082	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-45.9	175.5	-68.4	165.4	0	0	0	110.5	L52 F61 L65 I70 C71 R72 D76 Q77 I78	L52-I74 HydrophobicContact CD1-CD1 4Å; F61-I74 HydrophobicContact CE2-CD1 4.05Å; F61-I74 HydrophobicContact CZ-CD1 3.53Å; F61-I74 HydrophobicContact CZ-CG1 4.48Å; L65-I74 HydrophobicContact CD2-CD1 3.91Å; I70-I74 HydrophobicContact CG2-CD1 3.5Å; I70-I74 VanDerWaalsContact CG2-CD1 3.5Å; I70-I74 HydrophobicContact CG2-CG1 3.96Å; I70-I74 VanDerWaalsContact O-CG1 3.31Å; I70-I74 WeakPolarHBondContact O-CG1 3.29Å; I70-I74 PolarHBondContact O-N 2.7Å; C71-I74 PolarHBondContact O-N 3.4Å; R72-I74 VanDerWaalsContact C-N 3.3Å; R72-I74 PolarHBondContact O-N 3.14Å; I74-D76 VanDerWaalsContact C-N 3.29Å; I74-D76 PolarHBondContact O-N 3.5Å; I74-Q77 PolarHBondContact O-N 3.08Å; I74-I78 HydrophobicContact CG2-CD1 3.56Å; I74-I78 HydrophobicContact CG2-CG1 4.14Å; I74-I78 WeakPolarHBondContact O-CB 3.33Å; I74-I78 WeakPolarHBondContact O-CG1 3.31Å; I74-I78 PolarHBondContact O-N 3.39Å
75	D	85.2	Confident	83.7	Confident	79 Å²	79	82.3 Å²	82.3	42%	0.422	39%	0.394	S	S	.	.	H	α-helix	trans	-58.4	-43.9	178.6	-67.1	-27.7	0	0	0	110.7	C71 R72 I78 L79	C71-D75 PolarHBondContact O-N 3.19Å; R72-D75 PolarHBondContact O-N 3.19Å; D75-I78 PolarHBondContact O-N 3.23Å; D75-L79 WeakPolarHBondContact O-CB 3.45Å; D75-L79 PolarHBondContact O-N 2.92Å
76	D	87.3	Confident	83.7	Confident	97 Å²	97	86 Å²	86	52%	0.519	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-44.5	176.6	-65.5	-24.9	0	0	0	111.8	R72 M73 I74 L79 L80	R72-D76 VanDerWaalsContact O-CG 3.26Å; R72-D76 PolarHBondContact O-N 3.05Å; M73-D76 PolarHBondContact O-N 3.07Å; I74-D76 VanDerWaalsContact C-N 3.29Å; I74-D76 PolarHBondContact O-N 3.5Å; D76-L79 PolarHBondContact O-N 3.44Å; D76-L80 WeakPolarHBondContact O-CB 3.42Å; D76-L80 VanDerWaalsContact O-CG 3.28Å; D76-L80 WeakPolarHBondContact O-CG 3.03Å; D76-L80 PolarHBondContact O-N 3.3Å
77	Q	86.4	Confident	83.9	Confident	105 Å²	105	91.1 Å²	91.1	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-40.8	177.5	-73.4	-63.5	-34.2	0	0	112.3	M73 I74 H81	M73-Q77 WeakPolarHBondContact O-CB 3.48Å; M73-Q77 WeakPolarHBondContact O-CG 3.28Å; M73-Q77 PolarHBondContact O-N 3.1Å; I74-Q77 PolarHBondContact O-N 3.08Å; Q77-H81 VanDerWaalsContact O-CB 3.24Å; Q77-H81 WeakPolarHBondContact O-CB 3.44Å; Q77-H81 PolarHBondContact O-N 3.21Å
78	I	86.1	Confident	84.3	Confident	44 Å²	44	89.1 Å²	89.1	23%	0.226	42%	0.415	C	S	.	.	H	α-helix	trans	-60.6	-50.8	174.5	-73.2	171.1	0	0	0	109	Y48 I74 D75 L80 H81 W82	Y48-I78 HydrophobicContact CD1-CD1 3.93Å; Y48-I78 HydrophobicContact CD1-CG1 3.71Å; Y48-I78 HydrophobicContact CE1-CD1 3.53Å; Y48-I78 HydrophobicContact CE1-CG1 3.25Å; I74-I78 HydrophobicContact CG2-CD1 3.56Å; I74-I78 HydrophobicContact CG2-CG1 4.14Å; I74-I78 WeakPolarHBondContact O-CB 3.33Å; I74-I78 WeakPolarHBondContact O-CG1 3.31Å; I74-I78 PolarHBondContact O-N 3.39Å; D75-I78 PolarHBondContact O-N 3.23Å; I78-L80 PolarHBondContact O-N 2.96Å; I78-H81 WeakPolarHBondContact O-CB 3.48Å; I78-H81 PolarHBondContact O-N 2.73Å; I78-W82 VanDerWaalsContact CG2-CD1 3.4Å; I78-W82 PolarHBondContact O-N 3.41Å
79	L	86	Confident	84.8	Confident	97 Å²	97	93.3 Å²	93.3	51%	0.508	42%	0.424	S	S	.	.	H	α-helix	trans	-58.6	-48.1	-179.3	-179.9	62	0	0	0	111.9	D75 D76 W82 Q83	D75-L79 WeakPolarHBondContact O-CB 3.45Å; D75-L79 PolarHBondContact O-N 2.92Å; D76-L79 PolarHBondContact O-N 3.44Å; L79-W82 PolarHBondContact O-N 2.98Å; L79-Q83 WeakPolarHBondContact O-CG 3.34Å; L79-Q83 PolarHBondContact O-N 3.31Å
80	L	87.2	Confident	85.1	Confident	76 Å²	76	89.5 Å²	89.5	40%	0.398	42%	0.416	S	S	.	.	H	α-helix	trans	-59.9	-46.8	176.5	-72.3	170.6	0	0	0	111.2	D76 I78 W82 Q83 H84	D76-L80 WeakPolarHBondContact O-CB 3.42Å; D76-L80 VanDerWaalsContact O-CG 3.28Å; D76-L80 WeakPolarHBondContact O-CG 3.03Å; D76-L80 PolarHBondContact O-N 3.3Å; I78-L80 PolarHBondContact O-N 2.96Å; L80-W82 VanDerWaalsContact C-N 3.34Å; L80-W82 PolarHBondContact O-N 2.8Å; L80-Q83 PolarHBondContact O-N 2.93Å; L80-H84 PolarHBondContact O-CD2 2.87Å; L80-H84 PolarHBondContact O-N 2.75Å; L80-H84 VanDerWaalsContact O-N 3.08Å
81	H	85.3	Confident	85.5	Confident	87 Å²	87	91 Å²	91	40%	0.403	43%	0.433	S	S	.	.	H	α-helix	trans	-55.8	-48.8	176.7	179.6	80.8	0	0	0	111.2	Q77 I78 Q83 H84 Y85	Q77-H81 VanDerWaalsContact O-CB 3.24Å; Q77-H81 WeakPolarHBondContact O-CB 3.44Å; Q77-H81 PolarHBondContact O-N 3.21Å; I78-H81 WeakPolarHBondContact O-CB 3.48Å; I78-H81 PolarHBondContact O-N 2.73Å; H81-Q83 PolarHBondContact O-N 3.46Å; H81-H84 PolarHBondContact O-N 3.07Å; H81-Y85 WeakPolarHBondContact O-CB 3.5Å; H81-Y85 PolarHBondContact O-N 3.42Å
82	W	84	Confident	85.9	Confident	79 Å²	79	95.1 Å²	95.1	30%	0.299	45%	0.454	S	S	.	.	H	α-helix	trans	-61.3	-42.7	177.7	-74.6	110.9	0	0	0	112.9	Y46 I78 L79 L80 H84 M86	Y46-W82 AromaticContact CD1-CH2 3.87Å; Y46-W82 HydrophobicContact CD1-CH2 3.87Å; Y46-W82 AromaticContact CD1-CZ2 3.63Å; Y46-W82 HydrophobicContact CD1-CZ2 3.63Å; Y46-W82 AromaticContact CE1-CH2 3.98Å; Y46-W82 HydrophobicContact CE1-CH2 3.98Å; Y46-W82 AromaticContact CE1-CZ2 3.86Å; Y46-W82 HydrophobicContact CE1-CZ2 3.86Å; I78-W82 VanDerWaalsContact CG2-CD1 3.4Å; I78-W82 PolarHBondContact O-N 3.41Å; L79-W82 PolarHBondContact O-N 2.98Å; L80-W82 VanDerWaalsContact C-N 3.34Å; L80-W82 PolarHBondContact O-N 2.8Å; W82-H84 VanDerWaalsContact C-N 3.33Å; W82-H84 PolarHBondContact O-N 3.41Å; W82-M86 HydrophobicContact CE3-CE 3.71Å; W82-M86 HydrophobicContact CE3-CG 4.41Å; W82-M86 HydrophobicContact CZ3-CE 3.59Å; W82-M86 WeakPolarHBondContact O-CB 3.4Å; W82-M86 WeakPolarHBondContact O-CG 3.41Å; W82-M86 PolarHBondContact O-N 3.41Å; W82-M86 VanDerWaalsContact O-N 3.1Å
83	Q	84.5	Confident	86.3	Confident	86 Å²	86	91.6 Å²	91.6	40%	0.402	45%	0.447	S	S	.	.	H	α-helix	trans	-59.6	-42.1	179.1	-76.3	179.9	-11.4	0	0	112.3	L79 L80 H81 R87	L79-Q83 WeakPolarHBondContact O-CG 3.34Å; L79-Q83 PolarHBondContact O-N 3.31Å; L80-Q83 PolarHBondContact O-N 2.93Å; H81-Q83 PolarHBondContact O-N 3.46Å; Q83-R87 WeakPolarHBondContact O-CG 3.43Å
84	H	85.3	Confident	86.6	Confident	117 Å²	117	88.6 Å²	88.6	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-82.7	-38.5	179.9	-66.8	-70	0	0	0	112.6	L80 H81 W82 R87 K88	L80-H84 PolarHBondContact O-CD2 2.87Å; L80-H84 PolarHBondContact O-N 2.75Å; L80-H84 VanDerWaalsContact O-N 3.08Å; H81-H84 PolarHBondContact O-N 3.07Å; W82-H84 VanDerWaalsContact C-N 3.33Å; W82-H84 PolarHBondContact O-N 3.41Å; H84-R87 PolarHBondContact O-N 3.36Å; H84-K88 PolarHBondContact O-N 3.45Å; H84-K88 VanDerWaalsContact O-N 3.07Å
85	Y	84	Confident	86.8	Confident	92 Å²	92	93.6 Å²	93.6	36%	0.361	46%	0.46	S	S	.	.	H	α-helix	trans	-65.3	-44.9	-177	-179.1	-113.5	0	0	0	112.5	H81 R87 K88 R89	H81-Y85 WeakPolarHBondContact O-CB 3.5Å; H81-Y85 PolarHBondContact O-N 3.42Å; Y85-R87 VanDerWaalsContact C-N 3.34Å; Y85-R87 PolarHBondContact O-N 3.45Å; Y85-K88 PolarHBondContact O-N 3.34Å; Y85-R89 HydrophobicContact CD1-CG 4.44Å; Y85-R89 HydrophobicContact CD2-CG 4.35Å; Y85-R89 HydrophobicContact CE1-CG 4.16Å; Y85-R89 HydrophobicContact CE2-CG 4.02Å; Y85-R89 WeakPolarHBondContact O-CB 3.39Å; Y85-R89 WeakPolarHBondContact O-CG 3.46Å; Y85-R89 PolarHBondContact O-N 3.44Å; Y85-R89 WeakPolarHBondContact OH-CD 3.42Å
86	M	83	Confident	87	Confident	96 Å²	96	95.4 Å²	95.4	47%	0.473	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-40.3	179.7	-70.7	-58.1	-158.7	0	0	112.1	W82 R89 A90	W82-M86 HydrophobicContact CE3-CE 3.71Å; W82-M86 HydrophobicContact CE3-CG 4.41Å; W82-M86 HydrophobicContact CZ3-CE 3.59Å; W82-M86 WeakPolarHBondContact O-CB 3.4Å; W82-M86 WeakPolarHBondContact O-CG 3.41Å; W82-M86 PolarHBondContact O-N 3.41Å; W82-M86 VanDerWaalsContact O-N 3.1Å; M86-R89 PolarHBondContact O-N 3.1Å; M86-A90 WeakPolarHBondContact O-CB 3.49Å; M86-A90 PolarHBondContact O-N 3.2Å
87	R	84.9	Confident	87.1	Confident	168 Å²	168	93.7 Å²	93.7	63%	0.634	46%	0.459	S	S	*	.	H	α-helix	trans	-63.1	-47.8	175.9	-68.7	177.6	-175	143	-0.3	111.6	Q83 H84 Y85 R89 A90 A91	Q83-R87 WeakPolarHBondContact O-CG 3.43Å; H84-R87 PolarHBondContact O-N 3.36Å; Y85-R87 VanDerWaalsContact C-N 3.34Å; Y85-R87 PolarHBondContact O-N 3.45Å; R87-R89 VanDerWaalsContact C-N 3.33Å; R87-R89 PolarHBondContact O-N 2.98Å; R87-A90 PolarHBondContact O-N 2.98Å; R87-A91 PolarHBondContact O-N 3.38Å; R87-A91 VanDerWaalsContact O-N 3.09Å
88	K	87.3	Confident	87.2	Confident	144 Å²	144	94.8 Å²	94.8	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-41.5	177.6	-175.2	177.3	178.9	179.4	0	111.6	H84 Y85 A91 L92	H84-K88 PolarHBondContact O-N 3.45Å; H84-K88 VanDerWaalsContact O-N 3.07Å; Y85-K88 PolarHBondContact O-N 3.34Å; K88-A91 PolarHBondContact O-N 3.09Å; K88-L92 HydrophobicContact CG-CD1 4.27Å; K88-L92 WeakPolarHBondContact O-CG 3.05Å; K88-L92 PolarHBondContact O-N 2.87Å
89	R	86.5	Confident	87.1	Confident	111 Å²	111	98.2 Å²	98.2	42%	0.419	48%	0.479	S	S	.	.	H	α-helix	trans	-63.8	-45	176.4	-82.3	-171.7	69.6	-174.9	10.9	112.6	Y85 M86 R87 A91 L92 I93	Y85-R89 HydrophobicContact CD1-CG 4.44Å; Y85-R89 HydrophobicContact CD2-CG 4.35Å; Y85-R89 HydrophobicContact CE1-CG 4.16Å; Y85-R89 HydrophobicContact CE2-CG 4.02Å; Y85-R89 WeakPolarHBondContact O-CB 3.39Å; Y85-R89 WeakPolarHBondContact O-CG 3.46Å; Y85-R89 PolarHBondContact O-N 3.44Å; Y85-R89 WeakPolarHBondContact OH-CD 3.42Å; M86-R89 PolarHBondContact O-N 3.1Å; R87-R89 VanDerWaalsContact C-N 3.33Å; R87-R89 PolarHBondContact O-N 2.98Å; R89-A91 VanDerWaalsContact C-N 3.27Å; R89-A91 PolarHBondContact O-N 3.4Å; R89-L92 PolarHBondContact O-N 2.97Å; R89-I93 WeakPolarHBondContact O-CB 3.44Å; R89-I93 VanDerWaalsContact O-CG1 3.28Å; R89-I93 WeakPolarHBondContact O-CG1 3.45Å; R89-I93 PolarHBondContact O-N 3.5Å
90	A	87.6	Confident	87	Confident	59 Å²	59	97.8 Å²	97.8	49%	0.488	48%	0.481	S	S	.	.	H	α-helix	trans	-58.2	-43.2	176.8	0	0	0	0	0	111	M86 R87 I93 A94	M86-A90 WeakPolarHBondContact O-CB 3.49Å; M86-A90 PolarHBondContact O-N 3.2Å; R87-A90 PolarHBondContact O-N 2.98Å; A90-I93 PolarHBondContact O-N 2.98Å; A90-A94 WeakPolarHBondContact O-CB 3.46Å; A90-A94 PolarHBondContact O-N 3.46Å
91	A	90.3	Very high	86.5	Confident	64 Å²	64	99.8 Å²	99.8	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-41.8	175.5	0	0	0	0	0	113.1	R87 K88 R89 A94 K95	R87-A91 PolarHBondContact O-N 3.38Å; R87-A91 VanDerWaalsContact O-N 3.09Å; K88-A91 PolarHBondContact O-N 3.09Å; R89-A91 VanDerWaalsContact C-N 3.27Å; R89-A91 PolarHBondContact O-N 3.4Å; A91-A94 PolarHBondContact O-N 3.35Å; A91-K95 WeakPolarHBondContact O-CB 3.28Å; A91-K95 PolarHBondContact O-N 2.93Å
92	L	89.2	Confident	85.2	Confident	100 Å²	100	102.6 Å²	102.6	52%	0.524	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-39.8	177	-73.9	172.1	0	0	0	112.5	K88 R89 K95 H96	K88-L92 HydrophobicContact CG-CD1 4.27Å; K88-L92 WeakPolarHBondContact O-CG 3.05Å; K88-L92 PolarHBondContact O-N 2.87Å; R89-L92 PolarHBondContact O-N 2.97Å; L92-K95 PolarHBondContact O-N 2.9Å; L92-H96 WeakPolarHBondContact O-CB 3.36Å; L92-H96 PolarHBondContact O-N 3.45Å
93	I	90	Very high	84.1	Confident	97 Å²	97	104 Å²	104	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-44.9	176.1	-67.9	165.3	0	0	0	109.8	R89 A90 K95 H96 V97	R89-I93 WeakPolarHBondContact O-CB 3.44Å; R89-I93 VanDerWaalsContact O-CG1 3.28Å; R89-I93 WeakPolarHBondContact O-CG1 3.45Å; R89-I93 PolarHBondContact O-N 3.5Å; A90-I93 PolarHBondContact O-N 2.98Å; I93-K95 VanDerWaalsContact C-N 3.35Å; I93-K95 PolarHBondContact O-N 3.41Å; I93-H96 PolarHBondContact O-N 3Å; I93-V97 HydrophobicContact CG2-CG2 4.35Å; I93-V97 WeakPolarHBondContact O-CB 3.27Å; I93-V97 VanDerWaalsContact O-CG2 3.27Å; I93-V97 WeakPolarHBondContact O-CG2 3.44Å; I93-V97 PolarHBondContact O-N 3.27Å
94	A	91.2	Very high	82.8	Confident	47 Å²	47	109.9 Å²	109.9	39%	0.388	57%	0.566	S	S	.	*	H	α-helix	trans	-58.3	-46.7	176.4	0	0	0	0	0	111.6	A90 A91 H96 V97 E98	A90-A94 WeakPolarHBondContact O-CB 3.46Å; A90-A94 PolarHBondContact O-N 3.46Å; A91-A94 PolarHBondContact O-N 3.35Å; A94-H96 PolarHBondContact O-N 3.49Å; A94-V97 PolarHBondContact O-N 3.01Å; A94-E98 WeakPolarHBondContact O-CG 3.44Å; A94-E98 PolarHBondContact O-N 3.21Å
95	K	91.4	Very high	82.6	Confident	120 Å²	120	109.6 Å²	109.6	52%	0.522	57%	0.567	S	S	.	*	H	α-helix	trans	-60.2	-44.6	175.9	-175.5	179.1	173.2	-176.1	0	112.4	A91 L92 I93 V97 E98 E99	A91-K95 WeakPolarHBondContact O-CB 3.28Å; A91-K95 PolarHBondContact O-N 2.93Å; L92-K95 PolarHBondContact O-N 2.9Å; I93-K95 VanDerWaalsContact C-N 3.35Å; I93-K95 PolarHBondContact O-N 3.41Å; K95-V97 VanDerWaalsContact C-N 3.31Å; K95-V97 PolarHBondContact O-N 3.35Å; K95-E98 PolarHBondContact O-N 2.9Å; K95-E99 WeakPolarHBondContact CE-OE1 3.48Å; K95-E99 IonicContact NZ-OE1 2.7Å; K95-E99 WeakPolarHBondContact O-CG 3.28Å; K95-E99 PolarHBondContact O-N 3.36Å
96	H	89	Confident	82.6	Confident	117 Å²	117	110.5 Å²	110.5	54%	0.542	58%	0.578	S	S	.	*	H	α-helix	trans	-63.2	-39.6	177.2	-175.4	64.2	0	0	0	111.7	L92 I93 A94 E99 T100	L92-H96 WeakPolarHBondContact O-CB 3.36Å; L92-H96 PolarHBondContact O-N 3.45Å; I93-H96 PolarHBondContact O-N 3Å; A94-H96 PolarHBondContact O-N 3.49Å; H96-E99 PolarHBondContact O-N 3.41Å; H96-T100 WeakPolarHBondContact O-CG2 3.41Å; H96-T100 PolarHBondContact O-N 3.33Å; H96-T100 PolarHBondContact O-OG1 2.93Å
97	V	90.2	Very high	82.6	Confident	62 Å²	62	111.3 Å²	111.3	38%	0.376	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-43.3	176.6	169.7	0	0	0	0	111	I93 A94 K95 E99 T100 I101	I93-V97 HydrophobicContact CG2-CG2 4.35Å; I93-V97 WeakPolarHBondContact O-CB 3.27Å; I93-V97 VanDerWaalsContact O-CG2 3.27Å; I93-V97 WeakPolarHBondContact O-CG2 3.44Å; I93-V97 PolarHBondContact O-N 3.27Å; A94-V97 PolarHBondContact O-N 3.01Å; K95-V97 VanDerWaalsContact C-N 3.31Å; K95-V97 PolarHBondContact O-N 3.35Å; V97-E99 PolarHBondContact O-N 2.96Å; V97-T100 WeakPolarHBondContact CA-OG1 3.35Å; V97-T100 PolarHBondContact O-N 3.45Å; V97-T100 PolarHBondContact O-OG1 3.25Å; V97-I101 HydrophobicContact CG1-CD1 3.45Å; V97-I101 VanDerWaalsContact CG1-CD1 3.45Å; V97-I101 HydrophobicContact CG1-CG1 4.27Å; V97-I101 WeakPolarHBondContact O-CB 3.41Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.49Å; V97-I101 PolarHBondContact O-N 3.46Å
98	E	87.2	Confident	82.4	Confident	127 Å²	127	107.9 Å²	107.9	59%	0.593	58%	0.58	S	S	*	*	H	α-helix	trans	-59.1	-45.3	173.9	-73.3	170	-169.7	0	0	111.9	A94 K95 T100 I101 Q102	A94-E98 WeakPolarHBondContact O-CG 3.44Å; A94-E98 PolarHBondContact O-N 3.21Å; K95-E98 PolarHBondContact O-N 2.9Å; E98-T100 VanDerWaalsContact C-N 3.32Å; E98-T100 PolarHBondContact O-N 3.31Å; E98-I101 PolarHBondContact O-N 3.06Å; E98-Q102 WeakPolarHBondContact O-CB 3.42Å; E98-Q102 VanDerWaalsContact O-CG 3.28Å; E98-Q102 WeakPolarHBondContact O-CG 3.3Å; E98-Q102 PolarHBondContact O-N 2.84Å
99	E	85.3	Confident	82.1	Confident	117 Å²	117	105.7 Å²	105.7	55%	0.547	58%	0.578	S	S	.	*	H	α-helix	trans	-62.8	-34.8	176.8	-73.5	171.8	-179.9	0	0	112.7	K95 H96 V97	K95-E99 WeakPolarHBondContact CE-OE1 3.48Å; K95-E99 IonicContact NZ-OE1 2.7Å; K95-E99 WeakPolarHBondContact O-CG 3.28Å; K95-E99 PolarHBondContact O-N 3.36Å; H96-E99 PolarHBondContact O-N 3.41Å; V97-E99 PolarHBondContact O-N 2.96Å
100	T	84.1	Confident	81.8	Confident	88 Å²	88	105.3 Å²	105.3	54%	0.54	59%	0.588	S	S	.	*	H	α-helix	trans	-80.3	-27.7	177.8	57.7	0	0	0	0	114.3	H96 V97 E98	H96-T100 WeakPolarHBondContact O-CG2 3.41Å; H96-T100 PolarHBondContact O-N 3.33Å; H96-T100 PolarHBondContact O-OG1 2.93Å; V97-T100 WeakPolarHBondContact CA-OG1 3.35Å; V97-T100 PolarHBondContact O-N 3.45Å; V97-T100 PolarHBondContact O-OG1 3.25Å; E98-T100 VanDerWaalsContact C-N 3.32Å; E98-T100 PolarHBondContact O-N 3.31Å
101	I	77.2	Confident	81.4	Confident	118 Å²	118	108.6 Å²	108.6	61%	0.605	60%	0.595	S	S	*	*	H	α-helix	trans	-90.7	-17	-176.7	-66.8	174.9	0	0	0	111.6	V97 E98 P103	V97-I101 HydrophobicContact CG1-CD1 3.45Å; V97-I101 VanDerWaalsContact CG1-CD1 3.45Å; V97-I101 HydrophobicContact CG1-CG1 4.27Å; V97-I101 WeakPolarHBondContact O-CB 3.41Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.49Å; V97-I101 PolarHBondContact O-N 3.46Å; E98-I101 PolarHBondContact O-N 3.06Å; I101-P103 WeakPolarHBondContact O-CD 2.84Å
102	Q	57.5	Low	80.7	Confident	146 Å²	146	112.1 Å²	112.1	68%	0.682	60%	0.6	S	S	*	*			trans	-95.6	79.7	171.8	-63.2	-79.5	-11.8	0	0	109.9	E98 T104	E98-Q102 WeakPolarHBondContact O-CB 3.42Å; E98-Q102 VanDerWaalsContact O-CG 3.28Å; E98-Q102 WeakPolarHBondContact O-CG 3.3Å; E98-Q102 PolarHBondContact O-N 2.84Å; Q102-T104 PolarHBondContact O-N 3.25Å
103	P	59.5	Low	80	Confident	108 Å²	108	113.1 Å²	113.1	70%	0.701	61%	0.607	S	S	*	*			trans	-64.3	126.5	159.4	30.2	-30.2	0	0	0	106.6	I101	I101-P103 WeakPolarHBondContact O-CD 2.84Å
104	T	57.5	Low	79.1	Confident	210 Å²	210	114.5 Å²	114.5	100%	1.288	62%	0.617	S	S	*	*			trans	-52.7	0	164.9	-58	0	0	0	0	110.5	Q102	Q102-T104 PolarHBondContact O-N 3.25Å

Retrieved 104 of 104 residues in 143.6 ms (Link to these results)

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