A0A088QF11_HUMAN Loading...

Choline transporter-like protein

Choline transporter.

AlphaFold DB , UniProt , Accession A0A088QF11, Species HUMAN (Homo sapiens, Human), Gene SLC44A2, Length 704 aa.

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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	37	Very low	52.6	Low	196 Å²	196	111.5 Å²	111.5	97%	0.966	59%	0.586	S	S	*	*				0	-50.2	0	-81.5	-175	179.9	0	0	113.9	R5	M1-R5 PolarHBondContact O-N 3.04Å; M1-R5 VanDerWaalsContact O-N 3.14Å
2	E	35.8	Very low	54.4	Low	157 Å²	157	111.5 Å²	111.5	73%	0.734	59%	0.594	S	S	*	*	H	α-helix	trans	-70.1	-36.7	179.9	-138	179.5	175.7	0	0	113.8	K6	E2-K6 PolarHBondContact O-N 3.1Å
3	D	44.9	Very low	56	Low	121 Å²	121	106.9 Å²	106.9	65%	0.647	57%	0.574	S	S	*	*	H	α-helix	trans	-71.7	-32.8	174.9	-80.2	-25.6	0	0	0	113	N7	D3-N7 VanDerWaalsContact O-CG 3.31Å; D3-N7 PolarHBondContact O-N 3.32Å; D3-N7 PolarHBondContact O-ND2 3.24Å
4	E	44	Very low	57.5	Low	146 Å²	146	104.9 Å²	104.9	68%	0.682	56%	0.56	S	S	*	*	H	α-helix	trans	-72.8	-35.8	176.4	-73.2	178.8	145	0	0	112.3	N7	E4-N7 PolarHBondContact O-N 2.88Å
5	R	44.9	Very low	59	Low	223 Å²	223	109.5 Å²	109.5	84%	0.842	57%	0.572	S	S	*	*	H	α-helix	trans	-67	-35.3	174.2	-120.8	-179.2	-167.9	-175.5	3.9	112.4	M1 G8	M1-R5 PolarHBondContact O-N 3.04Å; M1-R5 VanDerWaalsContact O-N 3.14Å; R5-G8 PolarHBondContact O-N 3.47Å
6	K	49.5	Very low	60.2	Low	71 Å²	71	107.1 Å²	107.1	31%	0.309	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-34.4	176	-81.2	177.8	-179.7	167.9	0	113.1	E2 G8 A9 Y10	E2-K6 PolarHBondContact O-N 3.1Å; K6-G8 VanDerWaalsContact C-N 3.29Å; K6-G8 PolarHBondContact O-N 3.37Å; K6-A9 PolarHBondContact O-N 2.7Å; K6-Y10 PolarHBondContact O-N 2.81Å
7	N	53.3	Low	61.3	Low	59 Å²	59	104.9 Å²	104.9	32%	0.316	54%	0.543	S	S	.	.	H	α-helix	trans	-69.2	-23.5	179.9	-71	-21.7	0	0	0	113.3	D3 E4 G11	D3-N7 VanDerWaalsContact O-CG 3.31Å; D3-N7 PolarHBondContact O-N 3.32Å; D3-N7 PolarHBondContact O-ND2 3.24Å; E4-N7 PolarHBondContact O-N 2.88Å; N7-G11 CarbonylContact O-C 3.49Å; N7-G11 VanDerWaalsContact O-C 3.3Å
8	G	59.3	Low	61.9	Low	70 Å²	70	104.1 Å²	104.1	72%	0.722	55%	0.546	S	S	*	.	H	α-helix	trans	-73.5	-37.9	176.1	0	0	0	0	0	114.2	R5 K6	R5-G8 PolarHBondContact O-N 3.47Å; K6-G8 VanDerWaalsContact C-N 3.29Å; K6-G8 PolarHBondContact O-N 3.37Å
9	A	65.3	Low	62.6	Low	73 Å²	73	104.4 Å²	104.4	60%	0.603	55%	0.552	S	S	*	*	H	α-helix	trans	-84.5	-27.8	-175.3	0	0	0	0	0	114	K6	K6-A9 PolarHBondContact O-N 2.7Å
10	Y	74.2	Confident	63.6	Low	81 Å²	81	100.3 Å²	100.3	32%	0.318	53%	0.53	S	S	.	.	S	Bend	trans	-115.7	22.5	-175.2	-58.5	-67.2	0	0	0	113.5	K6 F580 M583	K6-Y10 PolarHBondContact O-N 2.81Å; Y10-F580 HydrophobicContact CD1-CD1 4.2Å; Y10-F580 HydrophobicContact CD1-CE1 4.42Å; Y10-F580 VanDerWaalsContact O-CB 3.27Å; Y10-F580 WeakPolarHBondContact O-CB 3.45Å; Y10-F580 WeakPolarHBondContact O-CD2 3.46Å; Y10-F580 WeakPolarHBondContact O-CG 3.36Å; Y10-M583 HydrophobicContact CD1-CB 3.65Å; Y10-M583 HydrophobicContact CD1-CG 4.16Å; Y10-M583 HydrophobicContact CD2-CB 4.29Å; Y10-M583 HydrophobicContact CE1-CB 3.81Å; Y10-M583 HydrophobicContact CE1-CG 3.97Å; Y10-M583 HydrophobicContact CE2-CB 4.43Å; Y10-M583 HydrophobicContact CG-CB 3.9Å
11	G	70.8	Confident	64	Low	30 Å²	30	103.9 Å²	103.9	31%	0.309	54%	0.541	S	S	.	.			trans	74.6	168.8	179.5	0	0	0	0	0	114.5	N7	N7-G11 CarbonylContact O-C 3.49Å; N7-G11 VanDerWaalsContact O-C 3.3Å
12	T	73.7	Confident	66.1	Low	111 Å²	111	94.7 Å²	94.7	68%	0.681	50%	0.497	S	S	*	.			trans	-81.8	149.1	-176.1	55.6	0	0	0	0	112.6
13	P	75	Confident	68.3	Low	52 Å²	52	87.6 Å²	87.6	34%	0.338	46%	0.464	S	S	.	.			trans	-43.9	140.7	166.5	-29.1	36.4	0	0	0	114.6	K15 E674	P13-K15 PolarHBondContact O-N 3.32Å; P13-E674 WeakPolarHBondContact CA-OE2 3.45Å; P13-E674 HydrophobicContact CB-CB 4.26Å; P13-E674 HydrophobicContact CB-CG 4.35Å
14	Q	77.4	Confident	70.1	Confident	79 Å²	79	85 Å²	85	37%	0.369	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-63.6	124.1	178.1	-165.3	67.1	18	0	0	109.3	E674 R675	Q14-E674 PolarHBondContact N-OE2 2.76Å; Q14-R675 HydrophobicContact CB-CG 4.11Å; Q14-R675 HydrophobicContact CG-CG 4.21Å
15	K	79.6	Confident	71.4	Confident	173 Å²	173	84.6 Å²	84.6	75%	0.752	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-71.4	149.7	-179.3	-64.3	-176.8	-179.2	-179.7	0	110.8	P13	P13-K15 PolarHBondContact O-N 3.32Å
16	Y	78.8	Confident	73	Confident	72 Å²	72	81.5 Å²	81.5	28%	0.282	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-62.3	132.8	173.4	177.2	-98.5	0	0	0	111	P18 N676 E681 R682	Y16-P18 HydrophobicContact CE1-CB 3.86Å; Y16-P18 HydrophobicContact CE1-CG 4.43Å; Y16-N676 WeakPolarHBondContact CD2-OD1 3.47Å; Y16-E681 PolarHBondContact OH-O 3.31Å; Y16-R682 HydrophobicContact CD1-CG 4.09Å; Y16-R682 VanDerWaalsContact CD1-NE 3.35Å; Y16-R682 HydrophobicContact CD2-CB 3.9Å; Y16-R682 HydrophobicContact CD2-CG 3.6Å; Y16-R682 HydrophobicContact CE1-CG 4.02Å; Y16-R682 HydrophobicContact CE2-CB 3.76Å; Y16-R682 HydrophobicContact CE2-CG 3.51Å; Y16-R682 HydrophobicContact CG-CG 3.89Å
17	D	78.8	Confident	74.7	Confident	69 Å²	69	79.4 Å²	79.4	37%	0.369	43%	0.433	S	S	.	.			trans	-125.4	113.3	175.2	176.7	-3.1	0	0	0	108.7	T19 F20	D17-T19 PolarHBondContact O-N 3.4Å; D17-T19 WeakPolarHBondContact OD1-CB 3.3Å; D17-T19 PolarHBondContact OD1-N 3.28Å; D17-T19 PolarHBondContact OD1-OG1 3.23Å; D17-T19 PolarHBondContact OD2-OG1 2.71Å; D17-F20 HydrophobicContact CB-CB 4.06Å; D17-F20 PolarHBondContact O-N 3.07Å
18	P	72.3	Confident	76.3	Confident	91 Å²	91	79 Å²	79	59%	0.591	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.3	-177.7	27.4	-34	0	0	0	113.5	Y16	Y16-P18 HydrophobicContact CE1-CB 3.86Å; Y16-P18 HydrophobicContact CE1-CG 4.43Å
19	T	75.5	Confident	77.8	Confident	109 Å²	109	79.2 Å²	79.2	67%	0.669	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-13.7	179.4	69.9	0	0	0	0	112.7	D17 K21	D17-T19 PolarHBondContact O-N 3.4Å; D17-T19 WeakPolarHBondContact OD1-CB 3.3Å; D17-T19 PolarHBondContact OD1-N 3.28Å; D17-T19 PolarHBondContact OD1-OG1 3.23Å; D17-T19 PolarHBondContact OD2-OG1 2.71Å; T19-K21 PolarHBondContact O-N 3.21Å
20	F	81.3	Confident	79.1	Confident	23 Å²	23	76.4 Å²	76.4	10%	0.101	41%	0.407	C	S	.	.			trans	-78.1	110.9	-177.7	-177.1	-96	0	0	0	111.6	D17 G22 W475 I566 Y567	D17-F20 HydrophobicContact CB-CB 4.06Å; D17-F20 PolarHBondContact O-N 3.07Å; F20-G22 WeakPolarHBondContact CE2-O 3.49Å; F20-W475 AromaticContact CE1-CD2 3.8Å; F20-W475 HydrophobicContact CE1-CD2 3.8Å; F20-W475 AromaticContact CE1-CE2 3.71Å; F20-W475 HydrophobicContact CE1-CE3 4.01Å; F20-W475 HydrophobicContact CE1-CG 4.39Å; F20-W475 HydrophobicContact CE1-CH2 4.07Å; F20-W475 AromaticContact CE1-CZ2 3.86Å; F20-W475 HydrophobicContact CE1-CZ2 3.86Å; F20-W475 HydrophobicContact CE1-CZ3 4.15Å; F20-W475 HydrophobicContact CZ-CZ2 4.43Å; F20-I566 HydrophobicContact CE2-CG2 4Å; F20-I566 HydrophobicContact CZ-CG2 3.7Å; F20-Y567 HydrophobicContact CE2-CD1 4.4Å; F20-Y567 HydrophobicContact CE2-CE1 4.11Å
21	K	72.6	Confident	80	Confident	176 Å²	176	74.6 Å²	74.6	77%	0.765	40%	0.403	S	S	*	.			trans	-115	26.4	177.3	-60.6	-176.1	-179.3	-178.5	0	112.6	T19	T19-K21 PolarHBondContact O-N 3.21Å
22	G	81	Confident	81.1	Confident	3 Å²	3	78.1 Å²	78.1	3%	0.031	41%	0.414	C	S	.	.	S	Bend	trans	105.2	-144.9	-176	0	0	0	0	0	113.2	F20 I24 W475	F20-G22 WeakPolarHBondContact CE2-O 3.49Å; G22-I24 PolarHBondContact O-N 3.36Å; G22-I24 VanDerWaalsContact O-N 3.13Å; G22-W475 VanDerWaalsContact CA-CG 3.47Å
23	P	81.9	Confident	82	Confident	7 Å²	7	79.8 Å²	79.8	5%	0.045	42%	0.417	C	S	.	.	S	Bend	trans	-54.4	119.9	-176.1	-28.8	37.7	0	0	0	112.7	Y25 A471 I566	P23-Y25 PolarHBondContact O-N 3.49Å; P23-A471 HydrophobicContact CG-CB 3.83Å; P23-I566 VanDerWaalsContact CA-O 3.28Å; P23-I566 WeakPolarHBondContact CA-O 3.44Å
24	I	82.3	Confident	82.9	Confident	66 Å²	66	78.6 Å²	78.6	34%	0.338	41%	0.409	S	S	.	.			trans	-63.2	131.8	-176.2	-60	179.8	0	0	0	109.3	G22 N26 R27 I566 Y567	G22-I24 PolarHBondContact O-N 3.36Å; G22-I24 VanDerWaalsContact O-N 3.13Å; I24-N26 WeakPolarHBondContact CG2-O 3.32Å; I24-R27 PolarHBondContact O-NE 3.11Å; I24-R27 PolarHBondContact O-NH2 3.19Å; I24-R27 VanDerWaalsContact O-NH2 3.1Å; I24-I566 PolarHBondContact N-O 2.65Å; I24-Y567 HydrophobicContact CD1-CD1 4.3Å
25	Y	72.9	Confident	83.7	Confident	139 Å²	139	76.3 Å²	76.3	55%	0.545	40%	0.402	S	S	.	.	S	Bend	trans	-85.9	-42.1	-179.9	-72	-80.7	0	0	0	112.8	P23 R27	P23-Y25 PolarHBondContact O-N 3.49Å; Y25-R27 PolarHBondContact O-N 2.86Å
26	N	78.1	Confident	84.4	Confident	157 Å²	157	71.6 Å²	71.6	84%	0.84	39%	0.388	S	S	*	.	S	Bend	trans	-80.9	105.7	176.8	-75.5	-14	0	0	0	110.2	I24	I24-N26 WeakPolarHBondContact CG2-O 3.32Å
27	R	85.4	Confident	85.2	Confident	28 Å²	28	73.3 Å²	73.3	11%	0.106	40%	0.397	C	S	.	.			trans	-129.1	148.6	-176.6	-58.6	-175.2	-176.8	-148.9	-6.2	111.7	I24 Y25 Y498 H499 I564 A565 I566 G568	I24-R27 PolarHBondContact O-NE 3.11Å; I24-R27 PolarHBondContact O-NH2 3.19Å; I24-R27 VanDerWaalsContact O-NH2 3.1Å; Y25-R27 PolarHBondContact O-N 2.86Å; R27-Y498 HydrophobicContact CB-CD1 4.41Å; R27-Y498 HydrophobicContact CB-CG 4.29Å; R27-Y498 WeakPolarHBondContact O-CE1 3.07Å; R27-H499 VanDerWaalsContact CD-NE2 3.34Å; R27-H499 WeakPolarHBondContact CD-NE2 3.49Å; R27-H499 PolarHBondContact NH1-NE2 3.44Å; R27-I564 PolarHBondContact NH1-O 2.97Å; R27-A565 PolarHBondContact NH1-O 2.97Å; R27-A565 PolarHBondContact NH2-O 2.94Å; R27-I566 PolarHBondContact NH2-O 2.88Å; R27-I566 VanDerWaalsContact NH2-O 3.08Å; R27-G568 VanDerWaalsContact NH1-CA 3.34Å
28	G	86.7	Confident	86	Confident	50 Å²	50	70.2 Å²	70.2	52%	0.515	38%	0.38	S	S	.	.			trans	-93.4	162.1	165.3	0	0	0	0	0	111.7
29	C	90.9	Very high	87.1	Confident	74 Å²	74	70.7 Å²	70.7	50%	0.5	38%	0.377	S	S	.	.			trans	-66.8	137.2	171.3	-62.4	0	0	0	0	110.6	I32 Y498	C29-I32 HydrophobicContact CB-CD1 4.05Å; C29-I32 HydrophobicContact CB-CG1 3.91Å; C29-Y498 CarbonylContact C-O 3.48Å; C29-Y498 WeakPolarHBondContact CA-O 3.46Å
30	T	91.5	Very high	88.1	Confident	14 Å²	14	71 Å²	71	9%	0.086	37%	0.374	C	S	.	.			trans	-111.3	142.5	-177.3	57.8	0	0	0	0	111.8	I32 Y498 H499 S502 G568	T30-I32 VanDerWaalsContact C-N 3.35Å; T30-I32 PolarHBondContact O-N 3.45Å; T30-Y498 PolarHBondContact N-O 3.47Å; T30-Y498 PolarHBondContact OG1-O 2.97Å; T30-H499 PolarHBondContact OG1-ND1 2.91Å; T30-S502 WeakPolarHBondContact CB-OG 3.28Å; T30-S502 PolarHBondContact OG1-OG 3.06Å; T30-G568 VanDerWaalsContact CG2-O 3.28Å; T30-G568 WeakPolarHBondContact CG2-O 3.32Å
31	D	93.1	Very high	88.8	Confident	43 Å²	43	70.5 Å²	70.5	23%	0.23	37%	0.374	C	S	.	.			trans	50.4	47.3	177.4	-57.1	-58.4	0	0	0	113.9	I33 C34 C35 G501 S502 N570 F571	D31-I33 PolarHBondContact O-N 3.1Å; D31-I33 VanDerWaalsContact O-N 3.14Å; D31-C34 HydrophobicContact CB-CB 4.37Å; D31-C34 WeakPolarHBondContact O-CB 3.5Å; D31-C34 PolarHBondContact O-N 3.38Å; D31-C35 PolarHBondContact O-N 2.78Å; D31-G501 VanDerWaalsContact O-CA 3.31Å; D31-G501 WeakPolarHBondContact O-CA 3.37Å; D31-S502 WeakPolarHBondContact OD2-CA 3.48Å; D31-S502 VanDerWaalsContact OD2-CB 3.25Å; D31-S502 WeakPolarHBondContact OD2-CB 3.49Å; D31-S502 PolarHBondContact OD2-OG 3.48Å; D31-N570 WeakPolarHBondContact OD1-CB 3.18Å; D31-N570 WeakPolarHBondContact OD2-CA 3.4Å; D31-N570 WeakPolarHBondContact OD2-CB 3.24Å; D31-F571 PolarHBondContact OD2-N 2.66Å
32	I	93.6	Very high	89.9	Confident	105 Å²	105	65 Å²	65	54%	0.538	35%	0.353	S	S	.	.	H	α-helix	trans	-53.7	-38.1	-173.4	-60	171.6	0	0	0	112.4	C29 T30 C34 C35 V36	C29-I32 HydrophobicContact CB-CD1 4.05Å; C29-I32 HydrophobicContact CB-CG1 3.91Å; T30-I32 VanDerWaalsContact C-N 3.35Å; T30-I32 PolarHBondContact O-N 3.45Å; I32-C34 VanDerWaalsContact C-N 3.29Å; I32-C34 PolarHBondContact O-N 3.03Å; I32-C35 WeakPolarHBondContact O-CA 3.23Å; I32-C35 VanDerWaalsContact O-CB 3.3Å; I32-C35 WeakPolarHBondContact O-CB 3.36Å; I32-C35 PolarHBondContact O-N 3.08Å; I32-V36 HydrophobicContact CG2-CG2 4.41Å; I32-V36 PolarHBondContact O-N 3.03Å
33	I	94.3	Very high	90.6	Very high	146 Å²	146	69.7 Å²	69.7	75%	0.749	38%	0.381	S	S	*	.	H	α-helix	trans	-58.2	-43	177.9	-60.9	174.1	0	0	0	110.9	D31 C35 V36 F37	D31-I33 PolarHBondContact O-N 3.1Å; D31-I33 VanDerWaalsContact O-N 3.14Å; I33-C35 VanDerWaalsContact C-N 3.3Å; I33-C35 PolarHBondContact O-N 2.67Å; I33-V36 PolarHBondContact O-N 3.1Å; I33-F37 WeakPolarHBondContact O-CB 3.18Å; I33-F37 PolarHBondContact O-N 3.19Å
34	C	93.4	Very high	91.2	Very high	26 Å²	26	70.7 Å²	70.7	18%	0.176	39%	0.392	C	S	.	.	H	α-helix	trans	-69.7	-30.5	178.1	-66.5	0	0	0	0	112	D31 I32 L38 G501 F505	D31-C34 HydrophobicContact CB-CB 4.37Å; D31-C34 WeakPolarHBondContact O-CB 3.5Å; D31-C34 PolarHBondContact O-N 3.38Å; I32-C34 VanDerWaalsContact C-N 3.29Å; I32-C34 PolarHBondContact O-N 3.03Å; C34-L38 WeakPolarHBondContact O-CB 3.37Å; C34-L38 PolarHBondContact O-N 3.34Å; C34-G501 WeakPolarHBondContact CB-O 3.23Å; C34-F505 HydrophobicContact CB-CB 4.06Å; C34-F505 WeakPolarHBondContact SG-CD2 3.13Å
35	C	93.8	Very high	91.9	Very high	32 Å²	32	68 Å²	68	22%	0.216	38%	0.378	C	S	.	.	H	α-helix	trans	-65.8	-47.6	172.4	-176.2	0	0	0	0	111.3	D31 I32 I33 F37 L38 L39	D31-C35 PolarHBondContact O-N 2.78Å; I32-C35 WeakPolarHBondContact O-CA 3.23Å; I32-C35 VanDerWaalsContact O-CB 3.3Å; I32-C35 WeakPolarHBondContact O-CB 3.36Å; I32-C35 PolarHBondContact O-N 3.08Å; I33-C35 VanDerWaalsContact C-N 3.3Å; I33-C35 PolarHBondContact O-N 2.67Å; C35-F37 VanDerWaalsContact C-N 3.33Å; C35-F37 PolarHBondContact O-N 3.13Å; C35-L38 PolarHBondContact O-N 2.89Å; C35-L39 WeakPolarHBondContact O-CG 3.34Å; C35-L39 PolarHBondContact O-N 2.82Å
36	V	95.2	Very high	92.9	Very high	74 Å²	74	64.8 Å²	64.8	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-44.4	175.8	174.7	0	0	0	0	110.7	I32 I33 L38 L39 L40	I32-V36 HydrophobicContact CG2-CG2 4.41Å; I32-V36 PolarHBondContact O-N 3.03Å; I33-V36 PolarHBondContact O-N 3.1Å; V36-L38 PolarHBondContact O-N 2.74Å; V36-L39 PolarHBondContact O-N 3.44Å; V36-L40 HydrophobicContact CG1-CD1 4.04Å; V36-L40 HydrophobicContact CG1-CG 4.39Å; V36-L40 WeakPolarHBondContact O-CG 3.28Å; V36-L40 PolarHBondContact O-N 3.44Å
37	F	95.4	Very high	93.7	Very high	107 Å²	107	59.4 Å²	59.4	47%	0.469	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-41.8	177.9	-173.5	-116.1	0	0	0	112.2	I33 C35 L40 A41 W453 L508	I33-F37 WeakPolarHBondContact O-CB 3.18Å; I33-F37 PolarHBondContact O-N 3.19Å; C35-F37 VanDerWaalsContact C-N 3.33Å; C35-F37 PolarHBondContact O-N 3.13Å; F37-L40 PolarHBondContact O-N 3.3Å; F37-A41 VanDerWaalsContact O-CB 3.26Å; F37-A41 WeakPolarHBondContact O-CB 3.37Å; F37-A41 PolarHBondContact O-N 3.04Å; F37-W453 AromaticContact CD1-CH2 3.23Å; F37-W453 HydrophobicContact CD1-CH2 3.23Å; F37-W453 AromaticContact CD1-CZ2 3.96Å; F37-W453 HydrophobicContact CD1-CZ2 3.96Å; F37-W453 HydrophobicContact CD1-CZ3 4.07Å; F37-W453 AromaticContact CE1-CH2 3.32Å; F37-W453 HydrophobicContact CE1-CH2 3.32Å; F37-W453 HydrophobicContact CE1-CZ2 4.24Å; F37-W453 AromaticContact CE1-CZ3 3.7Å; F37-W453 HydrophobicContact CE1-CZ3 3.7Å; F37-W453 HydrophobicContact CG-CH2 4.23Å; F37-W453 HydrophobicContact CZ-CH2 4.4Å; F37-W453 HydrophobicContact CZ-CZ3 4.49Å; F37-L508 HydrophobicContact CE1-CD2 4.39Å
38	L	95.3	Very high	94.1	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-44.3	174.4	179.7	65.9	0	0	0	111.7	C34 C35 V36 A41 I42 W453 L454 F457 T500 A504	C34-L38 WeakPolarHBondContact O-CB 3.37Å; C34-L38 PolarHBondContact O-N 3.34Å; C35-L38 PolarHBondContact O-N 2.89Å; V36-L38 PolarHBondContact O-N 2.74Å; L38-A41 PolarHBondContact O-N 2.86Å; L38-I42 HydrophobicContact CD1-CD1 4.22Å; L38-I42 HydrophobicContact CD1-CG1 4.42Å; L38-I42 HydrophobicContact CG-CD1 3.96Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.42Å; L38-I42 PolarHBondContact O-N 3.39Å; L38-W453 HydrophobicContact CB-CH2 4.38Å; L38-W453 HydrophobicContact CB-CZ2 4.17Å; L38-W453 HydrophobicContact CD1-CD2 4.23Å; L38-W453 HydrophobicContact CD1-CH2 4.19Å; L38-W453 HydrophobicContact CD1-CZ2 3.87Å; L38-L454 HydrophobicContact CD1-CD2 4.12Å; L38-F457 HydrophobicContact CD2-CD2 3.85Å; L38-F457 HydrophobicContact CD2-CE2 3.73Å; L38-F457 HydrophobicContact CD2-CG 4.33Å; L38-F457 HydrophobicContact CD2-CZ 4.15Å; L38-T500 HydrophobicContact CD2-CG2 4.34Å; L38-A504 HydrophobicContact CB-CB 3.98Å; L38-A504 HydrophobicContact CD2-CB 3.7Å; L38-A504 HydrophobicContact CG-CB 4.31Å
39	L	95.3	Very high	94.4	Very high	102 Å²	102	56.5 Å²	56.5	53%	0.534	33%	0.325	S	S	.	.	H	α-helix	trans	-62.7	-46.3	178.7	-70.9	173.2	0	0	0	111.7	C35 V36 A41 I42 V43	C35-L39 WeakPolarHBondContact O-CG 3.34Å; C35-L39 PolarHBondContact O-N 2.82Å; V36-L39 PolarHBondContact O-N 3.44Å; L39-A41 VanDerWaalsContact C-N 3.31Å; L39-A41 PolarHBondContact O-N 2.71Å; L39-I42 PolarHBondContact O-N 2.92Å; L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.28Å
40	L	96.3	Very high	94.5	Very high	114 Å²	114	57.3 Å²	57.3	60%	0.597	32%	0.323	S	S	*	.	H	α-helix	trans	-60.9	-41.4	175.4	-70	174.7	0	0	0	111.7	V36 F37 V43 G44	V36-L40 HydrophobicContact CG1-CD1 4.04Å; V36-L40 HydrophobicContact CG1-CG 4.39Å; V36-L40 WeakPolarHBondContact O-CG 3.28Å; V36-L40 PolarHBondContact O-N 3.44Å; F37-L40 PolarHBondContact O-N 3.3Å; L40-V43 PolarHBondContact O-N 3.49Å; L40-G44 PolarHBondContact O-N 2.92Å
41	A	95.5	Very high	94.5	Very high	13 Å²	13	60 Å²	60	11%	0.107	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-39	177.2	0	0	0	0	0	112.1	F37 L38 L39 G44 Y45 M450 W453	F37-A41 VanDerWaalsContact O-CB 3.26Å; F37-A41 WeakPolarHBondContact O-CB 3.37Å; F37-A41 PolarHBondContact O-N 3.04Å; L38-A41 PolarHBondContact O-N 2.86Å; L39-A41 VanDerWaalsContact C-N 3.31Å; L39-A41 PolarHBondContact O-N 2.71Å; A41-G44 PolarHBondContact O-N 3.38Å; A41-Y45 VanDerWaalsContact O-CB 3.26Å; A41-Y45 WeakPolarHBondContact O-CB 3.28Å; A41-Y45 PolarHBondContact O-N 3.45Å; A41-M450 HydrophobicContact CB-CE 3.8Å; A41-M450 HydrophobicContact CB-SD 3.86Å; A41-W453 HydrophobicContact CB-CE3 4.4Å; A41-W453 HydrophobicContact CB-CH2 4.07Å; A41-W453 HydrophobicContact CB-CZ3 3.53Å
42	I	95.6	Very high	94.3	Very high	62 Å²	62	58 Å²	58	32%	0.318	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-45.9	173.9	-70.7	166.4	0	0	0	110.5	L38 L39 G44 Y45 V46 L454	L38-I42 HydrophobicContact CD1-CD1 4.22Å; L38-I42 HydrophobicContact CD1-CG1 4.42Å; L38-I42 HydrophobicContact CG-CD1 3.96Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.42Å; L38-I42 PolarHBondContact O-N 3.39Å; L39-I42 PolarHBondContact O-N 2.92Å; I42-G44 PolarHBondContact O-N 2.71Å; I42-Y45 WeakPolarHBondContact O-CB 3.21Å; I42-Y45 PolarHBondContact O-N 2.98Å; I42-Y45 VanDerWaalsContact O-N 3.12Å; I42-V46 WeakPolarHBondContact O-CG2 3.35Å; I42-V46 PolarHBondContact O-N 3.29Å; I42-L454 HydrophobicContact CD1-CD2 4.07Å; I42-L454 HydrophobicContact CG1-CD2 3.94Å
43	V	96.1	Very high	94.1	Very high	101 Å²	101	58 Å²	58	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-60.7	-45.6	177	172.1	0	0	0	0	110.9	L39 L40 Y45 V46 A47	L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.28Å; L40-V43 PolarHBondContact O-N 3.49Å; V43-Y45 VanDerWaalsContact C-N 3.28Å; V43-Y45 PolarHBondContact O-N 2.97Å; V43-V46 PolarHBondContact O-N 2.88Å; V43-A47 PolarHBondContact O-N 3.27Å
44	G	95.1	Very high	93.9	Very high	28 Å²	28	55.7 Å²	55.7	29%	0.289	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-38.1	173.9	0	0	0	0	0	112.5	L40 A41 I42 A47 V48	L40-G44 PolarHBondContact O-N 2.92Å; A41-G44 PolarHBondContact O-N 3.38Å; I42-G44 PolarHBondContact O-N 2.71Å; G44-A47 WeakPolarHBondContact O-CB 3.28Å; G44-A47 PolarHBondContact O-N 2.96Å; G44-V48 WeakPolarHBondContact O-CG2 3.24Å; G44-V48 PolarHBondContact O-N 2.93Å
45	Y	95.9	Very high	93.5	Very high	10 Å²	10	59.9 Å²	59.9	4%	0.039	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-35.9	177.9	-170.1	-139.8	0	0	0	113.4	A41 I42 V43 V48 G49 Y375 W376 F446 N447 M450 L454	A41-Y45 VanDerWaalsContact O-CB 3.26Å; A41-Y45 WeakPolarHBondContact O-CB 3.28Å; A41-Y45 PolarHBondContact O-N 3.45Å; I42-Y45 WeakPolarHBondContact O-CB 3.21Å; I42-Y45 PolarHBondContact O-N 2.98Å; I42-Y45 VanDerWaalsContact O-N 3.12Å; V43-Y45 VanDerWaalsContact C-N 3.28Å; V43-Y45 PolarHBondContact O-N 2.97Å; Y45-V48 PolarHBondContact O-N 3.43Å; Y45-G49 PolarHBondContact O-N 3.02Å; Y45-Y375 HydrophobicContact CD1-CD1 4.03Å; Y45-Y375 AromaticContact CD1-CE1 3.63Å; Y45-Y375 HydrophobicContact CD1-CE1 3.63Å; Y45-Y375 HydrophobicContact CD2-CE1 4.17Å; Y45-Y375 AromaticContact CE1-CD1 3.27Å; Y45-Y375 HydrophobicContact CE1-CD1 3.27Å; Y45-Y375 AromaticContact CE1-CE1 3.29Å; Y45-Y375 HydrophobicContact CE1-CE1 3.29Å; Y45-Y375 HydrophobicContact CE1-CG 4.47Å; Y45-Y375 HydrophobicContact CE2-CD1 4.29Å; Y45-Y375 AromaticContact CE2-CE1 3.84Å; Y45-Y375 HydrophobicContact CE2-CE1 3.84Å; Y45-Y375 HydrophobicContact CG-CE1 4.07Å; Y45-Y375 AromaticContact CZ-CD1 3.43Å; Y45-Y375 VanDerWaalsContact CZ-CD1 3.43Å; Y45-Y375 AromaticContact CZ-CE1 3.4Å; Y45-Y375 VanDerWaalsContact CZ-CE1 3.4Å; Y45-Y375 PolarHBondContact O-OH 2.97Å; Y45-Y375 WeakPolarHBondContact OH-CD1 3.5Å; Y45-W376 WeakPolarHBondContact OH-CA 3.47Å; Y45-F446 HydrophobicContact CD2-CE1 4.11Å; Y45-N447 HydrophobicContact CE2-CB 4.23Å; Y45-N447 WeakPolarHBondContact CE2-OD1 3.3Å; Y45-N447 VanDerWaalsContact CZ-OD1 3.31Å; Y45-N447 PolarHBondContact OH-OD1 3.19Å; Y45-M450 HydrophobicContact CD1-CB 3.87Å; Y45-M450 HydrophobicContact CD1-CE 4.42Å; Y45-M450 HydrophobicContact CD1-CG 4.37Å; Y45-M450 HydrophobicContact CD2-CB 3.77Å; Y45-M450 HydrophobicContact CD2-CG 3.87Å; Y45-M450 HydrophobicContact CE1-CB 3.91Å; Y45-M450 HydrophobicContact CE2-CB 3.86Å; Y45-M450 HydrophobicContact CE2-CG 4.41Å; Y45-M450 HydrophobicContact CG-CB 3.79Å; Y45-M450 HydrophobicContact CG-CE 4.4Å; Y45-M450 HydrophobicContact CG-CG 3.86Å; Y45-L454 HydrophobicContact CD1-CD1 3.96Å; Y45-L454 HydrophobicContact CE1-CD1 4.01Å
46	V	95.4	Very high	93	Very high	70 Å²	70	58.8 Å²	58.8	42%	0.424	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-45.1	169.7	174.9	0	0	0	0	110.8	I42 V43 V48 G49 I50 Y375	I42-V46 WeakPolarHBondContact O-CG2 3.35Å; I42-V46 PolarHBondContact O-N 3.29Å; V43-V46 PolarHBondContact O-N 2.88Å; V46-V48 PolarHBondContact O-N 3.34Å; V46-G49 PolarHBondContact O-N 3.46Å; V46-G49 VanDerWaalsContact O-N 3.14Å; V46-I50 HydrophobicContact CG1-CD1 4.08Å; V46-I50 WeakPolarHBondContact O-CG1 3.24Å; V46-I50 PolarHBondContact O-N 2.72Å; V46-Y375 VanDerWaalsContact CA-OH 3.31Å; V46-Y375 WeakPolarHBondContact CA-OH 3.27Å
47	A	94.6	Very high	92.4	Very high	45 Å²	45	56.6 Å²	56.6	37%	0.372	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-42.6	176.8	0	0	0	0	0	112.5	V43 G44 G49 I50 I51	V43-A47 PolarHBondContact O-N 3.27Å; G44-A47 WeakPolarHBondContact O-CB 3.28Å; G44-A47 PolarHBondContact O-N 2.96Å; A47-G49 VanDerWaalsContact C-N 3.32Å; A47-G49 PolarHBondContact O-N 3.18Å; A47-I50 PolarHBondContact O-N 3.28Å; A47-I51 VanDerWaalsContact O-CG1 3.32Å; A47-I51 WeakPolarHBondContact O-CG1 3.41Å; A47-I51 PolarHBondContact O-N 3.43Å
48	V	93.4	Very high	91.7	Very high	16 Å²	16	53.5 Å²	53.5	10%	0.097	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-40.2	174.4	171.8	0	0	0	0	111.4	G44 Y45 V46 I51 A52 T379 L383 L443 F446	G44-V48 WeakPolarHBondContact O-CG2 3.24Å; G44-V48 PolarHBondContact O-N 2.93Å; Y45-V48 PolarHBondContact O-N 3.43Å; V46-V48 PolarHBondContact O-N 3.34Å; V48-I51 PolarHBondContact O-N 3.19Å; V48-A52 VanDerWaalsContact O-CB 3.28Å; V48-A52 WeakPolarHBondContact O-CB 3.43Å; V48-A52 PolarHBondContact O-N 3.49Å; V48-T379 HydrophobicContact CG1-CG2 4.37Å; V48-L383 HydrophobicContact CG1-CD1 4.26Å; V48-L443 HydrophobicContact CG1-CD2 4.29Å; V48-L443 HydrophobicContact CG2-CD2 3.94Å; V48-F446 HydrophobicContact CG2-CD1 4.01Å; V48-F446 HydrophobicContact CG2-CE1 3.96Å
49	G	93.4	Very high	91.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-47.4	174.2	0	0	0	0	0	112.1	Y45 V46 A47 I51 A52 W53	Y45-G49 PolarHBondContact O-N 3.02Å; V46-G49 PolarHBondContact O-N 3.46Å; V46-G49 VanDerWaalsContact O-N 3.14Å; A47-G49 VanDerWaalsContact C-N 3.32Å; A47-G49 PolarHBondContact O-N 3.18Å; G49-I51 PolarHBondContact O-N 3.04Å; G49-A52 WeakPolarHBondContact O-CB 3.4Å; G49-A52 PolarHBondContact O-N 2.92Å; G49-W53 WeakPolarHBondContact O-CB 3.21Å; G49-W53 PolarHBondContact O-N 3.22Å
50	I	93.4	Very high	90.1	Very high	91 Å²	91	56.2 Å²	56.2	47%	0.467	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-50.5	176.8	-65.8	166.8	0	0	0	110.6	V46 A47 A52 W53 T54	V46-I50 HydrophobicContact CG1-CD1 4.08Å; V46-I50 WeakPolarHBondContact O-CG1 3.24Å; V46-I50 PolarHBondContact O-N 2.72Å; A47-I50 PolarHBondContact O-N 3.28Å; I50-A52 VanDerWaalsContact C-N 3.3Å; I50-A52 PolarHBondContact O-N 3.17Å; I50-W53 PolarHBondContact O-N 2.83Å; I50-W53 VanDerWaalsContact O-N 3.14Å; I50-T54 HydrophobicContact CG2-CG2 4.36Å; I50-T54 WeakPolarHBondContact O-CG2 3.19Å; I50-T54 PolarHBondContact O-N 3.2Å; I50-T54 PolarHBondContact O-OG1 3.23Å
51	I	90.3	Very high	89	Confident	71 Å²	71	55.3 Å²	55.3	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-41.7	178.6	-65.5	165.8	0	0	0	111.1	A47 V48 G49 W53 T54 H55 Y436	A47-I51 VanDerWaalsContact O-CG1 3.32Å; A47-I51 WeakPolarHBondContact O-CG1 3.41Å; A47-I51 PolarHBondContact O-N 3.43Å; V48-I51 PolarHBondContact O-N 3.19Å; G49-I51 PolarHBondContact O-N 3.04Å; I51-W53 VanDerWaalsContact C-N 3.33Å; I51-W53 PolarHBondContact O-N 2.95Å; I51-T54 WeakPolarHBondContact CA-OG1 3.38Å; I51-T54 PolarHBondContact O-N 3.2Å; I51-T54 PolarHBondContact O-OG1 3.38Å; I51-H55 PolarHBondContact O-CD2 2.66Å; I51-H55 PolarHBondContact O-N 3.25Å; I51-Y436 HydrophobicContact CG2-CD2 4.3Å; I51-Y436 HydrophobicContact CG2-CE2 3.53Å
52	A	89.3	Confident	88	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-42.9	176.8	0	0	0	0	0	111.1	V48 G49 I50 G56 T379 F382 L383	V48-A52 VanDerWaalsContact O-CB 3.28Å; V48-A52 WeakPolarHBondContact O-CB 3.43Å; V48-A52 PolarHBondContact O-N 3.49Å; G49-A52 WeakPolarHBondContact O-CB 3.4Å; G49-A52 PolarHBondContact O-N 2.92Å; I50-A52 VanDerWaalsContact C-N 3.3Å; I50-A52 PolarHBondContact O-N 3.17Å; A52-G56 WeakPolarHBondContact O-CA 3.44Å; A52-G56 PolarHBondContact O-N 3.17Å; A52-T379 HydrophobicContact CB-CG2 4.19Å; A52-F382 HydrophobicContact CB-CB 4.03Å; A52-F382 WeakPolarHBondContact O-CB 3.38Å; A52-L383 HydrophobicContact CB-CD2 3.81Å; A52-L383 HydrophobicContact CB-CG 3.68Å
53	W	89.4	Confident	87.2	Confident	106 Å²	106	59 Å²	59	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-74	-28.1	-178.7	-59.9	-24.7	0	0	0	113.7	G49 I50 I51 Y375 F382	G49-W53 WeakPolarHBondContact O-CB 3.21Å; G49-W53 PolarHBondContact O-N 3.22Å; I50-W53 PolarHBondContact O-N 2.83Å; I50-W53 VanDerWaalsContact O-N 3.14Å; I51-W53 VanDerWaalsContact C-N 3.33Å; I51-W53 PolarHBondContact O-N 2.95Å; W53-Y375 HydrophobicContact CH2-CD2 4.35Å; W53-Y375 AromaticContact CH2-CE2 3.7Å; W53-Y375 HydrophobicContact CH2-CE2 3.7Å; W53-Y375 HydrophobicContact CZ2-CD2 4.4Å; W53-Y375 AromaticContact CZ2-CE2 3.97Å; W53-Y375 HydrophobicContact CZ2-CE2 3.97Å; W53-F382 HydrophobicContact CB-CD1 4.45Å; W53-F382 AromaticContact CD1-CD1 3.82Å; W53-F382 AromaticContact CD1-CD2 3.65Å; W53-F382 AromaticContact CD1-CG 3.5Å; W53-F382 VanDerWaalsContact CD1-CG 3.5Å
54	T	88.9	Confident	86.3	Confident	98 Å²	98	54.4 Å²	54.4	60%	0.601	29%	0.289	S	S	*	.	H	α-helix	trans	-76	-35.7	176.6	55.3	0	0	0	0	112.7	I50 I51	I50-T54 HydrophobicContact CG2-CG2 4.36Å; I50-T54 WeakPolarHBondContact O-CG2 3.19Å; I50-T54 PolarHBondContact O-N 3.2Å; I50-T54 PolarHBondContact O-OG1 3.23Å; I51-T54 WeakPolarHBondContact CA-OG1 3.38Å; I51-T54 PolarHBondContact O-N 3.2Å; I51-T54 PolarHBondContact O-OG1 3.38Å
55	H	85.4	Confident	85.5	Confident	113 Å²	113	53.7 Å²	53.7	52%	0.523	28%	0.279	S	S	.	.	H	α-helix	trans	-100.7	-25.6	-177.2	-67.6	-75.2	0	0	0	114	I51 Y436	I51-H55 PolarHBondContact O-CD2 2.66Å; I51-H55 PolarHBondContact O-N 3.25Å; H55-Y436 HydrophobicContact CB-CE1 4.44Å
56	G	83.8	Confident	84.9	Confident	10 Å²	10	53.2 Å²	53.2	10%	0.103	28%	0.278	C	S	.	.			trans	-74.2	134.7	-179.2	0	0	0	0	0	111.9	A52 F382	A52-G56 WeakPolarHBondContact O-CA 3.44Å; A52-G56 PolarHBondContact O-N 3.17Å; G56-F382 VanDerWaalsContact CA-O 3.27Å; G56-F382 WeakPolarHBondContact CA-O 3.01Å; G56-F382 WeakPolarHBondContact O-CD1 3.17Å
57	D	83.5	Confident	84.1	Confident	27 Å²	27	50.7 Å²	50.7	14%	0.144	26%	0.263	C	S	.	.			trans	-115.4	100.1	172	-171.3	-10.9	0	0	0	110.1	R59 K60 T385	D57-R59 VanDerWaalsContact CG-NE 3.34Å; D57-R59 PolarHBondContact O-N 3.07Å; D57-R59 WeakPolarHBondContact OD1-CB 3.46Å; D57-R59 VanDerWaalsContact OD1-CG 3.25Å; D57-R59 WeakPolarHBondContact OD1-CG 3.44Å; D57-R59 IonicContact OD1-CZ 3.57Å; D57-R59 PolarHBondContact OD1-N 3.03Å; D57-R59 IonicContact OD1-NE 2.98Å; D57-R59 PolarHBondContact OD1-NE 2.89Å; D57-R59 IonicContact OD1-NH2 2.93Å; D57-R59 IonicContact OD2-CZ 2.86Å; D57-R59 VanDerWaalsContact OD2-CZ 3.28Å; D57-R59 IonicContact OD2-NE 3.02Å; D57-R59 PolarHBondContact OD2-NE 3.05Å; D57-R59 IonicContact OD2-NH2 3.95Å; D57-R59 PolarHBondContact OD2-NH2 3.47Å; D57-K60 HydrophobicContact CB-CD 4.17Å; D57-K60 HydrophobicContact CB-CG 4.21Å; D57-K60 WeakPolarHBondContact O-CB 3.3Å; D57-K60 PolarHBondContact O-N 3.12Å; D57-T385 PolarHBondContact N-OG1 3.17Å; D57-T385 WeakPolarHBondContact O-CB 3.45Å; D57-T385 WeakPolarHBondContact O-CG2 2.99Å; D57-T385 PolarHBondContact O-OG1 3.27Å
58	P	80.8	Confident	83.3	Confident	43 Å²	43	54.3 Å²	54.3	28%	0.279	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.6	-177.6	27.6	-34.9	0	0	0	112.3	K60 V61 F382	P58-K60 PolarHBondContact O-N 3.35Å; P58-V61 PolarHBondContact O-N 3.23Å; P58-V61 VanDerWaalsContact O-N 3.16Å; P58-F382 HydrophobicContact CB-CE1 4.5Å; P58-F382 HydrophobicContact CB-CE2 4.43Å; P58-F382 HydrophobicContact CB-CZ 4.22Å; P58-F382 HydrophobicContact CG-CE1 3.85Å; P58-F382 HydrophobicContact CG-CE2 4.37Å; P58-F382 HydrophobicContact CG-CZ 3.7Å
59	R	81.4	Confident	82.4	Confident	110 Å²	110	54.6 Å²	54.6	42%	0.415	27%	0.273	S	S	.	.	H	α-helix	trans	-61.6	-29.9	175.7	-61	175	-69.9	-172.1	2.9	111.9	D57 V61 I62 Y63 F71	D57-R59 VanDerWaalsContact CG-NE 3.34Å; D57-R59 PolarHBondContact O-N 3.07Å; D57-R59 WeakPolarHBondContact OD1-CB 3.46Å; D57-R59 VanDerWaalsContact OD1-CG 3.25Å; D57-R59 WeakPolarHBondContact OD1-CG 3.44Å; D57-R59 IonicContact OD1-CZ 3.57Å; D57-R59 PolarHBondContact OD1-N 3.03Å; D57-R59 IonicContact OD1-NE 2.98Å; D57-R59 PolarHBondContact OD1-NE 2.89Å; D57-R59 IonicContact OD1-NH2 2.93Å; D57-R59 IonicContact OD2-CZ 2.86Å; D57-R59 VanDerWaalsContact OD2-CZ 3.28Å; D57-R59 IonicContact OD2-NE 3.02Å; D57-R59 PolarHBondContact OD2-NE 3.05Å; D57-R59 IonicContact OD2-NH2 3.95Å; D57-R59 PolarHBondContact OD2-NH2 3.47Å; R59-V61 PolarHBondContact O-N 3.24Å; R59-I62 PolarHBondContact O-N 2.83Å; R59-Y63 HydrophobicContact CB-CD2 4.01Å; R59-Y63 HydrophobicContact CG-CD2 4.49Å; R59-Y63 PolarHBondContact O-N 2.99Å; R59-F71 HydrophobicContact CB-CZ 4.4Å
60	K	75.6	Confident	82	Confident	53 Å²	53	57.7 Å²	57.7	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-22.2	177.4	-64.9	174.5	-173.4	165.4	0	113.5	D57 P58 F71 T385 N387 Y430	D57-K60 HydrophobicContact CB-CD 4.17Å; D57-K60 HydrophobicContact CB-CG 4.21Å; D57-K60 WeakPolarHBondContact O-CB 3.3Å; D57-K60 PolarHBondContact O-N 3.12Å; P58-K60 PolarHBondContact O-N 3.35Å; K60-F71 HydrophobicContact CG-CE1 4.12Å; K60-F71 HydrophobicContact CG-CZ 3.92Å; K60-T385 HydrophobicContact CB-CG2 4.11Å; K60-T385 WeakPolarHBondContact CD-O 3.41Å; K60-T385 PolarHBondContact NZ-O 3.46Å; K60-N387 PolarHBondContact NZ-O 2.93Å; K60-Y430 HydrophobicContact CD-CD1 4.15Å; K60-Y430 HydrophobicContact CD-CE1 3.86Å; K60-Y430 HydrophobicContact CG-CE1 4.33Å
61	V	72.4	Confident	81.6	Confident	95 Å²	95	54.7 Å²	54.7	58%	0.576	27%	0.271	S	S	*	.	H	α-helix	trans	-83	-34.6	173.1	-173.4	0	0	0	0	111.6	P58 R59 V381 T385	P58-V61 PolarHBondContact O-N 3.23Å; P58-V61 VanDerWaalsContact O-N 3.16Å; R59-V61 PolarHBondContact O-N 3.24Å; V61-V381 HydrophobicContact CG2-CG1 4.2Å; V61-T385 HydrophobicContact CG2-CG2 3.28Å
62	I	73.9	Confident	81.4	Confident	100 Å²	100	51.3 Å²	51.3	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-87.8	-40.4	-170.5	-59.4	170.9	0	0	0	111.6	R59	R59-I62 PolarHBondContact O-N 2.83Å
63	Y	79.4	Confident	81.2	Confident	51 Å²	51	52 Å²	52	20%	0.2	26%	0.262	C	S	.	.	S	Bend	trans	-109.8	126.8	-173.6	-62.5	-94.1	0	0	0	110.1	R59 C72 G73 Q74	R59-Y63 HydrophobicContact CB-CD2 4.01Å; R59-Y63 HydrophobicContact CG-CD2 4.49Å; R59-Y63 PolarHBondContact O-N 2.99Å; Y63-C72 WeakPolarHBondContact CD1-O 3.43Å; Y63-G73 WeakPolarHBondContact CE1-O 3.28Å; Y63-Q74 HydrophobicContact CD1-CB 3.89Å; Y63-Q74 HydrophobicContact CE1-CB 3.88Å; Y63-Q74 HydrophobicContact CE1-CG 4.47Å; Y63-Q74 HydrophobicContact CG-CB 4.46Å
64	P	77.6	Confident	80.9	Confident	6 Å²	6	48.1 Å²	48.1	4%	0.039	25%	0.248	C	C	.	.			trans	-70.7	157.1	168.4	28.3	-28.3	0	0	0	110.6	C72 L85 R168 R169	P64-C72 HydrophobicContact CG-CB 4.15Å; P64-C72 PolarHBondContact O-N 2.86Å; P64-L85 HydrophobicContact CB-CB 3.92Å; P64-L85 HydrophobicContact CB-CD2 4.03Å; P64-L85 HydrophobicContact CB-CG 4.44Å; P64-L85 HydrophobicContact CG-CB 4.01Å; P64-R168 HydrophobicContact CG-CB 3.79Å; P64-R168 WeakPolarHBondContact CG-O 3.44Å; P64-R169 HydrophobicContact CB-CG 4.43Å
65	T	78.1	Confident	80.6	Confident	12 Å²	12	51.6 Å²	51.6	7%	0.074	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-117.5	135.3	-175.8	-46.1	0	0	0	0	110	G69 E70 L85 Y430	T65-G69 VanDerWaalsContact CG2-O 3.26Å; T65-G69 WeakPolarHBondContact CG2-O 3.47Å; T65-E70 CarbonylContact C-O 3.59Å; T65-E70 WeakPolarHBondContact CA-O 3.42Å; T65-L85 WeakPolarHBondContact O-CD1 3.38Å; T65-Y430 PolarHBondContact OG1-OH 3.4Å
66	D	83.5	Confident	80.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.266	C	S	.	.			trans	-72.9	172	174.2	81.2	0.1	0	0	0	112.3	R68 G69 E70 L85 Q108	D66-R68 PolarHBondContact O-N 2.93Å; D66-R68 WeakPolarHBondContact OD1-CA 3.39Å; D66-R68 WeakPolarHBondContact OD1-CB 3.4Å; D66-R68 PolarHBondContact OD1-N 3.22Å; D66-R68 IonicContact OD2-CZ 2.97Å; D66-R68 IonicContact OD2-NE 2.78Å; D66-R68 PolarHBondContact OD2-NE 3.44Å; D66-R68 IonicContact OD2-NH2 3.85Å; D66-R68 PolarHBondContact OD2-NH2 3.35Å; D66-G69 PolarHBondContact O-N 3.31Å; D66-G69 PolarHBondContact OD1-N 2.66Å; D66-G69 VanDerWaalsContact OD1-N 3.08Å; D66-E70 PolarHBondContact N-O 2.9Å; D66-E70 WeakPolarHBondContact OD1-CB 3.33Å; D66-E70 PolarHBondContact OD1-N 2.53Å; D66-L85 HydrophobicContact CB-CD1 4.25Å; D66-Q108 WeakPolarHBondContact CB-O 3.39Å
67	S	78.4	Confident	80.3	Confident	16 Å²	16	50.9 Å²	50.9	11%	0.112	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-10.1	-179.9	-72	0	0	0	0	114.5	Q108 F427	S67-Q108 PolarHBondContact N-O 3.29Å; S67-Q108 PolarHBondContact OG-N 2.97Å; S67-F427 WeakPolarHBondContact O-CB 3.34Å; S67-F427 PolarHBondContact O-N 3.39Å
68	R	77.1	Confident	80.3	Confident	121 Å²	121	58.3 Å²	58.3	46%	0.457	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-7.2	175.7	-63.2	176.4	-63	172.1	9.2	112.5	D66 Y391	D66-R68 PolarHBondContact O-N 2.93Å; D66-R68 WeakPolarHBondContact OD1-CA 3.39Å; D66-R68 WeakPolarHBondContact OD1-CB 3.4Å; D66-R68 PolarHBondContact OD1-N 3.22Å; D66-R68 IonicContact OD2-CZ 2.97Å; D66-R68 IonicContact OD2-NE 2.78Å; D66-R68 PolarHBondContact OD2-NE 3.44Å; D66-R68 IonicContact OD2-NH2 3.85Å; D66-R68 PolarHBondContact OD2-NH2 3.35Å; R68-Y391 PolarHBondContact O-OH 3.27Å
69	G	75.6	Confident	80.5	Confident	23 Å²	23	56.6 Å²	56.6	24%	0.237	29%	0.291	C	S	.	.	S	Bend	trans	96.1	8.7	-178.2	0	0	0	0	0	114.3	T65 D66 Y391	T65-G69 VanDerWaalsContact CG2-O 3.26Å; T65-G69 WeakPolarHBondContact CG2-O 3.47Å; D66-G69 PolarHBondContact O-N 3.31Å; D66-G69 PolarHBondContact OD1-N 2.66Å; D66-G69 VanDerWaalsContact OD1-N 3.08Å; G69-Y391 WeakPolarHBondContact CA-OH 3.14Å
70	E	83.3	Confident	80.7	Confident	65 Å²	65	55.3 Å²	55.3	30%	0.304	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-91.6	136.2	-176.8	-62.2	-74.9	174.6	0	0	111.8	T65 D66 N79	T65-E70 CarbonylContact C-O 3.59Å; T65-E70 WeakPolarHBondContact CA-O 3.42Å; D66-E70 PolarHBondContact N-O 2.9Å; D66-E70 WeakPolarHBondContact OD1-CB 3.33Å; D66-E70 PolarHBondContact OD1-N 2.53Å; E70-N79 WeakPolarHBondContact CB-ND2 3.21Å
71	F	86.1	Confident	81.2	Confident	27 Å²	27	58.9 Å²	58.9	12%	0.118	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-74.9	131	178.2	-67.6	-64.8	0	0	0	112.5	R59 K60 Q74 T77 N79	R59-F71 HydrophobicContact CB-CZ 4.4Å; K60-F71 HydrophobicContact CG-CE1 4.12Å; K60-F71 HydrophobicContact CG-CZ 3.92Å; F71-Q74 HydrophobicContact CB-CB 4.02Å; F71-T77 PolarHBondContact O-OG1 2.86Å; F71-N79 WeakPolarHBondContact O-CB 3.3Å
72	C	86.3	Confident	82.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	121.6	176.6	-55.1	0	0	0	0	111.8	Y63 P64 K82 C110	Y63-C72 WeakPolarHBondContact CD1-O 3.43Å; P64-C72 HydrophobicContact CG-CB 4.15Å; P64-C72 PolarHBondContact O-N 2.86Å; C72-K82 CarbonylContact C-O 3.04Å; C72-K82 WeakPolarHBondContact CA-O 3.39Å; C72-K82 VanDerWaalsContact CB-O 3.3Å; C72-K82 WeakPolarHBondContact CB-O 3.46Å; C72-C110 WeakPolarHBondContact CA-SG 3.33Å; C72-C110 HydrophobicContact CB-CB 3.73Å; C72-C110 WeakPolarHBondContact CB-SG 3.29Å; C72-C110 VanDerWaalsContact SG-CA 3.54Å; C72-C110 WeakPolarHBondContact SG-CB 3.43Å; C72-C110 CovalentContact SG-SG 2.03Å; C72-C110 PolarHBondContact SG-SG 3.04Å
73	G	83.7	Confident	82.7	Confident	16 Å²	16	54.9 Å²	54.9	17%	0.165	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	14.1	173.5	0	0	0	0	0	115.8	Y63 N79 E80 K82	Y63-G73 WeakPolarHBondContact CE1-O 3.28Å; G73-N79 WeakPolarHBondContact CA-O 3.48Å; G73-N79 PolarHBondContact N-O 3.49Å; G73-E80 WeakPolarHBondContact CA-O 3.28Å; G73-K82 PolarHBondContact N-O 3.06Å
74	Q	84.9	Confident	83	Confident	24 Å²	24	55.5 Å²	55.5	11%	0.112	29%	0.288	C	S	.	.			trans	-82.8	132.3	175.3	-178.2	-179.3	-20.3	0	0	110.2	Y63 F71 G76 T77 E80	Y63-Q74 HydrophobicContact CD1-CB 3.89Å; Y63-Q74 HydrophobicContact CE1-CB 3.88Å; Y63-Q74 HydrophobicContact CE1-CG 4.47Å; Y63-Q74 HydrophobicContact CG-CB 4.46Å; F71-Q74 HydrophobicContact CB-CB 4.02Å; Q74-G76 PolarHBondContact O-N 3.42Å; Q74-T77 HydrophobicContact CB-CG2 3.89Å; Q74-T77 HydrophobicContact CG-CG2 3.9Å; Q74-T77 PolarHBondContact O-N 2.94Å; Q74-T77 PolarHBondContact O-OG1 3.33Å; Q74-T77 VanDerWaalsContact O-OG1 3.06Å; Q74-E80 WeakPolarHBondContact O-CA 3.2Å; Q74-E80 WeakPolarHBondContact O-CB 3.39Å
75	K	82.6	Confident	83.4	Confident	170 Å²	170	55.2 Å²	55.2	74%	0.739	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	134	175.9	-64.4	-168.4	174.6	-173.8	0	111.4
76	G	79.6	Confident	83.8	Confident	74 Å²	74	55.1 Å²	55.1	76%	0.763	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	9.8	-180	0	0	0	0	0	115.5	Q74 E80	Q74-G76 PolarHBondContact O-N 3.42Å; G76-E80 PolarHBondContact N-OE2 2.79Å
77	T	82.9	Confident	83.7	Confident	34 Å²	34	56.4 Å²	56.4	21%	0.209	29%	0.29	C	S	.	.	S	Bend	trans	-107.1	165.4	170.9	73.1	0	0	0	0	111.4	F71 Q74 N79 E80	F71-T77 PolarHBondContact O-OG1 2.86Å; Q74-T77 HydrophobicContact CB-CG2 3.89Å; Q74-T77 HydrophobicContact CG-CG2 3.9Å; Q74-T77 PolarHBondContact O-N 2.94Å; Q74-T77 PolarHBondContact O-OG1 3.33Å; Q74-T77 VanDerWaalsContact O-OG1 3.06Å; T77-N79 PolarHBondContact O-N 3.16Å; T77-E80 WeakPolarHBondContact O-CB 3.45Å; T77-E80 PolarHBondContact O-N 3.46Å; T77-E80 VanDerWaalsContact O-N 3.11Å
78	K	82.1	Confident	83.9	Confident	183 Å²	183	56.4 Å²	56.4	80%	0.796	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.4	177.8	-68.1	176	-177.7	165.5	0	113.5
79	N	85.1	Confident	83.8	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.043	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	23.9	-177.2	-67	-36.7	0	0	0	112.7	E70 F71 G73 T77 N81 K82 C110	E70-N79 WeakPolarHBondContact CB-ND2 3.21Å; F71-N79 WeakPolarHBondContact O-CB 3.3Å; G73-N79 WeakPolarHBondContact CA-O 3.48Å; G73-N79 PolarHBondContact N-O 3.49Å; T77-N79 PolarHBondContact O-N 3.16Å; N79-N81 VanDerWaalsContact C-N 3.31Å; N79-N81 PolarHBondContact O-N 2.64Å; N79-K82 HydrophobicContact CB-CB 4.3Å; N79-K82 CarbonylContact O-C 3.3Å; N79-K82 PolarHBondContact O-N 2.71Å; N79-C110 HydrophobicContact CB-CB 3.95Å; N79-C110 PolarHBondContact ND2-SG 3.11Å
80	E	85.9	Confident	83.6	Confident	82 Å²	82	54.2 Å²	54.2	38%	0.383	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-45.5	179.6	176.1	164.4	-170	0	0	113	G73 Q74 G76 T77 K82	G73-E80 WeakPolarHBondContact CA-O 3.28Å; Q74-E80 WeakPolarHBondContact O-CA 3.2Å; Q74-E80 WeakPolarHBondContact O-CB 3.39Å; G76-E80 PolarHBondContact N-OE2 2.79Å; T77-E80 WeakPolarHBondContact O-CB 3.45Å; T77-E80 PolarHBondContact O-N 3.46Å; T77-E80 VanDerWaalsContact O-N 3.11Å; E80-K82 PolarHBondContact O-N 2.8Å
81	N	87.7	Confident	82.8	Confident	128 Å²	128	52.9 Å²	52.9	68%	0.684	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	4.9	179.2	-62.8	-26.9	0	0	0	113.4	N79 P83	N79-N81 VanDerWaalsContact C-N 3.31Å; N79-N81 PolarHBondContact O-N 2.64Å; N81-P83 WeakPolarHBondContact O-CD 3.01Å
82	K	89.4	Confident	81.9	Confident	74 Å²	74	56.4 Å²	56.4	32%	0.322	29%	0.291	S	S	.	.			trans	-122.4	78.3	-175.3	-62.5	-169.7	-179.1	-171.9	0	110.7	C72 G73 N79 E80 Y84 C110 V111	C72-K82 CarbonylContact C-O 3.04Å; C72-K82 WeakPolarHBondContact CA-O 3.39Å; C72-K82 VanDerWaalsContact CB-O 3.3Å; C72-K82 WeakPolarHBondContact CB-O 3.46Å; G73-K82 PolarHBondContact N-O 3.06Å; N79-K82 HydrophobicContact CB-CB 4.3Å; N79-K82 CarbonylContact O-C 3.3Å; N79-K82 PolarHBondContact O-N 2.71Å; E80-K82 PolarHBondContact O-N 2.8Å; K82-Y84 PolarHBondContact O-N 3.48Å; K82-C110 HydrophobicContact CB-CB 3.81Å; K82-C110 VanDerWaalsContact CD-O 3.32Å; K82-C110 WeakPolarHBondContact CD-O 3.5Å; K82-V111 CarbonylContact C-O 3.18Å; K82-V111 WeakPolarHBondContact CA-O 3.18Å
83	P	87.1	Confident	80.8	Confident	37 Å²	37	57.4 Å²	57.4	24%	0.24	30%	0.298	C	S	.	.			trans	-82	-7	-169.7	33.4	-36.3	0	0	0	115.1	N81 R168	N81-P83 WeakPolarHBondContact O-CD 3.01Å; P83-R168 WeakPolarHBondContact O-CB 3.45Å
84	Y	86.5	Confident	79.5	Confident	65 Å²	65	58.1 Å²	58.1	26%	0.255	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.3	-175	-54	-65.6	0	0	0	112.3	K82 C110 V111 E112 P165 R168	K82-Y84 PolarHBondContact O-N 3.48Å; Y84-C110 CarbonylContact O-C 3.57Å; Y84-C110 VanDerWaalsContact O-CA 3.3Å; Y84-C110 WeakPolarHBondContact O-CA 3.45Å; Y84-V111 PolarHBondContact N-O 3.1Å; Y84-V111 VanDerWaalsContact N-O 3.11Å; Y84-V111 PolarHBondContact O-N 3.39Å; Y84-E112 WeakPolarHBondContact CD2-O 3.45Å; Y84-E112 WeakPolarHBondContact CE2-O 3.4Å; Y84-P165 HydrophobicContact CD1-CB 3.51Å; Y84-P165 HydrophobicContact CE1-CB 3.28Å; Y84-P165 HydrophobicContact CE1-CG 4.1Å; Y84-P165 HydrophobicContact CG-CB 4.27Å; Y84-R168 CarbonylContact C-O 3.39Å; Y84-R168 VanDerWaalsContact CA-O 3.32Å; Y84-R168 WeakPolarHBondContact CA-O 3.34Å
85	L	85.3	Confident	77.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.9	172.1	-170	77	0	0	0	110.7	P64 T65 D66 Q108 R168 R169 C170	P64-L85 HydrophobicContact CB-CB 3.92Å; P64-L85 HydrophobicContact CB-CD2 4.03Å; P64-L85 HydrophobicContact CB-CG 4.44Å; P64-L85 HydrophobicContact CG-CB 4.01Å; T65-L85 WeakPolarHBondContact O-CD1 3.38Å; D66-L85 HydrophobicContact CB-CD1 4.25Å; L85-Q108 HydrophobicContact CD1-CB 4.06Å; L85-Q108 HydrophobicContact CG-CB 4.34Å; L85-R168 PolarHBondContact N-O 3.35Å; L85-R169 HydrophobicContact CB-CG 4.15Å; L85-R169 HydrophobicContact CD2-CG 4.41Å; L85-R169 CarbonylContact O-C 3.53Å; L85-R169 WeakPolarHBondContact O-CA 3.45Å; L85-C170 PolarHBondContact O-N 3.44Å
86	F	86.1	Confident	75.8	Confident	10 Å²	10	56 Å²	56	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.8	177.9	175	-106.8	0	0	0	111.1	F88 Q108 I109 V111 P115 F136 P157 L160 C170	F86-F88 HydrophobicContact CD1-CD1 4.12Å; F86-F88 HydrophobicContact CD1-CE1 4.39Å; F86-F88 HydrophobicContact CE1-CD1 4Å; F86-F88 HydrophobicContact CE1-CE1 4.44Å; F86-Q108 VanDerWaalsContact O-CA 3.26Å; F86-Q108 WeakPolarHBondContact O-CA 3.41Å; F86-I109 HydrophobicContact CB-CG1 4.24Å; F86-I109 HydrophobicContact CD1-CD1 4.33Å; F86-I109 HydrophobicContact CD1-CG1 4.09Å; F86-I109 PolarHBondContact N-O 3.06Å; F86-I109 PolarHBondContact O-N 3.14Å; F86-V111 HydrophobicContact CB-CG1 3.88Å; F86-V111 HydrophobicContact CB-CG2 3.93Å; F86-P115 HydrophobicContact CD2-CG 4.27Å; F86-P115 HydrophobicContact CE2-CG 3.87Å; F86-F136 HydrophobicContact CD1-CB 4.4Å; F86-F136 HydrophobicContact CD1-CD1 4.22Å; F86-F136 HydrophobicContact CE1-CB 4.12Å; F86-F136 HydrophobicContact CE1-CD1 4.37Å; F86-F136 HydrophobicContact CG-CD1 4.3Å; F86-P157 HydrophobicContact CE1-CB 4.28Å; F86-P157 HydrophobicContact CE1-CG 4.06Å; F86-P157 HydrophobicContact CZ-CG 4.48Å; F86-L160 HydrophobicContact CE1-CD2 4.18Å; F86-L160 HydrophobicContact CZ-CD2 3.73Å; F86-C170 HydrophobicContact CD2-CB 4.1Å
87	Y	83.1	Confident	73.7	Confident	28 Å²	28	58.5 Å²	58.5	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.8	178	-61.7	-92.4	0	0	0	110.1	N89 I90 Q108 R169	Y87-N89 VanDerWaalsContact C-N 3.27Å; Y87-N89 PolarHBondContact O-N 3.01Å; Y87-I90 HydrophobicContact CD2-CD1 4.39Å; Y87-Q108 HydrophobicContact CD1-CG 3.55Å; Y87-Q108 HydrophobicContact CE1-CG 3.83Å; Y87-Q108 VanDerWaalsContact CE1-OE1 3.27Å; Y87-Q108 HydrophobicContact CG-CG 4.39Å; Y87-R169 HydrophobicContact CE2-CB 4.36Å; Y87-R169 PolarHBondContact OH-NH1 3.25Å
88	F	82.2	Confident	71.8	Confident	16 Å²	16	57.8 Å²	57.8	7%	0.07	30%	0.3	C	S	.	.	S	Bend	trans	-65	-33.2	179.8	-83.6	28	0	0	0	112.9	F86 P107 I109 F136 V138 G154 P157	F86-F88 HydrophobicContact CD1-CD1 4.12Å; F86-F88 HydrophobicContact CD1-CE1 4.39Å; F86-F88 HydrophobicContact CE1-CD1 4Å; F86-F88 HydrophobicContact CE1-CE1 4.44Å; F88-P107 HydrophobicContact CB-CB 4.41Å; F88-P107 WeakPolarHBondContact CB-O 3.5Å; F88-P107 HydrophobicContact CD1-CB 4.28Å; F88-P107 WeakPolarHBondContact CD1-O 3.36Å; F88-P107 HydrophobicContact CD2-CB 3.74Å; F88-P107 HydrophobicContact CD2-CG 3.95Å; F88-P107 HydrophobicContact CE2-CB 4.03Å; F88-P107 HydrophobicContact CE2-CG 4.44Å; F88-P107 HydrophobicContact CG-CB 3.88Å; F88-P107 HydrophobicContact CG-CG 4.37Å; F88-P107 HydrophobicContact CZ-CB 4.43Å; F88-P107 PolarHBondContact N-O 3.41Å; F88-I109 HydrophobicContact CE1-CD1 3.87Å; F88-I109 HydrophobicContact CE1-CG1 3.89Å; F88-I109 HydrophobicContact CE1-CG2 3.86Å; F88-I109 HydrophobicContact CZ-CG2 4.24Å; F88-F136 VanDerWaalsContact CE1-O 3.26Å; F88-F136 WeakPolarHBondContact CE1-O 3.42Å; F88-V138 HydrophobicContact CE2-CG1 4.42Å; F88-V138 HydrophobicContact CZ-CG1 4.07Å; F88-G154 WeakPolarHBondContact CE2-O 3.43Å; F88-P157 HydrophobicContact CB-CB 4.27Å; F88-P157 HydrophobicContact CD1-CB 4.48Å; F88-P157 HydrophobicContact CD2-CB 4.41Å; F88-P157 HydrophobicContact CG-CB 4.16Å
89	N	75	Confident	69.5	Low	65 Å²	65	54.9 Å²	54.9	35%	0.348	29%	0.292	S	S	.	.			trans	-147	101.2	171.2	-177.1	-25.8	0	0	0	109.6	Y87 V91 K92 T106	Y87-N89 VanDerWaalsContact C-N 3.27Å; Y87-N89 PolarHBondContact O-N 3.01Å; N89-V91 PolarHBondContact O-N 2.82Å; N89-V91 WeakPolarHBondContact OD1-CB 3.48Å; N89-V91 PolarHBondContact OD1-N 3.36Å; N89-K92 PolarHBondContact OD1-N 3.37Å; N89-T106 HydrophobicContact CB-CG2 3.98Å; N89-T106 VanDerWaalsContact O-CG2 3.28Å; N89-T106 WeakPolarHBondContact O-CG2 3.03Å; N89-T106 PolarHBondContact O-OG1 2.91Å
90	I	70.4	Confident	67	Low	33 Å²	33	61.4 Å²	61.4	17%	0.169	33%	0.327	C	S	.	.	S	Bend	trans	-72.5	-17.7	-178.7	-159.6	171.1	0	0	0	112.9	Y87 C93 F171 P172	Y87-I90 HydrophobicContact CD2-CD1 4.39Å; I90-C93 VanDerWaalsContact O-CB 3.31Å; I90-C93 WeakPolarHBondContact O-CB 3.22Å; I90-C93 PolarHBondContact O-N 3.29Å; I90-F171 HydrophobicContact CD1-CD1 3.64Å; I90-F171 HydrophobicContact CD1-CE1 4.02Å; I90-F171 HydrophobicContact CD1-CG 4.4Å; I90-P172 HydrophobicContact CD1-CG 4.35Å; I90-P172 HydrophobicContact CG2-CG 3.78Å
91	V	67.5	Low	64.7	Low	37 Å²	37	62.7 Å²	62.7	22%	0.224	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-74	-36.8	-178.5	-171.2	0	0	0	0	111.1	N89 C93 A94 L202	N89-V91 PolarHBondContact O-N 2.82Å; N89-V91 WeakPolarHBondContact OD1-CB 3.48Å; N89-V91 PolarHBondContact OD1-N 3.36Å; V91-C93 PolarHBondContact O-N 3.14Å; V91-C93 VanDerWaalsContact O-N 3.13Å; V91-A94 WeakPolarHBondContact O-CB 3.28Å; V91-A94 PolarHBondContact O-N 3.35Å; V91-L202 HydrophobicContact CG2-CD1 3.33Å; V91-L202 HydrophobicContact CG2-CG 4.21Å
92	K	66.6	Low	62.7	Low	100 Å²	100	65 Å²	65	44%	0.435	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-61.6	-19.5	172.6	-74.9	-169.4	174.7	-170.7	0	113	N89 P105 T106	N89-K92 PolarHBondContact OD1-N 3.37Å; K92-P105 HydrophobicContact CB-CG 4.4Å; K92-T106 HydrophobicContact CB-CG2 3.67Å; K92-T106 HydrophobicContact CD-CG2 3.89Å; K92-T106 HydrophobicContact CG-CG2 4.29Å
93	C	63.9	Low	61	Low	22 Å²	22	62.9 Å²	62.9	15%	0.149	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-83.2	-8.3	175.7	-70.8	0	0	0	0	114.5	I90 V91 V98 C104	I90-C93 VanDerWaalsContact O-CB 3.31Å; I90-C93 WeakPolarHBondContact O-CB 3.22Å; I90-C93 PolarHBondContact O-N 3.29Å; V91-C93 PolarHBondContact O-N 3.14Å; V91-C93 VanDerWaalsContact O-N 3.13Å; C93-V98 WeakPolarHBondContact O-CG1 3.29Å; C93-C104 HydrophobicContact CB-CB 4.29Å; C93-C104 WeakPolarHBondContact CB-SG 3.29Å; C93-C104 WeakPolarHBondContact SG-CB 3.06Å; C93-C104 CovalentContact SG-SG 2.03Å; C93-C104 PolarHBondContact SG-SG 3.4Å
94	A	55.1	Low	59.8	Low	31 Å²	31	62.9 Å²	62.9	26%	0.256	33%	0.329	S	S	.	.			trans	-92.9	-0.8	-172.9	0	0	0	0	0	114.1	V91	V91-A94 WeakPolarHBondContact O-CB 3.28Å; V91-A94 PolarHBondContact O-N 3.35Å
95	S	52	Low	58.8	Low	48 Å²	48	62.6 Å²	62.6	34%	0.336	34%	0.335	S	S	.	.	S	Bend	trans	-74.9	145.7	-175.9	74.6	0	0	0	0	112.5	L97 V98 L99	S95-L97 PolarHBondContact O-N 2.9Å; S95-L97 VanDerWaalsContact O-N 3.17Å; S95-V98 WeakPolarHBondContact O-CB 3.38Å; S95-V98 PolarHBondContact O-N 2.95Å; S95-V98 VanDerWaalsContact OG-CG2 3.22Å; S95-V98 WeakPolarHBondContact OG-CG2 3.25Å; S95-L99 PolarHBondContact O-N 3.37Å
96	P	37.8	Very low	58.3	Low	102 Å²	102	62.8 Å²	62.8	66%	0.662	34%	0.336	S	S	*	.	H	α-helix	trans	-58.6	-28.2	-179.9	-25.1	33.5	0	0	0	114.5	L99	P96-L99 PolarHBondContact O-N 3.01Å
97	L	37.1	Very low	57.9	Low	125 Å²	125	63.4 Å²	63.4	65%	0.654	34%	0.341	S	S	*	.	H	α-helix	trans	-66.4	-39.1	175.1	-115.1	86.8	0	0	0	112	S95 L99 L100 E101	S95-L97 PolarHBondContact O-N 2.9Å; S95-L97 VanDerWaalsContact O-N 3.17Å; L97-L99 VanDerWaalsContact C-N 3.29Å; L97-L99 PolarHBondContact O-N 2.8Å; L97-L100 PolarHBondContact O-N 3.3Å; L97-L100 VanDerWaalsContact O-N 3.16Å; L97-E101 PolarHBondContact O-N 2.81Å
98	V	42.7	Very low	58	Low	20 Å²	20	63.2 Å²	63.2	12%	0.121	34%	0.341	C	S	.	.	H	α-helix	trans	-67.3	-29.5	179.6	163.3	0	0	0	0	112	C93 S95 F102 Q103	C93-V98 WeakPolarHBondContact O-CG1 3.29Å; S95-V98 WeakPolarHBondContact O-CB 3.38Å; S95-V98 PolarHBondContact O-N 2.95Å; S95-V98 VanDerWaalsContact OG-CG2 3.22Å; S95-V98 WeakPolarHBondContact OG-CG2 3.25Å; V98-F102 WeakPolarHBondContact O-CA 3.18Å; V98-F102 PolarHBondContact O-N 3.49Å; V98-Q103 WeakPolarHBondContact CG1-O 3.46Å; V98-Q103 VanDerWaalsContact CG2-O 3.29Å; V98-Q103 WeakPolarHBondContact CG2-O 3.47Å; V98-Q103 PolarHBondContact O-N 2.81Å
99	L	33.7	Very low	58.3	Low	121 Å²	121	62.9 Å²	62.9	63%	0.634	34%	0.34	S	S	*	.	H	α-helix	trans	-72.4	-24.6	174	-81.6	163	0	0	0	113.8	S95 P96 L97	S95-L99 PolarHBondContact O-N 3.37Å; P96-L99 PolarHBondContact O-N 3.01Å; L97-L99 VanDerWaalsContact C-N 3.29Å; L97-L99 PolarHBondContact O-N 2.8Å
100	L	31.2	Very low	59.1	Low	146 Å²	146	60 Å²	60	76%	0.764	33%	0.325	S	S	*	.	H	α-helix	trans	-82.1	-30.2	175.2	-81.1	154.7	0	0	0	111.8	L97	L97-L100 PolarHBondContact O-N 3.3Å; L97-L100 VanDerWaalsContact O-N 3.16Å
101	E	39	Very low	60	Low	108 Å²	108	58.6 Å²	58.6	51%	0.505	32%	0.318	S	S	.	.	H	α-helix	trans	-102.9	-7.2	-176.1	-67.7	-170.6	168.7	0	0	114.8	L97 Q103	L97-E101 PolarHBondContact O-N 2.81Å; E101-Q103 HydrophobicContact CB-CB 4.21Å; E101-Q103 HydrophobicContact CB-CG 4.29Å; E101-Q103 WeakPolarHBondContact O-CG 3.23Å; E101-Q103 PolarHBondContact O-N 3.19Å; E101-Q103 PolarHBondContact O-NE2 3.02Å
102	F	45.1	Very low	61.1	Low	176 Å²	176	63.2 Å²	63.2	77%	0.772	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	31.4	-172.2	-69.3	-84	0	0	0	113.7	V98	V98-F102 WeakPolarHBondContact O-CA 3.18Å; V98-F102 PolarHBondContact O-N 3.49Å
103	Q	54.4	Low	62.2	Low	30 Å²	30	65.5 Å²	65.5	14%	0.14	35%	0.347	C	S	.	.			trans	-119.6	112.1	-171.4	-78.7	167.7	52.2	0	0	111.5	V98 E101 P105 F429	V98-Q103 WeakPolarHBondContact CG1-O 3.46Å; V98-Q103 VanDerWaalsContact CG2-O 3.29Å; V98-Q103 WeakPolarHBondContact CG2-O 3.47Å; V98-Q103 PolarHBondContact O-N 2.81Å; E101-Q103 HydrophobicContact CB-CB 4.21Å; E101-Q103 HydrophobicContact CB-CG 4.29Å; E101-Q103 WeakPolarHBondContact O-CG 3.23Å; E101-Q103 PolarHBondContact O-N 3.19Å; E101-Q103 PolarHBondContact O-NE2 3.02Å; Q103-P105 WeakPolarHBondContact O-CD 3.44Å; Q103-F429 HydrophobicContact CG-CD1 4.41Å
104	C	61.7	Low	63.3	Low	38 Å²	38	64.9 Å²	64.9	26%	0.257	34%	0.342	S	S	.	.			trans	-87.5	113.4	168.8	-92.7	0	0	0	0	109.8	C93 T106	C93-C104 HydrophobicContact CB-CB 4.29Å; C93-C104 WeakPolarHBondContact CB-SG 3.29Å; C93-C104 WeakPolarHBondContact SG-CB 3.06Å; C93-C104 CovalentContact SG-SG 2.03Å; C93-C104 PolarHBondContact SG-SG 3.4Å; C104-T106 PolarHBondContact O-N 2.97Å
105	P	65.7	Low	65	Low	58 Å²	58	63.4 Å²	63.4	38%	0.377	33%	0.33	S	S	.	.			trans	-81.1	49.8	-178.2	35.4	-36.9	0	0	0	111.3	K92 Q103	K92-P105 HydrophobicContact CB-CG 4.4Å; Q103-P105 WeakPolarHBondContact O-CD 3.44Å
106	T	73.1	Confident	66.6	Low	5 Å²	5	65 Å²	65	3%	0.031	34%	0.335	C	S	.	.	S	Bend	trans	-140.6	142.9	179.9	59	0	0	0	0	112.4	N89 K92 C104 Q108	N89-T106 HydrophobicContact CB-CG2 3.98Å; N89-T106 VanDerWaalsContact O-CG2 3.28Å; N89-T106 WeakPolarHBondContact O-CG2 3.03Å; N89-T106 PolarHBondContact O-OG1 2.91Å; K92-T106 HydrophobicContact CB-CG2 3.67Å; K92-T106 HydrophobicContact CD-CG2 3.89Å; K92-T106 HydrophobicContact CG-CG2 4.29Å; C104-T106 PolarHBondContact O-N 2.97Å; T106-Q108 PolarHBondContact O-N 3.43Å
107	P	79.5	Confident	68.8	Low	22 Å²	22	65.6 Å²	65.6	14%	0.143	32%	0.324	C	S	.	.			trans	-58.8	137.4	172	-23	32.6	0	0	0	111.6	F88	F88-P107 HydrophobicContact CB-CB 4.41Å; F88-P107 WeakPolarHBondContact CB-O 3.5Å; F88-P107 HydrophobicContact CD1-CB 4.28Å; F88-P107 WeakPolarHBondContact CD1-O 3.36Å; F88-P107 HydrophobicContact CD2-CB 3.74Å; F88-P107 HydrophobicContact CD2-CG 3.95Å; F88-P107 HydrophobicContact CE2-CB 4.03Å; F88-P107 HydrophobicContact CE2-CG 4.44Å; F88-P107 HydrophobicContact CG-CB 3.88Å; F88-P107 HydrophobicContact CG-CG 4.37Å; F88-P107 HydrophobicContact CZ-CB 4.43Å; F88-P107 PolarHBondContact N-O 3.41Å
108	Q	84.7	Confident	71	Confident	24 Å²	24	63.8 Å²	63.8	11%	0.112	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.3	-179.3	-64.4	166.9	65.2	0	0	108.6	D66 S67 L85 F86 Y87 T106	D66-Q108 WeakPolarHBondContact CB-O 3.39Å; S67-Q108 PolarHBondContact N-O 3.29Å; S67-Q108 PolarHBondContact OG-N 2.97Å; L85-Q108 HydrophobicContact CD1-CB 4.06Å; L85-Q108 HydrophobicContact CG-CB 4.34Å; F86-Q108 VanDerWaalsContact O-CA 3.26Å; F86-Q108 WeakPolarHBondContact O-CA 3.41Å; Y87-Q108 HydrophobicContact CD1-CG 3.55Å; Y87-Q108 HydrophobicContact CE1-CG 3.83Å; Y87-Q108 VanDerWaalsContact CE1-OE1 3.27Å; Y87-Q108 HydrophobicContact CG-CG 4.39Å; T106-Q108 PolarHBondContact O-N 3.43Å
109	I	89	Confident	73	Confident	9 Å²	9	63.6 Å²	63.6	5%	0.046	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	154.4	-179	63.7	166	0	0	0	111.2	F86 F88 V111 F136	F86-I109 HydrophobicContact CB-CG1 4.24Å; F86-I109 HydrophobicContact CD1-CD1 4.33Å; F86-I109 HydrophobicContact CD1-CG1 4.09Å; F86-I109 PolarHBondContact N-O 3.06Å; F86-I109 PolarHBondContact O-N 3.14Å; F88-I109 HydrophobicContact CE1-CD1 3.87Å; F88-I109 HydrophobicContact CE1-CG1 3.89Å; F88-I109 HydrophobicContact CE1-CG2 3.86Å; F88-I109 HydrophobicContact CZ-CG2 4.24Å; I109-V111 HydrophobicContact CD1-CG1 3.84Å; I109-V111 HydrophobicContact CG1-CG1 3.99Å; I109-F136 WeakPolarHBondContact CD1-O 3.41Å
110	C	90.1	Very high	75.3	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.034	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	134.6	169.1	-54.5	0	0	0	0	110.5	C72 N79 K82 Y84	C72-C110 WeakPolarHBondContact CA-SG 3.33Å; C72-C110 HydrophobicContact CB-CB 3.73Å; C72-C110 WeakPolarHBondContact CB-SG 3.29Å; C72-C110 VanDerWaalsContact SG-CA 3.54Å; C72-C110 WeakPolarHBondContact SG-CB 3.43Å; C72-C110 CovalentContact SG-SG 2.03Å; C72-C110 PolarHBondContact SG-SG 3.04Å; N79-C110 HydrophobicContact CB-CB 3.95Å; N79-C110 PolarHBondContact ND2-SG 3.11Å; K82-C110 HydrophobicContact CB-CB 3.81Å; K82-C110 VanDerWaalsContact CD-O 3.32Å; K82-C110 WeakPolarHBondContact CD-O 3.5Å; Y84-C110 CarbonylContact O-C 3.57Å; Y84-C110 VanDerWaalsContact O-CA 3.3Å; Y84-C110 WeakPolarHBondContact O-CA 3.45Å
111	V	90.4	Very high	77.8	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	152.5	178.1	-59.9	0	0	0	0	111.1	K82 Y84 F86 I109 K113 F136	K82-V111 CarbonylContact C-O 3.18Å; K82-V111 WeakPolarHBondContact CA-O 3.18Å; Y84-V111 PolarHBondContact N-O 3.1Å; Y84-V111 VanDerWaalsContact N-O 3.11Å; Y84-V111 PolarHBondContact O-N 3.39Å; F86-V111 HydrophobicContact CB-CG1 3.88Å; F86-V111 HydrophobicContact CB-CG2 3.93Å; I109-V111 HydrophobicContact CD1-CG1 3.84Å; I109-V111 HydrophobicContact CG1-CG1 3.99Å; V111-K113 WeakPolarHBondContact CG2-O 3.33Å; V111-F136 HydrophobicContact CB-CE1 4.45Å; V111-F136 HydrophobicContact CG1-CD1 3.93Å; V111-F136 HydrophobicContact CG1-CE1 4.26Å
112	E	89.9	Confident	79.8	Confident	133 Å²	133	50.4 Å²	50.4	62%	0.621	24%	0.242	S	C	*	.	S	Bend	trans	-73.4	-39.2	177.5	-178	174.5	175.6	0	0	111.8	Y84	Y84-E112 WeakPolarHBondContact CD2-O 3.45Å; Y84-E112 WeakPolarHBondContact CE2-O 3.4Å
113	K	89.6	Confident	81.5	Confident	149 Å²	149	46.7 Å²	46.7	65%	0.648	23%	0.229	S	C	*	.	S	Bend	trans	-139.3	141.3	179.5	-160	175.7	-178.2	-177.2	0	109.8	V111 F136	V111-K113 WeakPolarHBondContact CG2-O 3.33Å; K113-F136 WeakPolarHBondContact O-CE1 3.13Å
114	C	88.3	Confident	82.8	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.054	22%	0.223	C	C	.	.			trans	-66.7	149.6	172.3	-65.2	0	0	0	0	110.6	D116 S163 C170	C114-D116 PolarHBondContact O-N 2.93Å; C114-S163 WeakPolarHBondContact CB-O 3.45Å; C114-C170 WeakPolarHBondContact CA-SG 3.45Å; C114-C170 HydrophobicContact CB-CB 3.85Å; C114-C170 WeakPolarHBondContact CB-SG 3.4Å; C114-C170 WeakPolarHBondContact SG-CA 3.41Å; C114-C170 WeakPolarHBondContact SG-CB 3.27Å; C114-C170 CovalentContact SG-SG 2.05Å; C114-C170 PolarHBondContact SG-SG 3.34Å
115	P	89.1	Confident	83.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.224	C	C	.	.			trans	-60.8	131.5	-178.3	23.7	-33.2	0	0	0	111.1	F86 Y132 F136 L160 I161 P162 S163	F86-P115 HydrophobicContact CD2-CG 4.27Å; F86-P115 HydrophobicContact CE2-CG 3.87Å; P115-Y132 VanDerWaalsContact CA-OH 3.32Å; P115-Y132 WeakPolarHBondContact CA-OH 3.22Å; P115-F136 HydrophobicContact CB-CE1 3.98Å; P115-F136 HydrophobicContact CB-CE2 4.42Å; P115-F136 HydrophobicContact CB-CZ 3.87Å; P115-F136 HydrophobicContact CG-CE1 4.19Å; P115-L160 HydrophobicContact CB-CB 4.36Å; P115-I161 VanDerWaalsContact CG-O 3.31Å; P115-I161 WeakPolarHBondContact CG-O 3.38Å; P115-P162 CarbonylContact O-C 3.38Å; P115-P162 WeakPolarHBondContact O-CA 3.26Å; P115-S163 PolarHBondContact O-N 3.08Å
116	D	85.8	Confident	84.4	Confident	81 Å²	81	49 Å²	49	43%	0.433	24%	0.24	S	C	.	.			trans	-95.6	-18.7	-176.8	67.4	-9.7	0	0	0	113.8	C114 Y132	C114-D116 PolarHBondContact O-N 2.93Å; D116-Y132 PolarHBondContact N-OH 2.88Å; D116-Y132 PolarHBondContact OD1-OH 2.96Å
117	R	83.9	Confident	84.8	Confident	115 Å²	115	51 Å²	51	43%	0.434	25%	0.254	S	S	.	.	S	Bend	trans	-135.9	158.4	-173	70.8	-166.9	68.7	-165.6	-4	112.2	L119 Y132	R117-L119 HydrophobicContact CG-CD1 3.71Å; R117-L119 HydrophobicContact CG-CG 4.28Å; R117-Y132 HydrophobicContact CG-CE1 3.95Å
118	Y	84	Confident	84.9	Confident	88 Å²	88	61.9 Å²	61.9	35%	0.345	29%	0.292	S	S	.	.			trans	-84.7	127	177.6	-178.8	-90.7	0	0	0	110.9	T120 V159 L160 E190	Y118-T120 HydrophobicContact CE1-CG2 4.15Å; Y118-V159 HydrophobicContact CD2-CG2 4.08Å; Y118-V159 HydrophobicContact CE1-CG2 4.45Å; Y118-V159 HydrophobicContact CE2-CG2 3.36Å; Y118-L160 VanDerWaalsContact CA-O 3.32Å; Y118-L160 WeakPolarHBondContact CA-O 3.32Å; Y118-L160 WeakPolarHBondContact CD2-O 3.41Å; Y118-E190 WeakPolarHBondContact OH-CA 3.47Å; Y118-E190 WeakPolarHBondContact OH-CB 3.41Å; Y118-E190 PolarHBondContact OH-N 3.38Å; Y118-E190 PolarHBondContact OH-O 3.03Å; Y118-E190 VanDerWaalsContact OH-O 3.1Å
119	L	84.1	Confident	84.8	Confident	15 Å²	15	63.8 Å²	63.8	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	133.9	-179.6	-86	155.7	0	0	0	110.6	R117 A124 D129 Y132 Y133 V159 L160	R117-L119 HydrophobicContact CG-CD1 3.71Å; R117-L119 HydrophobicContact CG-CG 4.28Å; L119-A124 HydrophobicContact CD2-CB 4.38Å; L119-D129 HydrophobicContact CD1-CB 4.29Å; L119-D129 HydrophobicContact CD2-CB 3.97Å; L119-Y132 HydrophobicContact CD1-CD1 3.62Å; L119-Y132 HydrophobicContact CD1-CE1 3.73Å; L119-Y133 HydrophobicContact CB-CD2 4.08Å; L119-Y133 HydrophobicContact CB-CE2 4.24Å; L119-V159 CarbonylContact O-C 3.41Å; L119-V159 WeakPolarHBondContact O-CA 3.23Å; L119-L160 HydrophobicContact CB-CB 4.34Å; L119-L160 HydrophobicContact CB-CD1 4.39Å; L119-L160 PolarHBondContact N-O 3.45Å; L119-L160 PolarHBondContact O-N 2.91Å
120	T	83.4	Confident	84.7	Confident	6 Å²	6	64.6 Å²	64.6	4%	0.037	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	150.1	168	62	0	0	0	0	110	Y118 L122 N123 A124 V159	Y118-T120 HydrophobicContact CE1-CG2 4.15Å; T120-L122 VanDerWaalsContact C-N 3.27Å; T120-L122 PolarHBondContact O-N 2.63Å; T120-N123 PolarHBondContact O-N 2.9Å; T120-N123 WeakPolarHBondContact OG1-CB 3.47Å; T120-N123 PolarHBondContact OG1-ND2 3.47Å; T120-A124 WeakPolarHBondContact O-CB 3.33Å; T120-A124 PolarHBondContact O-N 2.93Å; T120-V159 HydrophobicContact CG2-CG2 4.29Å
121	Y	82.4	Confident	84.5	Confident	1 Å²	1	70 Å²	70	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-58.6	-38.7	179.7	177.8	-107.8	0	0	0	112.7	N123 A124 R125 F130 Y133 V147 V150 F151 C156 A158	Y121-N123 PolarHBondContact O-N 3.47Å; Y121-A124 PolarHBondContact O-N 2.88Å; Y121-R125 VanDerWaalsContact O-CB 3.27Å; Y121-R125 WeakPolarHBondContact O-CB 3.48Å; Y121-R125 PolarHBondContact O-N 2.95Å; Y121-F130 HydrophobicContact CE2-CE2 4.19Å; Y121-Y133 HydrophobicContact CD2-CD1 4.1Å; Y121-Y133 AromaticContact CD2-CE1 3.61Å; Y121-Y133 HydrophobicContact CD2-CE1 3.61Å; Y121-Y133 HydrophobicContact CG-CE1 4.41Å; Y121-V147 HydrophobicContact CD1-CG1 4.09Å; Y121-V147 HydrophobicContact CE1-CB 4.43Å; Y121-V147 HydrophobicContact CE1-CG1 4.09Å; Y121-V147 HydrophobicContact CE1-CG2 4.15Å; Y121-V150 HydrophobicContact CE1-CB 4.39Å; Y121-V150 HydrophobicContact CE1-CG1 4.17Å; Y121-V150 HydrophobicContact CE2-CG1 4.14Å; Y121-F151 AromaticContact CD1-CE1 3.84Å; Y121-F151 HydrophobicContact CD1-CE1 3.84Å; Y121-F151 HydrophobicContact CD1-CE2 4.28Å; Y121-F151 AromaticContact CD1-CZ 3.55Å; Y121-F151 HydrophobicContact CD1-CZ 3.55Å; Y121-F151 AromaticContact CG-CE1 3.89Å; Y121-F151 HydrophobicContact CG-CE1 3.89Å; Y121-F151 AromaticContact CG-CZ 3.87Å; Y121-F151 HydrophobicContact CG-CZ 3.87Å; Y121-C156 HydrophobicContact CD2-CB 4.26Å; Y121-C156 HydrophobicContact CE2-CB 4.31Å; Y121-A158 PolarHBondContact N-O 2.91Å
122	L	80.8	Confident	84.4	Confident	92 Å²	92	72.1 Å²	72.1	48%	0.482	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-43.3	179.1	-68.6	172.5	0	0	0	112.1	T120 S126 V147	T120-L122 VanDerWaalsContact C-N 3.27Å; T120-L122 PolarHBondContact O-N 2.63Å; L122-S126 PolarHBondContact O-OG 3.2Å; L122-S126 VanDerWaalsContact O-OG 3.06Å; L122-V147 HydrophobicContact CD2-CG1 3.82Å; L122-V147 HydrophobicContact CD2-CG2 4.11Å
123	N	81.4	Confident	84.3	Confident	97 Å²	97	65.8 Å²	65.8	52%	0.519	31%	0.309	S	S	.	.	H	α-helix	trans	-74.9	-35.8	178.6	-66.6	-8	0	0	0	111.4	T120 Y121 S126 S127	T120-N123 PolarHBondContact O-N 2.9Å; T120-N123 WeakPolarHBondContact OG1-CB 3.47Å; T120-N123 PolarHBondContact OG1-ND2 3.47Å; Y121-N123 PolarHBondContact O-N 3.47Å; N123-S126 PolarHBondContact O-OG 3.2Å; N123-S127 VanDerWaalsContact O-CB 3.24Å; N123-S127 WeakPolarHBondContact O-CB 3.42Å; N123-S127 PolarHBondContact O-N 3.41Å; N123-S127 PolarHBondContact O-OG 3.43Å
124	A	82.5	Confident	84.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.1	-41	177.7	0	0	0	0	0	112.2	L119 T120 Y121 S126 S127 F130 Y133	L119-A124 HydrophobicContact CD2-CB 4.38Å; T120-A124 WeakPolarHBondContact O-CB 3.33Å; T120-A124 PolarHBondContact O-N 2.93Å; Y121-A124 PolarHBondContact O-N 2.88Å; A124-S126 PolarHBondContact O-N 2.71Å; A124-S127 WeakPolarHBondContact CA-OG 3.31Å; A124-S127 PolarHBondContact O-N 3.46Å; A124-S127 PolarHBondContact O-OG 3.04Å; A124-F130 WeakPolarHBondContact O-CB 3.25Å; A124-F130 PolarHBondContact O-N 3.39Å; A124-Y133 HydrophobicContact CB-CD2 3.36Å; A124-Y133 HydrophobicContact CB-CE2 4.08Å; A124-Y133 HydrophobicContact CB-CG 3.62Å
125	R	81	Confident	84.2	Confident	73 Å²	73	67.3 Å²	67.3	28%	0.275	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-30.1	-178.3	-172.5	176.6	-173.7	159.5	11.3	113.4	Y121 F130 N143 K145 V147	Y121-R125 VanDerWaalsContact O-CB 3.27Å; Y121-R125 WeakPolarHBondContact O-CB 3.48Å; Y121-R125 PolarHBondContact O-N 2.95Å; R125-F130 HydrophobicContact CB-CD2 4.41Å; R125-N143 PolarHBondContact NE-OD1 3.07Å; R125-N143 PolarHBondContact NH2-OD1 3.21Å; R125-K145 PolarHBondContact NH1-O 3.37Å; R125-K145 VanDerWaalsContact NH1-O 3.11Å; R125-K145 PolarHBondContact NH2-O 3.01Å; R125-V147 VanDerWaalsContact NH1-CG2 3.31Å
126	S	78.6	Confident	84.2	Confident	103 Å²	103	67.4 Å²	67.4	72%	0.72	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-3.5	-178.4	53.1	0	0	0	0	113.7	L122 N123 A124	L122-S126 PolarHBondContact O-OG 3.2Å; L122-S126 VanDerWaalsContact O-OG 3.06Å; N123-S126 PolarHBondContact O-OG 3.2Å; A124-S126 PolarHBondContact O-N 2.71Å
127	S	82.3	Confident	84.3	Confident	47 Å²	47	63.8 Å²	63.8	33%	0.329	30%	0.299	S	S	.	.	S	Bend	trans	-119.1	175.1	-175.1	64.7	0	0	0	0	112.6	N123 A124 D129	N123-S127 VanDerWaalsContact O-CB 3.24Å; N123-S127 WeakPolarHBondContact O-CB 3.42Å; N123-S127 PolarHBondContact O-N 3.41Å; N123-S127 PolarHBondContact O-OG 3.43Å; A124-S127 WeakPolarHBondContact CA-OG 3.31Å; A124-S127 PolarHBondContact O-N 3.46Å; A124-S127 PolarHBondContact O-OG 3.04Å; S127-D129 PolarHBondContact O-N 2.99Å; S127-D129 PolarHBondContact OG-N 2.77Å
128	R	81	Confident	84.3	Confident	250 Å²	250	60.2 Å²	60.2	94%	0.943	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-10	174.6	-63.6	-177.4	-177.9	-179.7	0.7	112.9	F130	R128-F130 PolarHBondContact O-N 3.38Å
129	D	83.9	Confident	84.1	Confident	63 Å²	63	59.2 Å²	59.2	34%	0.337	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.7	-179.9	-64.5	-45	0	0	0	113.2	L119 S127 E131 Y132 Y133	L119-D129 HydrophobicContact CD1-CB 4.29Å; L119-D129 HydrophobicContact CD2-CB 3.97Å; S127-D129 PolarHBondContact O-N 2.99Å; S127-D129 PolarHBondContact OG-N 2.77Å; D129-E131 VanDerWaalsContact C-N 3.33Å; D129-E131 PolarHBondContact O-N 3.29Å; D129-Y132 WeakPolarHBondContact O-CB 3.34Å; D129-Y132 PolarHBondContact O-N 3.05Å; D129-Y133 PolarHBondContact O-N 2.71Å
130	F	85.6	Confident	83.7	Confident	26 Å²	26	62.1 Å²	62.1	11%	0.114	33%	0.327	C	S	.	.	H	α-helix	trans	-59.3	-39.9	-179.5	-170	-113	0	0	0	113.3	Y121 A124 R125 R128 Y132 Y133 K134 F141 N143	Y121-F130 HydrophobicContact CE2-CE2 4.19Å; A124-F130 WeakPolarHBondContact O-CB 3.25Å; A124-F130 PolarHBondContact O-N 3.39Å; R125-F130 HydrophobicContact CB-CD2 4.41Å; R128-F130 PolarHBondContact O-N 3.38Å; F130-Y132 VanDerWaalsContact C-N 3.32Å; F130-Y132 PolarHBondContact O-N 2.96Å; F130-Y133 PolarHBondContact O-N 3.15Å; F130-K134 HydrophobicContact CE1-CD 4.44Å; F130-K134 VanDerWaalsContact O-CB 3.26Å; F130-K134 WeakPolarHBondContact O-CB 3.49Å; F130-K134 PolarHBondContact O-N 3.43Å; F130-F141 HydrophobicContact CZ-CE1 4.2Å; F130-N143 HydrophobicContact CE1-CB 3.79Å; F130-N143 HydrophobicContact CZ-CB 3.64Å
131	E	86.1	Confident	83.6	Confident	120 Å²	120	62.5 Å²	62.5	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-66.7	-34.1	178.6	-78.3	-58.9	150.5	0	0	112.3	D129 K134	D129-E131 VanDerWaalsContact C-N 3.33Å; D129-E131 PolarHBondContact O-N 3.29Å; E131-K134 IonicContact OE1-NZ 3.3Å
132	Y	88.2	Confident	83.4	Confident	47 Å²	47	69.6 Å²	69.6	18%	0.184	36%	0.359	C	S	.	.	H	α-helix	trans	-67.8	-45.8	170.7	172	-97	0	0	0	110.8	P115 D116 R117 L119 D129 F130 K134 Q135 F136 L160	P115-Y132 VanDerWaalsContact CA-OH 3.32Å; P115-Y132 WeakPolarHBondContact CA-OH 3.22Å; D116-Y132 PolarHBondContact N-OH 2.88Å; D116-Y132 PolarHBondContact OD1-OH 2.96Å; R117-Y132 HydrophobicContact CG-CE1 3.95Å; L119-Y132 HydrophobicContact CD1-CD1 3.62Å; L119-Y132 HydrophobicContact CD1-CE1 3.73Å; D129-Y132 WeakPolarHBondContact O-CB 3.34Å; D129-Y132 PolarHBondContact O-N 3.05Å; F130-Y132 VanDerWaalsContact C-N 3.32Å; F130-Y132 PolarHBondContact O-N 2.96Å; Y132-K134 VanDerWaalsContact C-N 3.34Å; Y132-K134 PolarHBondContact O-N 3.46Å; Y132-Q135 WeakPolarHBondContact O-CB 3.44Å; Y132-Q135 PolarHBondContact O-N 2.83Å; Y132-F136 HydrophobicContact CD1-CE2 4.38Å; Y132-F136 AromaticContact CE1-CE2 3.85Å; Y132-F136 HydrophobicContact CE1-CE2 3.85Å; Y132-F136 HydrophobicContact CE2-CE2 4Å; Y132-F136 HydrophobicContact CE2-CZ 4.39Å; Y132-F136 AromaticContact CZ-CE2 3.64Å; Y132-F136 WeakPolarHBondContact O-CD2 3.39Å; Y132-L160 HydrophobicContact CE1-CD1 4.19Å
133	Y	87.9	Confident	83.2	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-41.2	-179.7	-163.2	-79.9	0	0	0	112.8	L119 Y121 A124 D129 F130 Q135 F136 C156 P157 A158 L160	L119-Y133 HydrophobicContact CB-CD2 4.08Å; L119-Y133 HydrophobicContact CB-CE2 4.24Å; Y121-Y133 HydrophobicContact CD2-CD1 4.1Å; Y121-Y133 AromaticContact CD2-CE1 3.61Å; Y121-Y133 HydrophobicContact CD2-CE1 3.61Å; Y121-Y133 HydrophobicContact CG-CE1 4.41Å; A124-Y133 HydrophobicContact CB-CD2 3.36Å; A124-Y133 HydrophobicContact CB-CE2 4.08Å; A124-Y133 HydrophobicContact CB-CG 3.62Å; D129-Y133 PolarHBondContact O-N 2.71Å; F130-Y133 PolarHBondContact O-N 3.15Å; Y133-Q135 PolarHBondContact O-N 3.38Å; Y133-Q135 VanDerWaalsContact O-N 3.12Å; Y133-F136 PolarHBondContact O-N 3.23Å; Y133-C156 HydrophobicContact CE1-CB 4.16Å; Y133-P157 HydrophobicContact CE1-CG 4.17Å; Y133-P157 PolarHBondContact OH-O 3.12Å; Y133-A158 PolarHBondContact OH-O 3.05Å; Y133-L160 HydrophobicContact CD2-CD1 3.46Å; Y133-L160 VanDerWaalsContact CD2-CD1 3.46Å; Y133-L160 HydrophobicContact CD2-CG 3.92Å; Y133-L160 HydrophobicContact CE2-CD1 3.69Å; Y133-L160 HydrophobicContact CE2-CD2 4.5Å; Y133-L160 HydrophobicContact CE2-CG 3.57Å; Y133-L160 HydrophobicContact CG-CD1 4.08Å
134	K	88	Confident	83.1	Confident	78 Å²	78	70 Å²	70	34%	0.339	36%	0.362	S	S	.	.	H	α-helix	trans	-59	-24.9	-178.8	-173.7	-179.8	175.9	-169.7	0	113.1	F130 E131 Y132 F136 C137 F141	F130-K134 HydrophobicContact CE1-CD 4.44Å; F130-K134 VanDerWaalsContact O-CB 3.26Å; F130-K134 WeakPolarHBondContact O-CB 3.49Å; F130-K134 PolarHBondContact O-N 3.43Å; E131-K134 IonicContact OE1-NZ 3.3Å; Y132-K134 VanDerWaalsContact C-N 3.34Å; Y132-K134 PolarHBondContact O-N 3.46Å; K134-F136 PolarHBondContact O-N 2.97Å; K134-C137 PolarHBondContact O-N 3.41Å; K134-C137 VanDerWaalsContact O-N 3.16Å; K134-F141 WeakPolarHBondContact CE-O 3.49Å
135	Q	87.9	Confident	83	Confident	111 Å²	111	73.2 Å²	73.2	52%	0.519	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.9	175	-59.2	-179.9	8.1	0	0	113	Y132 Y133	Y132-Q135 WeakPolarHBondContact O-CB 3.44Å; Y132-Q135 PolarHBondContact O-N 2.83Å; Y133-Q135 PolarHBondContact O-N 3.38Å; Y133-Q135 VanDerWaalsContact O-N 3.12Å
136	F	89.1	Confident	83	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.009	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	6	179.6	-56.7	-81.3	0	0	0	113.4	F86 F88 I109 V111 K113 P115 Y132 Y133 K134 P157 L160	F86-F136 HydrophobicContact CD1-CB 4.4Å; F86-F136 HydrophobicContact CD1-CD1 4.22Å; F86-F136 HydrophobicContact CE1-CB 4.12Å; F86-F136 HydrophobicContact CE1-CD1 4.37Å; F86-F136 HydrophobicContact CG-CD1 4.3Å; F88-F136 VanDerWaalsContact CE1-O 3.26Å; F88-F136 WeakPolarHBondContact CE1-O 3.42Å; I109-F136 WeakPolarHBondContact CD1-O 3.41Å; V111-F136 HydrophobicContact CB-CE1 4.45Å; V111-F136 HydrophobicContact CG1-CD1 3.93Å; V111-F136 HydrophobicContact CG1-CE1 4.26Å; K113-F136 WeakPolarHBondContact O-CE1 3.13Å; P115-F136 HydrophobicContact CB-CE1 3.98Å; P115-F136 HydrophobicContact CB-CE2 4.42Å; P115-F136 HydrophobicContact CB-CZ 3.87Å; P115-F136 HydrophobicContact CG-CE1 4.19Å; Y132-F136 HydrophobicContact CD1-CE2 4.38Å; Y132-F136 AromaticContact CE1-CE2 3.85Å; Y132-F136 HydrophobicContact CE1-CE2 3.85Å; Y132-F136 HydrophobicContact CE2-CE2 4Å; Y132-F136 HydrophobicContact CE2-CZ 4.39Å; Y132-F136 AromaticContact CZ-CE2 3.64Å; Y132-F136 WeakPolarHBondContact O-CD2 3.39Å; Y133-F136 PolarHBondContact O-N 3.23Å; K134-F136 PolarHBondContact O-N 2.97Å; F136-P157 HydrophobicContact CB-CG 4.34Å; F136-P157 VanDerWaalsContact O-CD 3.24Å; F136-P157 WeakPolarHBondContact O-CD 3.48Å; F136-L160 HydrophobicContact CB-CD1 4.47Å; F136-L160 HydrophobicContact CB-CD2 3.64Å; F136-L160 HydrophobicContact CD1-CD2 4.34Å; F136-L160 HydrophobicContact CD2-CD1 3.54Å; F136-L160 HydrophobicContact CD2-CD2 4.05Å; F136-L160 HydrophobicContact CD2-CG 4.47Å; F136-L160 HydrophobicContact CE2-CD1 4.04Å; F136-L160 HydrophobicContact CG-CD1 4.13Å; F136-L160 HydrophobicContact CG-CD2 3.74Å
137	C	87.6	Confident	83	Confident	6 Å²	6	69 Å²	69	4%	0.041	36%	0.361	C	S	.	.	S	Bend	trans	-93.1	168.9	173.2	-60.6	0	0	0	0	111.5	K134 F141 D155 C156	K134-C137 PolarHBondContact O-N 3.41Å; K134-C137 VanDerWaalsContact O-N 3.16Å; C137-F141 HydrophobicContact CB-CB 4.14Å; C137-F141 HydrophobicContact CB-CD1 4.09Å; C137-F141 HydrophobicContact CB-CG 4.27Å; C137-D155 CarbonylContact C-O 3.57Å; C137-D155 WeakPolarHBondContact CA-O 3.39Å; C137-D155 VanDerWaalsContact CB-O 3.28Å; C137-D155 WeakPolarHBondContact CB-O 3.48Å; C137-C156 HydrophobicContact CB-CB 4.11Å; C137-C156 WeakPolarHBondContact CB-SG 3.27Å; C137-C156 WeakPolarHBondContact SG-CB 3.24Å; C137-C156 CovalentContact SG-SG 2.04Å; C137-C156 PolarHBondContact SG-SG 2.99Å
138	V	84.2	Confident	82.6	Confident	40 Å²	40	70.6 Å²	70.6	24%	0.242	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-59.3	143.9	176.2	-62.1	0	0	0	0	111.2	F88 G140 F141 D155	F88-V138 HydrophobicContact CE2-CG1 4.42Å; F88-V138 HydrophobicContact CZ-CG1 4.07Å; V138-G140 PolarHBondContact O-N 3.42Å; V138-F141 HydrophobicContact CG2-CB 4.26Å; V138-F141 WeakPolarHBondContact O-CB 3.22Å; V138-F141 PolarHBondContact O-N 3.09Å; V138-D155 HydrophobicContact CG2-CB 4.05Å; V138-D155 WeakPolarHBondContact CG2-O 3.28Å; V138-D155 PolarHBondContact N-O 3.07Å
139	P	79.3	Confident	82.4	Confident	67 Å²	67	62.1 Å²	62.1	44%	0.435	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	129.8	-178	-27.9	39	0	0	0	112.4
140	G	75.6	Confident	82.3	Confident	75 Å²	75	59.1 Å²	59.1	77%	0.773	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	2.1	-179.5	0	0	0	0	0	115.2	V138 K142	V138-G140 PolarHBondContact O-N 3.42Å; G140-K142 PolarHBondContact O-N 2.88Å
141	F	82.6	Confident	81.9	Confident	15 Å²	15	60 Å²	60	7%	0.066	34%	0.336	C	S	.	.			trans	-58.4	134.4	176.9	179.2	-109.3	0	0	0	113.2	F130 K134 C137 V138 V150 D155 C156	F130-F141 HydrophobicContact CZ-CE1 4.2Å; K134-F141 WeakPolarHBondContact CE-O 3.49Å; C137-F141 HydrophobicContact CB-CB 4.14Å; C137-F141 HydrophobicContact CB-CD1 4.09Å; C137-F141 HydrophobicContact CB-CG 4.27Å; V138-F141 HydrophobicContact CG2-CB 4.26Å; V138-F141 WeakPolarHBondContact O-CB 3.22Å; V138-F141 PolarHBondContact O-N 3.09Å; F141-V150 HydrophobicContact CE2-CG1 4.23Å; F141-V150 HydrophobicContact CE2-CG2 3.86Å; F141-V150 HydrophobicContact CZ-CG1 4.02Å; F141-V150 HydrophobicContact CZ-CG2 3.74Å; F141-D155 HydrophobicContact CD2-CB 3.5Å; F141-D155 VanDerWaalsContact CD2-CB 3.5Å; F141-D155 HydrophobicContact CE2-CB 3.62Å; F141-D155 HydrophobicContact CG-CB 4.39Å; F141-C156 WeakPolarHBondContact CE1-SG 3.21Å
142	K	78.3	Confident	81.1	Confident	149 Å²	149	59.8 Å²	59.8	65%	0.648	33%	0.33	S	S	*	.			trans	-123.9	143	174.8	-65.3	-176.9	-179.1	179.4	0	109.8	G140 N144	G140-K142 PolarHBondContact O-N 2.88Å; K142-N144 PolarHBondContact O-N 3.29Å
143	N	77.1	Confident	80.3	Confident	57 Å²	57	59.5 Å²	59.5	31%	0.305	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	42.9	-174.4	-165.6	16.9	0	0	0	114	R125 F130	R125-N143 PolarHBondContact NE-OD1 3.07Å; R125-N143 PolarHBondContact NH2-OD1 3.21Å; F130-N143 HydrophobicContact CE1-CB 3.79Å; F130-N143 HydrophobicContact CZ-CB 3.64Å
144	N	79.3	Confident	79.7	Confident	141 Å²	141	59.9 Å²	59.9	75%	0.754	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-7	-171.9	-60.3	22.4	0	0	0	112.3	K142	K142-N144 PolarHBondContact O-N 3.29Å
145	K	80.3	Confident	79.4	Confident	68 Å²	68	57.3 Å²	57.3	30%	0.296	33%	0.326	S	S	.	.	S	Bend	trans	-98.1	153.1	-177.3	-67.9	176.7	171.2	-169	0	112.2	R125 E149 V150 D153 D155	R125-K145 PolarHBondContact NH1-O 3.37Å; R125-K145 VanDerWaalsContact NH1-O 3.11Å; R125-K145 PolarHBondContact NH2-O 3.01Å; K145-E149 HydrophobicContact CB-CB 4.42Å; K145-E149 HydrophobicContact CB-CG 4.12Å; K145-E149 HydrophobicContact CD-CG 4.1Å; K145-E149 HydrophobicContact CG-CG 4.27Å; K145-V150 HydrophobicContact CB-CG2 3.78Å; K145-D153 IonicContact NZ-OD2 2.69Å; K145-D153 PolarHBondContact NZ-OD2 3.47Å; K145-D155 WeakPolarHBondContact CD-OD2 3.5Å; K145-D155 IonicContact NZ-OD1 3.15Å; K145-D155 IonicContact NZ-OD2 3.25Å; K145-D155 PolarHBondContact NZ-OD2 2.89Å
146	G	80.4	Confident	79.3	Confident	40 Å²	40	52.2 Å²	52.2	41%	0.412	30%	0.302	S	S	.	.			trans	-64.5	155.1	172.8	0	0	0	0	0	112.1	A148 E149 V150	G146-A148 VanDerWaalsContact C-N 3.33Å; G146-A148 PolarHBondContact O-N 2.94Å; G146-E149 WeakPolarHBondContact O-CB 3.35Å; G146-E149 PolarHBondContact O-N 3.26Å; G146-E149 VanDerWaalsContact O-N 3.14Å; G146-V150 WeakPolarHBondContact O-CG2 3.21Å; G146-V150 PolarHBondContact O-N 3.44Å
147	V	78.5	Confident	79.2	Confident	47 Å²	47	52.2 Å²	52.2	29%	0.285	30%	0.303	S	S	.	.	H	α-helix	trans	-58.1	-44.5	-178.9	177.4	0	0	0	0	111.8	Y121 L122 R125 E149 V150 F151	Y121-V147 HydrophobicContact CD1-CG1 4.09Å; Y121-V147 HydrophobicContact CE1-CB 4.43Å; Y121-V147 HydrophobicContact CE1-CG1 4.09Å; Y121-V147 HydrophobicContact CE1-CG2 4.15Å; L122-V147 HydrophobicContact CD2-CG1 3.82Å; L122-V147 HydrophobicContact CD2-CG2 4.11Å; R125-V147 VanDerWaalsContact NH1-CG2 3.31Å; V147-E149 VanDerWaalsContact C-N 3.28Å; V147-E149 PolarHBondContact O-N 3Å; V147-V150 PolarHBondContact O-N 3.45Å; V147-F151 HydrophobicContact CG1-CD2 3.9Å; V147-F151 HydrophobicContact CG1-CE2 3.48Å; V147-F151 VanDerWaalsContact CG1-CE2 3.48Å; V147-F151 HydrophobicContact CG1-CZ 4.22Å; V147-F151 WeakPolarHBondContact O-CD2 3.32Å; V147-F151 PolarHBondContact O-N 3.22Å
148	A	74.3	Confident	78.9	Confident	80 Å²	80	53 Å²	53	66%	0.661	31%	0.309	S	S	*	.	H	α-helix	trans	-62.1	-37.1	178.1	0	0	0	0	0	112.1	G146 R152	G146-A148 VanDerWaalsContact C-N 3.33Å; G146-A148 PolarHBondContact O-N 2.94Å; A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 PolarHBondContact O-N 3.28Å
149	E	76.6	Confident	78.9	Confident	73 Å²	73	51.9 Å²	51.9	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-70.5	-38.2	177.5	178.4	163.6	-126.4	0	0	112.2	K145 G146 V147 F151 R152 D153	K145-E149 HydrophobicContact CB-CB 4.42Å; K145-E149 HydrophobicContact CB-CG 4.12Å; K145-E149 HydrophobicContact CD-CG 4.1Å; K145-E149 HydrophobicContact CG-CG 4.27Å; G146-E149 WeakPolarHBondContact O-CB 3.35Å; G146-E149 PolarHBondContact O-N 3.26Å; G146-E149 VanDerWaalsContact O-N 3.14Å; V147-E149 VanDerWaalsContact C-N 3.28Å; V147-E149 PolarHBondContact O-N 3Å; E149-F151 PolarHBondContact O-N 2.89Å; E149-R152 PolarHBondContact O-N 3.3Å; E149-R152 IonicContact OE1-NH2 3.64Å; E149-R152 PolarHBondContact OE1-NH2 2.94Å; E149-D153 WeakPolarHBondContact O-CB 3.47Å; E149-D153 PolarHBondContact O-N 2.9Å
150	V	80.8	Confident	79.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-41.6	176.3	171	0	0	0	0	112.2	Y121 F141 K145 G146 V147 G154 D155 C156	Y121-V150 HydrophobicContact CE1-CB 4.39Å; Y121-V150 HydrophobicContact CE1-CG1 4.17Å; Y121-V150 HydrophobicContact CE2-CG1 4.14Å; F141-V150 HydrophobicContact CE2-CG1 4.23Å; F141-V150 HydrophobicContact CE2-CG2 3.86Å; F141-V150 HydrophobicContact CZ-CG1 4.02Å; F141-V150 HydrophobicContact CZ-CG2 3.74Å; K145-V150 HydrophobicContact CB-CG2 3.78Å; G146-V150 WeakPolarHBondContact O-CG2 3.21Å; G146-V150 PolarHBondContact O-N 3.44Å; V147-V150 PolarHBondContact O-N 3.45Å; V150-G154 WeakPolarHBondContact O-CA 3.33Å; V150-G154 PolarHBondContact O-N 3.47Å; V150-D155 HydrophobicContact CG1-CB 4.26Å; V150-D155 PolarHBondContact O-N 3.25Å; V150-C156 HydrophobicContact CG1-CB 3.86Å
151	F	77.9	Confident	79.5	Confident	44 Å²	44	46 Å²	46	19%	0.193	25%	0.25	C	C	.	.	H	α-helix	trans	-76	-37.9	176.4	-62.1	-39.6	0	0	0	112.4	Y121 V147 E149 D153 G154 A158	Y121-F151 AromaticContact CD1-CE1 3.84Å; Y121-F151 HydrophobicContact CD1-CE1 3.84Å; Y121-F151 HydrophobicContact CD1-CE2 4.28Å; Y121-F151 AromaticContact CD1-CZ 3.55Å; Y121-F151 HydrophobicContact CD1-CZ 3.55Å; Y121-F151 AromaticContact CG-CE1 3.89Å; Y121-F151 HydrophobicContact CG-CE1 3.89Å; Y121-F151 AromaticContact CG-CZ 3.87Å; Y121-F151 HydrophobicContact CG-CZ 3.87Å; V147-F151 HydrophobicContact CG1-CD2 3.9Å; V147-F151 HydrophobicContact CG1-CE2 3.48Å; V147-F151 VanDerWaalsContact CG1-CE2 3.48Å; V147-F151 HydrophobicContact CG1-CZ 4.22Å; V147-F151 WeakPolarHBondContact O-CD2 3.32Å; V147-F151 PolarHBondContact O-N 3.22Å; E149-F151 PolarHBondContact O-N 2.89Å; F151-D153 VanDerWaalsContact C-N 3.33Å; F151-D153 PolarHBondContact O-N 3.46Å; F151-G154 PolarHBondContact O-N 3.06Å; F151-G154 VanDerWaalsContact O-N 3.1Å; F151-A158 HydrophobicContact CD1-CB 4.49Å; F151-A158 HydrophobicContact CE1-CB 4.06Å; F151-A158 HydrophobicContact CZ-CB 4.34Å
152	R	70	Confident	79.5	Confident	116 Å²	116	46.1 Å²	46.1	44%	0.438	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-37	174.9	-175.6	-165	67.2	-162.2	-1.3	112.4	A148 E149 G154 R424	A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 PolarHBondContact O-N 3.28Å; E149-R152 PolarHBondContact O-N 3.3Å; E149-R152 IonicContact OE1-NH2 3.64Å; E149-R152 PolarHBondContact OE1-NH2 2.94Å; R152-G154 VanDerWaalsContact C-N 3.3Å; R152-R424 VanDerWaalsContact C-NH2 3.35Å; R152-R424 PolarHBondContact O-NH2 3.49Å
153	D	71.4	Confident	79.5	Confident	40 Å²	40	39.7 Å²	39.7	21%	0.214	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-8.2	176.4	-61.2	1.4	0	0	0	111.2	K145 E149 F151 D155 R424	K145-D153 IonicContact NZ-OD2 2.69Å; K145-D153 PolarHBondContact NZ-OD2 3.47Å; E149-D153 WeakPolarHBondContact O-CB 3.47Å; E149-D153 PolarHBondContact O-N 2.9Å; F151-D153 VanDerWaalsContact C-N 3.33Å; F151-D153 PolarHBondContact O-N 3.46Å; D153-D155 PolarHBondContact O-N 3.27Å; D153-R424 VanDerWaalsContact C-NH1 3.34Å; D153-R424 PolarHBondContact O-NE 3.39Å; D153-R424 PolarHBondContact O-NH1 2.94Å; D153-R424 PolarHBondContact O-NH2 3.46Å
154	G	73.8	Confident	79.5	Confident	8 Å²	8	41.3 Å²	41.3	8%	0.082	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	42.9	-179.7	0	0	0	0	0	111.9	F88 V150 F151 R152 C156	F88-G154 WeakPolarHBondContact CE2-O 3.43Å; V150-G154 WeakPolarHBondContact O-CA 3.33Å; V150-G154 PolarHBondContact O-N 3.47Å; F151-G154 PolarHBondContact O-N 3.06Å; F151-G154 VanDerWaalsContact O-N 3.1Å; R152-G154 VanDerWaalsContact C-N 3.3Å; G154-C156 VanDerWaalsContact C-N 3.3Å
155	D	82.5	Confident	79.3	Confident	24 Å²	24	36.8 Å²	36.8	13%	0.128	21%	0.208	C	C	.	.			trans	-72.7	-29.2	177.3	-76	-27.6	0	0	0	110.8	C137 V138 F141 K145 V150 D153	C137-D155 CarbonylContact C-O 3.57Å; C137-D155 WeakPolarHBondContact CA-O 3.39Å; C137-D155 VanDerWaalsContact CB-O 3.28Å; C137-D155 WeakPolarHBondContact CB-O 3.48Å; V138-D155 HydrophobicContact CG2-CB 4.05Å; V138-D155 WeakPolarHBondContact CG2-O 3.28Å; V138-D155 PolarHBondContact N-O 3.07Å; F141-D155 HydrophobicContact CD2-CB 3.5Å; F141-D155 VanDerWaalsContact CD2-CB 3.5Å; F141-D155 HydrophobicContact CE2-CB 3.62Å; F141-D155 HydrophobicContact CG-CB 4.39Å; K145-D155 WeakPolarHBondContact CD-OD2 3.5Å; K145-D155 IonicContact NZ-OD1 3.15Å; K145-D155 IonicContact NZ-OD2 3.25Å; K145-D155 PolarHBondContact NZ-OD2 2.89Å; V150-D155 HydrophobicContact CG1-CB 4.26Å; V150-D155 PolarHBondContact O-N 3.25Å; D153-D155 PolarHBondContact O-N 3.27Å
156	C	85.9	Confident	78.7	Confident	4 Å²	4	33.9 Å²	33.9	3%	0.027	20%	0.196	C	C	.	.	S	Bend	trans	-136.3	153	178.4	-68	0	0	0	0	111.1	Y121 Y133 C137 F141 V150 G154	Y121-C156 HydrophobicContact CD2-CB 4.26Å; Y121-C156 HydrophobicContact CE2-CB 4.31Å; Y133-C156 HydrophobicContact CE1-CB 4.16Å; C137-C156 HydrophobicContact CB-CB 4.11Å; C137-C156 WeakPolarHBondContact CB-SG 3.27Å; C137-C156 WeakPolarHBondContact SG-CB 3.24Å; C137-C156 CovalentContact SG-SG 2.04Å; C137-C156 PolarHBondContact SG-SG 2.99Å; F141-C156 WeakPolarHBondContact CE1-SG 3.21Å; V150-C156 HydrophobicContact CG1-CB 3.86Å; G154-C156 VanDerWaalsContact C-N 3.3Å
157	P	86.7	Confident	78	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.013	20%	0.203	C	C	.	.			trans	-60.5	160.6	167.8	26.9	-34.1	0	0	0	110.6	F86 F88 Y133 F136 L160	F86-P157 HydrophobicContact CE1-CB 4.28Å; F86-P157 HydrophobicContact CE1-CG 4.06Å; F86-P157 HydrophobicContact CZ-CG 4.48Å; F88-P157 HydrophobicContact CB-CB 4.27Å; F88-P157 HydrophobicContact CD1-CB 4.48Å; F88-P157 HydrophobicContact CD2-CB 4.41Å; F88-P157 HydrophobicContact CG-CB 4.16Å; Y133-P157 HydrophobicContact CE1-CG 4.17Å; Y133-P157 PolarHBondContact OH-O 3.12Å; F136-P157 HydrophobicContact CB-CG 4.34Å; F136-P157 VanDerWaalsContact O-CD 3.24Å; F136-P157 WeakPolarHBondContact O-CD 3.48Å; P157-L160 HydrophobicContact CB-CD2 4.41Å; P157-L160 HydrophobicContact CG-CD2 3.62Å
158	A	82.6	Confident	77.9	Confident	22 Å²	22	36.5 Å²	36.5	18%	0.182	20%	0.203	C	C	.	.	S	Bend	trans	-79.9	-37.5	172.7	0	0	0	0	0	111.6	Y121 Y133 F151	Y121-A158 PolarHBondContact N-O 2.91Å; Y133-A158 PolarHBondContact OH-O 3.05Å; F151-A158 HydrophobicContact CD1-CB 4.49Å; F151-A158 HydrophobicContact CE1-CB 4.06Å; F151-A158 HydrophobicContact CZ-CB 4.34Å
159	V	83.3	Confident	78.1	Confident	17 Å²	17	36.5 Å²	36.5	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139.9	-177.4	63.5	0	0	0	0	110.1	Y118 L119 T120 I161	Y118-V159 HydrophobicContact CD2-CG2 4.08Å; Y118-V159 HydrophobicContact CE1-CG2 4.45Å; Y118-V159 HydrophobicContact CE2-CG2 3.36Å; L119-V159 CarbonylContact O-C 3.41Å; L119-V159 WeakPolarHBondContact O-CA 3.23Å; T120-V159 HydrophobicContact CG2-CG2 4.29Å; V159-I161 HydrophobicContact CG1-CD1 4.46Å; V159-I161 HydrophobicContact CG1-CG1 4.3Å; V159-I161 HydrophobicContact CG2-CG1 4.41Å
160	L	84.7	Confident	78.2	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.1	167.2	-61.9	-180	0	0	0	108.3	F86 P115 Y118 L119 Y132 Y133 F136 P157	F86-L160 HydrophobicContact CE1-CD2 4.18Å; F86-L160 HydrophobicContact CZ-CD2 3.73Å; P115-L160 HydrophobicContact CB-CB 4.36Å; Y118-L160 VanDerWaalsContact CA-O 3.32Å; Y118-L160 WeakPolarHBondContact CA-O 3.32Å; Y118-L160 WeakPolarHBondContact CD2-O 3.41Å; L119-L160 HydrophobicContact CB-CB 4.34Å; L119-L160 HydrophobicContact CB-CD1 4.39Å; L119-L160 PolarHBondContact N-O 3.45Å; L119-L160 PolarHBondContact O-N 2.91Å; Y132-L160 HydrophobicContact CE1-CD1 4.19Å; Y133-L160 HydrophobicContact CD2-CD1 3.46Å; Y133-L160 VanDerWaalsContact CD2-CD1 3.46Å; Y133-L160 HydrophobicContact CD2-CG 3.92Å; Y133-L160 HydrophobicContact CE2-CD1 3.69Å; Y133-L160 HydrophobicContact CE2-CD2 4.5Å; Y133-L160 HydrophobicContact CE2-CG 3.57Å; Y133-L160 HydrophobicContact CG-CD1 4.08Å; F136-L160 HydrophobicContact CB-CD1 4.47Å; F136-L160 HydrophobicContact CB-CD2 3.64Å; F136-L160 HydrophobicContact CD1-CD2 4.34Å; F136-L160 HydrophobicContact CD2-CD1 3.54Å; F136-L160 HydrophobicContact CD2-CD2 4.05Å; F136-L160 HydrophobicContact CD2-CG 4.47Å; F136-L160 HydrophobicContact CE2-CD1 4.04Å; F136-L160 HydrophobicContact CG-CD1 4.13Å; F136-L160 HydrophobicContact CG-CD2 3.74Å; P157-L160 HydrophobicContact CB-CD2 4.41Å; P157-L160 HydrophobicContact CG-CD2 3.62Å
161	I	81.9	Confident	78	Confident	18 Å²	18	35.3 Å²	35.3	9%	0.092	18%	0.18	C	C	.	.			trans	-108.9	129.3	178.7	-61.6	176	0	0	0	108.1	P115 V159 S163 P172 V183 L202	P115-I161 VanDerWaalsContact CG-O 3.31Å; P115-I161 WeakPolarHBondContact CG-O 3.38Å; V159-I161 HydrophobicContact CG1-CD1 4.46Å; V159-I161 HydrophobicContact CG1-CG1 4.3Å; V159-I161 HydrophobicContact CG2-CG1 4.41Å; I161-S163 PolarHBondContact O-N 3.38Å; I161-S163 PolarHBondContact O-OG 3.31Å; I161-P172 HydrophobicContact CG2-CB 4.05Å; I161-P172 HydrophobicContact CG2-CG 4.4Å; I161-V183 HydrophobicContact CG2-CG1 3.51Å; I161-L202 HydrophobicContact CD1-CD1 3.98Å; I161-L202 HydrophobicContact CD1-CD2 4.48Å
162	P	82.6	Confident	77.9	Confident	18 Å²	18	33.9 Å²	33.9	12%	0.117	18%	0.175	C	C	.	.			trans	-49.2	125.8	175.4	-24.9	31.2	0	0	0	110.9	P115 P172 A173	P115-P162 CarbonylContact O-C 3.38Å; P115-P162 WeakPolarHBondContact O-CA 3.26Å; P162-P172 CarbonylContact O-C 3.54Å; P162-P172 WeakPolarHBondContact O-CA 3.3Å; P162-A173 PolarHBondContact O-N 3.35Å
163	S	78.5	Confident	77.8	Confident	15 Å²	15	29.1 Å²	29.1	11%	0.105	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.1	-168.2	-66.8	0	0	0	0	112.2	C114 P115 I161 F171	C114-S163 WeakPolarHBondContact CB-O 3.45Å; P115-S163 PolarHBondContact O-N 3.08Å; I161-S163 PolarHBondContact O-N 3.38Å; I161-S163 PolarHBondContact O-OG 3.31Å; S163-F171 CarbonylContact C-O 3.55Å; S163-F171 WeakPolarHBondContact CA-O 3.46Å; S163-F171 WeakPolarHBondContact CB-O 3.45Å
164	K	77.7	Confident	77.5	Confident	91 Å²	91	27.8 Å²	27.8	40%	0.396	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.7	172.7	-72	-175.2	-178.6	177.7	0	111.1	F171 A173 L213	K164-F171 PolarHBondContact N-O 2.89Å; K164-F171 PolarHBondContact O-N 3.39Å; K164-F171 VanDerWaalsContact O-N 3.07Å; K164-A173 HydrophobicContact CG-CB 4.1Å; K164-L213 HydrophobicContact CB-CD2 4.18Å; K164-L213 HydrophobicContact CD-CD2 3.84Å
165	P	74.7	Confident	76.8	Confident	45 Å²	45	31.9 Å²	31.9	29%	0.292	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.1	177.7	28.3	-33.3	0	0	0	111.8	Y84 R169	Y84-P165 HydrophobicContact CD1-CB 3.51Å; Y84-P165 HydrophobicContact CE1-CB 3.28Å; Y84-P165 HydrophobicContact CE1-CG 4.1Å; Y84-P165 HydrophobicContact CG-CB 4.27Å; P165-R169 CarbonylContact C-O 3.59Å; P165-R169 WeakPolarHBondContact CA-O 3.35Å
166	L	68.5	Low	75.3	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	124.6	178.6	179.2	69.3	0	0	0	110.2	R168 R169 F171 A209 V212 L213	L166-R168 PolarHBondContact O-N 3.06Å; L166-R168 VanDerWaalsContact O-N 3.11Å; L166-R169 PolarHBondContact N-O 3.06Å; L166-R169 WeakPolarHBondContact O-CA 3.15Å; L166-R169 WeakPolarHBondContact O-CB 3.06Å; L166-R169 PolarHBondContact O-N 3.21Å; L166-R169 VanDerWaalsContact O-O 3.1Å; L166-F171 HydrophobicContact CB-CD2 3.77Å; L166-F171 HydrophobicContact CB-CE2 4.26Å; L166-F171 HydrophobicContact CD2-CD2 3.85Å; L166-F171 HydrophobicContact CD2-CE2 4Å; L166-F171 HydrophobicContact CD2-CG 4.37Å; L166-F171 HydrophobicContact CG-CD2 4.32Å; L166-F171 HydrophobicContact CG-CE2 4.46Å; L166-A209 HydrophobicContact CD2-CB 3.68Å; L166-A209 WeakPolarHBondContact CD2-O 3.18Å; L166-V212 HydrophobicContact CD1-CB 4Å; L166-V212 HydrophobicContact CD1-CG1 3.62Å; L166-V212 HydrophobicContact CD2-CB 3.96Å; L166-V212 HydrophobicContact CD2-CG1 4.09Å; L166-V212 HydrophobicContact CG-CB 4.41Å; L166-V212 HydrophobicContact CG-CG1 4.05Å; L166-L213 HydrophobicContact CD1-CB 3.96Å; L166-L213 HydrophobicContact CD1-CD1 4.18Å
167	A	66	Low	73.2	Confident	66 Å²	66	41.6 Å²	41.6	55%	0.545	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	40.1	-176.2	0	0	0	0	0	113.3	R169	A167-R169 VanDerWaalsContact C-N 3.26Å; A167-R169 PolarHBondContact O-N 2.86Å
168	R	75.4	Confident	70.9	Confident	75 Å²	75	50.1 Å²	50.1	28%	0.283	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	24.4	-174.9	-62.6	-177.3	178.3	-171.9	-0.1	114.8	P64 P83 Y84 L85 L166	P64-R168 HydrophobicContact CG-CB 3.79Å; P64-R168 WeakPolarHBondContact CG-O 3.44Å; P83-R168 WeakPolarHBondContact O-CB 3.45Å; Y84-R168 CarbonylContact C-O 3.39Å; Y84-R168 VanDerWaalsContact CA-O 3.32Å; Y84-R168 WeakPolarHBondContact CA-O 3.34Å; L85-R168 PolarHBondContact N-O 3.35Å; L166-R168 PolarHBondContact O-N 3.06Å; L166-R168 VanDerWaalsContact O-N 3.11Å
169	R	78.6	Confident	69.1	Low	81 Å²	81	52.6 Å²	52.6	31%	0.306	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.6	175	-58	177.2	-178.2	-99.2	-1.8	109.8	P64 L85 Y87 P165 L166 A167 F171	P64-R169 HydrophobicContact CB-CG 4.43Å; L85-R169 HydrophobicContact CB-CG 4.15Å; L85-R169 HydrophobicContact CD2-CG 4.41Å; L85-R169 CarbonylContact O-C 3.53Å; L85-R169 WeakPolarHBondContact O-CA 3.45Å; Y87-R169 HydrophobicContact CE2-CB 4.36Å; Y87-R169 PolarHBondContact OH-NH1 3.25Å; P165-R169 CarbonylContact C-O 3.59Å; P165-R169 WeakPolarHBondContact CA-O 3.35Å; L166-R169 PolarHBondContact N-O 3.06Å; L166-R169 WeakPolarHBondContact O-CA 3.15Å; L166-R169 WeakPolarHBondContact O-CB 3.06Å; L166-R169 PolarHBondContact O-N 3.21Å; L166-R169 VanDerWaalsContact O-O 3.1Å; A167-R169 VanDerWaalsContact C-N 3.26Å; A167-R169 PolarHBondContact O-N 2.86Å; R169-F171 HydrophobicContact CB-CD2 4.18Å; R169-F171 HydrophobicContact CB-CE2 3.72Å
170	C	79.4	Confident	67.4	Low	3 Å²	3	55.5 Å²	55.5	2%	0.02	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.2	177.2	-63.7	0	0	0	0	110.3	L85 F86 C114	L85-C170 PolarHBondContact O-N 3.44Å; F86-C170 HydrophobicContact CD2-CB 4.1Å; C114-C170 WeakPolarHBondContact CA-SG 3.45Å; C114-C170 HydrophobicContact CB-CB 3.85Å; C114-C170 WeakPolarHBondContact CB-SG 3.4Å; C114-C170 WeakPolarHBondContact SG-CA 3.41Å; C114-C170 WeakPolarHBondContact SG-CB 3.27Å; C114-C170 CovalentContact SG-SG 2.05Å; C114-C170 PolarHBondContact SG-SG 3.34Å
171	F	75.5	Confident	66	Low	45 Å²	45	58.6 Å²	58.6	20%	0.197	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.3	175.4	-76.5	-90.7	0	0	0	110.8	I90 S163 K164 L166 R169 A173 A209	I90-F171 HydrophobicContact CD1-CD1 3.64Å; I90-F171 HydrophobicContact CD1-CE1 4.02Å; I90-F171 HydrophobicContact CD1-CG 4.4Å; S163-F171 CarbonylContact C-O 3.55Å; S163-F171 WeakPolarHBondContact CA-O 3.46Å; S163-F171 WeakPolarHBondContact CB-O 3.45Å; K164-F171 PolarHBondContact N-O 2.89Å; K164-F171 PolarHBondContact O-N 3.39Å; K164-F171 VanDerWaalsContact O-N 3.07Å; L166-F171 HydrophobicContact CB-CD2 3.77Å; L166-F171 HydrophobicContact CB-CE2 4.26Å; L166-F171 HydrophobicContact CD2-CD2 3.85Å; L166-F171 HydrophobicContact CD2-CE2 4Å; L166-F171 HydrophobicContact CD2-CG 4.37Å; L166-F171 HydrophobicContact CG-CD2 4.32Å; L166-F171 HydrophobicContact CG-CE2 4.46Å; R169-F171 HydrophobicContact CB-CD2 4.18Å; R169-F171 HydrophobicContact CB-CE2 3.72Å; F171-A173 PolarHBondContact O-N 3.24Å; F171-A209 HydrophobicContact CB-CB 4.28Å; F171-A209 HydrophobicContact CD1-CB 3.5Å; F171-A209 VanDerWaalsContact CD1-CB 3.5Å; F171-A209 HydrophobicContact CD2-CB 4.42Å; F171-A209 HydrophobicContact CE1-CB 3.83Å; F171-A209 HydrophobicContact CG-CB 3.82Å; F171-A209 HydrophobicContact CZ-CB 4.38Å
172	P	75.4	Confident	64.8	Low	14 Å²	14	59.6 Å²	59.6	9%	0.091	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	133.2	177	-28	34.3	0	0	0	112.5	I90 I161 P162 I174 L202	I90-P172 HydrophobicContact CD1-CG 4.35Å; I90-P172 HydrophobicContact CG2-CG 3.78Å; I161-P172 HydrophobicContact CG2-CB 4.05Å; I161-P172 HydrophobicContact CG2-CG 4.4Å; P162-P172 CarbonylContact O-C 3.54Å; P162-P172 WeakPolarHBondContact O-CA 3.3Å; P172-I174 VanDerWaalsContact C-N 3.33Å; P172-I174 HydrophobicContact CB-CG1 4.09Å; P172-I174 PolarHBondContact O-N 3.42Å; P172-L202 HydrophobicContact CB-CD2 3.63Å; P172-L202 HydrophobicContact CG-CD2 3.75Å
173	A	68.7	Low	63.6	Low	15 Å²	15	59.6 Å²	59.6	12%	0.124	33%	0.325	C	S	.	.			trans	-78.3	83.5	175.9	0	0	0	0	0	109.2	P162 K164 F171	P162-A173 PolarHBondContact O-N 3.35Å; K164-A173 HydrophobicContact CG-CB 4.1Å; F171-A173 PolarHBondContact O-N 3.24Å
174	I	64.4	Low	62.9	Low	13 Å²	13	60.6 Å²	60.6	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.6	178.8	-49.9	-170.2	0	0	0	109.5	P172 L181 M182 V183 L202 V203 A206	P172-I174 VanDerWaalsContact C-N 3.33Å; P172-I174 HydrophobicContact CB-CG1 4.09Å; P172-I174 PolarHBondContact O-N 3.42Å; I174-L181 HydrophobicContact CG2-CB 4.27Å; I174-L181 HydrophobicContact CG2-CD2 3.71Å; I174-M182 WeakPolarHBondContact CA-O 3.33Å; I174-V183 HydrophobicContact CG1-CG2 4.03Å; I174-L202 HydrophobicContact CD1-CD2 4.29Å; I174-V203 HydrophobicContact CD1-CG2 3.94Å; I174-V203 HydrophobicContact CG2-CG2 4.32Å; I174-A206 HydrophobicContact CD1-CB 3.28Å; I174-A206 HydrophobicContact CG1-CB 4.21Å
175	H	59.7	Low	62.2	Low	94 Å²	94	64 Å²	64	44%	0.435	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.2	176.4	-70	-81.2	0	0	0	109.9	M182	H175-M182 PolarHBondContact N-O 2.9Å; H175-M182 PolarHBondContact O-N 3.43Å
176	A	50.6	Low	61.5	Low	79 Å²	79	66.7 Å²	66.7	65%	0.653	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.5	172.8	0	0	0	0	0	109.2	V180	A176-V180 WeakPolarHBondContact CA-O 3.48Å
177	Y	42.9	Very low	61.2	Low	152 Å²	152	69.5 Å²	69.5	60%	0.596	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.7	173.4	-170.6	-104.5	0	0	0	108.8	G179 V180 M182	Y177-G179 PolarHBondContact O-N 3.46Å; Y177-G179 VanDerWaalsContact O-N 3.14Å; Y177-V180 PolarHBondContact N-O 3.42Å; Y177-V180 PolarHBondContact O-N 2.79Å; Y177-M182 HydrophobicContact CG-CE 4.26Å
178	K	37.6	Very low	61.1	Low	182 Å²	182	68.4 Å²	68.4	79%	0.791	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	38.4	-177.5	-62.5	-174.6	175.1	-175.4	0	114.1	V180	K178-V180 VanDerWaalsContact C-N 3.32Å; K178-V180 PolarHBondContact O-N 3.49Å
179	G	44.9	Very low	60.8	Low	74 Å²	74	65.9 Å²	65.9	76%	0.763	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-2.1	178.4	0	0	0	0	0	115.8	Y177	Y177-G179 PolarHBondContact O-N 3.46Å; Y177-G179 VanDerWaalsContact O-N 3.14Å
180	V	48.2	Very low	60.2	Low	77 Å²	77	65 Å²	65	47%	0.467	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.9	175	-175.4	0	0	0	0	109.8	A176 Y177 K178 T187	A176-V180 WeakPolarHBondContact CA-O 3.48Å; Y177-V180 PolarHBondContact N-O 3.42Å; Y177-V180 PolarHBondContact O-N 2.79Å; K178-V180 VanDerWaalsContact C-N 3.32Å; K178-V180 PolarHBondContact O-N 3.49Å; V180-T187 HydrophobicContact CG1-CG2 3.79Å
181	L	55.5	Low	59.4	Low	65 Å²	65	66.1 Å²	66.1	34%	0.34	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.7	-179	-68.7	137.4	0	0	0	110.1	I174 I199 V203	I174-L181 HydrophobicContact CG2-CB 4.27Å; I174-L181 HydrophobicContact CG2-CD2 3.71Å; L181-I199 HydrophobicContact CB-CG2 4.34Å; L181-V203 HydrophobicContact CB-CG2 3.86Å; L181-V203 HydrophobicContact CD1-CB 4.26Å; L181-V203 HydrophobicContact CD1-CG1 3.73Å; L181-V203 HydrophobicContact CD1-CG2 3.82Å; L181-V203 HydrophobicContact CD2-CG1 4.03Å; L181-V203 HydrophobicContact CD2-CG2 3.9Å; L181-V203 HydrophobicContact CG-CG1 4.45Å; L181-V203 HydrophobicContact CG-CG2 4.04Å
182	M	56.1	Low	58.6	Low	39 Å²	39	64.3 Å²	64.3	19%	0.192	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.3	-177.5	-63.9	-175.6	-64.8	0	0	111	I174 H175 Y177 T187	I174-M182 WeakPolarHBondContact CA-O 3.33Å; H175-M182 PolarHBondContact N-O 2.9Å; H175-M182 PolarHBondContact O-N 3.43Å; Y177-M182 HydrophobicContact CG-CE 4.26Å; M182-T187 HydrophobicContact CG-CG2 3.99Å; M182-T187 HydrophobicContact SD-CG2 4.49Å
183	V	56.6	Low	58	Low	19 Å²	19	70.5 Å²	70.5	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	108.1	173	174.2	0	0	0	0	106.8	I161 I174 N185 E186 I199 L202	I161-V183 HydrophobicContact CG2-CG1 3.51Å; I174-V183 HydrophobicContact CG1-CG2 4.03Å; V183-N185 PolarHBondContact O-N 3.34Å; V183-E186 PolarHBondContact N-O 2.89Å; V183-I199 HydrophobicContact CB-CD1 3.95Å; V183-I199 HydrophobicContact CG2-CD1 4.02Å; V183-I199 HydrophobicContact CG2-CG1 4.44Å; V183-I199 HydrophobicContact CG2-CG2 3.95Å; V183-L202 HydrophobicContact CG2-CD2 3.97Å
184	G	65	Low	57.6	Low	35 Å²	35	72.6 Å²	72.6	36%	0.361	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-125.8	-159.2	0	0	0	0	0	110.6
185	N	62.2	Low	57.6	Low	162 Å²	162	74.9 Å²	74.9	87%	0.866	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	1.7	-178.4	-75.7	-2.5	0	0	0	114.5	V183	V183-N185 PolarHBondContact O-N 3.34Å
186	E	60.4	Low	58	Low	102 Å²	102	78.7 Å²	78.7	48%	0.477	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-109.6	153.7	-177.3	-63.2	-163.1	167.8	0	0	112	V183 R196 I199	V183-E186 PolarHBondContact N-O 2.89Å; E186-R196 IonicContact OE2-NH2 3.28Å; E186-I199 WeakPolarHBondContact O-CD1 3.34Å
187	T	62.2	Low	58.9	Low	67 Å²	67	79.2 Å²	79.2	41%	0.411	43%	0.428	S	S	.	.	S	Bend	trans	-96.7	-6.8	176.6	51.1	0	0	0	0	113.1	V180 M182 N198 I199	V180-T187 HydrophobicContact CG1-CG2 3.79Å; M182-T187 HydrophobicContact CG-CG2 3.99Å; M182-T187 HydrophobicContact SD-CG2 4.49Å; T187-N198 PolarHBondContact O-OD1 2.97Å; T187-I199 WeakPolarHBondContact O-CD1 3.29Å; T187-I199 VanDerWaalsContact O-CG1 3.22Å; T187-I199 WeakPolarHBondContact O-CG1 3.37Å; T187-I199 PolarHBondContact O-N 2.96Å
188	T	64.6	Low	60.1	Low	44 Å²	44	76 Å²	76	27%	0.27	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.8	179.4	56.7	0	0	0	0	110	K197	T188-K197 CarbonylContact C-O 3.57Å; T188-K197 VanDerWaalsContact CA-O 3.26Å; T188-K197 WeakPolarHBondContact CA-O 3.09Å
189	Y	67.6	Low	61.5	Low	21 Å²	21	67.5 Å²	67.5	8%	0.082	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.3	173.3	73.6	-84	0	0	0	110.7	D191 R196 K197 I199 L202	Y189-D191 HydrophobicContact CE2-CB 4.26Å; Y189-R196 CarbonylContact O-C 3.6Å; Y189-R196 WeakPolarHBondContact O-CA 3.49Å; Y189-K197 HydrophobicContact CD1-CB 4.44Å; Y189-K197 HydrophobicContact CE1-CB 3.85Å; Y189-K197 HydrophobicContact CE2-CB 4.48Å; Y189-K197 PolarHBondContact N-O 3.33Å; Y189-K197 PolarHBondContact O-N 2.99Å; Y189-I199 HydrophobicContact CD1-CG1 4.24Å; Y189-L202 HydrophobicContact CD1-CD1 4.25Å; Y189-L202 HydrophobicContact CE1-CD1 3.8Å; Y189-L202 HydrophobicContact CE2-CD1 4.42Å
190	E	65.9	Low	62.3	Low	64 Å²	64	67.5 Å²	67.5	30%	0.299	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.2	173.5	-159.2	-177.7	168.6	0	0	109.1	Y118 G192	Y118-E190 WeakPolarHBondContact OH-CA 3.47Å; Y118-E190 WeakPolarHBondContact OH-CB 3.41Å; Y118-E190 PolarHBondContact OH-N 3.38Å; Y118-E190 PolarHBondContact OH-O 3.03Å; Y118-E190 VanDerWaalsContact OH-O 3.1Å; E190-G192 PolarHBondContact O-N 3.01Å
191	D	63.3	Low	62.9	Low	25 Å²	25	67.8 Å²	67.8	13%	0.134	37%	0.369	C	S	.	.			trans	-79.1	5	-175.3	68.6	0.7	0	0	0	114.3	Y189 H193 S195 K197	Y189-D191 HydrophobicContact CE2-CB 4.26Å; D191-H193 VanDerWaalsContact C-N 3.25Å; D191-H193 PolarHBondContact O-N 2.92Å; D191-H193 PolarHBondContact OD1-N 3.34Å; D191-S195 PolarHBondContact N-O 3.5Å; D191-S195 PolarHBondContact OD1-N 3.43Å; D191-K197 HydrophobicContact CB-CD 4.31Å; D191-K197 WeakPolarHBondContact OD2-CE 3.22Å; D191-K197 IonicContact OD2-NZ 3.72Å; D191-K197 PolarHBondContact OD2-NZ 2.86Å
192	G	59.6	Low	63.2	Low	8 Å²	8	65.1 Å²	65.1	8%	0.082	35%	0.354	C	S	.	.	S	Bend	trans	80.4	-1.2	-178.5	0	0	0	0	0	114.5	E190	E190-G192 PolarHBondContact O-N 3.01Å
193	H	61.1	Low	63.2	Low	144 Å²	144	64 Å²	64	67%	0.667	35%	0.35	S	S	*	.	S	Bend	trans	-108.2	16.6	172.3	-69.7	-74.5	0	0	0	112.6	D191	D191-H193 VanDerWaalsContact C-N 3.25Å; D191-H193 PolarHBondContact O-N 2.92Å; D191-H193 PolarHBondContact OD1-N 3.34Å
194	G	61.8	Low	63.2	Low	58 Å²	58	71 Å²	71	60%	0.598	38%	0.382	S	S	*	.	S	Bend	trans	82.7	8.9	-179.7	0	0	0	0	0	114.7
195	S	63.1	Low	62.5	Low	61 Å²	61	71.2 Å²	71.2	43%	0.427	38%	0.383	S	S	.	.			trans	-108.7	131.5	178.4	-60.7	0	0	0	0	111.4	D191	D191-S195 PolarHBondContact N-O 3.5Å; D191-S195 PolarHBondContact OD1-N 3.43Å
196	R	68.7	Low	62	Low	175 Å²	175	63.8 Å²	63.8	66%	0.66	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.9	174.3	-80.8	-177.5	154.1	-174.9	-11.7	110.7	E186 Y189	E186-R196 IonicContact OE2-NH2 3.28Å; Y189-R196 CarbonylContact O-C 3.6Å; Y189-R196 WeakPolarHBondContact O-CA 3.49Å
197	K	69.7	Low	61.5	Low	89 Å²	89	67 Å²	67	39%	0.387	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.3	179.1	-67.5	-175.4	179.2	163.5	0	111.6	T188 Y189 D191	T188-K197 CarbonylContact C-O 3.57Å; T188-K197 VanDerWaalsContact CA-O 3.26Å; T188-K197 WeakPolarHBondContact CA-O 3.09Å; Y189-K197 HydrophobicContact CD1-CB 4.44Å; Y189-K197 HydrophobicContact CE1-CB 3.85Å; Y189-K197 HydrophobicContact CE2-CB 4.48Å; Y189-K197 PolarHBondContact N-O 3.33Å; Y189-K197 PolarHBondContact O-N 2.99Å; D191-K197 HydrophobicContact CB-CD 4.31Å; D191-K197 WeakPolarHBondContact OD2-CE 3.22Å; D191-K197 IonicContact OD2-NZ 3.72Å; D191-K197 PolarHBondContact OD2-NZ 2.86Å
198	N	68.3	Low	60.9	Low	86 Å²	86	72 Å²	72	46%	0.46	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	144.2	-179.9	-158.9	-19.9	0	0	0	110.5	T187 T200 D201	T187-N198 PolarHBondContact O-OD1 2.97Å; N198-T200 PolarHBondContact O-N 3.17Å; N198-D201 PolarHBondContact O-N 3.02Å
199	I	66.5	Low	59.9	Low	2 Å²	2	70.4 Å²	70.4	1%	0.01	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.6	-177.6	-71.7	175.6	0	0	0	112.2	L181 V183 E186 T187 Y189 D201 L202 V203	L181-I199 HydrophobicContact CB-CG2 4.34Å; V183-I199 HydrophobicContact CB-CD1 3.95Å; V183-I199 HydrophobicContact CG2-CD1 4.02Å; V183-I199 HydrophobicContact CG2-CG1 4.44Å; V183-I199 HydrophobicContact CG2-CG2 3.95Å; E186-I199 WeakPolarHBondContact O-CD1 3.34Å; T187-I199 WeakPolarHBondContact O-CD1 3.29Å; T187-I199 VanDerWaalsContact O-CG1 3.22Å; T187-I199 WeakPolarHBondContact O-CG1 3.37Å; T187-I199 PolarHBondContact O-N 2.96Å; Y189-I199 HydrophobicContact CD1-CG1 4.24Å; I199-D201 PolarHBondContact O-N 2.97Å; I199-D201 VanDerWaalsContact O-N 3.15Å; I199-L202 WeakPolarHBondContact O-CA 3.32Å; I199-L202 VanDerWaalsContact O-CB 3.24Å; I199-L202 WeakPolarHBondContact O-CB 3.42Å; I199-L202 PolarHBondContact O-N 3.49Å; I199-V203 HydrophobicContact CG2-CG2 3.93Å; I199-V203 WeakPolarHBondContact O-CG2 3.37Å; I199-V203 PolarHBondContact O-N 3.42Å; I199-V203 VanDerWaalsContact O-N 3.15Å
200	T	61.6	Low	59	Low	75 Å²	75	72.5 Å²	72.5	46%	0.46	38%	0.377	S	S	.	.	H	α-helix	trans	-51.7	-35.7	173.9	48.5	0	0	0	0	113.3	N198 L202 V203	N198-T200 PolarHBondContact O-N 3.17Å; T200-L202 VanDerWaalsContact C-N 3.3Å; T200-L202 PolarHBondContact O-N 3.41Å; T200-V203 PolarHBondContact O-N 3.32Å
201	D	61.2	Low	58.3	Low	83 Å²	83	71.3 Å²	71.3	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-71.5	-26.7	179	-58.6	-12	0	0	0	112.3	N198 I199	N198-D201 PolarHBondContact O-N 3.02Å; I199-D201 PolarHBondContact O-N 2.97Å; I199-D201 VanDerWaalsContact O-N 3.15Å
202	L	60.8	Low	57.5	Low	8 Å²	8	73.8 Å²	73.8	4%	0.042	40%	0.398	C	S	.	.	H	α-helix	trans	-77.3	-28.8	174.5	-137.5	97.1	0	0	0	111.5	V91 I161 P172 I174 V183 Y189 I199 T200 A206	V91-L202 HydrophobicContact CG2-CD1 3.33Å; V91-L202 HydrophobicContact CG2-CG 4.21Å; I161-L202 HydrophobicContact CD1-CD1 3.98Å; I161-L202 HydrophobicContact CD1-CD2 4.48Å; P172-L202 HydrophobicContact CB-CD2 3.63Å; P172-L202 HydrophobicContact CG-CD2 3.75Å; I174-L202 HydrophobicContact CD1-CD2 4.29Å; V183-L202 HydrophobicContact CG2-CD2 3.97Å; Y189-L202 HydrophobicContact CD1-CD1 4.25Å; Y189-L202 HydrophobicContact CE1-CD1 3.8Å; Y189-L202 HydrophobicContact CE2-CD1 4.42Å; I199-L202 WeakPolarHBondContact O-CA 3.32Å; I199-L202 VanDerWaalsContact O-CB 3.24Å; I199-L202 WeakPolarHBondContact O-CB 3.42Å; I199-L202 PolarHBondContact O-N 3.49Å; T200-L202 VanDerWaalsContact C-N 3.3Å; T200-L202 PolarHBondContact O-N 3.41Å; L202-A206 WeakPolarHBondContact O-CB 3.36Å; L202-A206 PolarHBondContact O-N 3.49Å
203	V	57	Low	57.1	Low	15 Å²	15	74.8 Å²	74.8	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-76.6	-33.8	-170.2	171.2	0	0	0	0	111.5	I174 L181 I199 T200 G205 A206 K207	I174-V203 HydrophobicContact CD1-CG2 3.94Å; I174-V203 HydrophobicContact CG2-CG2 4.32Å; L181-V203 HydrophobicContact CB-CG2 3.86Å; L181-V203 HydrophobicContact CD1-CB 4.26Å; L181-V203 HydrophobicContact CD1-CG1 3.73Å; L181-V203 HydrophobicContact CD1-CG2 3.82Å; L181-V203 HydrophobicContact CD2-CG1 4.03Å; L181-V203 HydrophobicContact CD2-CG2 3.9Å; L181-V203 HydrophobicContact CG-CG1 4.45Å; L181-V203 HydrophobicContact CG-CG2 4.04Å; I199-V203 HydrophobicContact CG2-CG2 3.93Å; I199-V203 WeakPolarHBondContact O-CG2 3.37Å; I199-V203 PolarHBondContact O-N 3.42Å; I199-V203 VanDerWaalsContact O-N 3.15Å; T200-V203 PolarHBondContact O-N 3.32Å; V203-G205 PolarHBondContact O-N 3.4Å; V203-A206 PolarHBondContact O-N 3.27Å; V203-A206 VanDerWaalsContact O-N 3.15Å; V203-K207 HydrophobicContact CG1-CB 4.34Å; V203-K207 WeakPolarHBondContact O-CB 3.33Å; V203-K207 PolarHBondContact O-N 3.14Å
204	E	56.6	Low	56.9	Low	168 Å²	168	74 Å²	74	79%	0.785	40%	0.398	S	S	*	.	H	α-helix	trans	-61.8	-32.8	179.8	-160.9	160.9	-165.8	0	0	112.3
205	G	50.3	Low	56.4	Low	38 Å²	38	73.8 Å²	73.8	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-81.9	-30	172.5	0	0	0	0	0	115.2	V203	V203-G205 PolarHBondContact O-N 3.4Å
206	A	51.3	Low	56	Low	7 Å²	7	76.6 Å²	76.6	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-97.6	-15.3	-174.2	0	0	0	0	0	114.9	I174 L202 V203 K208 A209 N210	I174-A206 HydrophobicContact CD1-CB 3.28Å; I174-A206 HydrophobicContact CG1-CB 4.21Å; L202-A206 WeakPolarHBondContact O-CB 3.36Å; L202-A206 PolarHBondContact O-N 3.49Å; V203-A206 PolarHBondContact O-N 3.27Å; V203-A206 VanDerWaalsContact O-N 3.15Å; A206-K208 PolarHBondContact O-N 3.49Å; A206-K208 VanDerWaalsContact O-N 3.16Å; A206-A209 WeakPolarHBondContact O-CB 3.45Å; A206-A209 PolarHBondContact O-N 3.04Å; A206-N210 PolarHBondContact O-N 3.12Å; A206-N210 VanDerWaalsContact O-N 3.1Å
207	K	51.5	Low	55.6	Low	168 Å²	168	73.3 Å²	73.3	73%	0.73	38%	0.384	S	S	*	.	H	α-helix	trans	-58.3	-30.4	-179.2	-165.4	173.3	-174.3	178.7	0	112.7	V203	V203-K207 HydrophobicContact CG1-CB 4.34Å; V203-K207 WeakPolarHBondContact O-CB 3.33Å; V203-K207 PolarHBondContact O-N 3.14Å
208	K	47.6	Very low	55.5	Low	172 Å²	172	72.1 Å²	72.1	75%	0.748	38%	0.381	S	S	*	.	H	α-helix	trans	-79	-31.5	172.1	-71.9	-177	-179.6	174	0	113.2	A206 V212	A206-K208 PolarHBondContact O-N 3.49Å; A206-K208 VanDerWaalsContact O-N 3.16Å; K208-V212 VanDerWaalsContact O-CG2 3.28Å; K208-V212 WeakPolarHBondContact O-CG2 3.49Å
209	A	44.2	Very low	55.2	Low	11 Å²	11	70.6 Å²	70.6	9%	0.091	38%	0.38	C	S	.	.	H	α-helix	trans	-74.8	-38.3	-176.4	0	0	0	0	0	112.6	L166 F171 A206 G211 V212 L213	L166-A209 HydrophobicContact CD2-CB 3.68Å; L166-A209 WeakPolarHBondContact CD2-O 3.18Å; F171-A209 HydrophobicContact CB-CB 4.28Å; F171-A209 HydrophobicContact CD1-CB 3.5Å; F171-A209 VanDerWaalsContact CD1-CB 3.5Å; F171-A209 HydrophobicContact CD2-CB 4.42Å; F171-A209 HydrophobicContact CE1-CB 3.83Å; F171-A209 HydrophobicContact CG-CB 3.82Å; F171-A209 HydrophobicContact CZ-CB 4.38Å; A206-A209 WeakPolarHBondContact O-CB 3.45Å; A206-A209 PolarHBondContact O-N 3.04Å; A209-G211 PolarHBondContact O-N 3.05Å; A209-V212 PolarHBondContact O-N 3.06Å; A209-V212 VanDerWaalsContact O-N 3.09Å; A209-L213 PolarHBondContact O-N 3.1Å; A209-L213 VanDerWaalsContact O-N 3.08Å
210	N	50.1	Low	55.2	Low	65 Å²	65	76.1 Å²	76.1	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-63.9	-40.2	-179.5	-156.8	30.1	0	0	0	112.3	A206 V212 L213 E214	A206-N210 PolarHBondContact O-N 3.12Å; A206-N210 VanDerWaalsContact O-N 3.1Å; N210-V212 VanDerWaalsContact C-N 3.28Å; N210-V212 PolarHBondContact O-N 3.4Å; N210-L213 WeakPolarHBondContact O-CB 3.41Å; N210-L213 PolarHBondContact O-N 3.13Å; N210-L213 VanDerWaalsContact O-N 3.13Å; N210-E214 PolarHBondContact O-N 3.25Å; N210-E214 VanDerWaalsContact O-N 3.16Å
211	G	50.3	Low	55.8	Low	40 Å²	40	78 Å²	78	41%	0.412	41%	0.406	S	S	.	.	H	α-helix	trans	-63.3	-31	173.3	0	0	0	0	0	113.7	A209 A215	A209-G211 PolarHBondContact O-N 3.05Å; G211-A215 VanDerWaalsContact O-CB 3.27Å; G211-A215 WeakPolarHBondContact O-CB 3.46Å; G211-A215 PolarHBondContact O-N 3.24Å
212	V	47.3	Very low	56.6	Low	76 Å²	76	75.9 Å²	75.9	46%	0.461	40%	0.395	S	S	.	.	H	α-helix	trans	-73.5	-30.5	175.5	179.3	0	0	0	0	110.9	L166 K208 A209 N210 R216	L166-V212 HydrophobicContact CD1-CB 4Å; L166-V212 HydrophobicContact CD1-CG1 3.62Å; L166-V212 HydrophobicContact CD2-CB 3.96Å; L166-V212 HydrophobicContact CD2-CG1 4.09Å; L166-V212 HydrophobicContact CG-CB 4.41Å; L166-V212 HydrophobicContact CG-CG1 4.05Å; K208-V212 VanDerWaalsContact O-CG2 3.28Å; K208-V212 WeakPolarHBondContact O-CG2 3.49Å; A209-V212 PolarHBondContact O-N 3.06Å; A209-V212 VanDerWaalsContact O-N 3.09Å; N210-V212 VanDerWaalsContact C-N 3.28Å; N210-V212 PolarHBondContact O-N 3.4Å; V212-R216 WeakPolarHBondContact O-CB 3.29Å; V212-R216 PolarHBondContact O-N 3Å
213	L	49.8	Very low	57.2	Low	30 Å²	30	81.9 Å²	81.9	16%	0.157	42%	0.421	C	S	.	.	H	α-helix	trans	-68.3	-46.2	175.6	-175.3	66.3	0	0	0	111.3	K164 L166 A209 N210 R216 Q217	K164-L213 HydrophobicContact CB-CD2 4.18Å; K164-L213 HydrophobicContact CD-CD2 3.84Å; L166-L213 HydrophobicContact CD1-CB 3.96Å; L166-L213 HydrophobicContact CD1-CD1 4.18Å; A209-L213 PolarHBondContact O-N 3.1Å; A209-L213 VanDerWaalsContact O-N 3.08Å; N210-L213 WeakPolarHBondContact O-CB 3.41Å; N210-L213 PolarHBondContact O-N 3.13Å; N210-L213 VanDerWaalsContact O-N 3.13Å; L213-R216 PolarHBondContact O-N 3.43Å; L213-Q217 PolarHBondContact O-N 3.22Å
214	E	56.4	Low	58	Low	126 Å²	126	86.4 Å²	86.4	59%	0.589	44%	0.441	S	S	*	.	H	α-helix	trans	-61.5	-43.9	173.4	-68.8	-178.1	169.9	0	0	111.2	N210 R216 Q217 L218	N210-E214 PolarHBondContact O-N 3.25Å; N210-E214 VanDerWaalsContact O-N 3.16Å; E214-R216 VanDerWaalsContact C-N 3.32Å; E214-R216 PolarHBondContact O-N 3.38Å; E214-Q217 PolarHBondContact O-N 3.4Å; E214-L218 WeakPolarHBondContact O-CB 3.44Å; E214-L218 PolarHBondContact O-N 3.05Å
215	A	52.3	Low	59.2	Low	54 Å²	54	78.5 Å²	78.5	45%	0.446	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-35.9	176	0	0	0	0	0	113	G211 A219	G211-A215 VanDerWaalsContact O-CB 3.27Å; G211-A215 WeakPolarHBondContact O-CB 3.46Å; G211-A215 PolarHBondContact O-N 3.24Å; A215-A219 WeakPolarHBondContact O-CB 3.45Å; A215-A219 PolarHBondContact O-N 2.88Å
216	R	54.5	Low	60.8	Low	121 Å²	121	80.7 Å²	80.7	46%	0.457	40%	0.401	S	S	.	.	H	α-helix	trans	-71.9	-39.9	176.9	-171.7	179.9	-177.8	-164.4	1.3	112.3	V212 L213 E214 L218 A219 M220	V212-R216 WeakPolarHBondContact O-CB 3.29Å; V212-R216 PolarHBondContact O-N 3Å; L213-R216 PolarHBondContact O-N 3.43Å; E214-R216 VanDerWaalsContact C-N 3.32Å; E214-R216 PolarHBondContact O-N 3.38Å; R216-L218 VanDerWaalsContact C-N 3.34Å; R216-A219 PolarHBondContact O-N 3.18Å; R216-M220 WeakPolarHBondContact O-CG 3.3Å; R216-M220 PolarHBondContact O-N 3.35Å
217	Q	60.9	Low	62.2	Low	105 Å²	105	83.8 Å²	83.8	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-64	-42.6	174.3	-72.8	-178.9	-13.6	0	0	111	L213 E214 A219 M220 R221	L213-Q217 PolarHBondContact O-N 3.22Å; E214-Q217 PolarHBondContact O-N 3.4Å; Q217-A219 VanDerWaalsContact C-N 3.35Å; Q217-M220 PolarHBondContact O-N 3.22Å; Q217-R221 PolarHBondContact O-N 2.94Å; Q217-R221 VanDerWaalsContact O-N 3.15Å
218	L	66.8	Low	63.8	Low	65 Å²	65	78.7 Å²	78.7	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-57.3	-47.5	171.2	179.1	64	0	0	0	111.1	E214 R216 M220 R221 I222 Y635	E214-L218 WeakPolarHBondContact O-CB 3.44Å; E214-L218 PolarHBondContact O-N 3.05Å; R216-L218 VanDerWaalsContact C-N 3.34Å; L218-M220 PolarHBondContact O-N 3.46Å; L218-R221 PolarHBondContact O-N 3.42Å; L218-I222 HydrophobicContact CD1-CD1 4.06Å; L218-I222 HydrophobicContact CD1-CG1 4.4Å; L218-I222 HydrophobicContact CD2-CD1 4.5Å; L218-I222 HydrophobicContact CG-CD1 3.8Å; L218-I222 WeakPolarHBondContact O-CB 3.47Å; L218-I222 VanDerWaalsContact O-CG1 3.24Å; L218-I222 WeakPolarHBondContact O-CG1 3.39Å; L218-I222 PolarHBondContact O-N 3.31Å; L218-Y635 HydrophobicContact CD1-CD2 4.14Å; L218-Y635 HydrophobicContact CD1-CE1 4.37Å; L218-Y635 HydrophobicContact CD1-CE2 3.62Å
219	A	61.8	Low	65.8	Low	53 Å²	53	70.5 Å²	70.5	44%	0.438	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-39.1	179.2	0	0	0	0	0	113.7	A215 R216 Q217 I222 F223	A215-A219 WeakPolarHBondContact O-CB 3.45Å; A215-A219 PolarHBondContact O-N 2.88Å; R216-A219 PolarHBondContact O-N 3.18Å; Q217-A219 VanDerWaalsContact C-N 3.35Å; A219-I222 PolarHBondContact O-N 2.88Å; A219-F223 WeakPolarHBondContact O-CB 3.42Å; A219-F223 PolarHBondContact O-N 3.32Å
220	M	67.5	Low	67.9	Low	119 Å²	119	77.1 Å²	77.1	59%	0.586	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-43.9	176.6	-74.7	-62.9	-58.6	0	0	112.1	R216 Q217 L218 I222 F223 E224	R216-M220 WeakPolarHBondContact O-CG 3.3Å; R216-M220 PolarHBondContact O-N 3.35Å; Q217-M220 PolarHBondContact O-N 3.22Å; L218-M220 PolarHBondContact O-N 3.46Å; M220-I222 VanDerWaalsContact C-N 3.34Å; M220-F223 WeakPolarHBondContact O-CB 3.39Å; M220-F223 PolarHBondContact O-N 3.23Å; M220-E224 PolarHBondContact O-N 3.28Å
221	R	73.9	Confident	69.9	Low	114 Å²	114	78.6 Å²	78.6	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-63.8	-39.7	175	-70.5	178.1	179.8	172.6	-0.7	111.7	Q217 L218 F223 E224 D225 N634 Y635	Q217-R221 PolarHBondContact O-N 2.94Å; Q217-R221 VanDerWaalsContact O-N 3.15Å; L218-R221 PolarHBondContact O-N 3.42Å; R221-F223 VanDerWaalsContact C-N 3.35Å; R221-E224 PolarHBondContact O-N 2.78Å; R221-D225 WeakPolarHBondContact O-CB 3.21Å; R221-D225 PolarHBondContact O-N 3.25Å; R221-N634 HydrophobicContact CB-CB 4.24Å; R221-Y635 HydrophobicContact CB-CD2 4.11Å; R221-Y635 HydrophobicContact CB-CE2 3.72Å; R221-Y635 HydrophobicContact CG-CE2 4.38Å; R221-Y635 PolarHBondContact NH1-OH 3.2Å
222	I	77.2	Confident	71.8	Confident	38 Å²	38	79.2 Å²	79.2	20%	0.195	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-44	172.4	-75.8	170.9	0	0	0	111.3	L218 A219 M220 D225 Y226 V638	L218-I222 HydrophobicContact CD1-CD1 4.06Å; L218-I222 HydrophobicContact CD1-CG1 4.4Å; L218-I222 HydrophobicContact CD2-CD1 4.5Å; L218-I222 HydrophobicContact CG-CD1 3.8Å; L218-I222 WeakPolarHBondContact O-CB 3.47Å; L218-I222 VanDerWaalsContact O-CG1 3.24Å; L218-I222 WeakPolarHBondContact O-CG1 3.39Å; L218-I222 PolarHBondContact O-N 3.31Å; A219-I222 PolarHBondContact O-N 2.88Å; M220-I222 VanDerWaalsContact C-N 3.34Å; I222-D225 PolarHBondContact O-N 3.02Å; I222-Y226 HydrophobicContact CG2-CD2 3.67Å; I222-Y226 HydrophobicContact CG2-CE2 3.49Å; I222-Y226 VanDerWaalsContact CG2-CE2 3.49Å; I222-Y226 WeakPolarHBondContact O-CD2 3.05Å; I222-Y226 PolarHBondContact O-N 3.32Å; I222-V638 HydrophobicContact CD1-CG2 4.32Å; I222-V638 HydrophobicContact CG1-CG1 4.3Å; I222-V638 HydrophobicContact CG1-CG2 3.9Å; I222-V638 HydrophobicContact CG2-CG1 3.96Å
223	F	73.4	Confident	73.9	Confident	135 Å²	135	76.1 Å²	76.1	59%	0.592	36%	0.361	S	S	*	.	H	α-helix	trans	-63.4	-44.9	178.7	179.7	-97	0	0	0	111.4	A219 M220 R221 D225 Y226 T227	A219-F223 WeakPolarHBondContact O-CB 3.42Å; A219-F223 PolarHBondContact O-N 3.32Å; M220-F223 WeakPolarHBondContact O-CB 3.39Å; M220-F223 PolarHBondContact O-N 3.23Å; R221-F223 VanDerWaalsContact C-N 3.35Å; F223-D225 PolarHBondContact O-N 3.4Å; F223-Y226 WeakPolarHBondContact O-CB 3.17Å; F223-Y226 PolarHBondContact O-N 2.91Å; F223-T227 HydrophobicContact CD1-CG2 4.03Å; F223-T227 HydrophobicContact CE1-CG2 3.58Å; F223-T227 HydrophobicContact CE2-CG2 4.34Å; F223-T227 HydrophobicContact CZ-CG2 3.76Å; F223-T227 WeakPolarHBondContact O-CG2 3.26Å; F223-T227 PolarHBondContact O-N 3.42Å
224	E	74.8	Confident	75.9	Confident	110 Å²	110	78.8 Å²	78.8	51%	0.514	38%	0.375	S	S	.	.	H	α-helix	trans	-57.1	-49.4	173.8	-172.5	175.2	-170	0	0	111.1	M220 R221 Y226 T227 V228	M220-E224 PolarHBondContact O-N 3.28Å; R221-E224 PolarHBondContact O-N 2.78Å; E224-Y226 VanDerWaalsContact C-N 3.26Å; E224-Y226 PolarHBondContact O-N 3.47Å; E224-T227 PolarHBondContact O-N 2.91Å; E224-T227 VanDerWaalsContact O-N 3.07Å; E224-T227 PolarHBondContact O-OG1 3.29Å; E224-V228 PolarHBondContact O-N 3.27Å; E224-V228 VanDerWaalsContact O-N 3.17Å
225	D	81.7	Confident	77.5	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.011	37%	0.366	C	S	.	.	H	α-helix	trans	-55.8	-39.8	176.1	-70.1	-12	0	0	0	111.8	R221 I222 F223 S229 L633 N634 Y635	R221-D225 WeakPolarHBondContact O-CB 3.21Å; R221-D225 PolarHBondContact O-N 3.25Å; I222-D225 PolarHBondContact O-N 3.02Å; F223-D225 PolarHBondContact O-N 3.4Å; D225-S229 VanDerWaalsContact O-CB 3.26Å; D225-S229 WeakPolarHBondContact O-CB 3.25Å; D225-S229 PolarHBondContact O-N 3.28Å; D225-S229 PolarHBondContact O-OG 3.43Å; D225-L633 HydrophobicContact CB-CD2 3.92Å; D225-N634 WeakPolarHBondContact OD1-CB 3.44Å; D225-N634 PolarHBondContact OD1-N 3.05Å; D225-N634 PolarHBondContact OD1-ND2 3.16Å; D225-Y635 PolarHBondContact OD2-N 2.88Å
226	Y	83.6	Confident	79.4	Confident	83 Å²	83	74.5 Å²	74.5	33%	0.325	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-44.6	174.4	-84.1	-61.1	0	0	0	113.3	I222 F223 E224 V228 S229 W230 I233 V638 T642	I222-Y226 HydrophobicContact CG2-CD2 3.67Å; I222-Y226 HydrophobicContact CG2-CE2 3.49Å; I222-Y226 VanDerWaalsContact CG2-CE2 3.49Å; I222-Y226 WeakPolarHBondContact O-CD2 3.05Å; I222-Y226 PolarHBondContact O-N 3.32Å; F223-Y226 WeakPolarHBondContact O-CB 3.17Å; F223-Y226 PolarHBondContact O-N 2.91Å; E224-Y226 VanDerWaalsContact C-N 3.26Å; E224-Y226 PolarHBondContact O-N 3.47Å; Y226-V228 PolarHBondContact O-N 2.98Å; Y226-S229 PolarHBondContact O-N 2.9Å; Y226-W230 WeakPolarHBondContact O-CB 3.46Å; Y226-W230 PolarHBondContact O-N 3.39Å; Y226-I233 HydrophobicContact CD1-CD1 3.7Å; Y226-I233 HydrophobicContact CE1-CD1 3.77Å; Y226-V638 HydrophobicContact CE2-CG1 3.98Å; Y226-T642 HydrophobicContact CE1-CG2 4.02Å; Y226-T642 PolarHBondContact OH-OG1 2.8Å
227	T	81.7	Confident	81.3	Confident	73 Å²	73	70.9 Å²	70.9	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-27.7	-179.1	58.1	0	0	0	0	112.7	F223 E224	F223-T227 HydrophobicContact CD1-CG2 4.03Å; F223-T227 HydrophobicContact CE1-CG2 3.58Å; F223-T227 HydrophobicContact CE2-CG2 4.34Å; F223-T227 HydrophobicContact CZ-CG2 3.76Å; F223-T227 WeakPolarHBondContact O-CG2 3.26Å; F223-T227 PolarHBondContact O-N 3.42Å; E224-T227 PolarHBondContact O-N 2.91Å; E224-T227 VanDerWaalsContact O-N 3.07Å; E224-T227 PolarHBondContact O-OG1 3.29Å
228	V	84.8	Confident	82.8	Confident	61 Å²	61	69.6 Å²	69.6	37%	0.37	34%	0.339	S	S	.	.	H	α-helix	trans	-87.7	-36.7	176.5	-177.9	0	0	0	0	111.8	E224 Y226 Y231 P631	E224-V228 PolarHBondContact O-N 3.27Å; E224-V228 VanDerWaalsContact O-N 3.17Å; Y226-V228 PolarHBondContact O-N 2.98Å; V228-Y231 WeakPolarHBondContact O-CE1 3.36Å; V228-P631 HydrophobicContact CG1-CB 3.42Å; V228-P631 VanDerWaalsContact CG1-CB 3.42Å; V228-P631 HydrophobicContact CG1-CG 4.25Å
229	S	88.8	Confident	84	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-98.8	-5.5	-170.9	65.3	0	0	0	0	116.3	D225 Y226 Y231 W232 I233 P639	D225-S229 VanDerWaalsContact O-CB 3.26Å; D225-S229 WeakPolarHBondContact O-CB 3.25Å; D225-S229 PolarHBondContact O-N 3.28Å; D225-S229 PolarHBondContact O-OG 3.43Å; Y226-S229 PolarHBondContact O-N 2.9Å; S229-Y231 VanDerWaalsContact C-N 3.32Å; S229-Y231 PolarHBondContact O-N 2.97Å; S229-Y231 VanDerWaalsContact O-N 3.15Å; S229-W232 WeakPolarHBondContact O-CB 3.46Å; S229-W232 PolarHBondContact O-N 3.47Å; S229-I233 WeakPolarHBondContact O-CG1 3.42Å; S229-I233 PolarHBondContact O-N 3.38Å; S229-P639 WeakPolarHBondContact OG-CG 3.39Å
230	W	89.1	Confident	85.5	Confident	149 Å²	149	67.6 Å²	67.6	56%	0.564	32%	0.321	S	S	*	.	H	α-helix	trans	-54	-40.1	-170.4	69.5	-82.1	0	0	0	114.7	Y226 I233 I234	Y226-W230 WeakPolarHBondContact O-CB 3.46Å; Y226-W230 PolarHBondContact O-N 3.39Å; W230-I233 WeakPolarHBondContact O-CB 3.42Å; W230-I233 PolarHBondContact O-N 2.96Å; W230-I234 HydrophobicContact CE3-CD1 3.54Å; W230-I234 HydrophobicContact CZ3-CD1 3.68Å; W230-I234 WeakPolarHBondContact O-CG1 3.19Å; W230-I234 PolarHBondContact O-N 3.33Å
231	Y	90.6	Very high	86.6	Confident	96 Å²	96	66.3 Å²	66.3	38%	0.376	31%	0.314	S	S	.	.	H	α-helix	trans	-69.2	-37.3	-179.2	69.8	-87.7	0	0	0	111.9	V228 S229 I233 I234 I235	V228-Y231 WeakPolarHBondContact O-CE1 3.36Å; S229-Y231 VanDerWaalsContact C-N 3.32Å; S229-Y231 PolarHBondContact O-N 2.97Å; S229-Y231 VanDerWaalsContact O-N 3.15Å; Y231-I233 VanDerWaalsContact C-N 3.35Å; Y231-I234 PolarHBondContact O-N 3.12Å; Y231-I235 HydrophobicContact CD2-CD1 4.34Å; Y231-I235 WeakPolarHBondContact O-CG1 3.38Å; Y231-I235 PolarHBondContact O-N 3.45Å
232	W	90.5	Very high	87.5	Confident	53 Å²	53	63.5 Å²	63.5	20%	0.201	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-38.5	172.8	-69.4	118.6	0	0	0	112	S229 I234 I235 G236 F618 F619	S229-W232 WeakPolarHBondContact O-CB 3.46Å; S229-W232 PolarHBondContact O-N 3.47Å; W232-I234 VanDerWaalsContact C-N 3.33Å; W232-I235 HydrophobicContact CE3-CD1 3.92Å; W232-I235 HydrophobicContact CZ3-CD1 4.16Å; W232-I235 PolarHBondContact O-N 2.87Å; W232-G236 PolarHBondContact O-N 3.49Å; W232-F618 HydrophobicContact CB-CE1 4.24Å; W232-F618 AromaticContact CD2-CE1 3.8Å; W232-F618 HydrophobicContact CD2-CE1 3.8Å; W232-F618 HydrophobicContact CD2-CE2 4.43Å; W232-F618 AromaticContact CD2-CZ 3.4Å; W232-F618 HydrophobicContact CD2-CZ 3.4Å; W232-F618 VanDerWaalsContact CD2-CZ 3.4Å; W232-F618 AromaticContact CE2-CZ 3.61Å; W232-F618 HydrophobicContact CE3-CE1 4.04Å; W232-F618 HydrophobicContact CE3-CE2 4.07Å; W232-F618 AromaticContact CE3-CZ 3.43Å; W232-F618 HydrophobicContact CE3-CZ 3.43Å; W232-F618 VanDerWaalsContact CE3-CZ 3.43Å; W232-F618 AromaticContact CG-CE1 3.9Å; W232-F618 HydrophobicContact CG-CE1 3.9Å; W232-F618 HydrophobicContact CG-CZ 4Å; W232-F618 HydrophobicContact CH2-CE2 4.23Å; W232-F618 AromaticContact CH2-CZ 3.94Å; W232-F618 HydrophobicContact CH2-CZ 3.94Å; W232-F618 AromaticContact CZ2-CZ 3.9Å; W232-F618 HydrophobicContact CZ2-CZ 3.9Å; W232-F618 AromaticContact CZ3-CE2 3.96Å; W232-F618 HydrophobicContact CZ3-CE2 3.96Å; W232-F618 AromaticContact CZ3-CZ 3.7Å; W232-F618 HydrophobicContact CZ3-CZ 3.7Å; W232-F619 HydrophobicContact CB-CE1 4.38Å; W232-F619 HydrophobicContact CB-CZ 4.11Å
233	I	91.1	Very high	88.2	Confident	11 Å²	11	63.9 Å²	63.9	6%	0.056	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-46.8	173.7	-64.2	171.2	0	0	0	109.6	Y226 S229 W230 Y231 I235 G236 L237 P639 T642 V643	Y226-I233 HydrophobicContact CD1-CD1 3.7Å; Y226-I233 HydrophobicContact CE1-CD1 3.77Å; S229-I233 WeakPolarHBondContact O-CG1 3.42Å; S229-I233 PolarHBondContact O-N 3.38Å; W230-I233 WeakPolarHBondContact O-CB 3.42Å; W230-I233 PolarHBondContact O-N 2.96Å; Y231-I233 VanDerWaalsContact C-N 3.35Å; I233-I235 PolarHBondContact O-N 3.24Å; I233-G236 PolarHBondContact O-N 3.11Å; I233-L237 HydrophobicContact CG2-CD1 4.28Å; I233-L237 HydrophobicContact CG2-CG 4.49Å; I233-L237 WeakPolarHBondContact O-CG 3.35Å; I233-L237 PolarHBondContact O-N 3.41Å; I233-P639 HydrophobicContact CD1-CB 4.02Å; I233-P639 HydrophobicContact CG1-CB 4.09Å; I233-T642 HydrophobicContact CG2-CG2 4.09Å; I233-V643 HydrophobicContact CB-CG2 4.31Å; I233-V643 HydrophobicContact CG1-CG2 4.29Å; I233-V643 HydrophobicContact CG2-CG2 4.03Å
234	I	92	Very high	89	Confident	86 Å²	86	57.5 Å²	57.5	44%	0.441	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-45.7	177.2	-68.7	174.5	0	0	0	111.3	W230 Y231 W232 G236 L237 V238	W230-I234 HydrophobicContact CE3-CD1 3.54Å; W230-I234 HydrophobicContact CZ3-CD1 3.68Å; W230-I234 WeakPolarHBondContact O-CG1 3.19Å; W230-I234 PolarHBondContact O-N 3.33Å; Y231-I234 PolarHBondContact O-N 3.12Å; W232-I234 VanDerWaalsContact C-N 3.33Å; I234-G236 VanDerWaalsContact C-N 3.3Å; I234-G236 PolarHBondContact O-N 2.87Å; I234-L237 PolarHBondContact O-N 3.05Å; I234-L237 VanDerWaalsContact O-N 3.12Å; I234-V238 HydrophobicContact CG2-CG2 4.41Å; I234-V238 WeakPolarHBondContact O-CG2 3.38Å; I234-V238 PolarHBondContact O-N 2.83Å
235	I	91.7	Very high	89.5	Confident	79 Å²	79	55.5 Å²	55.5	41%	0.405	28%	0.282	S	S	.	.	H	α-helix	trans	-58	-45	176.3	-68.1	165.7	0	0	0	110.5	Y231 W232 I233 L237 V238 I239	Y231-I235 HydrophobicContact CD2-CD1 4.34Å; Y231-I235 WeakPolarHBondContact O-CG1 3.38Å; Y231-I235 PolarHBondContact O-N 3.45Å; W232-I235 HydrophobicContact CE3-CD1 3.92Å; W232-I235 HydrophobicContact CZ3-CD1 4.16Å; W232-I235 PolarHBondContact O-N 2.87Å; I233-I235 PolarHBondContact O-N 3.24Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.48Å; I235-V238 PolarHBondContact O-N 3.25Å; I235-I239 HydrophobicContact CG2-CD1 4.03Å; I235-I239 WeakPolarHBondContact O-CG1 3.36Å; I235-I239 PolarHBondContact O-N 2.91Å
236	G	91.7	Very high	89.8	Confident	12 Å²	12	60 Å²	60	12%	0.124	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-40.8	175.2	0	0	0	0	0	113.1	W232 I233 I234 I239 A240	W232-G236 PolarHBondContact O-N 3.49Å; I233-G236 PolarHBondContact O-N 3.11Å; I234-G236 VanDerWaalsContact C-N 3.3Å; I234-G236 PolarHBondContact O-N 2.87Å; G236-I239 PolarHBondContact O-N 2.85Å; G236-A240 PolarHBondContact O-N 3.04Å
237	L	92.9	Very high	90	Very high	44 Å²	44	56.8 Å²	56.8	23%	0.23	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-35.8	176.1	-65	178.2	0	0	0	112.7	I233 I234 I235 A240 M241 I650	I233-L237 HydrophobicContact CG2-CD1 4.28Å; I233-L237 HydrophobicContact CG2-CG 4.49Å; I233-L237 WeakPolarHBondContact O-CG 3.35Å; I233-L237 PolarHBondContact O-N 3.41Å; I234-L237 PolarHBondContact O-N 3.05Å; I234-L237 VanDerWaalsContact O-N 3.12Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.48Å; L237-A240 WeakPolarHBondContact O-CB 3.29Å; L237-A240 PolarHBondContact O-N 3.32Å; L237-M241 PolarHBondContact O-N 2.89Å; L237-I650 HydrophobicContact CB-CD1 3.95Å; L237-I650 HydrophobicContact CD2-CD1 4.06Å; L237-I650 WeakPolarHBondContact O-CD1 3.34Å
238	V	92.6	Very high	90	Very high	78 Å²	78	53.6 Å²	53.6	47%	0.473	27%	0.273	S	S	.	.	H	α-helix	trans	-66.1	-41.5	173.6	172.7	0	0	0	0	110.7	I234 I235 A240 M241 A242	I234-V238 HydrophobicContact CG2-CG2 4.41Å; I234-V238 WeakPolarHBondContact O-CG2 3.38Å; I234-V238 PolarHBondContact O-N 2.83Å; I235-V238 PolarHBondContact O-N 3.25Å; V238-A240 VanDerWaalsContact C-N 3.33Å; V238-A240 PolarHBondContact O-N 3.46Å; V238-M241 WeakPolarHBondContact O-CB 3.49Å; V238-M241 PolarHBondContact O-N 2.83Å; V238-A242 PolarHBondContact O-N 3.02Å
239	I	93.1	Very high	89.9	Confident	77 Å²	77	54.3 Å²	54.3	40%	0.395	27%	0.274	S	S	.	.	H	α-helix	trans	-60.5	-44.9	172.7	-67.3	167.2	0	0	0	110	I235 G236 M241 A242 M243	I235-I239 HydrophobicContact CG2-CD1 4.03Å; I235-I239 WeakPolarHBondContact O-CG1 3.36Å; I235-I239 PolarHBondContact O-N 2.91Å; G236-I239 PolarHBondContact O-N 2.85Å; I239-M241 VanDerWaalsContact C-N 3.3Å; I239-M241 PolarHBondContact O-N 3.45Å; I239-A242 PolarHBondContact O-N 2.99Å; I239-M243 HydrophobicContact CG2-CG 4.26Å; I239-M243 HydrophobicContact CG2-SD 4.32Å; I239-M243 WeakPolarHBondContact O-CG 3.44Å; I239-M243 PolarHBondContact O-N 2.84Å
240	A	93.8	Very high	89.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.6	-41.4	176.2	0	0	0	0	0	112.5	G236 L237 V238 S244 V611 S647 I650	G236-A240 PolarHBondContact O-N 3.04Å; L237-A240 WeakPolarHBondContact O-CB 3.29Å; L237-A240 PolarHBondContact O-N 3.32Å; V238-A240 VanDerWaalsContact C-N 3.33Å; V238-A240 PolarHBondContact O-N 3.46Å; A240-S244 WeakPolarHBondContact O-CB 3.39Å; A240-S244 PolarHBondContact O-N 3.5Å; A240-S244 PolarHBondContact O-OG 3.32Å; A240-V611 HydrophobicContact CB-CG1 4.47Å; A240-V611 HydrophobicContact CB-CG2 3.76Å; A240-S647 VanDerWaalsContact CB-OG 3.26Å; A240-S647 WeakPolarHBondContact CB-OG 3.48Å; A240-I650 HydrophobicContact CB-CD1 4.43Å
241	M	90.7	Very high	89.3	Confident	91 Å²	91	50.7 Å²	50.7	45%	0.448	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-47.4	174.7	-178.7	178	69.2	0	0	111.6	L237 V238 I239 S244 L245 I650 F654	L237-M241 PolarHBondContact O-N 2.89Å; V238-M241 WeakPolarHBondContact O-CB 3.49Å; V238-M241 PolarHBondContact O-N 2.83Å; I239-M241 VanDerWaalsContact C-N 3.3Å; I239-M241 PolarHBondContact O-N 3.45Å; M241-S244 WeakPolarHBondContact O-CB 3.47Å; M241-S244 PolarHBondContact O-N 2.94Å; M241-L245 PolarHBondContact O-N 3.46Å; M241-I650 HydrophobicContact CB-CG2 4.1Å; M241-F654 HydrophobicContact CG-CE2 3.91Å; M241-F654 HydrophobicContact CG-CZ 3.91Å
242	A	91.3	Very high	88.7	Confident	55 Å²	55	51.2 Å²	51.2	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-43.6	178.4	0	0	0	0	0	111.9	V238 I239 S244 L245 L246	V238-A242 PolarHBondContact O-N 3.02Å; I239-A242 PolarHBondContact O-N 2.99Å; A242-S244 VanDerWaalsContact C-N 3.35Å; A242-S244 PolarHBondContact O-N 3.42Å; A242-L245 PolarHBondContact O-N 3.4Å; A242-L246 WeakPolarHBondContact O-CB 3.49Å; A242-L246 PolarHBondContact O-N 3.31Å
243	M	91.7	Very high	88.2	Confident	46 Å²	46	55.2 Å²	55.2	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-36.1	175.1	-68	-162.6	-33.5	0	0	112.5	I239 L246 F247 I607 S610 V611	I239-M243 HydrophobicContact CG2-CG 4.26Å; I239-M243 HydrophobicContact CG2-SD 4.32Å; I239-M243 WeakPolarHBondContact O-CG 3.44Å; I239-M243 PolarHBondContact O-N 2.84Å; M243-L246 PolarHBondContact O-N 3.06Å; M243-F247 VanDerWaalsContact O-CB 3.29Å; M243-F247 WeakPolarHBondContact O-CB 3.5Å; M243-F247 PolarHBondContact O-N 3.45Å; M243-I607 HydrophobicContact CE-CG2 4.28Å; M243-S610 VanDerWaalsContact CE-OG 3.28Å; M243-S610 WeakPolarHBondContact CE-OG 3.48Å; M243-V611 HydrophobicContact CE-CB 4.32Å; M243-V611 HydrophobicContact CE-CG2 3.13Å
244	S	90.7	Very high	87.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-43.8	174.6	-60.2	0	0	0	0	111.4	A240 M241 A242 F247 I248	A240-S244 WeakPolarHBondContact O-CB 3.39Å; A240-S244 PolarHBondContact O-N 3.5Å; A240-S244 PolarHBondContact O-OG 3.32Å; M241-S244 WeakPolarHBondContact O-CB 3.47Å; M241-S244 PolarHBondContact O-N 2.94Å; A242-S244 VanDerWaalsContact C-N 3.35Å; A242-S244 PolarHBondContact O-N 3.42Å; S244-F247 PolarHBondContact O-N 3.21Å; S244-I248 WeakPolarHBondContact O-CG1 3.37Å; S244-I248 PolarHBondContact O-N 2.78Å; S244-I248 VanDerWaalsContact O-N 3.14Å
245	L	86.3	Confident	87.1	Confident	69 Å²	69	54.5 Å²	54.5	36%	0.361	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-45.9	175.9	-173.2	70.6	0	0	0	111.2	M241 A242 F247 I248 I249 L359	M241-L245 PolarHBondContact O-N 3.46Å; A242-L245 PolarHBondContact O-N 3.4Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 3.25Å; L245-I248 PolarHBondContact O-N 3.19Å; L245-I249 HydrophobicContact CG-CD1 4.08Å; L245-I249 WeakPolarHBondContact O-CG1 3.41Å; L245-I249 PolarHBondContact O-N 3.37Å; L245-L359 HydrophobicContact CD1-CD1 3.71Å
246	L	88.2	Confident	86.5	Confident	96 Å²	96	52 Å²	52	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-57.8	-46.1	176.2	179.2	63.3	0	0	0	111	A242 M243 I248 I249 L250	A242-L246 WeakPolarHBondContact O-CB 3.49Å; A242-L246 PolarHBondContact O-N 3.31Å; M243-L246 PolarHBondContact O-N 3.06Å; L246-I248 VanDerWaalsContact C-N 3.31Å; L246-I248 PolarHBondContact O-N 3.12Å; L246-I249 PolarHBondContact O-N 2.85Å; L246-I249 VanDerWaalsContact O-N 3.16Å; L246-L250 HydrophobicContact CD1-CD1 4.35Å; L246-L250 HydrophobicContact CD1-CG 4.24Å; L246-L250 HydrophobicContact CG-CD1 4Å; L246-L250 HydrophobicContact CG-CG 4.32Å; L246-L250 WeakPolarHBondContact O-CB 3.26Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.31Å; L246-L250 PolarHBondContact O-N 3.47Å
247	F	87.2	Confident	86.3	Confident	15 Å²	15	56.7 Å²	56.7	7%	0.066	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-43	177.7	-174.5	-88.5	0	0	0	111.9	M243 S244 L245 L250 L251 M258 M262 I607 F655	M243-F247 VanDerWaalsContact O-CB 3.29Å; M243-F247 WeakPolarHBondContact O-CB 3.5Å; M243-F247 PolarHBondContact O-N 3.45Å; S244-F247 PolarHBondContact O-N 3.21Å; L245-F247 VanDerWaalsContact C-N 3.33Å; L245-F247 PolarHBondContact O-N 3.25Å; F247-L250 PolarHBondContact O-N 3.3Å; F247-L251 HydrophobicContact CD1-CD1 4.01Å; F247-L251 HydrophobicContact CD1-CG 4.25Å; F247-L251 HydrophobicContact CE1-CD1 3.67Å; F247-L251 HydrophobicContact CE1-CD2 4.36Å; F247-L251 HydrophobicContact CE1-CG 3.96Å; F247-L251 WeakPolarHBondContact O-CG 3.03Å; F247-L251 PolarHBondContact O-N 3.35Å; F247-M258 HydrophobicContact CD1-CE 4.38Å; F247-M258 HydrophobicContact CD2-CE 3.66Å; F247-M258 HydrophobicContact CE1-CE 4.02Å; F247-M258 HydrophobicContact CE2-CE 3.25Å; F247-M258 HydrophobicContact CG-CE 4.21Å; F247-M258 HydrophobicContact CZ-CE 3.46Å; F247-M258 VanDerWaalsContact CZ-CE 3.46Å; F247-M262 HydrophobicContact CE2-SD 4.11Å; F247-M262 HydrophobicContact CZ-CE 4.35Å; F247-M262 HydrophobicContact CZ-SD 3.78Å; F247-I607 HydrophobicContact CB-CD1 4.05Å; F247-I607 HydrophobicContact CB-CG1 4.5Å; F247-I607 HydrophobicContact CD1-CD1 4.4Å; F247-I607 HydrophobicContact CG-CD1 4.11Å; F247-F655 HydrophobicContact CD1-CE1 4.17Å; F247-F655 AromaticContact CD1-CZ 3.65Å; F247-F655 HydrophobicContact CD1-CZ 3.65Å; F247-F655 AromaticContact CE1-CE1 3.8Å; F247-F655 HydrophobicContact CE1-CE1 3.8Å; F247-F655 AromaticContact CE1-CZ 3.45Å; F247-F655 HydrophobicContact CE1-CZ 3.45Å; F247-F655 VanDerWaalsContact CE1-CZ 3.45Å; F247-F655 HydrophobicContact CZ-CZ 4.36Å
248	I	82.4	Confident	85.8	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-39.9	176.9	-70.8	172.9	0	0	0	111.7	S244 L245 L246 L251 R252 L359 F654 Y658	S244-I248 WeakPolarHBondContact O-CG1 3.37Å; S244-I248 PolarHBondContact O-N 2.78Å; S244-I248 VanDerWaalsContact O-N 3.14Å; L245-I248 PolarHBondContact O-N 3.19Å; L246-I248 VanDerWaalsContact C-N 3.31Å; L246-I248 PolarHBondContact O-N 3.12Å; I248-L251 WeakPolarHBondContact O-CB 3.46Å; I248-L251 PolarHBondContact O-N 3.47Å; I248-R252 PolarHBondContact O-N 3.08Å; I248-L359 HydrophobicContact CD1-CD2 4.35Å; I248-F654 HydrophobicContact CD1-CB 3.79Å; I248-F654 HydrophobicContact CD1-CD1 3.92Å; I248-F654 HydrophobicContact CD1-CG 4.21Å; I248-Y658 HydrophobicContact CG2-CD2 4.34Å; I248-Y658 HydrophobicContact CG2-CE2 4.19Å
249	I	82	Confident	85.3	Confident	76 Å²	76	52.1 Å²	52.1	39%	0.39	27%	0.271	S	S	.	.	H	α-helix	trans	-64.9	-41.8	175.3	-67.3	167.8	0	0	0	110.3	L245 L246 L251 R252 F253	L245-I249 HydrophobicContact CG-CD1 4.08Å; L245-I249 WeakPolarHBondContact O-CG1 3.41Å; L245-I249 PolarHBondContact O-N 3.37Å; L246-I249 PolarHBondContact O-N 2.85Å; L246-I249 VanDerWaalsContact O-N 3.16Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 3.06Å; I249-R252 WeakPolarHBondContact O-CB 3.3Å; I249-R252 PolarHBondContact O-N 3.45Å; I249-F253 HydrophobicContact CG2-CD2 4.46Å; I249-F253 HydrophobicContact CG2-CE2 3.91Å; I249-F253 WeakPolarHBondContact O-CD2 3.26Å
250	L	84.1	Confident	84.9	Confident	68 Å²	68	54.1 Å²	54.1	36%	0.356	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-37.2	177.5	-70	173.1	0	0	0	112.1	L246 F247 R252 F253 L254 M258	L246-L250 HydrophobicContact CD1-CD1 4.35Å; L246-L250 HydrophobicContact CD1-CG 4.24Å; L246-L250 HydrophobicContact CG-CD1 4Å; L246-L250 HydrophobicContact CG-CG 4.32Å; L246-L250 WeakPolarHBondContact O-CB 3.26Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.31Å; L246-L250 PolarHBondContact O-N 3.47Å; F247-L250 PolarHBondContact O-N 3.3Å; L250-R252 PolarHBondContact O-N 2.86Å; L250-R252 VanDerWaalsContact O-N 3.14Å; L250-F253 PolarHBondContact O-N 2.84Å; L250-F253 VanDerWaalsContact O-N 3.17Å; L250-L254 PolarHBondContact O-N 2.82Å; L250-M258 HydrophobicContact CB-CE 4.44Å; L250-M258 HydrophobicContact CB-SD 3.55Å; L250-M258 VanDerWaalsContact CB-SD 3.55Å
251	L	80.4	Confident	84.6	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-26.5	172.6	-77.2	177.4	0	0	0	112.4	F247 I248 I249 A255 M258	F247-L251 HydrophobicContact CD1-CD1 4.01Å; F247-L251 HydrophobicContact CD1-CG 4.25Å; F247-L251 HydrophobicContact CE1-CD1 3.67Å; F247-L251 HydrophobicContact CE1-CD2 4.36Å; F247-L251 HydrophobicContact CE1-CG 3.96Å; F247-L251 WeakPolarHBondContact O-CG 3.03Å; F247-L251 PolarHBondContact O-N 3.35Å; I248-L251 WeakPolarHBondContact O-CB 3.46Å; I248-L251 PolarHBondContact O-N 3.47Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 3.06Å; L251-A255 WeakPolarHBondContact O-CA 3.46Å; L251-A255 WeakPolarHBondContact O-CB 3.41Å; L251-A255 PolarHBondContact O-N 2.91Å; L251-M258 HydrophobicContact CD2-CB 4.43Å; L251-M258 HydrophobicContact CD2-CE 3.7Å; L251-M258 HydrophobicContact CD2-SD 4Å; L251-M258 HydrophobicContact CG-CE 3.94Å; L251-M258 HydrophobicContact CG-SD 4.26Å
252	R	79	Confident	84.2	Confident	106 Å²	106	54.3 Å²	54.3	40%	0.4	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-44.9	177.3	-166.8	178.4	172.6	173.5	-1.3	112.7	I248 I249 L250 S349	I248-R252 PolarHBondContact O-N 3.08Å; I249-R252 WeakPolarHBondContact O-CB 3.3Å; I249-R252 PolarHBondContact O-N 3.45Å; L250-R252 PolarHBondContact O-N 2.86Å; L250-R252 VanDerWaalsContact O-N 3.14Å; R252-S349 WeakPolarHBondContact CA-OG 3.48Å; R252-S349 WeakPolarHBondContact CB-OG 3.46Å; R252-S349 PolarHBondContact N-OG 2.91Å
253	F	79.8	Confident	83.9	Confident	137 Å²	137	52 Å²	52	60%	0.601	26%	0.259	S	S	*	.	H	α-helix	trans	-93.9	-38.4	-171.1	-57.7	-71.4	0	0	0	111.6	I249 L250	I249-F253 HydrophobicContact CG2-CD2 4.46Å; I249-F253 HydrophobicContact CG2-CE2 3.91Å; I249-F253 WeakPolarHBondContact O-CD2 3.26Å; L250-F253 PolarHBondContact O-N 2.84Å; L250-F253 VanDerWaalsContact O-N 3.17Å
254	L	82.8	Confident	83.7	Confident	79 Å²	79	54.2 Å²	54.2	41%	0.414	27%	0.271	S	S	.	.	H	α-helix	trans	-122.9	18.6	-166.8	-61	166.4	0	0	0	112.8	L250 G256 I257 M258	L250-L254 PolarHBondContact O-N 2.82Å; L254-G256 PolarHBondContact O-N 3.37Å; L254-I257 HydrophobicContact CD2-CD1 3.85Å; L254-I257 PolarHBondContact O-N 3.06Å; L254-M258 HydrophobicContact CB-CG 4.14Å; L254-M258 WeakPolarHBondContact O-CB 3.32Å; L254-M258 PolarHBondContact O-N 3.16Å
255	A	76.5	Confident	83.5	Confident	3 Å²	3	58.4 Å²	58.4	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-43.2	-47	-178.3	0	0	0	0	0	114	L251 V259 I342 K346	L251-A255 WeakPolarHBondContact O-CA 3.46Å; L251-A255 WeakPolarHBondContact O-CB 3.41Å; L251-A255 PolarHBondContact O-N 2.91Å; A255-V259 WeakPolarHBondContact O-CB 3.48Å; A255-V259 WeakPolarHBondContact O-CG2 3.22Å; A255-V259 PolarHBondContact O-N 2.96Å; A255-I342 HydrophobicContact CB-CG2 4.45Å; A255-K346 HydrophobicContact CB-CB 4.46Å
256	G	80.6	Confident	83.4	Confident	28 Å²	28	56.3 Å²	56.3	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-51.9	178.7	0	0	0	0	0	112.5	L254 V259 W260	L254-G256 PolarHBondContact O-N 3.37Å; G256-V259 PolarHBondContact O-N 3.37Å; G256-W260 PolarHBondContact O-N 3.14Å; G256-W260 VanDerWaalsContact O-N 3.15Å
257	I	85.4	Confident	83.5	Confident	109 Å²	109	54.2 Å²	54.2	56%	0.559	27%	0.27	S	S	*	.	H	α-helix	trans	-62.9	-46.6	-179.6	-64	172.9	0	0	0	110.1	L254 V259 W260 V261	L254-I257 HydrophobicContact CD2-CD1 3.85Å; L254-I257 PolarHBondContact O-N 3.06Å; I257-V259 PolarHBondContact O-N 3.21Å; I257-W260 PolarHBondContact O-N 2.83Å; I257-V261 HydrophobicContact CG2-CG2 4.05Å; I257-V261 WeakPolarHBondContact O-CB 3.36Å; I257-V261 VanDerWaalsContact O-CG2 3.27Å; I257-V261 WeakPolarHBondContact O-CG2 3.26Å; I257-V261 PolarHBondContact O-N 3.28Å
258	M	82.8	Confident	83.6	Confident	26 Å²	26	59 Å²	59	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-46.5	178	-79.1	-174.2	58.3	0	0	112.2	F247 L250 L251 L254 W260 V261 M262	F247-M258 HydrophobicContact CD1-CE 4.38Å; F247-M258 HydrophobicContact CD2-CE 3.66Å; F247-M258 HydrophobicContact CE1-CE 4.02Å; F247-M258 HydrophobicContact CE2-CE 3.25Å; F247-M258 HydrophobicContact CG-CE 4.21Å; F247-M258 HydrophobicContact CZ-CE 3.46Å; F247-M258 VanDerWaalsContact CZ-CE 3.46Å; L250-M258 HydrophobicContact CB-CE 4.44Å; L250-M258 HydrophobicContact CB-SD 3.55Å; L250-M258 VanDerWaalsContact CB-SD 3.55Å; L251-M258 HydrophobicContact CD2-CB 4.43Å; L251-M258 HydrophobicContact CD2-CE 3.7Å; L251-M258 HydrophobicContact CD2-SD 4Å; L251-M258 HydrophobicContact CG-CE 3.94Å; L251-M258 HydrophobicContact CG-SD 4.26Å; L254-M258 HydrophobicContact CB-CG 4.14Å; L254-M258 WeakPolarHBondContact O-CB 3.32Å; L254-M258 PolarHBondContact O-N 3.16Å; M258-W260 VanDerWaalsContact C-N 3.34Å; M258-W260 PolarHBondContact O-N 3.44Å; M258-V261 PolarHBondContact O-N 3.5Å; M258-M262 VanDerWaalsContact O-CB 3.3Å; M258-M262 WeakPolarHBondContact O-CB 3.14Å; M258-M262 WeakPolarHBondContact O-CG 3.28Å; M258-M262 PolarHBondContact O-N 3.44Å
259	V	82.3	Confident	83.9	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-61.3	-44.4	179.3	167.3	0	0	0	0	110.9	A255 G256 I257 M262 I263 I338 I342 L599	A255-V259 WeakPolarHBondContact O-CB 3.48Å; A255-V259 WeakPolarHBondContact O-CG2 3.22Å; A255-V259 PolarHBondContact O-N 2.96Å; G256-V259 PolarHBondContact O-N 3.37Å; I257-V259 PolarHBondContact O-N 3.21Å; V259-M262 HydrophobicContact CG2-CE 4.05Å; V259-M262 PolarHBondContact O-N 3.39Å; V259-I263 HydrophobicContact CG1-CD1 3.69Å; V259-I263 HydrophobicContact CG1-CG1 4.5Å; V259-I263 WeakPolarHBondContact O-CB 3.34Å; V259-I263 WeakPolarHBondContact O-CD1 3.39Å; V259-I263 WeakPolarHBondContact O-CG1 3.18Å; V259-I263 PolarHBondContact O-N 2.92Å; V259-I338 HydrophobicContact CG1-CG2 4.46Å; V259-I342 HydrophobicContact CB-CD1 4.18Å; V259-I342 HydrophobicContact CB-CG1 4.24Å; V259-I342 HydrophobicContact CG1-CD1 3.9Å; V259-I342 HydrophobicContact CG1-CG1 4.1Å; V259-I342 HydrophobicContact CG2-CG1 4.2Å; V259-L599 HydrophobicContact CB-CD2 4.38Å; V259-L599 HydrophobicContact CG1-CD1 4.16Å; V259-L599 HydrophobicContact CG1-CD2 3.63Å; V259-L599 HydrophobicContact CG2-CD1 3.96Å; V259-L599 HydrophobicContact CG2-CD2 4.06Å
260	W	85.8	Confident	84.2	Confident	119 Å²	119	60.1 Å²	60.1	45%	0.451	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-42.9	176.6	-75.3	113.9	0	0	0	113.2	G256 I257 M258 M262 I263 I264	G256-W260 PolarHBondContact O-N 3.14Å; G256-W260 VanDerWaalsContact O-N 3.15Å; I257-W260 PolarHBondContact O-N 2.83Å; M258-W260 VanDerWaalsContact C-N 3.34Å; M258-W260 PolarHBondContact O-N 3.44Å; W260-M262 VanDerWaalsContact C-N 3.32Å; W260-M262 PolarHBondContact O-N 2.98Å; W260-I263 HydrophobicContact CE3-CD1 4.38Å; W260-I263 PolarHBondContact O-N 3.14Å; W260-I264 WeakPolarHBondContact O-CB 3.5Å; W260-I264 VanDerWaalsContact O-CG1 3.26Å; W260-I264 WeakPolarHBondContact O-CG1 3.26Å; W260-I264 PolarHBondContact O-N 3.03Å
261	V	86.4	Confident	84.6	Confident	86 Å²	86	58.4 Å²	58.4	52%	0.521	30%	0.304	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.9	168.6	0	0	0	0	110.6	I257 M258 I264 M265	I257-V261 HydrophobicContact CG2-CG2 4.05Å; I257-V261 WeakPolarHBondContact O-CB 3.36Å; I257-V261 VanDerWaalsContact O-CG2 3.27Å; I257-V261 WeakPolarHBondContact O-CG2 3.26Å; I257-V261 PolarHBondContact O-N 3.28Å; M258-V261 PolarHBondContact O-N 3.5Å; V261-I264 PolarHBondContact O-N 3.3Å; V261-M265 VanDerWaalsContact O-CB 3.24Å; V261-M265 WeakPolarHBondContact O-CB 3.22Å; V261-M265 PolarHBondContact O-N 3.45Å
262	M	83	Confident	85.1	Confident	8 Å²	8	65.2 Å²	65.2	4%	0.039	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-43.2	177.2	-74.1	-172.3	-60.5	0	0	111.7	F247 M258 V259 W260 M265 V266 L602 L606	F247-M262 HydrophobicContact CE2-SD 4.11Å; F247-M262 HydrophobicContact CZ-CE 4.35Å; F247-M262 HydrophobicContact CZ-SD 3.78Å; M258-M262 VanDerWaalsContact O-CB 3.3Å; M258-M262 WeakPolarHBondContact O-CB 3.14Å; M258-M262 WeakPolarHBondContact O-CG 3.28Å; M258-M262 PolarHBondContact O-N 3.44Å; V259-M262 HydrophobicContact CG2-CE 4.05Å; V259-M262 PolarHBondContact O-N 3.39Å; W260-M262 VanDerWaalsContact C-N 3.32Å; W260-M262 PolarHBondContact O-N 2.98Å; M262-M265 PolarHBondContact O-N 3.35Å; M262-V266 WeakPolarHBondContact O-CG2 3.42Å; M262-V266 PolarHBondContact O-N 3.42Å; M262-L602 HydrophobicContact CB-CD2 3.54Å; M262-L602 HydrophobicContact CB-CG 4Å; M262-L602 HydrophobicContact CG-CD2 4.45Å; M262-L602 HydrophobicContact CG-CG 4.42Å; M262-L602 HydrophobicContact SD-CG 4.21Å; M262-L606 HydrophobicContact CG-CD1 4.38Å
263	I	84.1	Confident	85.6	Confident	8 Å²	8	61.1 Å²	61.1	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-48.2	175.8	-73.3	163.5	0	0	0	111	V259 W260 M265 V266 I267 L331	V259-I263 HydrophobicContact CG1-CD1 3.69Å; V259-I263 HydrophobicContact CG1-CG1 4.5Å; V259-I263 WeakPolarHBondContact O-CB 3.34Å; V259-I263 WeakPolarHBondContact O-CD1 3.39Å; V259-I263 WeakPolarHBondContact O-CG1 3.18Å; V259-I263 PolarHBondContact O-N 2.92Å; W260-I263 HydrophobicContact CE3-CD1 4.38Å; W260-I263 PolarHBondContact O-N 3.14Å; I263-M265 VanDerWaalsContact C-N 3.33Å; I263-M265 PolarHBondContact O-N 3.28Å; I263-V266 PolarHBondContact O-N 3.03Å; I263-I267 HydrophobicContact CG2-CD1 4.17Å; I263-I267 WeakPolarHBondContact O-CG1 3.46Å; I263-I267 PolarHBondContact O-N 3.41Å; I263-L331 HydrophobicContact CD1-CD2 3.8Å; I263-L331 HydrophobicContact CG1-CD2 4.03Å; I263-L331 HydrophobicContact CG2-CD1 3.41Å; I263-L331 VanDerWaalsContact CG2-CD1 3.41Å; I263-L331 HydrophobicContact CG2-CD2 3.81Å; I263-L331 HydrophobicContact CG2-CG 4.25Å
264	I	88.2	Confident	86.2	Confident	92 Å²	92	56.4 Å²	56.4	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-42.8	178.7	-68.8	165.6	0	0	0	110.4	W260 V261 V266 I267 L268	W260-I264 WeakPolarHBondContact O-CB 3.5Å; W260-I264 VanDerWaalsContact O-CG1 3.26Å; W260-I264 WeakPolarHBondContact O-CG1 3.26Å; W260-I264 PolarHBondContact O-N 3.03Å; V261-I264 PolarHBondContact O-N 3.3Å; I264-V266 VanDerWaalsContact C-N 3.33Å; I264-V266 PolarHBondContact O-N 3.17Å; I264-I267 PolarHBondContact O-N 3.31Å; I264-L268 HydrophobicContact CG2-CD1 3.92Å; I264-L268 HydrophobicContact CG2-CG 4.28Å; I264-L268 WeakPolarHBondContact O-CG 3.42Å; I264-L268 PolarHBondContact O-N 3Å
265	M	85.4	Confident	86.7	Confident	89 Å²	89	58.5 Å²	58.5	44%	0.438	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-39.8	179	-176.7	-111	-167.8	0	0	112.1	V261 M262 I263 L268 V269	V261-M265 VanDerWaalsContact O-CB 3.24Å; V261-M265 WeakPolarHBondContact O-CB 3.22Å; V261-M265 PolarHBondContact O-N 3.45Å; M262-M265 PolarHBondContact O-N 3.35Å; I263-M265 VanDerWaalsContact C-N 3.33Å; I263-M265 PolarHBondContact O-N 3.28Å; M265-L268 PolarHBondContact O-N 3.48Å; M265-V269 HydrophobicContact CE-CG2 4.31Å; M265-V269 HydrophobicContact CG-CG2 4.46Å; M265-V269 WeakPolarHBondContact O-CB 3.45Å; M265-V269 VanDerWaalsContact O-CG2 3.28Å; M265-V269 WeakPolarHBondContact O-CG2 3.32Å; M265-V269 PolarHBondContact O-N 3.23Å; M265-V269 HydrophobicContact SD-CG2 4.43Å
266	V	85.4	Confident	87.3	Confident	24 Å²	24	62 Å²	62	15%	0.145	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-47.6	175.2	170.1	0	0	0	0	111.5	M262 I263 I264 L268 V269 L270 I327 L602	M262-V266 WeakPolarHBondContact O-CG2 3.42Å; M262-V266 PolarHBondContact O-N 3.42Å; I263-V266 PolarHBondContact O-N 3.03Å; I264-V266 VanDerWaalsContact C-N 3.33Å; I264-V266 PolarHBondContact O-N 3.17Å; V266-L268 VanDerWaalsContact C-N 3.3Å; V266-L268 PolarHBondContact O-N 2.91Å; V266-V269 PolarHBondContact O-N 3.44Å; V266-L270 HydrophobicContact CG1-CD1 3.84Å; V266-L270 HydrophobicContact CG1-CG 4.43Å; V266-L270 WeakPolarHBondContact O-CB 3.17Å; V266-L270 WeakPolarHBondContact O-CG 3.32Å; V266-L270 PolarHBondContact O-N 3.47Å; V266-I327 HydrophobicContact CG1-CD1 4.32Å; V266-L602 HydrophobicContact CG2-CD1 3.34Å; V266-L602 HydrophobicContact CG2-CD2 3.57Å; V266-L602 HydrophobicContact CG2-CG 4.11Å
267	I	89.4	Confident	87.7	Confident	52 Å²	52	61 Å²	61	27%	0.267	31%	0.312	S	S	.	.	H	α-helix	trans	-57.2	-45.1	176.4	-72	170.2	0	0	0	110.4	I263 I264 G271 E324 L331	I263-I267 HydrophobicContact CG2-CD1 4.17Å; I263-I267 WeakPolarHBondContact O-CG1 3.46Å; I263-I267 PolarHBondContact O-N 3.41Å; I264-I267 PolarHBondContact O-N 3.31Å; I267-G271 PolarHBondContact O-N 3.38Å; I267-E324 VanDerWaalsContact CG2-OE1 3.31Å; I267-E324 WeakPolarHBondContact CG2-OE1 3.39Å; I267-L331 HydrophobicContact CD1-CD1 3.95Å
268	L	90.8	Very high	88	Confident	115 Å²	115	61.8 Å²	61.8	60%	0.602	31%	0.309	S	S	*	.	H	α-helix	trans	-65.9	-42.1	178.9	-71	175.5	0	0	0	112.7	I264 M265 V266 G271 Y272	I264-L268 HydrophobicContact CG2-CD1 3.92Å; I264-L268 HydrophobicContact CG2-CG 4.28Å; I264-L268 WeakPolarHBondContact O-CG 3.42Å; I264-L268 PolarHBondContact O-N 3Å; M265-L268 PolarHBondContact O-N 3.48Å; V266-L268 VanDerWaalsContact C-N 3.3Å; V266-L268 PolarHBondContact O-N 2.91Å; L268-G271 PolarHBondContact O-N 3.36Å; L268-Y272 WeakPolarHBondContact O-CB 3.41Å; L268-Y272 PolarHBondContact O-N 2.85Å
269	V	87.8	Confident	88.3	Confident	81 Å²	81	65.2 Å²	65.2	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-66.6	-42.5	178.9	169	0	0	0	0	111	M265 V266 Y272 G273	M265-V269 HydrophobicContact CE-CG2 4.31Å; M265-V269 HydrophobicContact CG-CG2 4.46Å; M265-V269 WeakPolarHBondContact O-CB 3.45Å; M265-V269 VanDerWaalsContact O-CG2 3.28Å; M265-V269 WeakPolarHBondContact O-CG2 3.32Å; M265-V269 PolarHBondContact O-N 3.23Å; M265-V269 HydrophobicContact SD-CG2 4.43Å; V266-V269 PolarHBondContact O-N 3.44Å; V269-Y272 PolarHBondContact O-N 3.39Å; V269-G273 PolarHBondContact O-N 2.84Å
270	L	88.3	Confident	88.5	Confident	25 Å²	25	66.8 Å²	66.8	13%	0.131	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-42.8	175.6	-71.8	174.3	0	0	0	111.2	V266 Y272 G273 I274 L320 L323 E324 I327	V266-L270 HydrophobicContact CG1-CD1 3.84Å; V266-L270 HydrophobicContact CG1-CG 4.43Å; V266-L270 WeakPolarHBondContact O-CB 3.17Å; V266-L270 WeakPolarHBondContact O-CG 3.32Å; V266-L270 PolarHBondContact O-N 3.47Å; L270-Y272 PolarHBondContact O-N 3.34Å; L270-G273 PolarHBondContact O-N 2.6Å; L270-G273 VanDerWaalsContact O-N 3.14Å; L270-I274 WeakPolarHBondContact O-CG1 3.33Å; L270-I274 PolarHBondContact O-N 2.66Å; L270-L320 HydrophobicContact CD2-CD2 3.84Å; L270-L323 HydrophobicContact CD1-CD2 4.47Å; L270-L323 HydrophobicContact CD2-CD2 4.05Å; L270-E324 WeakPolarHBondContact CB-OE2 3.39Å; L270-E324 WeakPolarHBondContact CD1-OE2 3.17Å; L270-I327 HydrophobicContact CD1-CD1 3.49Å; L270-I327 VanDerWaalsContact CD1-CD1 3.49Å
271	G	92.5	Very high	88.6	Confident	33 Å²	33	63.5 Å²	63.5	34%	0.34	32%	0.321	S	S	.	.	H	α-helix	trans	-58.3	-44.6	172.7	0	0	0	0	0	113	I267 L268 I274 F275	I267-G271 PolarHBondContact O-N 3.38Å; L268-G271 PolarHBondContact O-N 3.36Å; G271-I274 PolarHBondContact O-N 3.4Å; G271-F275 PolarHBondContact O-N 3.24Å
272	Y	91.9	Very high	88.6	Confident	149 Å²	149	62.3 Å²	62.3	58%	0.584	32%	0.316	S	S	*	.	H	α-helix	trans	-62.8	-41	173.2	175.8	-97.7	0	0	0	111.9	L268 V269 L270 F275 H276	L268-Y272 WeakPolarHBondContact O-CB 3.41Å; L268-Y272 PolarHBondContact O-N 2.85Å; V269-Y272 PolarHBondContact O-N 3.39Å; L270-Y272 PolarHBondContact O-N 3.34Å; Y272-F275 PolarHBondContact O-N 3.35Å; Y272-H276 HydrophobicContact CE1-CB 4.44Å; Y272-H276 WeakPolarHBondContact O-CB 3.35Å; Y272-H276 PolarHBondContact O-N 3.37Å
273	G	88.4	Confident	88.8	Confident	19 Å²	19	68.8 Å²	68.8	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-43.8	175.3	0	0	0	0	0	112.5	V269 L270 H276 C277	V269-G273 PolarHBondContact O-N 2.84Å; L270-G273 PolarHBondContact O-N 2.6Å; L270-G273 VanDerWaalsContact O-N 3.14Å; G273-H276 PolarHBondContact O-N 3.22Å; G273-C277 WeakPolarHBondContact O-CB 3.46Å; G273-C277 PolarHBondContact O-N 2.97Å; G273-C277 PolarHBondContact O-SG 3.47Å
274	I	91.9	Very high	88.8	Confident	39 Å²	39	68.5 Å²	68.5	20%	0.2	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-46.7	174.6	-65.8	163.6	0	0	0	110.2	L270 G271 C277 Y278 M317 L320 E324	L270-I274 WeakPolarHBondContact O-CG1 3.33Å; L270-I274 PolarHBondContact O-N 2.66Å; G271-I274 PolarHBondContact O-N 3.4Å; I274-C277 PolarHBondContact O-N 2.99Å; I274-Y278 WeakPolarHBondContact O-CB 3.4Å; I274-Y278 PolarHBondContact O-N 3.05Å; I274-M317 HydrophobicContact CG2-CG 4.19Å; I274-L320 HydrophobicContact CD1-CB 4.46Å; I274-L320 HydrophobicContact CG1-CB 3.72Å; I274-E324 HydrophobicContact CD1-CB 4.23Å
275	F	93.6	Very high	88.2	Confident	122 Å²	122	72.3 Å²	72.3	54%	0.535	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-45.3	177.1	176.9	-101.4	0	0	0	112.4	G271 Y272 Y278 M279	G271-F275 PolarHBondContact O-N 3.24Å; Y272-F275 PolarHBondContact O-N 3.35Å; F275-Y278 WeakPolarHBondContact O-CB 3.38Å; F275-Y278 PolarHBondContact O-N 3.14Å; F275-M279 HydrophobicContact CD1-CG 4.24Å; F275-M279 HydrophobicContact CE1-CG 3.78Å; F275-M279 HydrophobicContact CE2-CG 4.12Å; F275-M279 HydrophobicContact CE2-SD 4.24Å; F275-M279 HydrophobicContact CZ-CG 3.71Å; F275-M279 HydrophobicContact CZ-SD 3.91Å; F275-M279 WeakPolarHBondContact O-CG 3.28Å; F275-M279 PolarHBondContact O-N 3.38Å
276	H	89.4	Confident	87.5	Confident	76 Å²	76	71.7 Å²	71.7	35%	0.352	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-45.2	177.5	-176.7	-76.6	0	0	0	111.5	Y272 G273 Y278 M279 E280 W313	Y272-H276 HydrophobicContact CE1-CB 4.44Å; Y272-H276 WeakPolarHBondContact O-CB 3.35Å; Y272-H276 PolarHBondContact O-N 3.37Å; G273-H276 PolarHBondContact O-N 3.22Å; H276-Y278 VanDerWaalsContact C-N 3.27Å; H276-Y278 PolarHBondContact O-N 2.93Å; H276-M279 PolarHBondContact O-N 3.29Å; H276-E280 PolarHBondContact O-N 3.23Å; H276-W313 AromaticContact ND1-CZ3 3.85Å
277	C	89.7	Confident	87.2	Confident	8 Å²	8	75.6 Å²	75.6	5%	0.054	38%	0.38	C	S	.	.	H	α-helix	trans	-60.7	-37.6	175	-70.1	0	0	0	0	111.9	G273 I274 Y281 W313 M317	G273-C277 WeakPolarHBondContact O-CB 3.46Å; G273-C277 PolarHBondContact O-N 2.97Å; G273-C277 PolarHBondContact O-SG 3.47Å; I274-C277 PolarHBondContact O-N 2.99Å; C277-Y281 WeakPolarHBondContact O-CB 3.48Å; C277-Y281 PolarHBondContact O-N 3.4Å; C277-W313 HydrophobicContact CB-CE3 4.11Å; C277-M317 HydrophobicContact CB-CB 4.05Å
278	Y	91.6	Very high	86	Confident	126 Å²	126	78.3 Å²	78.3	49%	0.494	41%	0.41	S	S	.	.	H	α-helix	trans	-65.4	-45.6	174.7	173.7	-97.6	0	0	0	112.5	I274 F275 H276 E280 Y281 S282 M317	I274-Y278 WeakPolarHBondContact O-CB 3.4Å; I274-Y278 PolarHBondContact O-N 3.05Å; F275-Y278 WeakPolarHBondContact O-CB 3.38Å; F275-Y278 PolarHBondContact O-N 3.14Å; H276-Y278 VanDerWaalsContact C-N 3.27Å; H276-Y278 PolarHBondContact O-N 2.93Å; Y278-E280 PolarHBondContact O-N 2.93Å; Y278-Y281 PolarHBondContact O-N 3.37Å; Y278-S282 WeakPolarHBondContact O-CB 3.42Å; Y278-S282 PolarHBondContact O-N 3.06Å; Y278-M317 VanDerWaalsContact CA-CE 3.5Å; Y278-M317 HydrophobicContact CD2-CE 4.22Å
279	M	89.2	Confident	84.9	Confident	98 Å²	98	75.9 Å²	75.9	48%	0.483	41%	0.413	S	S	.	.	H	α-helix	trans	-59.6	-47.1	177	-73.8	-62.8	-61.8	0	0	111.6	F275 H276 S282 R283	F275-M279 HydrophobicContact CD1-CG 4.24Å; F275-M279 HydrophobicContact CE1-CG 3.78Å; F275-M279 HydrophobicContact CE2-CG 4.12Å; F275-M279 HydrophobicContact CE2-SD 4.24Å; F275-M279 HydrophobicContact CZ-CG 3.71Å; F275-M279 HydrophobicContact CZ-SD 3.91Å; F275-M279 WeakPolarHBondContact O-CG 3.28Å; F275-M279 PolarHBondContact O-N 3.38Å; H276-M279 PolarHBondContact O-N 3.29Å; M279-S282 PolarHBondContact O-N 3.31Å; M279-R283 PolarHBondContact O-N 2.87Å
280	E	86.6	Confident	84.1	Confident	33 Å²	33	72.4 Å²	72.4	15%	0.154	39%	0.392	C	S	.	.	H	α-helix	trans	-69.8	-39.4	-179.3	-162.3	68.2	176.9	0	0	112.1	H276 Y278 S282 R283 L284 W313	H276-E280 PolarHBondContact O-N 3.23Å; Y278-E280 PolarHBondContact O-N 2.93Å; E280-S282 VanDerWaalsContact C-N 3.31Å; E280-S282 PolarHBondContact O-N 2.99Å; E280-R283 VanDerWaalsContact CD-CZ 3.46Å; E280-R283 VanDerWaalsContact CD-NH1 3.28Å; E280-R283 PolarHBondContact O-N 3.39Å; E280-R283 IonicContact OE1-CZ 2.67Å; E280-R283 IonicContact OE1-NE 3.85Å; E280-R283 IonicContact OE1-NH1 2.65Å; E280-R283 PolarHBondContact OE1-NH1 3.45Å; E280-R283 IonicContact OE1-NH2 3.98Å; E280-R283 PolarHBondContact OE1-NH2 3.03Å; E280-R283 IonicContact OE2-CZ 2.73Å; E280-R283 IonicContact OE2-NE 2.82Å; E280-R283 IonicContact OE2-NH1 3.03Å; E280-R283 PolarHBondContact OE2-NH1 2.82Å; E280-R283 IonicContact OE2-NH2 2.76Å; E280-L284 HydrophobicContact CG-CD1 4.17Å; E280-L284 WeakPolarHBondContact O-CG 3.41Å; E280-L284 PolarHBondContact O-N 3.13Å; E280-W313 HydrophobicContact CB-CD2 3.96Å; E280-W313 HydrophobicContact CB-CE3 4.2Å; E280-W313 HydrophobicContact CB-CG 4.31Å; E280-W313 HydrophobicContact CB-CZ2 4.45Å; E280-W313 HydrophobicContact CG-CD2 3.87Å; E280-W313 VanDerWaalsContact CG-CE2 3.49Å; E280-W313 HydrophobicContact CG-CE3 4.47Å; E280-W313 HydrophobicContact CG-CG 4.22Å; E280-W313 HydrophobicContact CG-CH2 4.38Å; E280-W313 HydrophobicContact CG-CZ2 3.78Å
281	Y	87	Confident	83.4	Confident	50 Å²	50	75.6 Å²	75.6	20%	0.196	41%	0.409	C	S	.	.	H	α-helix	trans	-57.4	-44.2	170.9	169.6	-97.4	0	0	0	111.7	C277 Y278 R285 R310 L314 M317	C277-Y281 WeakPolarHBondContact O-CB 3.48Å; C277-Y281 PolarHBondContact O-N 3.4Å; Y278-Y281 PolarHBondContact O-N 3.37Å; Y281-R285 PolarHBondContact O-N 3.49Å; Y281-R310 HydrophobicContact CD2-CG 3.5Å; Y281-R310 HydrophobicContact CE2-CG 3.43Å; Y281-R310 VanDerWaalsContact CE2-CG 3.43Å; Y281-L314 HydrophobicContact CD2-CB 4.04Å; Y281-L314 HydrophobicContact CE2-CB 4.07Å; Y281-L314 HydrophobicContact CE2-CD1 4.27Å; Y281-M317 HydrophobicContact CD1-CE 4.4Å; Y281-M317 HydrophobicContact CG-CE 4.27Å
282	S	87.6	Confident	82.4	Confident	61 Å²	61	77 Å²	77	43%	0.427	41%	0.411	S	S	.	.	H	α-helix	trans	-68	-34.9	178.1	-168.8	0	0	0	0	112.3	Y278 M279 E280 R285	Y278-S282 WeakPolarHBondContact O-CB 3.42Å; Y278-S282 PolarHBondContact O-N 3.06Å; M279-S282 PolarHBondContact O-N 3.31Å; E280-S282 VanDerWaalsContact C-N 3.31Å; E280-S282 PolarHBondContact O-N 2.99Å; S282-R285 WeakPolarHBondContact O-CB 3.31Å
283	R	86.6	Confident	81.2	Confident	145 Å²	145	71.5 Å²	71.5	55%	0.547	40%	0.395	S	S	.	.	H	α-helix	trans	-65.7	-47.5	176.1	-164.6	-175.3	87.1	-154.9	1.1	111.3	M279 E280 R285 G286	M279-R283 PolarHBondContact O-N 2.87Å; E280-R283 VanDerWaalsContact CD-CZ 3.46Å; E280-R283 VanDerWaalsContact CD-NH1 3.28Å; E280-R283 PolarHBondContact O-N 3.39Å; E280-R283 IonicContact OE1-CZ 2.67Å; E280-R283 IonicContact OE1-NE 3.85Å; E280-R283 IonicContact OE1-NH1 2.65Å; E280-R283 PolarHBondContact OE1-NH1 3.45Å; E280-R283 IonicContact OE1-NH2 3.98Å; E280-R283 PolarHBondContact OE1-NH2 3.03Å; E280-R283 IonicContact OE2-CZ 2.73Å; E280-R283 IonicContact OE2-NE 2.82Å; E280-R283 IonicContact OE2-NH1 3.03Å; E280-R283 PolarHBondContact OE2-NH1 2.82Å; E280-R283 IonicContact OE2-NH2 2.76Å; R283-R285 PolarHBondContact O-N 3.45Å; R283-G286 PolarHBondContact O-N 2.98Å
284	L	82.9	Confident	80	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.01	41%	0.405	C	S	.	.	H	α-helix	trans	-68.2	-22.4	-178.1	-72.7	164.6	0	0	0	113.1	E280 G286 E287 S290 R310 W313	E280-L284 HydrophobicContact CG-CD1 4.17Å; E280-L284 WeakPolarHBondContact O-CG 3.41Å; E280-L284 PolarHBondContact O-N 3.13Å; L284-G286 PolarHBondContact O-N 3.42Å; L284-G286 VanDerWaalsContact O-N 3.1Å; L284-E287 WeakPolarHBondContact CD2-OE2 3.44Å; L284-E287 PolarHBondContact O-N 3.29Å; L284-S290 PolarHBondContact O-OG 2.82Å; L284-R310 HydrophobicContact CB-CB 4.48Å; L284-W313 HydrophobicContact CD1-CG 4.38Å
285	R	77.3	Confident	78.6	Confident	172 Å²	172	78.5 Å²	78.5	65%	0.649	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.5	176.9	-164.5	176.4	-174.5	-175.3	1.3	113.8	Y281 S282 R283	Y281-R285 PolarHBondContact O-N 3.49Å; S282-R285 WeakPolarHBondContact O-CB 3.31Å; R283-R285 PolarHBondContact O-N 3.45Å
286	G	70	Confident	77.3	Confident	75 Å²	75	78.6 Å²	78.6	77%	0.773	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-1.6	177.6	0	0	0	0	0	115.2	R283 L284	R283-G286 PolarHBondContact O-N 2.98Å; L284-G286 PolarHBondContact O-N 3.42Å; L284-G286 VanDerWaalsContact O-N 3.1Å
287	E	78.5	Confident	76	Confident	107 Å²	107	77.2 Å²	77.2	50%	0.5	43%	0.433	S	S	.	.	S	Bend	trans	-104	124.7	-169.7	-143.4	167.8	-172.5	0	0	111.1	L284 G289 S290	L284-E287 WeakPolarHBondContact CD2-OE2 3.44Å; L284-E287 PolarHBondContact O-N 3.29Å; E287-G289 PolarHBondContact O-N 2.94Å; E287-S290 PolarHBondContact O-N 3.47Å; E287-S290 PolarHBondContact O-OG 3.14Å
288	A	65.4	Low	74.7	Confident	109 Å²	109	78.7 Å²	78.7	90%	0.901	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	127.3	-177.3	0	0	0	0	0	111.4
289	G	67.2	Low	72.5	Confident	64 Å²	64	82.3 Å²	82.3	66%	0.66	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-4	-179.8	0	0	0	0	0	115.8	E287 D291	E287-G289 PolarHBondContact O-N 2.94Å; G289-D291 VanDerWaalsContact C-N 3.33Å
290	S	71.4	Confident	71.2	Confident	8 Å²	8	82.1 Å²	82.1	6%	0.056	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-9.8	177.1	68.7	0	0	0	0	114.3	L284 E287 R310	L284-S290 PolarHBondContact O-OG 2.82Å; E287-S290 PolarHBondContact O-N 3.47Å; E287-S290 PolarHBondContact O-OG 3.14Å; S290-R310 WeakPolarHBondContact O-CB 3.3Å; S290-R310 PolarHBondContact O-N 3.26Å
291	D	72.7	Confident	69.6	Low	91 Å²	91	86.9 Å²	86.9	49%	0.487	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.4	-173.4	-83.4	10.5	0	0	0	114.6	G289 R310	G289-D291 VanDerWaalsContact C-N 3.33Å; D291-R310 VanDerWaalsContact CG-NH2 3.31Å; D291-R310 WeakPolarHBondContact OD1-CD 3.15Å; D291-R310 IonicContact OD1-CZ 3Å; D291-R310 IonicContact OD1-NE 3.72Å; D291-R310 PolarHBondContact OD1-NE 2.91Å; D291-R310 VanDerWaalsContact OD1-NE 3.15Å; D291-R310 IonicContact OD1-NH1 2.72Å; D291-R310 PolarHBondContact OD1-NH1 3.43Å; D291-R310 IonicContact OD1-NH2 3.9Å; D291-R310 PolarHBondContact OD1-NH2 3.01Å; D291-R310 IonicContact OD2-CZ 2.8Å; D291-R310 VanDerWaalsContact OD2-CZ 3.3Å; D291-R310 IonicContact OD2-NH1 3.82Å; D291-R310 PolarHBondContact OD2-NH1 2.77Å; D291-R310 IonicContact OD2-NH2 3.26Å; D291-R310 PolarHBondContact OD2-NH2 3.43Å
292	V	72.5	Confident	68.3	Low	63 Å²	63	88.5 Å²	88.5	38%	0.382	51%	0.51	S	S	.	.			trans	-67.5	137.5	178.2	-174	0	0	0	0	110.1	D296 L297 L309	V292-D296 HydrophobicContact CG1-CB 4.13Å; V292-L297 HydrophobicContact CB-CD1 3.92Å; V292-L297 HydrophobicContact CG1-CD1 3.62Å; V292-L297 HydrophobicContact CG1-CG 3.84Å; V292-L309 WeakPolarHBondContact O-CD2 3.49Å
293	S	65.6	Low	66.9	Low	33 Å²	33	93.2 Å²	93.2	23%	0.231	52%	0.523	C	S	.	.			trans	-77.4	148.8	-178.7	88.3	0	0	0	0	111.8	V295 D296 L297	S293-V295 PolarHBondContact O-N 2.93Å; S293-V295 VanDerWaalsContact O-N 3.1Å; S293-V295 PolarHBondContact OG-N 2.89Å; S293-D296 WeakPolarHBondContact CB-OD2 3.49Å; S293-D296 PolarHBondContact O-N 3.49Å; S293-D296 VanDerWaalsContact O-N 3.1Å; S293-D296 PolarHBondContact OG-N 3.42Å; S293-D296 PolarHBondContact OG-OD2 3.39Å; S293-L297 PolarHBondContact O-N 2.91Å
294	L	62.8	Low	66.1	Low	78 Å²	78	95.2 Å²	95.2	41%	0.408	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-23.7	177.7	-147.9	88.9	0	0	0	112.9	Y306 L309 T312	L294-Y306 HydrophobicContact CD1-CD1 3.59Å; L294-Y306 HydrophobicContact CD1-CE1 3.76Å; L294-Y306 HydrophobicContact CG-CD1 4.49Å; L294-Y306 HydrophobicContact CG-CE1 4.18Å; L294-L309 HydrophobicContact CD1-CD2 4.35Å; L294-T312 HydrophobicContact CD1-CG2 3.68Å
295	V	63.9	Low	65.6	Low	127 Å²	127	97.6 Å²	97.6	77%	0.77	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-36.2	179.6	-179.3	0	0	0	0	110.9	S293	S293-V295 PolarHBondContact O-N 2.93Å; S293-V295 VanDerWaalsContact O-N 3.1Å; S293-V295 PolarHBondContact OG-N 2.89Å
296	D	65.4	Low	65.3	Low	124 Å²	124	91 Å²	91	66%	0.663	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-26.4	-178.7	-60	-40.6	0	0	0	112.8	V292 S293	V292-D296 HydrophobicContact CG1-CB 4.13Å; S293-D296 WeakPolarHBondContact CB-OD2 3.49Å; S293-D296 PolarHBondContact O-N 3.49Å; S293-D296 VanDerWaalsContact O-N 3.1Å; S293-D296 PolarHBondContact OG-N 3.42Å; S293-D296 PolarHBondContact OG-OD2 3.39Å
297	L	62.2	Low	65.7	Low	48 Å²	48	91.4 Å²	91.4	25%	0.251	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-17.2	179.3	-89.3	143.2	0	0	0	114.6	V292 S293 Q300 V305 L309	V292-L297 HydrophobicContact CB-CD1 3.92Å; V292-L297 HydrophobicContact CG1-CD1 3.62Å; V292-L297 HydrophobicContact CG1-CG 3.84Å; S293-L297 PolarHBondContact O-N 2.91Å; L297-Q300 PolarHBondContact O-NE2 3.01Å; L297-V305 HydrophobicContact CD2-CG1 4.16Å; L297-L309 HydrophobicContact CD1-CD1 3.74Å; L297-L309 HydrophobicContact CD1-CD2 3.44Å; L297-L309 VanDerWaalsContact CD1-CD2 3.44Å; L297-L309 HydrophobicContact CD1-CG 4.02Å
298	G	61.6	Low	65.6	Low	38 Å²	38	92.2 Å²	92.2	39%	0.392	51%	0.508	S	S	.	.			trans	62.9	-174.9	-171.7	0	0	0	0	0	113.7	Q300 Y306	G298-Q300 PolarHBondContact O-N 3.39Å; G298-Y306 PolarHBondContact O-OH 3.41Å
299	F	46.6	Very low	66.4	Low	203 Å²	203	87.4 Å²	87.4	89%	0.89	47%	0.467	S	S	*	.			trans	-83.5	100.9	178.2	-138.8	-85	0	0	0	109.8
300	Q	60.5	Low	67.1	Low	93 Å²	93	87.6 Å²	87.6	44%	0.435	45%	0.447	S	S	.	.			trans	-94.1	140.7	175.4	-64.6	-64.8	-30.2	0	0	109.6	L297 G298 D302 Y306	L297-Q300 PolarHBondContact O-NE2 3.01Å; G298-Q300 PolarHBondContact O-N 3.39Å; Q300-D302 VanDerWaalsContact C-N 3.31Å; Q300-Y306 HydrophobicContact CB-CE2 4.42Å; Q300-Y306 PolarHBondContact N-OH 3.41Å; Q300-Y306 WeakPolarHBondContact O-CE2 3.29Å
301	T	54	Low	67.6	Low	134 Å²	134	91.6 Å²	91.6	82%	0.822	47%	0.465	S	S	*	.	S	Bend	trans	-80	-13	179.1	51.2	0	0	0	0	113.4
302	D	58.8	Low	68.2	Low	84 Å²	84	88 Å²	88	45%	0.449	45%	0.446	S	S	.	.			trans	-91.1	104.9	176.9	-168	-12.7	0	0	0	111.2	Q300 R304 V305	Q300-D302 VanDerWaalsContact C-N 3.31Å; D302-R304 PolarHBondContact O-N 3.44Å; D302-R304 WeakPolarHBondContact OD1-CB 3.33Å; D302-R304 WeakPolarHBondContact OD1-CG 3.27Å; D302-R304 PolarHBondContact OD1-N 2.94Å; D302-V305 HydrophobicContact CB-CG2 4.19Å; D302-V305 PolarHBondContact O-N 3.1Å
303	F	58.5	Low	68.9	Low	160 Å²	160	86.4 Å²	86.4	70%	0.702	43%	0.434	S	S	*	.	H	α-helix	trans	-63.7	-19.8	-179.9	-70.9	-79.4	0	0	0	114.2	V305 Y306 L307	F303-V305 VanDerWaalsContact C-N 3.28Å; F303-V305 PolarHBondContact O-N 2.6Å; F303-Y306 HydrophobicContact CD1-CD2 4.36Å; F303-Y306 PolarHBondContact O-N 2.67Å; F303-L307 PolarHBondContact O-N 3.1Å
304	R	70.1	Confident	69.9	Low	186 Å²	186	87.9 Å²	87.9	70%	0.702	44%	0.439	S	S	*	.	H	α-helix	trans	-66.4	-33.9	179.2	-64.6	-178.3	177.6	-154.6	-0	111.8	D302 Y306 L307 H308	D302-R304 PolarHBondContact O-N 3.44Å; D302-R304 WeakPolarHBondContact OD1-CB 3.33Å; D302-R304 WeakPolarHBondContact OD1-CG 3.27Å; D302-R304 PolarHBondContact OD1-N 2.94Å; R304-Y306 VanDerWaalsContact C-N 3.27Å; R304-Y306 PolarHBondContact O-N 2.91Å; R304-L307 PolarHBondContact O-N 3.4Å; R304-H308 PolarHBondContact O-CD2 2.93Å; R304-H308 PolarHBondContact O-N 3.49Å
305	V	72.1	Confident	71	Confident	52 Å²	52	86.2 Å²	86.2	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-56.3	-47.6	176	-179.7	0	0	0	0	109.3	L297 D302 F303 L307 H308 L309	L297-V305 HydrophobicContact CD2-CG1 4.16Å; D302-V305 HydrophobicContact CB-CG2 4.19Å; D302-V305 PolarHBondContact O-N 3.1Å; F303-V305 VanDerWaalsContact C-N 3.28Å; F303-V305 PolarHBondContact O-N 2.6Å; V305-L307 PolarHBondContact O-N 3.22Å; V305-H308 PolarHBondContact O-N 2.86Å; V305-L309 HydrophobicContact CG1-CD1 4.28Å; V305-L309 WeakPolarHBondContact O-CD1 3.31Å
306	Y	71.6	Confident	72.2	Confident	34 Å²	34	84.7 Å²	84.7	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-61.4	-26.5	177.8	-64.3	-62.5	0	0	0	114.1	L294 G298 Q300 F303 R304 H308 L309 T312	L294-Y306 HydrophobicContact CD1-CD1 3.59Å; L294-Y306 HydrophobicContact CD1-CE1 3.76Å; L294-Y306 HydrophobicContact CG-CD1 4.49Å; L294-Y306 HydrophobicContact CG-CE1 4.18Å; G298-Y306 PolarHBondContact O-OH 3.41Å; Q300-Y306 HydrophobicContact CB-CE2 4.42Å; Q300-Y306 PolarHBondContact N-OH 3.41Å; Q300-Y306 WeakPolarHBondContact O-CE2 3.29Å; F303-Y306 HydrophobicContact CD1-CD2 4.36Å; F303-Y306 PolarHBondContact O-N 2.67Å; R304-Y306 VanDerWaalsContact C-N 3.27Å; R304-Y306 PolarHBondContact O-N 2.91Å; Y306-H308 VanDerWaalsContact C-N 3.31Å; Y306-L309 PolarHBondContact O-N 3.19Å; Y306-T312 HydrophobicContact CD1-CG2 4.42Å; Y306-T312 VanDerWaalsContact O-CB 3.26Å; Y306-T312 WeakPolarHBondContact O-CB 3.25Å; Y306-T312 VanDerWaalsContact O-CG2 3.32Å; Y306-T312 WeakPolarHBondContact O-CG2 3.36Å; Y306-T312 PolarHBondContact O-OG1 2.92Å
307	L	77.4	Confident	73.4	Confident	83 Å²	83	80.2 Å²	80.2	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-77.4	-15.1	176.4	-64.5	173.9	0	0	0	113.4	F303 R304 V305 W313 F316	F303-L307 PolarHBondContact O-N 3.1Å; R304-L307 PolarHBondContact O-N 3.4Å; V305-L307 PolarHBondContact O-N 3.22Å; L307-W313 HydrophobicContact CD2-CZ2 4.12Å; L307-W313 PolarHBondContact O-NE1 3.33Å; L307-F316 HydrophobicContact CD2-CE2 4.33Å
308	H	78.4	Confident	74.8	Confident	125 Å²	125	82.3 Å²	82.3	58%	0.579	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-6.8	173.9	-71.3	-73.9	0	0	0	113.2	R304 V305 Y306	R304-H308 PolarHBondContact O-CD2 2.93Å; R304-H308 PolarHBondContact O-N 3.49Å; V305-H308 PolarHBondContact O-N 2.86Å; Y306-H308 VanDerWaalsContact C-N 3.31Å
309	L	80.8	Confident	76.1	Confident	8 Å²	8	85.5 Å²	85.5	4%	0.042	41%	0.412	C	S	.	.			trans	-82.4	140.9	178.4	-89.4	95.5	0	0	0	112.2	V292 L294 L297 V305 Y306 T312 W313	V292-L309 WeakPolarHBondContact O-CD2 3.49Å; L294-L309 HydrophobicContact CD1-CD2 4.35Å; L297-L309 HydrophobicContact CD1-CD1 3.74Å; L297-L309 HydrophobicContact CD1-CD2 3.44Å; L297-L309 VanDerWaalsContact CD1-CD2 3.44Å; L297-L309 HydrophobicContact CD1-CG 4.02Å; V305-L309 HydrophobicContact CG1-CD1 4.28Å; V305-L309 WeakPolarHBondContact O-CD1 3.31Å; Y306-L309 PolarHBondContact O-N 3.19Å; L309-T312 HydrophobicContact CB-CG2 4.22Å; L309-T312 WeakPolarHBondContact CB-OG1 3.44Å; L309-T312 PolarHBondContact O-OG1 3.2Å; L309-W313 VanDerWaalsContact O-CD1 3.24Å
310	R	82	Confident	78.2	Confident	67 Å²	67	77.9 Å²	77.9	25%	0.253	38%	0.381	S	S	.	.	H	α-helix	trans	-66.7	-39.8	171.9	-174.3	-176.4	71.5	-166.7	-7.5	112.2	Y281 L284 S290 D291 T312 W313 L314	Y281-R310 HydrophobicContact CD2-CG 3.5Å; Y281-R310 HydrophobicContact CE2-CG 3.43Å; Y281-R310 VanDerWaalsContact CE2-CG 3.43Å; L284-R310 HydrophobicContact CB-CB 4.48Å; S290-R310 WeakPolarHBondContact O-CB 3.3Å; S290-R310 PolarHBondContact O-N 3.26Å; D291-R310 VanDerWaalsContact CG-NH2 3.31Å; D291-R310 WeakPolarHBondContact OD1-CD 3.15Å; D291-R310 IonicContact OD1-CZ 3Å; D291-R310 IonicContact OD1-NE 3.72Å; D291-R310 PolarHBondContact OD1-NE 2.91Å; D291-R310 VanDerWaalsContact OD1-NE 3.15Å; D291-R310 IonicContact OD1-NH1 2.72Å; D291-R310 PolarHBondContact OD1-NH1 3.43Å; D291-R310 IonicContact OD1-NH2 3.9Å; D291-R310 PolarHBondContact OD1-NH2 3.01Å; D291-R310 IonicContact OD2-CZ 2.8Å; D291-R310 VanDerWaalsContact OD2-CZ 3.3Å; D291-R310 IonicContact OD2-NH1 3.82Å; D291-R310 PolarHBondContact OD2-NH1 2.77Å; D291-R310 IonicContact OD2-NH2 3.26Å; D291-R310 PolarHBondContact OD2-NH2 3.43Å; R310-T312 VanDerWaalsContact C-N 3.31Å; R310-T312 PolarHBondContact O-N 2.93Å; R310-W313 PolarHBondContact O-N 3.09Å; R310-L314 PolarHBondContact O-N 2.82Å
311	Q	82.9	Confident	79.8	Confident	92 Å²	92	75.4 Å²	75.4	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-30.7	-173.3	-167	177.7	6.2	0	0	113	A315	Q311-A315 WeakPolarHBondContact O-CB 3.43Å; Q311-A315 PolarHBondContact O-N 2.75Å
312	T	84.1	Confident	81.7	Confident	15 Å²	15	73.7 Å²	73.7	9%	0.092	36%	0.359	C	S	.	.	H	α-helix	trans	-71.6	-42.7	178.8	41.1	0	0	0	0	112.1	L294 Y306 L309 R310 L314 A315 F316	L294-T312 HydrophobicContact CD1-CG2 3.68Å; Y306-T312 HydrophobicContact CD1-CG2 4.42Å; Y306-T312 VanDerWaalsContact O-CB 3.26Å; Y306-T312 WeakPolarHBondContact O-CB 3.25Å; Y306-T312 VanDerWaalsContact O-CG2 3.32Å; Y306-T312 WeakPolarHBondContact O-CG2 3.36Å; Y306-T312 PolarHBondContact O-OG1 2.92Å; L309-T312 HydrophobicContact CB-CG2 4.22Å; L309-T312 WeakPolarHBondContact CB-OG1 3.44Å; L309-T312 PolarHBondContact O-OG1 3.2Å; R310-T312 VanDerWaalsContact C-N 3.31Å; R310-T312 PolarHBondContact O-N 2.93Å; T312-L314 VanDerWaalsContact C-N 3.33Å; T312-L314 PolarHBondContact O-N 3.36Å; T312-A315 PolarHBondContact O-N 3.48Å; T312-F316 WeakPolarHBondContact O-CG 3.27Å; T312-F316 PolarHBondContact O-N 3.5Å
313	W	87	Confident	83.1	Confident	31 Å²	31	73.4 Å²	73.4	12%	0.117	36%	0.357	C	S	.	.	H	α-helix	trans	-64.8	-36.4	174.1	-69.5	105.2	0	0	0	112.5	H276 C277 E280 L284 L307 L309 R310 F316 M317	H276-W313 AromaticContact ND1-CZ3 3.85Å; C277-W313 HydrophobicContact CB-CE3 4.11Å; E280-W313 HydrophobicContact CB-CD2 3.96Å; E280-W313 HydrophobicContact CB-CE3 4.2Å; E280-W313 HydrophobicContact CB-CG 4.31Å; E280-W313 HydrophobicContact CB-CZ2 4.45Å; E280-W313 HydrophobicContact CG-CD2 3.87Å; E280-W313 VanDerWaalsContact CG-CE2 3.49Å; E280-W313 HydrophobicContact CG-CE3 4.47Å; E280-W313 HydrophobicContact CG-CG 4.22Å; E280-W313 HydrophobicContact CG-CH2 4.38Å; E280-W313 HydrophobicContact CG-CZ2 3.78Å; L284-W313 HydrophobicContact CD1-CG 4.38Å; L307-W313 HydrophobicContact CD2-CZ2 4.12Å; L307-W313 PolarHBondContact O-NE1 3.33Å; L309-W313 VanDerWaalsContact O-CD1 3.24Å; R310-W313 PolarHBondContact O-N 3.09Å; W313-F316 HydrophobicContact CE3-CD2 4.27Å; W313-M317 WeakPolarHBondContact O-CB 3.18Å; W313-M317 PolarHBondContact O-N 3.35Å
314	L	87.1	Confident	84.7	Confident	64 Å²	64	66.8 Å²	66.8	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-45.4	170.9	-177.7	68.1	0	0	0	111.6	Y281 R310 T312 M317 I318	Y281-L314 HydrophobicContact CD2-CB 4.04Å; Y281-L314 HydrophobicContact CE2-CB 4.07Å; Y281-L314 HydrophobicContact CE2-CD1 4.27Å; R310-L314 PolarHBondContact O-N 2.82Å; T312-L314 VanDerWaalsContact C-N 3.33Å; T312-L314 PolarHBondContact O-N 3.36Å; L314-M317 WeakPolarHBondContact O-CB 3.36Å; L314-M317 PolarHBondContact O-N 3.3Å; L314-I318 HydrophobicContact CD1-CD1 4.46Å; L314-I318 HydrophobicContact CG-CD1 4.16Å; L314-I318 WeakPolarHBondContact O-CG1 3.49Å; L314-I318 PolarHBondContact O-N 2.86Å
315	A	86.6	Confident	85.8	Confident	43 Å²	43	62 Å²	62	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-45	177	0	0	0	0	0	111.9	Q311 T312 M317 I318 I319	Q311-A315 WeakPolarHBondContact O-CB 3.43Å; Q311-A315 PolarHBondContact O-N 2.75Å; T312-A315 PolarHBondContact O-N 3.48Å; A315-M317 VanDerWaalsContact C-N 3.34Å; A315-M317 PolarHBondContact O-N 3.29Å; A315-I318 PolarHBondContact O-N 3.43Å; A315-I319 VanDerWaalsContact O-CG1 3.26Å; A315-I319 WeakPolarHBondContact O-CG1 3.21Å; A315-I319 PolarHBondContact O-N 3.01Å
316	F	87.8	Confident	86.5	Confident	94 Å²	94	63.5 Å²	63.5	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-60.5	-42.4	174.8	-68.9	-24.3	0	0	0	112.1	L307 T312 W313 I318 I319 L320	L307-F316 HydrophobicContact CD2-CE2 4.33Å; T312-F316 WeakPolarHBondContact O-CG 3.27Å; T312-F316 PolarHBondContact O-N 3.5Å; W313-F316 HydrophobicContact CE3-CD2 4.27Å; F316-I318 PolarHBondContact O-N 3Å; F316-I319 PolarHBondContact O-N 3.2Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 VanDerWaalsContact O-CG 3.24Å; F316-L320 WeakPolarHBondContact O-CG 3.36Å; F316-L320 PolarHBondContact O-N 3.42Å
317	M	90.9	Very high	87.2	Confident	30 Å²	30	63 Å²	63	15%	0.148	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-46.1	176.1	-170.8	-165.8	-47.4	0	0	112	I274 C277 Y278 Y281 W313 L314 A315 S321	I274-M317 HydrophobicContact CG2-CG 4.19Å; C277-M317 HydrophobicContact CB-CB 4.05Å; Y278-M317 VanDerWaalsContact CA-CE 3.5Å; Y278-M317 HydrophobicContact CD2-CE 4.22Å; Y281-M317 HydrophobicContact CD1-CE 4.4Å; Y281-M317 HydrophobicContact CG-CE 4.27Å; W313-M317 WeakPolarHBondContact O-CB 3.18Å; W313-M317 PolarHBondContact O-N 3.35Å; L314-M317 WeakPolarHBondContact O-CB 3.36Å; L314-M317 PolarHBondContact O-N 3.3Å; A315-M317 VanDerWaalsContact C-N 3.34Å; A315-M317 PolarHBondContact O-N 3.29Å; M317-S321 VanDerWaalsContact O-CB 3.31Å; M317-S321 WeakPolarHBondContact O-CB 3.5Å; M317-S321 PolarHBondContact O-N 2.84Å; M317-S321 PolarHBondContact O-OG 3.45Å
318	I	91.8	Very high	87.7	Confident	92 Å²	92	62.1 Å²	62.1	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-47.2	178.3	-66.9	167.1	0	0	0	110.6	L314 A315 F316 S321 I322	L314-I318 HydrophobicContact CD1-CD1 4.46Å; L314-I318 HydrophobicContact CG-CD1 4.16Å; L314-I318 WeakPolarHBondContact O-CG1 3.49Å; L314-I318 PolarHBondContact O-N 2.86Å; A315-I318 PolarHBondContact O-N 3.43Å; F316-I318 PolarHBondContact O-N 3Å; I318-S321 PolarHBondContact O-N 2.83Å; I318-I322 HydrophobicContact CG2-CD1 3.81Å; I318-I322 HydrophobicContact CG2-CG1 4.49Å; I318-I322 WeakPolarHBondContact O-CG1 3.33Å; I318-I322 PolarHBondContact O-N 3.19Å
319	I	89.6	Confident	88.2	Confident	105 Å²	105	60.1 Å²	60.1	54%	0.538	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-47.2	179.8	-68.3	166	0	0	0	110.9	A315 F316 S321 I322 L323	A315-I319 VanDerWaalsContact O-CG1 3.26Å; A315-I319 WeakPolarHBondContact O-CG1 3.21Å; A315-I319 PolarHBondContact O-N 3.01Å; F316-I319 PolarHBondContact O-N 3.2Å; I319-S321 VanDerWaalsContact C-N 3.33Å; I319-S321 PolarHBondContact O-N 3.32Å; I319-I322 PolarHBondContact O-N 3.47Å; I319-L323 WeakPolarHBondContact O-CB 3.22Å; I319-L323 PolarHBondContact O-N 3.27Å
320	L	91.3	Very high	88.2	Confident	43 Å²	43	64.2 Å²	64.2	23%	0.225	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-38.6	178.3	-71.2	173.8	0	0	0	111.7	L270 I274 F316 L323 E324	L270-L320 HydrophobicContact CD2-CD2 3.84Å; I274-L320 HydrophobicContact CD1-CB 4.46Å; I274-L320 HydrophobicContact CG1-CB 3.72Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 VanDerWaalsContact O-CG 3.24Å; F316-L320 WeakPolarHBondContact O-CG 3.36Å; F316-L320 PolarHBondContact O-N 3.42Å; L320-L323 PolarHBondContact O-N 2.96Å; L320-E324 WeakPolarHBondContact O-CB 3.29Å; L320-E324 PolarHBondContact O-N 3.49Å
321	S	93.4	Very high	88.3	Confident	42 Å²	42	62.5 Å²	62.5	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-44	176.8	-58.7	0	0	0	0	112.2	M317 I318 I319 L323 E324 V325	M317-S321 VanDerWaalsContact O-CB 3.31Å; M317-S321 WeakPolarHBondContact O-CB 3.5Å; M317-S321 PolarHBondContact O-N 2.84Å; M317-S321 PolarHBondContact O-OG 3.45Å; I318-S321 PolarHBondContact O-N 2.83Å; I319-S321 VanDerWaalsContact C-N 3.33Å; I319-S321 PolarHBondContact O-N 3.32Å; S321-L323 VanDerWaalsContact C-N 3.34Å; S321-E324 PolarHBondContact O-N 2.89Å; S321-V325 WeakPolarHBondContact O-CG2 3.32Å; S321-V325 PolarHBondContact O-N 2.96Å; S321-V325 VanDerWaalsContact O-N 3.07Å
322	I	93.3	Very high	88.5	Confident	98 Å²	98	63 Å²	63	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-44.9	175.4	-68.9	168.6	0	0	0	110.3	I318 I319 E324 V325 I326	I318-I322 HydrophobicContact CG2-CD1 3.81Å; I318-I322 HydrophobicContact CG2-CG1 4.49Å; I318-I322 WeakPolarHBondContact O-CG1 3.33Å; I318-I322 PolarHBondContact O-N 3.19Å; I319-I322 PolarHBondContact O-N 3.47Å; I322-E324 PolarHBondContact O-N 3.24Å; I322-V325 PolarHBondContact O-N 3.23Å; I322-I326 HydrophobicContact CG2-CD1 3.74Å; I322-I326 HydrophobicContact CG2-CG1 4.45Å; I322-I326 VanDerWaalsContact O-CG1 3.28Å; I322-I326 WeakPolarHBondContact O-CG1 3.28Å; I322-I326 PolarHBondContact O-N 3.37Å
323	L	88.3	Confident	88.5	Confident	78 Å²	78	69.9 Å²	69.9	41%	0.408	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-45.5	178.6	-178.7	64	0	0	0	111.7	L270 I319 L320 S321 I326 I327	L270-L323 HydrophobicContact CD1-CD2 4.47Å; L270-L323 HydrophobicContact CD2-CD2 4.05Å; I319-L323 WeakPolarHBondContact O-CB 3.22Å; I319-L323 PolarHBondContact O-N 3.27Å; L320-L323 PolarHBondContact O-N 2.96Å; S321-L323 VanDerWaalsContact C-N 3.34Å; L323-I326 PolarHBondContact O-N 2.92Å; L323-I327 HydrophobicContact CD1-CD1 4.18Å; L323-I327 HydrophobicContact CG-CD1 3.99Å; L323-I327 WeakPolarHBondContact O-CG1 3.27Å; L323-I327 PolarHBondContact O-N 3.43Å
324	E	91.9	Very high	88.2	Confident	21 Å²	21	70.4 Å²	70.4	10%	0.098	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-47.1	178.2	-176.7	60.9	-163.3	0	0	111.7	I267 L270 I274 L320 S321 I322 I326 I327 I328	I267-E324 VanDerWaalsContact CG2-OE1 3.31Å; I267-E324 WeakPolarHBondContact CG2-OE1 3.39Å; L270-E324 WeakPolarHBondContact CB-OE2 3.39Å; L270-E324 WeakPolarHBondContact CD1-OE2 3.17Å; I274-E324 HydrophobicContact CD1-CB 4.23Å; L320-E324 WeakPolarHBondContact O-CB 3.29Å; L320-E324 PolarHBondContact O-N 3.49Å; S321-E324 PolarHBondContact O-N 2.89Å; I322-E324 PolarHBondContact O-N 3.24Å; E324-I326 VanDerWaalsContact C-N 3.35Å; E324-I326 PolarHBondContact O-N 2.84Å; E324-I327 PolarHBondContact O-N 3.2Å; E324-I328 HydrophobicContact CG-CD1 4.08Å; E324-I328 WeakPolarHBondContact O-CG1 3.27Å; E324-I328 PolarHBondContact O-N 3.45Å
325	V	92.7	Very high	88.1	Confident	84 Å²	84	75 Å²	75	51%	0.509	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-44	177	171.1	0	0	0	0	111.4	S321 I322 I327 I328 L329	S321-V325 WeakPolarHBondContact O-CG2 3.32Å; S321-V325 PolarHBondContact O-N 2.96Å; S321-V325 VanDerWaalsContact O-N 3.07Å; I322-V325 PolarHBondContact O-N 3.23Å; V325-I327 VanDerWaalsContact C-N 3.34Å; V325-I327 PolarHBondContact O-N 3.34Å; V325-I328 PolarHBondContact O-N 2.84Å; V325-L329 HydrophobicContact CG1-CD1 3.9Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 WeakPolarHBondContact O-CB 3.24Å; V325-L329 VanDerWaalsContact O-CG 3.29Å; V325-L329 WeakPolarHBondContact O-CG 3.28Å; V325-L329 PolarHBondContact O-N 2.86Å
326	I	87.7	Confident	87.9	Confident	84 Å²	84	80.2 Å²	80.2	43%	0.431	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-44.9	177.2	-70.5	168.8	0	0	0	110.6	I322 L323 E324 L329 L330	I322-I326 HydrophobicContact CG2-CD1 3.74Å; I322-I326 HydrophobicContact CG2-CG1 4.45Å; I322-I326 VanDerWaalsContact O-CG1 3.28Å; I322-I326 WeakPolarHBondContact O-CG1 3.28Å; I322-I326 PolarHBondContact O-N 3.37Å; L323-I326 PolarHBondContact O-N 2.92Å; E324-I326 VanDerWaalsContact C-N 3.35Å; E324-I326 PolarHBondContact O-N 2.84Å; I326-L329 PolarHBondContact O-N 2.85Å; I326-L330 HydrophobicContact CG2-CD1 3.94Å; I326-L330 HydrophobicContact CG2-CG 4.38Å; I326-L330 WeakPolarHBondContact O-CB 3.48Å; I326-L330 VanDerWaalsContact O-CG 3.26Å; I326-L330 WeakPolarHBondContact O-CG 3.24Å; I326-L330 PolarHBondContact O-N 3.34Å
327	I	85.8	Confident	87.6	Confident	23 Å²	23	79.6 Å²	79.6	12%	0.118	39%	0.39	C	S	.	.	H	α-helix	trans	-62	-47.6	179.1	-71.2	167.5	0	0	0	110.6	V266 L270 L323 E324 V325 L329 L330 L331	V266-I327 HydrophobicContact CG1-CD1 4.32Å; L270-I327 HydrophobicContact CD1-CD1 3.49Å; L270-I327 VanDerWaalsContact CD1-CD1 3.49Å; L323-I327 HydrophobicContact CD1-CD1 4.18Å; L323-I327 HydrophobicContact CG-CD1 3.99Å; L323-I327 WeakPolarHBondContact O-CG1 3.27Å; L323-I327 PolarHBondContact O-N 3.43Å; E324-I327 PolarHBondContact O-N 3.2Å; V325-I327 VanDerWaalsContact C-N 3.34Å; V325-I327 PolarHBondContact O-N 3.34Å; I327-L329 PolarHBondContact O-N 3.5Å; I327-L330 PolarHBondContact O-N 2.74Å; I327-L331 HydrophobicContact CG2-CD1 3.91Å; I327-L331 HydrophobicContact CG2-CG 4.41Å; I327-L331 VanDerWaalsContact O-CG 3.26Å; I327-L331 WeakPolarHBondContact O-CG 3.41Å; I327-L331 PolarHBondContact O-N 2.91Å
328	I	88.8	Confident	87.2	Confident	65 Å²	65	78.6 Å²	78.6	33%	0.333	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-45.8	178.5	-68.3	170.6	0	0	0	111	E324 V325 L330 L331 I332	E324-I328 HydrophobicContact CG-CD1 4.08Å; E324-I328 WeakPolarHBondContact O-CG1 3.27Å; E324-I328 PolarHBondContact O-N 3.45Å; V325-I328 PolarHBondContact O-N 2.84Å; I328-L330 PolarHBondContact O-N 3.07Å; I328-L331 PolarHBondContact O-N 3.5Å; I328-I332 HydrophobicContact CG2-CD1 3.88Å; I328-I332 WeakPolarHBondContact O-CG1 3.47Å; I328-I332 PolarHBondContact O-N 3.32Å
329	L	88.2	Confident	86.8	Confident	83 Å²	83	78.2 Å²	78.2	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-46.3	177.1	-72.6	172	0	0	0	111.3	V325 I326 I327 L331 I332 F333	V325-L329 HydrophobicContact CG1-CD1 3.9Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 WeakPolarHBondContact O-CB 3.24Å; V325-L329 VanDerWaalsContact O-CG 3.29Å; V325-L329 WeakPolarHBondContact O-CG 3.28Å; V325-L329 PolarHBondContact O-N 2.86Å; I326-L329 PolarHBondContact O-N 2.85Å; I327-L329 PolarHBondContact O-N 3.5Å; L329-L331 VanDerWaalsContact C-N 3.32Å; L329-L331 PolarHBondContact O-N 3.08Å; L329-I332 PolarHBondContact O-N 3.43Å; L329-F333 HydrophobicContact CB-CD2 4.47Å; L329-F333 HydrophobicContact CD2-CE2 4.18Å; L329-F333 WeakPolarHBondContact O-CD2 3.33Å; L329-F333 PolarHBondContact O-N 2.9Å
330	L	82.1	Confident	86.4	Confident	94 Å²	94	74.2 Å²	74.2	49%	0.492	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-42.6	176.7	-72.5	172.7	0	0	0	111.8	I326 I327 I328 I332 L334	I326-L330 HydrophobicContact CG2-CD1 3.94Å; I326-L330 HydrophobicContact CG2-CG 4.38Å; I326-L330 WeakPolarHBondContact O-CB 3.48Å; I326-L330 VanDerWaalsContact O-CG 3.26Å; I326-L330 WeakPolarHBondContact O-CG 3.24Å; I326-L330 PolarHBondContact O-N 3.34Å; I327-L330 PolarHBondContact O-N 2.74Å; I328-L330 PolarHBondContact O-N 3.07Å; L330-I332 PolarHBondContact O-N 2.93Å; L330-L334 HydrophobicContact CD2-CD1 4.35Å; L330-L334 WeakPolarHBondContact O-CB 3.39Å; L330-L334 WeakPolarHBondContact O-CG 3.48Å; L330-L334 PolarHBondContact O-N 3.38Å
331	L	83.7	Confident	86	Confident	31 Å²	31	72.1 Å²	72.1	16%	0.162	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-41.3	178.7	-68.6	168.5	0	0	0	112.3	I263 I267 I327 I328 L329 R335 I338	I263-L331 HydrophobicContact CD1-CD2 3.8Å; I263-L331 HydrophobicContact CG1-CD2 4.03Å; I263-L331 HydrophobicContact CG2-CD1 3.41Å; I263-L331 VanDerWaalsContact CG2-CD1 3.41Å; I263-L331 HydrophobicContact CG2-CD2 3.81Å; I263-L331 HydrophobicContact CG2-CG 4.25Å; I267-L331 HydrophobicContact CD1-CD1 3.95Å; I327-L331 HydrophobicContact CG2-CD1 3.91Å; I327-L331 HydrophobicContact CG2-CG 4.41Å; I327-L331 VanDerWaalsContact O-CG 3.26Å; I327-L331 WeakPolarHBondContact O-CG 3.41Å; I327-L331 PolarHBondContact O-N 2.91Å; I328-L331 PolarHBondContact O-N 3.5Å; L329-L331 VanDerWaalsContact C-N 3.32Å; L329-L331 PolarHBondContact O-N 3.08Å; L331-R335 PolarHBondContact O-N 3.25Å; L331-R335 VanDerWaalsContact O-N 3.16Å; L331-I338 HydrophobicContact CD2-CD1 3.96Å
332	I	85.7	Confident	85.5	Confident	102 Å²	102	71 Å²	71	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-51.8	178.8	-66.5	168.3	0	0	0	110.6	I328 L329 L330 L334 R335	I328-I332 HydrophobicContact CG2-CD1 3.88Å; I328-I332 WeakPolarHBondContact O-CG1 3.47Å; I328-I332 PolarHBondContact O-N 3.32Å; L329-I332 PolarHBondContact O-N 3.43Å; L330-I332 PolarHBondContact O-N 2.93Å; I332-L334 PolarHBondContact O-N 3.26Å; I332-R335 WeakPolarHBondContact O-CG 3.38Å
333	F	85.1	Confident	85.1	Confident	160 Å²	160	66.7 Å²	66.7	70%	0.702	32%	0.322	S	S	*	.	H	α-helix	trans	-67.9	-34.9	-177.1	-76	-66.3	0	0	0	112.5	L329	L329-F333 HydrophobicContact CB-CD2 4.47Å; L329-F333 HydrophobicContact CD2-CE2 4.18Å; L329-F333 WeakPolarHBondContact O-CD2 3.33Å; L329-F333 PolarHBondContact O-N 2.9Å
334	L	81.6	Confident	84.9	Confident	42 Å²	42	63.2 Å²	63.2	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-93.7	2.7	-175.4	-55.2	-177.9	0	0	0	113.7	L330 I332 K336 R337 I338 V591 V595	L330-L334 HydrophobicContact CD2-CD1 4.35Å; L330-L334 WeakPolarHBondContact O-CB 3.39Å; L330-L334 WeakPolarHBondContact O-CG 3.48Å; L330-L334 PolarHBondContact O-N 3.38Å; I332-L334 PolarHBondContact O-N 3.26Å; L334-K336 VanDerWaalsContact C-N 3.31Å; L334-K336 PolarHBondContact O-N 2.79Å; L334-K336 VanDerWaalsContact O-N 3.08Å; L334-R337 CarbonylContact O-C 3.53Å; L334-R337 WeakPolarHBondContact O-CA 3.42Å; L334-R337 WeakPolarHBondContact O-CB 3.31Å; L334-R337 PolarHBondContact O-N 3.15Å; L334-I338 HydrophobicContact CB-CD1 4.13Å; L334-I338 HydrophobicContact CB-CG1 4.16Å; L334-I338 WeakPolarHBondContact O-CG1 3.35Å; L334-I338 PolarHBondContact O-N 3.41Å; L334-V591 HydrophobicContact CD1-CG1 4.31Å; L334-V591 HydrophobicContact CD2-CG1 3.74Å; L334-V591 HydrophobicContact CD2-CG2 4.19Å; L334-V591 HydrophobicContact CG-CG1 4.43Å; L334-V595 HydrophobicContact CD1-CG2 4.11Å
335	R	84.8	Confident	84.6	Confident	161 Å²	161	62.3 Å²	62.3	61%	0.608	30%	0.299	S	S	*	.	H	α-helix	trans	-45.1	-48.3	-175.5	71.5	-176.5	179.8	162.9	-2.1	114.7	L331 I332 R337 I338 L339	L331-R335 PolarHBondContact O-N 3.25Å; L331-R335 VanDerWaalsContact O-N 3.16Å; I332-R335 WeakPolarHBondContact O-CG 3.38Å; R335-R337 VanDerWaalsContact C-N 3.29Å; R335-R337 PolarHBondContact O-N 3.46Å; R335-I338 PolarHBondContact O-N 2.98Å; R335-L339 WeakPolarHBondContact O-CG 3.48Å; R335-L339 PolarHBondContact O-N 3.38Å
336	K	81.2	Confident	84.3	Confident	152 Å²	152	61.7 Å²	61.7	66%	0.661	29%	0.29	S	S	*	.	H	α-helix	trans	-67.7	-32.9	-178.9	-69.6	-172.4	177.8	-178.1	0	111.8	L334	L334-K336 VanDerWaalsContact C-N 3.31Å; L334-K336 PolarHBondContact O-N 2.79Å; L334-K336 VanDerWaalsContact O-N 3.08Å
337	R	82.4	Confident	84.3	Confident	81 Å²	81	58.7 Å²	58.7	31%	0.306	27%	0.274	S	S	.	.	H	α-helix	trans	-80.2	-35.6	-179	-58.3	-71.7	-169.8	-161.3	0.1	111.2	L334 R335 L339 I340 A341 V591	L334-R337 CarbonylContact O-C 3.53Å; L334-R337 WeakPolarHBondContact O-CA 3.42Å; L334-R337 WeakPolarHBondContact O-CB 3.31Å; L334-R337 PolarHBondContact O-N 3.15Å; R335-R337 VanDerWaalsContact C-N 3.29Å; R335-R337 PolarHBondContact O-N 3.46Å; R337-L339 VanDerWaalsContact C-N 3.26Å; R337-L339 PolarHBondContact O-N 2.79Å; R337-I340 WeakPolarHBondContact O-CB 3.44Å; R337-I340 PolarHBondContact O-N 2.83Å; R337-I340 VanDerWaalsContact O-N 3.1Å; R337-A341 PolarHBondContact O-N 3.2Å; R337-V591 HydrophobicContact CB-CB 4.44Å; R337-V591 HydrophobicContact CB-CG1 3.38Å; R337-V591 HydrophobicContact CG-CB 4.42Å; R337-V591 HydrophobicContact CG-CG1 3.7Å
338	I	81.7	Confident	84.4	Confident	9 Å²	9	57.6 Å²	57.6	5%	0.046	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-40.8	171.2	-66.4	167.4	0	0	0	110.2	V259 L331 L334 R335 I340 A341 I342 V595	V259-I338 HydrophobicContact CG1-CG2 4.46Å; L331-I338 HydrophobicContact CD2-CD1 3.96Å; L334-I338 HydrophobicContact CB-CD1 4.13Å; L334-I338 HydrophobicContact CB-CG1 4.16Å; L334-I338 WeakPolarHBondContact O-CG1 3.35Å; L334-I338 PolarHBondContact O-N 3.41Å; R335-I338 PolarHBondContact O-N 2.98Å; I338-I340 VanDerWaalsContact C-N 3.34Å; I338-I340 PolarHBondContact O-N 2.98Å; I338-A341 PolarHBondContact O-N 3.47Å; I338-I342 HydrophobicContact CG2-CD1 3.79Å; I338-I342 HydrophobicContact CG2-CG1 4.27Å; I338-I342 VanDerWaalsContact O-CG1 3.26Å; I338-I342 WeakPolarHBondContact O-CG1 3.18Å; I338-I342 PolarHBondContact O-N 3.48Å; I338-V595 HydrophobicContact CG1-CG1 3.99Å; I338-V595 HydrophobicContact CG1-CG2 4.06Å
339	L	83.1	Confident	84.4	Confident	84 Å²	84	54.8 Å²	54.8	44%	0.44	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-38.5	174.9	-66.8	172.1	0	0	0	113.1	R335 R337 A343 L693	R335-L339 WeakPolarHBondContact O-CG 3.48Å; R335-L339 PolarHBondContact O-N 3.38Å; R337-L339 VanDerWaalsContact C-N 3.26Å; R337-L339 PolarHBondContact O-N 2.79Å; L339-A343 PolarHBondContact O-N 3.24Å; L339-L693 HydrophobicContact CB-CD1 4.1Å
340	I	81.4	Confident	84.4	Confident	21 Å²	21	55 Å²	55	11%	0.108	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-46.7	173.1	-61.1	166.7	0	0	0	110	R337 I338 I342 A343 L344 L592 L690 L693	R337-I340 WeakPolarHBondContact O-CB 3.44Å; R337-I340 PolarHBondContact O-N 2.83Å; R337-I340 VanDerWaalsContact O-N 3.1Å; I338-I340 VanDerWaalsContact C-N 3.34Å; I338-I340 PolarHBondContact O-N 2.98Å; I340-I342 VanDerWaalsContact C-N 3.34Å; I340-I342 PolarHBondContact O-N 2.76Å; I340-A343 WeakPolarHBondContact O-CB 3.33Å; I340-A343 PolarHBondContact O-N 3.48Å; I340-A343 VanDerWaalsContact O-N 3.13Å; I340-L344 PolarHBondContact O-N 2.83Å; I340-L592 HydrophobicContact CG2-CD1 4.01Å; I340-L690 HydrophobicContact CG2-CD1 4.46Å; I340-L693 HydrophobicContact CB-CD2 4.16Å; I340-L693 HydrophobicContact CD1-CD2 4.27Å; I340-L693 HydrophobicContact CG1-CD2 3.21Å
341	A	82.9	Confident	84.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.5	179	0	0	0	0	0	111.5	R337 I338 A343 L344 I345 V595 T596	R337-A341 PolarHBondContact O-N 3.2Å; I338-A341 PolarHBondContact O-N 3.47Å; A341-A343 VanDerWaalsContact C-N 3.33Å; A341-A343 PolarHBondContact O-N 2.89Å; A341-L344 PolarHBondContact O-N 3.44Å; A341-I345 WeakPolarHBondContact O-CB 3.34Å; A341-I345 VanDerWaalsContact O-CG1 3.22Å; A341-I345 WeakPolarHBondContact O-CG1 3.29Å; A341-I345 PolarHBondContact O-N 3.03Å; A341-V595 HydrophobicContact CB-CB 4.3Å; A341-V595 HydrophobicContact CB-CG1 3.66Å; A341-T596 HydrophobicContact CB-CG2 4.21Å
342	I	84.3	Confident	85	Confident	17 Å²	17	49.1 Å²	49.1	9%	0.087	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-43.2	173.8	-69.3	166.2	0	0	0	110.7	A255 V259 I338 I340 I345 K346	A255-I342 HydrophobicContact CB-CG2 4.45Å; V259-I342 HydrophobicContact CB-CD1 4.18Å; V259-I342 HydrophobicContact CB-CG1 4.24Å; V259-I342 HydrophobicContact CG1-CD1 3.9Å; V259-I342 HydrophobicContact CG1-CG1 4.1Å; V259-I342 HydrophobicContact CG2-CG1 4.2Å; I338-I342 HydrophobicContact CG2-CD1 3.79Å; I338-I342 HydrophobicContact CG2-CG1 4.27Å; I338-I342 VanDerWaalsContact O-CG1 3.26Å; I338-I342 WeakPolarHBondContact O-CG1 3.18Å; I338-I342 PolarHBondContact O-N 3.48Å; I340-I342 VanDerWaalsContact C-N 3.34Å; I340-I342 PolarHBondContact O-N 2.76Å; I342-I345 PolarHBondContact O-N 2.95Å; I342-K346 WeakPolarHBondContact O-CB 3.38Å; I342-K346 PolarHBondContact O-N 2.8Å
343	A	84.1	Confident	85.1	Confident	8 Å²	8	45.4 Å²	45.4	7%	0.066	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-44.7	177.5	0	0	0	0	0	111.7	L339 I340 A341 K346 E347 L690	L339-A343 PolarHBondContact O-N 3.24Å; I340-A343 WeakPolarHBondContact O-CB 3.33Å; I340-A343 PolarHBondContact O-N 3.48Å; I340-A343 VanDerWaalsContact O-N 3.13Å; A341-A343 VanDerWaalsContact C-N 3.33Å; A341-A343 PolarHBondContact O-N 2.89Å; A343-K346 PolarHBondContact O-N 2.85Å; A343-E347 WeakPolarHBondContact O-CG 3.2Å; A343-E347 PolarHBondContact O-N 2.99Å; A343-L690 HydrophobicContact CB-CD1 4.16Å
344	L	83.3	Confident	85.2	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-40.7	175.9	-69.7	-170.4	0	0	0	112.6	I340 A341 K346 E347 A348 L592 F666 L690	I340-L344 PolarHBondContact O-N 2.83Å; A341-L344 PolarHBondContact O-N 3.44Å; L344-K346 VanDerWaalsContact C-N 3.29Å; L344-K346 PolarHBondContact O-N 3.41Å; L344-E347 PolarHBondContact O-N 2.99Å; L344-A348 WeakPolarHBondContact O-CB 3.27Å; L344-A348 PolarHBondContact O-N 2.98Å; L344-L592 HydrophobicContact CD1-CD1 3.32Å; L344-L592 HydrophobicContact CD1-CD2 4.1Å; L344-L592 HydrophobicContact CD1-CG 4.3Å; L344-L592 HydrophobicContact CG-CD1 4.32Å; L344-F666 HydrophobicContact CD1-CB 4.02Å; L344-F666 HydrophobicContact CD1-CD2 3.58Å; L344-F666 HydrophobicContact CD1-CE2 4.49Å; L344-F666 HydrophobicContact CD1-CG 4.18Å; L344-L690 HydrophobicContact CD2-CD1 4.12Å; L344-L690 HydrophobicContact CD2-CD2 3.81Å
345	I	85.8	Confident	85.5	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-43.1	174.4	-73.6	167.1	0	0	0	109.6	A341 I342 E347 A348 S349 T596 L599 Y658 V662	A341-I345 WeakPolarHBondContact O-CB 3.34Å; A341-I345 VanDerWaalsContact O-CG1 3.22Å; A341-I345 WeakPolarHBondContact O-CG1 3.29Å; A341-I345 PolarHBondContact O-N 3.03Å; I342-I345 PolarHBondContact O-N 2.95Å; I345-E347 PolarHBondContact O-N 2.88Å; I345-A348 PolarHBondContact O-N 3.28Å; I345-S349 PolarHBondContact O-N 3.32Å; I345-T596 HydrophobicContact CD1-CG2 4.34Å; I345-T596 HydrophobicContact CG1-CG2 4.48Å; I345-L599 HydrophobicContact CD1-CD1 3.6Å; I345-Y658 HydrophobicContact CB-CE1 4.41Å; I345-Y658 HydrophobicContact CG2-CE1 3.9Å; I345-Y658 PolarHBondContact O-OH 3.1Å; I345-V662 HydrophobicContact CG1-CG2 4.34Å
346	K	86.7	Confident	85.6	Confident	70 Å²	70	37.8 Å²	37.8	30%	0.304	18%	0.175	S	C	.	.	H	α-helix	trans	-62.8	-41.6	177.5	-170.3	175.2	-175.3	172.3	0	112	A255 I342 A343 L344 S349 R350	A255-K346 HydrophobicContact CB-CB 4.46Å; I342-K346 WeakPolarHBondContact O-CB 3.38Å; I342-K346 PolarHBondContact O-N 2.8Å; A343-K346 PolarHBondContact O-N 2.85Å; L344-K346 VanDerWaalsContact C-N 3.29Å; L344-K346 PolarHBondContact O-N 3.41Å; K346-S349 WeakPolarHBondContact O-CB 3.19Å; K346-S349 PolarHBondContact O-N 3.02Å; K346-R350 PolarHBondContact O-N 2.64Å
347	E	87.3	Confident	85.9	Confident	22 Å²	22	33.8 Å²	33.8	10%	0.103	17%	0.165	C	C	.	.	H	α-helix	trans	-69.3	-36.8	175	-67.3	-53.7	151.9	0	0	112.7	A343 L344 I345 S349 R350 A351 L665 S687	A343-E347 WeakPolarHBondContact O-CG 3.2Å; A343-E347 PolarHBondContact O-N 2.99Å; L344-E347 PolarHBondContact O-N 2.99Å; I345-E347 PolarHBondContact O-N 2.88Å; E347-S349 VanDerWaalsContact C-N 3.31Å; E347-S349 PolarHBondContact O-N 3.42Å; E347-R350 WeakPolarHBondContact O-CB 3.5Å; E347-R350 PolarHBondContact O-N 2.93Å; E347-R350 IonicContact OE1-CZ 2.8Å; E347-R350 IonicContact OE1-NH1 2.79Å; E347-R350 PolarHBondContact OE1-NH1 3.32Å; E347-R350 WeakPolarHBondContact OE2-CD 3.44Å; E347-R350 IonicContact OE2-NH1 2.81Å; E347-A351 PolarHBondContact O-N 3.44Å; E347-L665 HydrophobicContact CB-CD1 4.4Å; E347-S687 VanDerWaalsContact CD-OG 3.26Å; E347-S687 WeakPolarHBondContact OE1-CB 3.2Å; E347-S687 PolarHBondContact OE1-OG 3.32Å
348	A	89.3	Confident	86.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62	-39.8	172.6	0	0	0	0	0	111.5	L344 I345 R350 A351 V352 Y658 C661 V662 L665	L344-A348 WeakPolarHBondContact O-CB 3.27Å; L344-A348 PolarHBondContact O-N 2.98Å; I345-A348 PolarHBondContact O-N 3.28Å; A348-R350 VanDerWaalsContact C-N 3.29Å; A348-R350 PolarHBondContact O-N 3.29Å; A348-A351 WeakPolarHBondContact O-CB 3.38Å; A348-A351 PolarHBondContact O-N 2.84Å; A348-V352 WeakPolarHBondContact O-CB 3.5Å; A348-V352 WeakPolarHBondContact O-CG2 3.36Å; A348-V352 PolarHBondContact O-N 3.38Å; A348-Y658 HydrophobicContact CB-CD1 4.33Å; A348-Y658 HydrophobicContact CB-CE1 3.72Å; A348-C661 HydrophobicContact CB-CB 4.3Å; A348-V662 HydrophobicContact CB-CG2 3.56Å; A348-L665 HydrophobicContact CB-CD1 3.97Å
349	S	88	Confident	86.6	Confident	5 Å²	5	30.1 Å²	30.1	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-43.3	174.6	-166.4	0	0	0	0	111.4	R252 I345 K346 E347 G353 Y658	R252-S349 WeakPolarHBondContact CA-OG 3.48Å; R252-S349 WeakPolarHBondContact CB-OG 3.46Å; R252-S349 PolarHBondContact N-OG 2.91Å; I345-S349 PolarHBondContact O-N 3.32Å; K346-S349 WeakPolarHBondContact O-CB 3.19Å; K346-S349 PolarHBondContact O-N 3.02Å; E347-S349 VanDerWaalsContact C-N 3.31Å; E347-S349 PolarHBondContact O-N 3.42Å; S349-G353 PolarHBondContact O-N 3.05Å; S349-Y658 VanDerWaalsContact CA-OH 3.22Å; S349-Y658 WeakPolarHBondContact CA-OH 3.48Å; S349-Y658 WeakPolarHBondContact CB-OH 3.17Å; S349-Y658 PolarHBondContact N-OH 2.86Å
350	R	87.9	Confident	86.8	Confident	89 Å²	89	31.5 Å²	31.5	34%	0.336	16%	0.159	S	C	.	.	H	α-helix	trans	-63.8	-46.7	176.1	-69.7	171.7	171	179	-7.8	110.8	K346 E347 A348 V352 G353 Y354	K346-R350 PolarHBondContact O-N 2.64Å; E347-R350 WeakPolarHBondContact O-CB 3.5Å; E347-R350 PolarHBondContact O-N 2.93Å; E347-R350 IonicContact OE1-CZ 2.8Å; E347-R350 IonicContact OE1-NH1 2.79Å; E347-R350 PolarHBondContact OE1-NH1 3.32Å; E347-R350 WeakPolarHBondContact OE2-CD 3.44Å; E347-R350 IonicContact OE2-NH1 2.81Å; A348-R350 VanDerWaalsContact C-N 3.29Å; A348-R350 PolarHBondContact O-N 3.29Å; R350-V352 PolarHBondContact O-N 3.38Å; R350-G353 CarbonylContact O-C 3.57Å; R350-G353 VanDerWaalsContact O-CA 3.29Å; R350-G353 WeakPolarHBondContact O-CA 3.4Å; R350-G353 PolarHBondContact O-N 2.94Å; R350-Y354 WeakPolarHBondContact O-CD2 3.3Å; R350-Y354 PolarHBondContact O-N 2.91Å; R350-Y354 VanDerWaalsContact O-N 3.08Å
351	A	89.6	Confident	87.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-48.5	178.2	0	0	0	0	0	112.2	E347 A348 G353 Y354 V355 F470 Y473 L665	E347-A351 PolarHBondContact O-N 3.44Å; A348-A351 WeakPolarHBondContact O-CB 3.38Å; A348-A351 PolarHBondContact O-N 2.84Å; A351-G353 VanDerWaalsContact C-N 3.25Å; A351-G353 PolarHBondContact O-N 3.46Å; A351-Y354 PolarHBondContact O-N 3.33Å; A351-Y354 VanDerWaalsContact O-N 3.1Å; A351-V355 PolarHBondContact O-N 3.08Å; A351-F470 HydrophobicContact CB-CD1 4.2Å; A351-Y473 HydrophobicContact CB-CD1 3.3Å; A351-Y473 HydrophobicContact CB-CD2 4.4Å; A351-Y473 HydrophobicContact CB-CE1 3.34Å; A351-Y473 HydrophobicContact CB-CE2 4.43Å; A351-Y473 HydrophobicContact CB-CG 3.87Å; A351-L665 HydrophobicContact CB-CD1 4.16Å
352	V	89.8	Confident	87.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-38.4	173.9	172.3	0	0	0	0	110.7	A348 R350 Y354 V355 M356 L359 F470 Y658 C661	A348-V352 WeakPolarHBondContact O-CB 3.5Å; A348-V352 WeakPolarHBondContact O-CG2 3.36Å; A348-V352 PolarHBondContact O-N 3.38Å; R350-V352 PolarHBondContact O-N 3.38Å; V352-Y354 VanDerWaalsContact C-N 3.32Å; V352-Y354 PolarHBondContact O-N 3.33Å; V352-V355 CarbonylContact O-C 3.49Å; V352-V355 PolarHBondContact O-N 2.82Å; V352-V355 VanDerWaalsContact O-N 3.11Å; V352-M356 HydrophobicContact CG1-CE 3.81Å; V352-M356 WeakPolarHBondContact O-CA 3.5Å; V352-M356 VanDerWaalsContact O-CE 3.25Å; V352-M356 WeakPolarHBondContact O-CE 3.48Å; V352-M356 PolarHBondContact O-N 3.4Å; V352-L359 HydrophobicContact CG1-CD1 4.14Å; V352-L359 HydrophobicContact CG1-CD2 3.68Å; V352-L359 HydrophobicContact CG1-CG 3.9Å; V352-F470 HydrophobicContact CG2-CE1 3.84Å; V352-F470 HydrophobicContact CG2-CZ 3.91Å; V352-Y658 HydrophobicContact CG2-CD2 4.21Å; V352-Y658 HydrophobicContact CG2-CE2 4.47Å; V352-C661 HydrophobicContact CG2-CB 4.19Å
353	G	86.6	Confident	87.6	Confident	23 Å²	23	37 Å²	37	24%	0.237	19%	0.189	C	C	.	.	H	α-helix	trans	-55.5	-37.6	171.6	0	0	0	0	0	115	S349 R350 A351 M356	S349-G353 PolarHBondContact O-N 3.05Å; R350-G353 CarbonylContact O-C 3.57Å; R350-G353 VanDerWaalsContact O-CA 3.29Å; R350-G353 WeakPolarHBondContact O-CA 3.4Å; R350-G353 PolarHBondContact O-N 2.94Å; A351-G353 VanDerWaalsContact C-N 3.25Å; A351-G353 PolarHBondContact O-N 3.46Å; G353-M356 VanDerWaalsContact O-CG 3.28Å; G353-M356 WeakPolarHBondContact O-CG 3.35Å
354	Y	87.9	Confident	87.9	Confident	108 Å²	108	39.7 Å²	39.7	42%	0.424	20%	0.204	S	C	.	.	H	α-helix	trans	-81.5	-25.4	174.9	-74.8	-82.6	0	0	0	112.7	R350 A351 V352 Y473 K479 P480	R350-Y354 WeakPolarHBondContact O-CD2 3.3Å; R350-Y354 PolarHBondContact O-N 2.91Å; R350-Y354 VanDerWaalsContact O-N 3.08Å; A351-Y354 PolarHBondContact O-N 3.33Å; A351-Y354 VanDerWaalsContact O-N 3.1Å; V352-Y354 VanDerWaalsContact C-N 3.32Å; V352-Y354 PolarHBondContact O-N 3.33Å; Y354-Y473 AromaticContact CD2-CD2 3.97Å; Y354-Y473 HydrophobicContact CD2-CD2 3.97Å; Y354-Y473 AromaticContact CD2-CE2 3.29Å; Y354-Y473 HydrophobicContact CD2-CE2 3.29Å; Y354-Y473 AromaticContact CE2-CE2 3.79Å; Y354-Y473 HydrophobicContact CE2-CE2 3.79Å; Y354-Y473 HydrophobicContact CG-CD2 4.22Å; Y354-Y473 AromaticContact CG-CE2 3.98Å; Y354-Y473 HydrophobicContact CG-CE2 3.98Å; Y354-K479 HydrophobicContact CE1-CB 4.45Å; Y354-P480 HydrophobicContact CD1-CB 4.41Å; Y354-P480 HydrophobicContact CE1-CB 4.31Å
355	V	88.6	Confident	88.2	Confident	5 Å²	5	40.5 Å²	40.5	3%	0.03	21%	0.209	C	C	.	.			trans	-116.3	54.4	-180	-163.9	0	0	0	0	110	A351 V352 C357 S358 A469 F470 P487 L488	A351-V355 PolarHBondContact O-N 3.08Å; V352-V355 CarbonylContact O-C 3.49Å; V352-V355 PolarHBondContact O-N 2.82Å; V352-V355 VanDerWaalsContact O-N 3.11Å; V355-C357 PolarHBondContact O-N 2.84Å; V355-C357 VanDerWaalsContact O-N 3.14Å; V355-S358 WeakPolarHBondContact O-CB 3.41Å; V355-S358 PolarHBondContact O-N 3.16Å; V355-S358 PolarHBondContact O-OG 3.44Å; V355-A469 HydrophobicContact CG1-CB 4.14Å; V355-F470 HydrophobicContact CB-CE1 4.34Å; V355-P487 HydrophobicContact CG1-CB 4.41Å; V355-P487 HydrophobicContact CG2-CG 4.39Å; V355-L488 HydrophobicContact CG1-CB 4.5Å
356	M	86.8	Confident	88.4	Confident	91 Å²	91	46.7 Å²	46.7	45%	0.448	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-58.3	-32.2	-173.1	-72.5	-94.3	82.1	0	0	113.4	V352 G353 S358 L359	V352-M356 HydrophobicContact CG1-CE 3.81Å; V352-M356 WeakPolarHBondContact O-CA 3.5Å; V352-M356 VanDerWaalsContact O-CE 3.25Å; V352-M356 WeakPolarHBondContact O-CE 3.48Å; V352-M356 PolarHBondContact O-N 3.4Å; G353-M356 VanDerWaalsContact O-CG 3.28Å; G353-M356 WeakPolarHBondContact O-CG 3.35Å; M356-S358 PolarHBondContact O-N 3.46Å; M356-L359 HydrophobicContact CE-CD1 3.68Å; M356-L359 HydrophobicContact CE-CG 4.46Å; M356-L359 WeakPolarHBondContact O-CB 3.42Å; M356-L359 PolarHBondContact O-N 2.87Å
357	C	87.5	Confident	88.7	Confident	67 Å²	67	50 Å²	50	45%	0.453	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-58.1	-21.6	175.1	-66.4	0	0	0	0	113.3	V355 L359 L360 L488	V355-C357 PolarHBondContact O-N 2.84Å; V355-C357 VanDerWaalsContact O-N 3.14Å; C357-L359 PolarHBondContact O-N 3.45Å; C357-L360 PolarHBondContact O-N 3.33Å; C357-L360 VanDerWaalsContact O-N 3.12Å; C357-L488 HydrophobicContact CB-CD2 4Å; C357-L488 WeakPolarHBondContact O-CD2 3.37Å
358	S	90.6	Very high	88.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-60.2	-27.6	175.5	65.1	0	0	0	0	112.9	V355 M356 L360 Y361 V657	V355-S358 WeakPolarHBondContact O-CB 3.41Å; V355-S358 PolarHBondContact O-N 3.16Å; V355-S358 PolarHBondContact O-OG 3.44Å; M356-S358 PolarHBondContact O-N 3.46Å; S358-L360 VanDerWaalsContact C-N 3.27Å; S358-L360 PolarHBondContact O-N 2.96Å; S358-Y361 VanDerWaalsContact O-CB 3.27Å; S358-Y361 WeakPolarHBondContact O-CB 3.28Å; S358-Y361 PolarHBondContact O-N 3.14Å; S358-V657 WeakPolarHBondContact O-CG2 3.35Å
359	L	87.4	Confident	89.1	Confident	14 Å²	14	53.1 Å²	53.1	7%	0.073	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-70.8	-21	177.9	-63.3	-177.6	0	0	0	113.3	L245 I248 V352 M356 C357 P362 F654 V657	L245-L359 HydrophobicContact CD1-CD1 3.71Å; I248-L359 HydrophobicContact CD1-CD2 4.35Å; V352-L359 HydrophobicContact CG1-CD1 4.14Å; V352-L359 HydrophobicContact CG1-CD2 3.68Å; V352-L359 HydrophobicContact CG1-CG 3.9Å; M356-L359 HydrophobicContact CE-CD1 3.68Å; M356-L359 HydrophobicContact CE-CG 4.46Å; M356-L359 WeakPolarHBondContact O-CB 3.42Å; M356-L359 PolarHBondContact O-N 2.87Å; C357-L359 PolarHBondContact O-N 3.45Å; L359-P362 WeakPolarHBondContact O-CD 3.41Å; L359-F654 HydrophobicContact CB-CD1 4.42Å; L359-F654 HydrophobicContact CB-CE1 4.15Å; L359-F654 HydrophobicContact CD2-CD1 4.16Å; L359-V657 HydrophobicContact CD2-CG1 4.3Å
360	L	86.8	Confident	89.3	Confident	112 Å²	112	55.4 Å²	55.4	59%	0.586	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-87.2	-15.2	175.2	-62	176.8	0	0	0	112.5	C357 S358 P362 L363	C357-L360 PolarHBondContact O-N 3.33Å; C357-L360 VanDerWaalsContact O-N 3.12Å; S358-L360 VanDerWaalsContact C-N 3.27Å; S358-L360 PolarHBondContact O-N 2.96Å; L360-P362 VanDerWaalsContact C-CD 3.42Å; L360-L363 HydrophobicContact CD2-CD1 4.16Å; L360-L363 VanDerWaalsContact O-CB 3.3Å; L360-L363 WeakPolarHBondContact O-CB 3.36Å; L360-L363 PolarHBondContact O-N 3.37Å
361	Y	89.7	Confident	89.6	Confident	13 Å²	13	56.1 Å²	56.1	5%	0.051	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-36.8	-178	-164.1	-85.6	0	0	0	114.4	S358 L363 V364 T365 G462 T465 L466 L488 F492	S358-Y361 VanDerWaalsContact O-CB 3.27Å; S358-Y361 WeakPolarHBondContact O-CB 3.28Å; S358-Y361 PolarHBondContact O-N 3.14Å; Y361-L363 PolarHBondContact O-N 2.65Å; Y361-L363 VanDerWaalsContact O-N 3.13Å; Y361-V364 WeakPolarHBondContact O-CB 3.16Å; Y361-V364 PolarHBondContact O-N 3Å; Y361-T365 VanDerWaalsContact CE1-OG1 3.29Å; Y361-T365 WeakPolarHBondContact CE1-OG1 3.3Å; Y361-T365 PolarHBondContact O-N 3.47Å; Y361-T365 VanDerWaalsContact O-N 3.1Å; Y361-T365 PolarHBondContact O-OG1 3.25Å; Y361-G462 WeakPolarHBondContact OH-CA 3.35Å; Y361-T465 HydrophobicContact CD2-CG2 4.25Å; Y361-T465 HydrophobicContact CE2-CG2 3.61Å; Y361-L466 HydrophobicContact CD1-CD1 4.36Å; Y361-L466 HydrophobicContact CD1-CG 4.33Å; Y361-L466 HydrophobicContact CG-CD2 4.28Å; Y361-L466 HydrophobicContact CG-CG 4.5Å; Y361-L488 HydrophobicContact CD2-CD1 4.03Å; Y361-L488 HydrophobicContact CD2-CD2 4.11Å; Y361-L488 HydrophobicContact CD2-CG 4.26Å; Y361-F492 HydrophobicContact CE2-CD2 4.14Å
362	P	88.6	Confident	89.9	Confident	27 Å²	27	57.1 Å²	57.1	18%	0.175	30%	0.3	C	S	.	.	H	α-helix	trans	-54.9	-29	173.6	-28.6	37.5	0	0	0	114.3	L359 L360 T365 F366 G653 V657	L359-P362 WeakPolarHBondContact O-CD 3.41Å; L360-P362 VanDerWaalsContact C-CD 3.42Å; P362-T365 PolarHBondContact O-N 3.16Å; P362-F366 VanDerWaalsContact O-CB 3.26Å; P362-F366 WeakPolarHBondContact O-CB 3.48Å; P362-F366 PolarHBondContact O-N 3.17Å; P362-G653 WeakPolarHBondContact CG-O 3.42Å; P362-V657 HydrophobicContact CG-CG2 3.35Å
363	L	87.4	Confident	90.1	Very high	114 Å²	114	61 Å²	61	60%	0.597	32%	0.32	S	S	*	.	H	α-helix	trans	-67.4	-40	175.7	-59.4	175.5	0	0	0	111.5	L360 Y361 F366 F367	L360-L363 HydrophobicContact CD2-CD1 4.16Å; L360-L363 VanDerWaalsContact O-CB 3.3Å; L360-L363 WeakPolarHBondContact O-CB 3.36Å; L360-L363 PolarHBondContact O-N 3.37Å; Y361-L363 PolarHBondContact O-N 2.65Å; Y361-L363 VanDerWaalsContact O-N 3.13Å; L363-F366 PolarHBondContact O-N 3.4Å; L363-F367 WeakPolarHBondContact O-CB 3.49Å; L363-F367 PolarHBondContact O-N 2.92Å
364	V	90	Very high	90.4	Very high	65 Å²	65	62.7 Å²	62.7	39%	0.394	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-47.7	175.2	-179.2	0	0	0	0	110	Y361 F366 F367 L368	Y361-V364 WeakPolarHBondContact O-CB 3.16Å; Y361-V364 PolarHBondContact O-N 3Å; V364-F366 VanDerWaalsContact C-N 3.34Å; V364-F366 PolarHBondContact O-N 3.08Å; V364-F367 PolarHBondContact O-N 2.85Å; V364-L368 HydrophobicContact CG1-CD1 4.16Å; V364-L368 WeakPolarHBondContact O-CG 3.12Å; V364-L368 PolarHBondContact O-N 3.4Å
365	T	90.8	Very high	90.8	Very high	21 Å²	21	59.9 Å²	59.9	13%	0.129	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-44.8	175.9	-54.2	0	0	0	0	111.5	Y361 P362 L368 L369 V458 L459	Y361-T365 VanDerWaalsContact CE1-OG1 3.29Å; Y361-T365 WeakPolarHBondContact CE1-OG1 3.3Å; Y361-T365 PolarHBondContact O-N 3.47Å; Y361-T365 VanDerWaalsContact O-N 3.1Å; Y361-T365 PolarHBondContact O-OG1 3.25Å; P362-T365 PolarHBondContact O-N 3.16Å; T365-L368 PolarHBondContact O-N 3.27Å; T365-L369 HydrophobicContact CG2-CD1 4.07Å; T365-L369 HydrophobicContact CG2-CG 4.44Å; T365-L369 WeakPolarHBondContact O-CB 3.26Å; T365-L369 VanDerWaalsContact O-CG 3.3Å; T365-L369 WeakPolarHBondContact O-CG 3.2Å; T365-L369 PolarHBondContact O-N 3.07Å; T365-V458 HydrophobicContact CG2-CG1 4.12Å; T365-L459 HydrophobicContact CG2-CD2 4Å
366	F	89.8	Confident	91.1	Very high	134 Å²	134	63.9 Å²	63.9	59%	0.588	34%	0.335	S	S	*	.	H	α-helix	trans	-61.2	-48.4	178.6	178.8	-99.2	0	0	0	111.6	P362 L363 V364 L368 L369 C370	P362-F366 VanDerWaalsContact O-CB 3.26Å; P362-F366 WeakPolarHBondContact O-CB 3.48Å; P362-F366 PolarHBondContact O-N 3.17Å; L363-F366 PolarHBondContact O-N 3.4Å; V364-F366 VanDerWaalsContact C-N 3.34Å; V364-F366 PolarHBondContact O-N 3.08Å; F366-L368 PolarHBondContact O-N 3.01Å; F366-L369 PolarHBondContact O-N 3.12Å; F366-C370 VanDerWaalsContact CE1-SG 3.55Å; F366-C370 VanDerWaalsContact CZ-SG 3.52Å; F366-C370 WeakPolarHBondContact O-CB 3.39Å; F366-C370 PolarHBondContact O-N 3.24Å; F366-C370 PolarHBondContact O-SG 2.94Å; F366-C370 VanDerWaalsContact O-SG 3.36Å
367	F	92	Very high	91.4	Very high	139 Å²	139	61.3 Å²	61.3	61%	0.61	33%	0.328	S	S	*	.	H	α-helix	trans	-56.9	-47.7	177	174.1	-100.2	0	0	0	112.2	L363 V364 L369 C370 L371	L363-F367 WeakPolarHBondContact O-CB 3.49Å; L363-F367 PolarHBondContact O-N 2.92Å; V364-F367 PolarHBondContact O-N 2.85Å; F367-L369 PolarHBondContact O-N 3.31Å; F367-C370 WeakPolarHBondContact O-CB 3.4Å; F367-C370 PolarHBondContact O-N 2.96Å; F367-L371 PolarHBondContact O-N 3.39Å
368	L	92.9	Very high	91.6	Very high	46 Å²	46	59.9 Å²	59.9	24%	0.241	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-39	178.4	-68.7	175.3	0	0	0	112.3	V364 T365 F366 L371 C372 V458	V364-L368 HydrophobicContact CG1-CD1 4.16Å; V364-L368 WeakPolarHBondContact O-CG 3.12Å; V364-L368 PolarHBondContact O-N 3.4Å; T365-L368 PolarHBondContact O-N 3.27Å; F366-L368 PolarHBondContact O-N 3.01Å; L368-L371 WeakPolarHBondContact O-CB 3.19Å; L368-L371 PolarHBondContact O-N 3.07Å; L368-C372 PolarHBondContact O-N 2.91Å; L368-C372 PolarHBondContact O-SG 3.27Å; L368-C372 VanDerWaalsContact O-SG 3.37Å; L368-V458 HydrophobicContact CB-CB 4.49Å; L368-V458 HydrophobicContact CB-CG1 3.59Å; L368-V458 HydrophobicContact CB-CG2 3.99Å; L368-V458 HydrophobicContact CD1-CG1 4.13Å
369	L	92.9	Very high	91.7	Very high	42 Å²	42	59.9 Å²	59.9	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-39.6	174.6	-72.2	176.1	0	0	0	112.1	T365 F366 F367 L371 C372 I373 A455 V458 L459	T365-L369 HydrophobicContact CG2-CD1 4.07Å; T365-L369 HydrophobicContact CG2-CG 4.44Å; T365-L369 WeakPolarHBondContact O-CB 3.26Å; T365-L369 VanDerWaalsContact O-CG 3.3Å; T365-L369 WeakPolarHBondContact O-CG 3.2Å; T365-L369 PolarHBondContact O-N 3.07Å; F366-L369 PolarHBondContact O-N 3.12Å; F367-L369 PolarHBondContact O-N 3.31Å; L369-L371 VanDerWaalsContact C-N 3.3Å; L369-L371 PolarHBondContact O-N 2.89Å; L369-C372 WeakPolarHBondContact O-CB 3.37Å; L369-C372 PolarHBondContact O-N 3.13Å; L369-I373 VanDerWaalsContact O-CG1 3.29Å; L369-I373 WeakPolarHBondContact O-CG1 3.19Å; L369-I373 PolarHBondContact O-N 3.47Å; L369-A455 HydrophobicContact CD2-CB 3.9Å; L369-V458 HydrophobicContact CD2-CB 4.21Å; L369-V458 HydrophobicContact CD2-CG1 4.1Å; L369-V458 HydrophobicContact CG-CG1 4.05Å; L369-L459 HydrophobicContact CD1-CD2 4.09Å
370	C	91.9	Very high	91.9	Very high	52 Å²	52	60.1 Å²	60.1	35%	0.351	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-41.3	173.4	-74.7	0	0	0	0	111.6	F366 F367 I373 A374	F366-C370 VanDerWaalsContact CE1-SG 3.55Å; F366-C370 VanDerWaalsContact CZ-SG 3.52Å; F366-C370 WeakPolarHBondContact O-CB 3.39Å; F366-C370 PolarHBondContact O-N 3.24Å; F366-C370 PolarHBondContact O-SG 2.94Å; F366-C370 VanDerWaalsContact O-SG 3.36Å; F367-C370 WeakPolarHBondContact O-CB 3.4Å; F367-C370 PolarHBondContact O-N 2.96Å; C370-I373 PolarHBondContact O-N 3.45Å; C370-A374 VanDerWaalsContact O-CB 3.3Å; C370-A374 WeakPolarHBondContact O-CB 3.3Å; C370-A374 PolarHBondContact O-N 3.5Å
371	L	94.4	Very high	92	Very high	105 Å²	105	57.7 Å²	57.7	55%	0.55	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-46.5	174.2	-176.5	66.2	0	0	0	111.5	F367 L368 L369 I373 A374 Y375	F367-L371 PolarHBondContact O-N 3.39Å; L368-L371 WeakPolarHBondContact O-CB 3.19Å; L368-L371 PolarHBondContact O-N 3.07Å; L369-L371 VanDerWaalsContact C-N 3.3Å; L369-L371 PolarHBondContact O-N 2.89Å; L371-I373 PolarHBondContact O-N 3.4Å; L371-A374 PolarHBondContact O-N 3.2Å; L371-Y375 WeakPolarHBondContact O-CB 3.26Å; L371-Y375 PolarHBondContact O-N 3.34Å
372	C	95.2	Very high	91.9	Very high	20 Å²	20	59.4 Å²	59.4	14%	0.135	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-44.8	175.5	-68.8	0	0	0	0	112.3	L368 L369 W376	L368-C372 PolarHBondContact O-N 2.91Å; L368-C372 PolarHBondContact O-SG 3.27Å; L368-C372 VanDerWaalsContact O-SG 3.37Å; L369-C372 WeakPolarHBondContact O-CB 3.37Å; L369-C372 PolarHBondContact O-N 3.13Å; C372-W376 VanDerWaalsContact O-CB 3.27Å; C372-W376 WeakPolarHBondContact O-CB 3.45Å; C372-W376 PolarHBondContact O-N 3.46Å
373	I	94.4	Very high	91.9	Very high	82 Å²	82	58.1 Å²	58.1	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-45.3	179	-67.7	165.9	0	0	0	110.7	L369 C370 L371 W376 A377 F451	L369-I373 VanDerWaalsContact O-CG1 3.29Å; L369-I373 WeakPolarHBondContact O-CG1 3.19Å; L369-I373 PolarHBondContact O-N 3.47Å; C370-I373 PolarHBondContact O-N 3.45Å; L371-I373 PolarHBondContact O-N 3.4Å; I373-W376 PolarHBondContact O-N 3.33Å; I373-A377 VanDerWaalsContact O-CB 3.22Å; I373-A377 WeakPolarHBondContact O-CB 3.46Å; I373-A377 PolarHBondContact O-N 3.19Å; I373-F451 HydrophobicContact CB-CE2 4.43Å; I373-F451 HydrophobicContact CG1-CE2 3.62Å; I373-F451 HydrophobicContact CG1-CZ 4.05Å
374	A	93.4	Very high	91.7	Very high	59 Å²	59	55.8 Å²	55.8	49%	0.488	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-44.6	-179.2	0	0	0	0	0	111.7	C370 L371 S378	C370-A374 VanDerWaalsContact O-CB 3.3Å; C370-A374 WeakPolarHBondContact O-CB 3.3Å; C370-A374 PolarHBondContact O-N 3.5Å; L371-A374 PolarHBondContact O-N 3.2Å; A374-S378 WeakPolarHBondContact O-CB 3.33Å; A374-S378 PolarHBondContact O-N 2.84Å; A374-S378 PolarHBondContact O-OG 2.9Å
375	Y	95.1	Very high	91.4	Very high	49 Å²	49	53.1 Å²	53.1	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-43.3	177.1	-170.9	-83.5	0	0	0	111.9	Y45 V46 W53 L371 S378 T379	Y45-Y375 HydrophobicContact CD1-CD1 4.03Å; Y45-Y375 AromaticContact CD1-CE1 3.63Å; Y45-Y375 HydrophobicContact CD1-CE1 3.63Å; Y45-Y375 HydrophobicContact CD2-CE1 4.17Å; Y45-Y375 AromaticContact CE1-CD1 3.27Å; Y45-Y375 HydrophobicContact CE1-CD1 3.27Å; Y45-Y375 AromaticContact CE1-CE1 3.29Å; Y45-Y375 HydrophobicContact CE1-CE1 3.29Å; Y45-Y375 HydrophobicContact CE1-CG 4.47Å; Y45-Y375 HydrophobicContact CE2-CD1 4.29Å; Y45-Y375 AromaticContact CE2-CE1 3.84Å; Y45-Y375 HydrophobicContact CE2-CE1 3.84Å; Y45-Y375 HydrophobicContact CG-CE1 4.07Å; Y45-Y375 AromaticContact CZ-CD1 3.43Å; Y45-Y375 VanDerWaalsContact CZ-CD1 3.43Å; Y45-Y375 AromaticContact CZ-CE1 3.4Å; Y45-Y375 VanDerWaalsContact CZ-CE1 3.4Å; Y45-Y375 PolarHBondContact O-OH 2.97Å; Y45-Y375 WeakPolarHBondContact OH-CD1 3.5Å; V46-Y375 VanDerWaalsContact CA-OH 3.31Å; V46-Y375 WeakPolarHBondContact CA-OH 3.27Å; W53-Y375 HydrophobicContact CH2-CD2 4.35Å; W53-Y375 AromaticContact CH2-CE2 3.7Å; W53-Y375 HydrophobicContact CH2-CE2 3.7Å; W53-Y375 HydrophobicContact CZ2-CD2 4.4Å; W53-Y375 AromaticContact CZ2-CE2 3.97Å; W53-Y375 HydrophobicContact CZ2-CE2 3.97Å; L371-Y375 WeakPolarHBondContact O-CB 3.26Å; L371-Y375 PolarHBondContact O-N 3.34Å; Y375-S378 PolarHBondContact O-OG 3.31Å; Y375-T379 WeakPolarHBondContact O-CB 3.48Å; Y375-T379 PolarHBondContact O-N 3.12Å; Y375-T379 PolarHBondContact O-OG1 2.93Å
376	W	96.3	Very high	91.1	Very high	89 Å²	89	52.3 Å²	52.3	34%	0.337	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-48.5	175.8	165.9	77.1	0	0	0	112.5	Y45 C372 I373 T379 A380 N447 F451	Y45-W376 WeakPolarHBondContact OH-CA 3.47Å; C372-W376 VanDerWaalsContact O-CB 3.27Å; C372-W376 WeakPolarHBondContact O-CB 3.45Å; C372-W376 PolarHBondContact O-N 3.46Å; I373-W376 PolarHBondContact O-N 3.33Å; W376-T379 PolarHBondContact O-N 2.96Å; W376-A380 VanDerWaalsContact O-CB 3.24Å; W376-A380 WeakPolarHBondContact O-CB 3.29Å; W376-A380 PolarHBondContact O-N 2.92Å; W376-N447 PolarHBondContact O-ND2 2.92Å; W376-F451 HydrophobicContact CB-CB 3.96Å; W376-F451 HydrophobicContact CB-CD2 3.74Å; W376-F451 HydrophobicContact CB-CG 4.06Å; W376-F451 VanDerWaalsContact CD1-CB 3.47Å; W376-F451 AromaticContact CD1-CG 3.96Å; W376-F451 HydrophobicContact CD2-CD2 4.38Å; W376-F451 HydrophobicContact CD2-CG 4.27Å; W376-F451 HydrophobicContact CG-CB 3.72Å; W376-F451 AromaticContact CG-CD2 3.91Å; W376-F451 HydrophobicContact CG-CD2 3.91Å; W376-F451 AromaticContact CG-CG 3.8Å; W376-F451 HydrophobicContact CG-CG 3.8Å
377	A	91.8	Very high	90.6	Very high	37 Å²	37	47.6 Å²	47.6	31%	0.306	27%	0.266	S	S	.	.	H	α-helix	trans	-65.6	-44.5	-176.6	0	0	0	0	0	111.3	I373 A380 V381	I373-A377 VanDerWaalsContact O-CB 3.22Å; I373-A377 WeakPolarHBondContact O-CB 3.46Å; I373-A377 PolarHBondContact O-N 3.19Å; A377-A380 PolarHBondContact O-N 3.39Å; A377-V381 WeakPolarHBondContact O-CG2 3.36Å; A377-V381 PolarHBondContact O-N 2.9Å
378	S	92.2	Very high	89.9	Confident	38 Å²	38	47 Å²	47	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-53.7	174.7	54.8	0	0	0	0	110.8	A374 Y375 A380 V381 F382	A374-S378 WeakPolarHBondContact O-CB 3.33Å; A374-S378 PolarHBondContact O-N 2.84Å; A374-S378 PolarHBondContact O-OG 2.9Å; Y375-S378 PolarHBondContact O-OG 3.31Å; S378-A380 VanDerWaalsContact C-N 3.28Å; S378-A380 PolarHBondContact O-N 3.4Å; S378-V381 PolarHBondContact O-N 2.81Å; S378-V381 VanDerWaalsContact O-N 3.17Å; S378-F382 VanDerWaalsContact O-CD2 3.29Å; S378-F382 WeakPolarHBondContact O-CD2 3.46Å; S378-F382 PolarHBondContact O-N 3.22Å
379	T	93.7	Very high	89.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.3	-40.4	178.4	-55.7	0	0	0	0	112.1	V48 A52 Y375 W376 F382 L383	V48-T379 HydrophobicContact CG1-CG2 4.37Å; A52-T379 HydrophobicContact CB-CG2 4.19Å; Y375-T379 WeakPolarHBondContact O-CB 3.48Å; Y375-T379 PolarHBondContact O-N 3.12Å; Y375-T379 PolarHBondContact O-OG1 2.93Å; W376-T379 PolarHBondContact O-N 2.96Å; T379-F382 PolarHBondContact O-N 3.42Å; T379-L383 HydrophobicContact CG2-CD1 3.92Å; T379-L383 HydrophobicContact CG2-CG 4.3Å; T379-L383 VanDerWaalsContact O-CB 3.32Å; T379-L383 WeakPolarHBondContact O-CB 3.37Å; T379-L383 WeakPolarHBondContact O-CG 3.2Å; T379-L383 PolarHBondContact O-N 3.38Å
380	A	91.3	Very high	88.4	Confident	18 Å²	18	46 Å²	46	15%	0.149	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-43.9	178.3	0	0	0	0	0	112.7	W376 A377 S378 S384 Q444 N447	W376-A380 VanDerWaalsContact O-CB 3.24Å; W376-A380 WeakPolarHBondContact O-CB 3.29Å; W376-A380 PolarHBondContact O-N 2.92Å; A377-A380 PolarHBondContact O-N 3.39Å; S378-A380 VanDerWaalsContact C-N 3.28Å; S378-A380 PolarHBondContact O-N 3.4Å; A380-S384 WeakPolarHBondContact O-CB 3.46Å; A380-S384 PolarHBondContact O-N 3.21Å; A380-S384 PolarHBondContact O-OG 3.46Å; A380-Q444 PolarHBondContact O-NE2 3.06Å; A380-N447 WeakPolarHBondContact CB-ND2 3.17Å; A380-N447 PolarHBondContact N-ND2 3.4Å
381	V	87.8	Confident	87.9	Confident	62 Å²	62	45.5 Å²	45.5	38%	0.376	26%	0.257	S	S	.	.	H	α-helix	trans	-67.1	-42.8	178.4	169.8	0	0	0	0	111.4	V61 A377 S378 S384 T385	V61-V381 HydrophobicContact CG2-CG1 4.2Å; A377-V381 WeakPolarHBondContact O-CG2 3.36Å; A377-V381 PolarHBondContact O-N 2.9Å; S378-V381 PolarHBondContact O-N 2.81Å; S378-V381 VanDerWaalsContact O-N 3.17Å; V381-S384 PolarHBondContact O-N 3.49Å; V381-S384 PolarHBondContact O-OG 3.4Å; V381-T385 WeakPolarHBondContact O-CG2 3.41Å; V381-T385 PolarHBondContact O-N 2.95Å; V381-T385 PolarHBondContact O-OG1 2.94Å
382	F	88.6	Confident	87.3	Confident	48 Å²	48	42.5 Å²	42.5	21%	0.211	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-39.9	179	-85.7	-94.9	0	0	0	111.9	A52 W53 G56 P58 S378 T379 S384 T385 S386	A52-F382 HydrophobicContact CB-CB 4.03Å; A52-F382 WeakPolarHBondContact O-CB 3.38Å; W53-F382 HydrophobicContact CB-CD1 4.45Å; W53-F382 AromaticContact CD1-CD1 3.82Å; W53-F382 AromaticContact CD1-CD2 3.65Å; W53-F382 AromaticContact CD1-CG 3.5Å; W53-F382 VanDerWaalsContact CD1-CG 3.5Å; G56-F382 VanDerWaalsContact CA-O 3.27Å; G56-F382 WeakPolarHBondContact CA-O 3.01Å; G56-F382 WeakPolarHBondContact O-CD1 3.17Å; P58-F382 HydrophobicContact CB-CE1 4.5Å; P58-F382 HydrophobicContact CB-CE2 4.43Å; P58-F382 HydrophobicContact CB-CZ 4.22Å; P58-F382 HydrophobicContact CG-CE1 3.85Å; P58-F382 HydrophobicContact CG-CE2 4.37Å; P58-F382 HydrophobicContact CG-CZ 3.7Å; S378-F382 VanDerWaalsContact O-CD2 3.29Å; S378-F382 WeakPolarHBondContact O-CD2 3.46Å; S378-F382 PolarHBondContact O-N 3.22Å; T379-F382 PolarHBondContact O-N 3.42Å; F382-S384 PolarHBondContact O-N 2.94Å; F382-T385 WeakPolarHBondContact CA-OG1 3.45Å; F382-T385 PolarHBondContact O-N 3.12Å; F382-T385 PolarHBondContact O-OG1 3.45Å; F382-S386 PolarHBondContact O-N 3.21Å
383	L	88.5	Confident	86.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-44.4	172.1	-78.7	172.3	0	0	0	111.6	V48 A52 T379 T385 S386 L440 L443 Q444 N447	V48-L383 HydrophobicContact CG1-CD1 4.26Å; A52-L383 HydrophobicContact CB-CD2 3.81Å; A52-L383 HydrophobicContact CB-CG 3.68Å; T379-L383 HydrophobicContact CG2-CD1 3.92Å; T379-L383 HydrophobicContact CG2-CG 4.3Å; T379-L383 VanDerWaalsContact O-CB 3.32Å; T379-L383 WeakPolarHBondContact O-CB 3.37Å; T379-L383 WeakPolarHBondContact O-CG 3.2Å; T379-L383 PolarHBondContact O-N 3.38Å; L383-T385 PolarHBondContact O-N 2.99Å; L383-S386 PolarHBondContact O-N 3.02Å; L383-S386 PolarHBondContact O-OG 3.49Å; L383-L440 HydrophobicContact CD2-CD1 4.23Å; L383-L440 WeakPolarHBondContact O-CD1 3.4Å; L383-L443 HydrophobicContact CD1-CB 4.14Å; L383-L443 HydrophobicContact CD2-CB 4.01Å; L383-L443 HydrophobicContact CD2-CD1 4Å; L383-Q444 HydrophobicContact CB-CG 4.27Å; L383-Q444 HydrophobicContact CD1-CG 4.35Å; L383-N447 HydrophobicContact CD1-CB 4.27Å
384	S	83	Confident	85.7	Confident	66 Å²	66	40 Å²	40	46%	0.462	22%	0.224	S	C	.	.	H	α-helix	trans	-66.7	-18.8	-178.6	69.4	0	0	0	0	113.7	A380 V381 F382	A380-S384 WeakPolarHBondContact O-CB 3.46Å; A380-S384 PolarHBondContact O-N 3.21Å; A380-S384 PolarHBondContact O-OG 3.46Å; V381-S384 PolarHBondContact O-N 3.49Å; V381-S384 PolarHBondContact O-OG 3.4Å; F382-S384 PolarHBondContact O-N 2.94Å
385	T	83.8	Confident	84.9	Confident	8 Å²	8	38.5 Å²	38.5	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-103.1	0	-179.9	52.4	0	0	0	0	114.7	D57 K60 V61 V381 F382 L383 N387	D57-T385 PolarHBondContact N-OG1 3.17Å; D57-T385 WeakPolarHBondContact O-CB 3.45Å; D57-T385 WeakPolarHBondContact O-CG2 2.99Å; D57-T385 PolarHBondContact O-OG1 3.27Å; K60-T385 HydrophobicContact CB-CG2 4.11Å; K60-T385 WeakPolarHBondContact CD-O 3.41Å; K60-T385 PolarHBondContact NZ-O 3.46Å; V61-T385 HydrophobicContact CG2-CG2 3.28Å; V381-T385 WeakPolarHBondContact O-CG2 3.41Å; V381-T385 PolarHBondContact O-N 2.95Å; V381-T385 PolarHBondContact O-OG1 2.94Å; F382-T385 WeakPolarHBondContact CA-OG1 3.45Å; F382-T385 PolarHBondContact O-N 3.12Å; F382-T385 PolarHBondContact O-OG1 3.45Å; L383-T385 PolarHBondContact O-N 2.99Å; T385-N387 PolarHBondContact O-N 3Å
386	S	84.1	Confident	83.5	Confident	5 Å²	5	43 Å²	43	4%	0.035	24%	0.235	C	C	.	.			trans	-74.7	-5.9	-177.8	65.7	0	0	0	0	114.5	F382 L383 Y436 H437 L440	F382-S386 PolarHBondContact O-N 3.21Å; L383-S386 PolarHBondContact O-N 3.02Å; L383-S386 PolarHBondContact O-OG 3.49Å; S386-Y436 VanDerWaalsContact CB-OH 3.24Å; S386-Y436 WeakPolarHBondContact CB-OH 3.25Å; S386-Y436 PolarHBondContact OG-OH 2.95Å; S386-H437 PolarHBondContact O-CE1 3.45Å; S386-L440 WeakPolarHBondContact OG-CD1 3.32Å
387	N	78.6	Confident	82.2	Confident	34 Å²	34	41.1 Å²	41.1	18%	0.182	24%	0.236	C	C	.	.			trans	-69.8	144	177	-74	-21.5	0	0	0	112.5	K60 T385 Y430 H437	K60-N387 PolarHBondContact NZ-O 2.93Å; T385-N387 PolarHBondContact O-N 3Å; N387-Y430 PolarHBondContact ND2-O 3.45Å; N387-H437 PolarHBondContact OD1-ND1 2.99Å
388	E	78.9	Confident	81.2	Confident	128 Å²	128	46 Å²	46	60%	0.598	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	159.1	178.8	-65.5	-175.8	169.3	0	0	111.7	V390 Y430 G431	E388-V390 PolarHBondContact O-N 3.44Å; E388-Y430 CarbonylContact O-C 3.3Å; E388-Y430 WeakPolarHBondContact O-CA 3.26Å; E388-G431 CarbonylContact C-O 3.37Å; E388-G431 WeakPolarHBondContact CA-O 3.43Å; E388-G431 PolarHBondContact N-O 2.86Å; E388-G431 PolarHBondContact O-N 3.36Å
389	A	75.6	Confident	80.4	Confident	41 Å²	41	44.9 Å²	44.9	34%	0.339	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.1	178	0	0	0	0	0	110.1	Y391 F427 Y430	A389-Y391 HydrophobicContact CB-CE2 3.8Å; A389-F427 HydrophobicContact CB-CD2 3.94Å; A389-F427 HydrophobicContact CB-CE2 3.72Å; A389-Y430 HydrophobicContact CB-CD1 4.31Å; A389-Y430 HydrophobicContact CB-CE1 4.08Å
390	V	78.8	Confident	79.8	Confident	25 Å²	25	49.9 Å²	49.9	15%	0.152	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.3	176.7	-178.1	0	0	0	0	109.1	E388 T405 A428 F429	E388-V390 PolarHBondContact O-N 3.44Å; V390-T405 HydrophobicContact CG1-CG2 3.71Å; V390-A428 WeakPolarHBondContact O-CB 3.43Å; V390-A428 PolarHBondContact O-N 3.27Å; V390-F429 WeakPolarHBondContact CB-O 3.43Å; V390-F429 PolarHBondContact N-O 2.89Å; V390-F429 PolarHBondContact O-N 3.32Å
391	Y	80.6	Confident	79.2	Confident	41 Å²	41	50.8 Å²	50.8	16%	0.161	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	139.5	176.7	-58.3	-105.5	0	0	0	109.6	R68 G69 A389 T405 C406 P408 Q426 F427	R68-Y391 PolarHBondContact O-OH 3.27Å; G69-Y391 WeakPolarHBondContact CA-OH 3.14Å; A389-Y391 HydrophobicContact CB-CE2 3.8Å; Y391-T405 VanDerWaalsContact O-CA 3.3Å; Y391-T405 WeakPolarHBondContact O-CA 3.38Å; Y391-C406 WeakPolarHBondContact CB-O 3.38Å; Y391-C406 PolarHBondContact O-N 3.29Å; Y391-P408 HydrophobicContact CD1-CB 4.4Å; Y391-P408 HydrophobicContact CD1-CG 3.9Å; Y391-P408 HydrophobicContact CD2-CG 4.35Å; Y391-P408 HydrophobicContact CE1-CG 3.89Å; Y391-P408 HydrophobicContact CE2-CG 4.35Å; Y391-P408 HydrophobicContact CG-CG 4.16Å; Y391-Q426 CarbonylContact C-O 3.54Å; Y391-Q426 VanDerWaalsContact CA-O 3.27Å; Y391-Q426 WeakPolarHBondContact CA-O 3.36Å; Y391-F427 VanDerWaalsContact CD1-CA 3.5Å; Y391-F427 HydrophobicContact CD1-CB 3.96Å; Y391-F427 VanDerWaalsContact CD1-N 3.32Å; Y391-F427 HydrophobicContact CE1-CB 3.84Å; Y391-F427 HydrophobicContact CE1-CD2 4.48Å
392	K	80.9	Confident	78.7	Confident	42 Å²	42	50.6 Å²	50.6	18%	0.183	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.5	-179.9	-70.9	-173.3	169.9	-166.2	0	112	F394 A403 K404 Q426 A428	K392-F394 HydrophobicContact CB-CE2 4.05Å; K392-F394 HydrophobicContact CB-CZ 4.45Å; K392-F394 VanDerWaalsContact O-CD2 3.24Å; K392-F394 WeakPolarHBondContact O-CD2 3.15Å; K392-F394 WeakPolarHBondContact O-CE2 3.31Å; K392-A403 WeakPolarHBondContact CD-O 3.44Å; K392-A403 WeakPolarHBondContact CE-O 3.23Å; K392-K404 VanDerWaalsContact CA-O 3.25Å; K392-K404 WeakPolarHBondContact CA-O 3.48Å; K392-Q426 PolarHBondContact N-O 2.89Å; K392-Q426 PolarHBondContact O-N 3.27Å; K392-A428 HydrophobicContact CB-CB 4.01Å; K392-A428 HydrophobicContact CD-CB 4Å; K392-A428 HydrophobicContact CG-CB 3.86Å
393	I	81.6	Confident	78.1	Confident	4 Å²	4	51 Å²	51	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.2	177	-56.6	173.5	0	0	0	109.8	F401 A403 K404 C406 F411 E416 A423 R424	I393-F401 HydrophobicContact CD1-CB 4.17Å; I393-A403 PolarHBondContact O-N 3.05Å; I393-K404 HydrophobicContact CD1-CB 4.38Å; I393-K404 PolarHBondContact N-O 3Å; I393-C406 HydrophobicContact CD1-CB 4.26Å; I393-C406 HydrophobicContact CG1-CB 3.71Å; I393-F411 HydrophobicContact CD1-CD2 4.35Å; I393-F411 HydrophobicContact CD1-CE2 3.66Å; I393-F411 HydrophobicContact CG1-CD2 4.31Å; I393-F411 HydrophobicContact CG1-CE2 3.69Å; I393-F411 HydrophobicContact CG1-CZ 4.33Å; I393-F411 HydrophobicContact CG2-CE2 4.28Å; I393-F411 HydrophobicContact CG2-CZ 4.18Å; I393-E416 HydrophobicContact CD1-CB 4.22Å; I393-A423 HydrophobicContact CG2-CB 3.59Å; I393-R424 CarbonylContact C-O 3.55Å; I393-R424 WeakPolarHBondContact CA-O 3.48Å
394	F	75.1	Confident	77.8	Confident	46 Å²	46	56.5 Å²	56.5	20%	0.202	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.5	175.7	-67.5	-88.4	0	0	0	110.5	K392 A423 R424 Q426 A428	K392-F394 HydrophobicContact CB-CE2 4.05Å; K392-F394 HydrophobicContact CB-CZ 4.45Å; K392-F394 VanDerWaalsContact O-CD2 3.24Å; K392-F394 WeakPolarHBondContact O-CD2 3.15Å; K392-F394 WeakPolarHBondContact O-CE2 3.31Å; F394-A423 CarbonylContact O-C 3.59Å; F394-A423 WeakPolarHBondContact O-CA 3.49Å; F394-R424 PolarHBondContact N-O 3.23Å; F394-R424 PolarHBondContact O-N 2.69Å; F394-Q426 HydrophobicContact CD2-CB 3.82Å; F394-Q426 HydrophobicContact CD2-CG 4.39Å; F394-Q426 HydrophobicContact CE2-CB 4.03Å; F394-A428 HydrophobicContact CE2-CB 4.48Å; F394-A428 HydrophobicContact CZ-CB 4.37Å
395	D	76.6	Confident	77.9	Confident	27 Å²	27	57.5 Å²	57.5	14%	0.144	33%	0.328	C	S	.	.			trans	-140.4	138.3	174.1	-165	-20.6	0	0	0	108.3	S397 C399 A423	D395-S397 VanDerWaalsContact C-N 3.26Å; D395-S397 PolarHBondContact OD1-N 3.45Å; D395-S397 PolarHBondContact OD1-OG 3.01Å; D395-S397 PolarHBondContact OD2-OG 3.24Å; D395-S397 VanDerWaalsContact OD2-OG 3.07Å; D395-C399 HydrophobicContact CB-CB 4.02Å; D395-C399 WeakPolarHBondContact OD2-CB 3.3Å; D395-A423 HydrophobicContact CB-CB 4.02Å
396	D	65.6	Low	77.8	Confident	143 Å²	143	58.2 Å²	58.2	77%	0.765	33%	0.333	S	S	*	.	S	Bend	trans	-79.8	-12.4	174	-73	-45.4	0	0	0	111.4
397	S	68.3	Low	77.8	Confident	50 Å²	50	61.8 Å²	61.8	35%	0.35	35%	0.352	S	S	.	.	S	Bend	trans	-101.8	154.8	173.7	68.9	0	0	0	0	112	D395 C399	D395-S397 VanDerWaalsContact C-N 3.26Å; D395-S397 PolarHBondContact OD1-N 3.45Å; D395-S397 PolarHBondContact OD1-OG 3.01Å; D395-S397 PolarHBondContact OD2-OG 3.24Å; D395-S397 VanDerWaalsContact OD2-OG 3.07Å; S397-C399 VanDerWaalsContact C-N 3.32Å; S397-C399 PolarHBondContact O-N 3.41Å
398	P	70.6	Confident	77.8	Confident	141 Å²	141	62.4 Å²	62.4	92%	0.916	36%	0.358	S	S	*	.			trans	-69	88	-179.2	25.3	-30.8	0	0	0	111.2
399	C	77.3	Confident	77.8	Confident	14 Å²	14	64.3 Å²	64.3	10%	0.095	37%	0.367	C	S	.	.			trans	-97.2	137.4	174.2	168	0	0	0	0	110.7	D395 S397 F401 T402 C420	D395-C399 HydrophobicContact CB-CB 4.02Å; D395-C399 WeakPolarHBondContact OD2-CB 3.3Å; S397-C399 VanDerWaalsContact C-N 3.32Å; S397-C399 PolarHBondContact O-N 3.41Å; C399-F401 PolarHBondContact O-N 2.95Å; C399-F401 PolarHBondContact SG-N 3Å; C399-F401 VanDerWaalsContact SG-N 3.37Å; C399-T402 PolarHBondContact O-N 3.44Å; C399-T402 PolarHBondContact O-OG1 3.17Å; C399-T402 VanDerWaalsContact O-OG1 3.07Å; C399-C420 HydrophobicContact CB-CB 3.91Å; C399-C420 WeakPolarHBondContact CB-SG 3.41Å; C399-C420 WeakPolarHBondContact SG-CB 3.48Å; C399-C420 CovalentContact SG-SG 2.03Å; C399-C420 PolarHBondContact SG-SG 3.33Å
400	P	80	Confident	78.2	Confident	105 Å²	105	66 Å²	66	68%	0.682	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.1	179.3	26.2	-32.7	0	0	0	114.5
401	F	79.4	Confident	78.3	Confident	37 Å²	37	65.6 Å²	65.6	16%	0.162	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	1.9	179.3	-57.8	-86.7	0	0	0	113.6	I393 C399 A403 K404 E416 Q419	I393-F401 HydrophobicContact CD1-CB 4.17Å; C399-F401 PolarHBondContact O-N 2.95Å; C399-F401 PolarHBondContact SG-N 3Å; C399-F401 VanDerWaalsContact SG-N 3.37Å; F401-A403 PolarHBondContact O-N 3.26Å; F401-K404 HydrophobicContact CD1-CD 4.04Å; F401-K404 WeakPolarHBondContact O-CB 3.33Å; F401-K404 PolarHBondContact O-N 3.38Å; F401-E416 HydrophobicContact CD1-CB 4.42Å; F401-E416 HydrophobicContact CD1-CG 3.77Å; F401-E416 HydrophobicContact CE1-CG 4.13Å; F401-E416 HydrophobicContact CG-CB 4.34Å; F401-E416 HydrophobicContact CG-CG 4.17Å; F401-Q419 HydrophobicContact CE2-CB 4.16Å
402	T	77.5	Confident	78.2	Confident	58 Å²	58	68.2 Å²	68.2	36%	0.356	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	139.1	176.9	-57.9	0	0	0	0	110.8	C399 K404	C399-T402 PolarHBondContact O-N 3.44Å; C399-T402 PolarHBondContact O-OG1 3.17Å; C399-T402 VanDerWaalsContact O-OG1 3.07Å; T402-K404 PolarHBondContact O-N 3.41Å
403	A	74.8	Confident	78.2	Confident	57 Å²	57	70.2 Å²	70.2	47%	0.471	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	3.8	-177.9	0	0	0	0	0	117.2	K392 I393 F401	K392-A403 WeakPolarHBondContact CD-O 3.44Å; K392-A403 WeakPolarHBondContact CE-O 3.23Å; I393-A403 PolarHBondContact O-N 3.05Å; F401-A403 PolarHBondContact O-N 3.26Å
404	K	82.8	Confident	78.2	Confident	114 Å²	114	71 Å²	71	50%	0.496	42%	0.416	S	S	.	.			trans	-73.7	151.9	167.5	-69.7	-171.4	179.7	178.5	0	111.6	K392 I393 F401 T402	K392-K404 VanDerWaalsContact CA-O 3.25Å; K392-K404 WeakPolarHBondContact CA-O 3.48Å; I393-K404 HydrophobicContact CD1-CB 4.38Å; I393-K404 PolarHBondContact N-O 3Å; F401-K404 HydrophobicContact CD1-CD 4.04Å; F401-K404 WeakPolarHBondContact O-CB 3.33Å; F401-K404 PolarHBondContact O-N 3.38Å; T402-K404 PolarHBondContact O-N 3.41Å
405	T	84.1	Confident	78.5	Confident	88 Å²	88	73.5 Å²	73.5	54%	0.54	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-70.9	141.5	176.6	44.2	0	0	0	0	111.1	V390 Y391	V390-T405 HydrophobicContact CG1-CG2 3.71Å; Y391-T405 VanDerWaalsContact O-CA 3.3Å; Y391-T405 WeakPolarHBondContact O-CA 3.38Å
406	C	83	Confident	78.6	Confident	23 Å²	23	75.7 Å²	75.7	16%	0.155	44%	0.441	C	S	.	.			trans	-140.6	159	-179.1	56.1	0	0	0	0	110.1	Y391 I393 F411 C425	Y391-C406 WeakPolarHBondContact CB-O 3.38Å; Y391-C406 PolarHBondContact O-N 3.29Å; I393-C406 HydrophobicContact CD1-CB 4.26Å; I393-C406 HydrophobicContact CG1-CB 3.71Å; C406-F411 HydrophobicContact CB-CD2 3.96Å; C406-C425 VanDerWaalsContact C-SG 3.55Å; C406-C425 HydrophobicContact CB-CB 3.9Å; C406-C425 WeakPolarHBondContact CB-SG 3.21Å; C406-C425 WeakPolarHBondContact SG-CA 3.35Å; C406-C425 WeakPolarHBondContact SG-CB 3.31Å; C406-C425 CovalentContact SG-SG 2.02Å; C406-C425 PolarHBondContact SG-SG 3.02Å
407	N	82.8	Confident	79.3	Confident	79 Å²	79	70.1 Å²	70.1	42%	0.422	41%	0.414	S	S	.	.			trans	-104.9	122.2	168.5	178.8	-18.1	0	0	0	108.2	E409 T410 F411	N407-E409 PolarHBondContact O-N 2.95Å; N407-E409 VanDerWaalsContact O-N 3.15Å; N407-E409 PolarHBondContact OD1-N 3.4Å; N407-T410 PolarHBondContact O-N 2.73Å; N407-F411 VanDerWaalsContact O-CB 3.23Å; N407-F411 WeakPolarHBondContact O-CB 3.38Å; N407-F411 PolarHBondContact O-N 2.88Å
408	P	79.1	Confident	79.8	Confident	47 Å²	47	76.9 Å²	76.9	31%	0.305	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.7	-175.7	22.8	-33.9	0	0	0	113.9	Y391	Y391-P408 HydrophobicContact CD1-CB 4.4Å; Y391-P408 HydrophobicContact CD1-CG 3.9Å; Y391-P408 HydrophobicContact CD2-CG 4.35Å; Y391-P408 HydrophobicContact CE1-CG 3.89Å; Y391-P408 HydrophobicContact CE2-CG 4.35Å; Y391-P408 HydrophobicContact CG-CG 4.16Å
409	E	79.6	Confident	80.4	Confident	169 Å²	169	75.6 Å²	75.6	79%	0.79	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-36.8	-179.9	-63.2	-172.1	163.6	0	0	112.8	N407	N407-E409 PolarHBondContact O-N 2.95Å; N407-E409 VanDerWaalsContact O-N 3.15Å; N407-E409 PolarHBondContact OD1-N 3.4Å
410	T	83.1	Confident	80.5	Confident	77 Å²	77	75.2 Å²	75.2	47%	0.472	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-16.2	-175.1	61.5	0	0	0	0	113.3	N407 P412 S413 S414	N407-T410 PolarHBondContact O-N 2.73Å; T410-P412 VanDerWaalsContact C-CD 3.46Å; T410-S413 PolarHBondContact O-N 3.21Å; T410-S413 PolarHBondContact O-OG 2.99Å; T410-S414 PolarHBondContact O-N 3.19Å
411	F	81.7	Confident	80.1	Confident	16 Å²	16	75.2 Å²	75.2	7%	0.07	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-56.6	-42.7	-178.4	-177.9	-102.6	0	0	0	114.4	I393 C406 N407 S413 S414 E416 S417 A423 C425	I393-F411 HydrophobicContact CD1-CD2 4.35Å; I393-F411 HydrophobicContact CD1-CE2 3.66Å; I393-F411 HydrophobicContact CG1-CD2 4.31Å; I393-F411 HydrophobicContact CG1-CE2 3.69Å; I393-F411 HydrophobicContact CG1-CZ 4.33Å; I393-F411 HydrophobicContact CG2-CE2 4.28Å; I393-F411 HydrophobicContact CG2-CZ 4.18Å; C406-F411 HydrophobicContact CB-CD2 3.96Å; N407-F411 VanDerWaalsContact O-CB 3.23Å; N407-F411 WeakPolarHBondContact O-CB 3.38Å; N407-F411 PolarHBondContact O-N 2.88Å; F411-S413 PolarHBondContact O-N 3.49Å; F411-S413 VanDerWaalsContact O-N 3.07Å; F411-S414 WeakPolarHBondContact O-CB 3.48Å; F411-S414 PolarHBondContact O-N 2.89Å; F411-S414 PolarHBondContact O-OG 3.28Å; F411-E416 HydrophobicContact CE2-CB 4.36Å; F411-S417 WeakPolarHBondContact O-CB 3.26Å; F411-A423 VanDerWaalsContact CE1-O 3.32Å; F411-A423 WeakPolarHBondContact CE1-O 3.35Å; F411-A423 HydrophobicContact CZ-CB 4.23Å; F411-C425 HydrophobicContact CB-CB 3.82Å; F411-C425 HydrophobicContact CD1-CB 3.68Å; F411-C425 HydrophobicContact CD2-CB 4.1Å; F411-C425 HydrophobicContact CE1-CB 4.27Å; F411-C425 HydrophobicContact CG-CB 3.58Å
412	P	78.9	Confident	79.7	Confident	95 Å²	95	76.7 Å²	76.7	62%	0.617	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-60.6	-24.3	-179.4	-23.1	34	0	0	0	114.1	T410	T410-P412 VanDerWaalsContact C-CD 3.46Å
413	S	79.4	Confident	79.7	Confident	84 Å²	84	74.3 Å²	74.3	59%	0.587	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-98.4	-2	178.2	48.6	0	0	0	0	114	T410 F411	T410-S413 PolarHBondContact O-N 3.21Å; T410-S413 PolarHBondContact O-OG 2.99Å; F411-S413 PolarHBondContact O-N 3.49Å; F411-S413 VanDerWaalsContact O-N 3.07Å
414	S	82.4	Confident	79.7	Confident	21 Å²	21	74.2 Å²	74.2	15%	0.147	39%	0.394	C	S	.	.	S	Bend	trans	-82.7	160.7	-170.7	93.3	0	0	0	0	112.7	T410 F411 E416 S417 R418	T410-S414 PolarHBondContact O-N 3.19Å; F411-S414 WeakPolarHBondContact O-CB 3.48Å; F411-S414 PolarHBondContact O-N 2.89Å; F411-S414 PolarHBondContact O-OG 3.28Å; S414-E416 VanDerWaalsContact C-N 3.25Å; S414-E416 WeakPolarHBondContact CB-OE2 3.38Å; S414-E416 PolarHBondContact O-N 2.92Å; S414-E416 PolarHBondContact OG-N 3.45Å; S414-E416 PolarHBondContact OG-OE2 3.49Å; S414-S417 PolarHBondContact O-N 3.29Å; S414-S417 PolarHBondContact OG-N 3.34Å; S414-R418 PolarHBondContact O-N 2.93Å
415	N	81.1	Confident	79.6	Confident	98 Å²	98	69.8 Å²	69.8	52%	0.524	38%	0.377	S	S	.	.	H	α-helix	trans	-68.9	-30	-179.7	-158.4	18.7	0	0	0	111.4	R418 Q419	N415-R418 PolarHBondContact O-N 3.29Å; N415-Q419 WeakPolarHBondContact O-CG 3.35Å; N415-Q419 PolarHBondContact O-N 3.26Å
416	E	80.1	Confident	79.1	Confident	73 Å²	73	66.8 Å²	66.8	34%	0.341	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-42.3	175.8	-57.9	77.7	-171.7	0	0	111.5	I393 F401 F411 S414 R418 Q419 C420	I393-E416 HydrophobicContact CD1-CB 4.22Å; F401-E416 HydrophobicContact CD1-CB 4.42Å; F401-E416 HydrophobicContact CD1-CG 3.77Å; F401-E416 HydrophobicContact CE1-CG 4.13Å; F401-E416 HydrophobicContact CG-CB 4.34Å; F401-E416 HydrophobicContact CG-CG 4.17Å; F411-E416 HydrophobicContact CE2-CB 4.36Å; S414-E416 VanDerWaalsContact C-N 3.25Å; S414-E416 WeakPolarHBondContact CB-OE2 3.38Å; S414-E416 PolarHBondContact O-N 2.92Å; S414-E416 PolarHBondContact OG-N 3.45Å; S414-E416 PolarHBondContact OG-OE2 3.49Å; E416-R418 VanDerWaalsContact C-N 3.28Å; E416-R418 PolarHBondContact O-N 3.48Å; E416-Q419 PolarHBondContact O-N 2.94Å; E416-C420 PolarHBondContact O-N 2.96Å
417	S	79.1	Confident	78.6	Confident	27 Å²	27	67.2 Å²	67.2	19%	0.189	36%	0.356	C	S	.	.	H	α-helix	trans	-67.4	-28.5	174.9	178.1	0	0	0	0	112.5	F411 S414 C420 P421	F411-S417 WeakPolarHBondContact O-CB 3.26Å; S414-S417 PolarHBondContact O-N 3.29Å; S414-S417 PolarHBondContact OG-N 3.34Å; S417-C420 CarbonylContact O-C 3.43Å; S417-P421 WeakPolarHBondContact O-CA 3.47Å
418	R	79.9	Confident	78.1	Confident	192 Å²	192	63.9 Å²	63.9	73%	0.725	34%	0.339	S	S	*	.	H	α-helix	trans	-73.8	-35.5	174.5	-67.3	179.5	-177.9	179	0.6	112.8	S414 N415 E416	S414-R418 PolarHBondContact O-N 2.93Å; N415-R418 PolarHBondContact O-N 3.29Å; E416-R418 VanDerWaalsContact C-N 3.28Å; E416-R418 PolarHBondContact O-N 3.48Å
419	Q	81.8	Confident	77.6	Confident	113 Å²	113	65 Å²	65	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-80.2	-29.8	179.2	-71.7	179.9	6.6	0	0	112.6	F401 N415 E416	F401-Q419 HydrophobicContact CE2-CB 4.16Å; N415-Q419 WeakPolarHBondContact O-CG 3.35Å; N415-Q419 PolarHBondContact O-N 3.26Å; E416-Q419 PolarHBondContact O-N 2.94Å
420	C	79.1	Confident	77.2	Confident	7 Å²	7	60.1 Å²	60.1	5%	0.047	31%	0.314	C	S	.	.			trans	-123	84.9	173.8	-59.1	0	0	0	0	109.8	C399 E416 S417 N422 A423	C399-C420 HydrophobicContact CB-CB 3.91Å; C399-C420 WeakPolarHBondContact CB-SG 3.41Å; C399-C420 WeakPolarHBondContact SG-CB 3.48Å; C399-C420 CovalentContact SG-SG 2.03Å; C399-C420 PolarHBondContact SG-SG 3.33Å; E416-C420 PolarHBondContact O-N 2.96Å; S417-C420 CarbonylContact O-C 3.43Å; C420-N422 PolarHBondContact O-N 3.32Å; C420-N422 VanDerWaalsContact O-N 3.16Å; C420-A423 HydrophobicContact CB-CB 3.6Å; C420-A423 WeakPolarHBondContact O-CB 3.36Å; C420-A423 PolarHBondContact O-N 3.49Å
421	P	72.4	Confident	76.5	Confident	104 Å²	104	56.8 Å²	56.8	68%	0.675	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19	-174.2	24.9	-33.8	0	0	0	113.7	S417	S417-P421 WeakPolarHBondContact O-CA 3.47Å
422	N	72.1	Confident	75.8	Confident	68 Å²	68	57.4 Å²	57.4	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-5.2	177.6	-61.3	-34.2	0	0	0	113.3	C420	C420-N422 PolarHBondContact O-N 3.32Å; C420-N422 VanDerWaalsContact O-N 3.16Å
423	A	76.3	Confident	75.3	Confident	8 Å²	8	60.4 Å²	60.4	7%	0.066	31%	0.312	C	S	.	.			trans	-79.9	146.9	-175.1	0	0	0	0	0	111.7	I393 F394 D395 F411 C420	I393-A423 HydrophobicContact CG2-CB 3.59Å; F394-A423 CarbonylContact O-C 3.59Å; F394-A423 WeakPolarHBondContact O-CA 3.49Å; D395-A423 HydrophobicContact CB-CB 4.02Å; F411-A423 VanDerWaalsContact CE1-O 3.32Å; F411-A423 WeakPolarHBondContact CE1-O 3.35Å; F411-A423 HydrophobicContact CZ-CB 4.23Å; C420-A423 HydrophobicContact CB-CB 3.6Å; C420-A423 WeakPolarHBondContact O-CB 3.36Å; C420-A423 PolarHBondContact O-N 3.49Å
424	R	75.9	Confident	75.1	Confident	55 Å²	55	59 Å²	59	21%	0.208	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.3	-176.5	-52.2	-170.1	-155.1	156.9	16.6	111.5	R152 D153 I393 F394 Q426	R152-R424 VanDerWaalsContact C-NH2 3.35Å; R152-R424 PolarHBondContact O-NH2 3.49Å; D153-R424 VanDerWaalsContact C-NH1 3.34Å; D153-R424 PolarHBondContact O-NE 3.39Å; D153-R424 PolarHBondContact O-NH1 2.94Å; D153-R424 PolarHBondContact O-NH2 3.46Å; I393-R424 CarbonylContact C-O 3.55Å; I393-R424 WeakPolarHBondContact CA-O 3.48Å; F394-R424 PolarHBondContact N-O 3.23Å; F394-R424 PolarHBondContact O-N 2.69Å; R424-Q426 HydrophobicContact CB-CG 4.16Å; R424-Q426 PolarHBondContact O-N 3.05Å
425	C	79.8	Confident	74.7	Confident	22 Å²	22	61 Å²	61	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	109.8	170.1	-170.7	0	0	0	0	109.9	C406 F411	C406-C425 VanDerWaalsContact C-SG 3.55Å; C406-C425 HydrophobicContact CB-CB 3.9Å; C406-C425 WeakPolarHBondContact CB-SG 3.21Å; C406-C425 WeakPolarHBondContact SG-CA 3.35Å; C406-C425 WeakPolarHBondContact SG-CB 3.31Å; C406-C425 CovalentContact SG-SG 2.02Å; C406-C425 PolarHBondContact SG-SG 3.02Å; F411-C425 HydrophobicContact CB-CB 3.82Å; F411-C425 HydrophobicContact CD1-CB 3.68Å; F411-C425 HydrophobicContact CD2-CB 4.1Å; F411-C425 HydrophobicContact CE1-CB 4.27Å; F411-C425 HydrophobicContact CG-CB 3.58Å
426	Q	74	Confident	74.6	Confident	24 Å²	24	58.7 Å²	58.7	11%	0.112	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.1	-179.1	-61.6	-176.5	-5.3	0	0	110.9	Y391 K392 F394 R424 A428	Y391-Q426 CarbonylContact C-O 3.54Å; Y391-Q426 VanDerWaalsContact CA-O 3.27Å; Y391-Q426 WeakPolarHBondContact CA-O 3.36Å; K392-Q426 PolarHBondContact N-O 2.89Å; K392-Q426 PolarHBondContact O-N 3.27Å; F394-Q426 HydrophobicContact CD2-CB 3.82Å; F394-Q426 HydrophobicContact CD2-CG 4.39Å; F394-Q426 HydrophobicContact CE2-CB 4.03Å; R424-Q426 HydrophobicContact CB-CG 4.16Å; R424-Q426 PolarHBondContact O-N 3.05Å; Q426-A428 PolarHBondContact O-N 3.25Å
427	F	73.1	Confident	74.4	Confident	33 Å²	33	56.2 Å²	56.2	15%	0.145	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	124	172.2	174	-94.3	0	0	0	109.8	S67 A389 Y391 F429 Y430	S67-F427 WeakPolarHBondContact O-CB 3.34Å; S67-F427 PolarHBondContact O-N 3.39Å; A389-F427 HydrophobicContact CB-CD2 3.94Å; A389-F427 HydrophobicContact CB-CE2 3.72Å; Y391-F427 VanDerWaalsContact CD1-CA 3.5Å; Y391-F427 HydrophobicContact CD1-CB 3.96Å; Y391-F427 VanDerWaalsContact CD1-N 3.32Å; Y391-F427 HydrophobicContact CE1-CB 3.84Å; Y391-F427 HydrophobicContact CE1-CD2 4.48Å; F427-F429 VanDerWaalsContact CZ-C 3.49Å; F427-Y430 HydrophobicContact CE1-CE2 4.41Å; F427-Y430 HydrophobicContact CE2-CD1 4.19Å; F427-Y430 HydrophobicContact CE2-CD2 4.28Å; F427-Y430 HydrophobicContact CE2-CE1 4.05Å; F427-Y430 HydrophobicContact CE2-CE2 4.13Å; F427-Y430 HydrophobicContact CE2-CG 4.3Å; F427-Y430 HydrophobicContact CZ-CD1 4.32Å; F427-Y430 AromaticContact CZ-CD2 3.6Å; F427-Y430 HydrophobicContact CZ-CD2 3.6Å; F427-Y430 HydrophobicContact CZ-CE1 4.28Å; F427-Y430 AromaticContact CZ-CE2 3.54Å; F427-Y430 HydrophobicContact CZ-CE2 3.54Å; F427-Y430 AromaticContact CZ-CG 3.99Å; F427-Y430 HydrophobicContact CZ-CG 3.99Å; F427-Y430 AromaticContact CZ-CZ 3.9Å
428	A	70.8	Confident	74.4	Confident	8 Å²	8	64.4 Å²	64.4	7%	0.066	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-61.7	179.9	0	0	0	0	0	110.7	V390 K392 F394 Q426	V390-A428 WeakPolarHBondContact O-CB 3.43Å; V390-A428 PolarHBondContact O-N 3.27Å; K392-A428 HydrophobicContact CB-CB 4.01Å; K392-A428 HydrophobicContact CD-CB 4Å; K392-A428 HydrophobicContact CG-CB 3.86Å; F394-A428 HydrophobicContact CE2-CB 4.48Å; F394-A428 HydrophobicContact CZ-CB 4.37Å; Q426-A428 PolarHBondContact O-N 3.25Å
429	F	69.6	Low	74.6	Confident	71 Å²	71	57.4 Å²	57.4	31%	0.311	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	167.9	179.9	59.9	-87.6	0	0	0	111.3	Q103 V390 F427 G431	Q103-F429 HydrophobicContact CG-CD1 4.41Å; V390-F429 WeakPolarHBondContact CB-O 3.43Å; V390-F429 PolarHBondContact N-O 2.89Å; V390-F429 PolarHBondContact O-N 3.32Å; F427-F429 VanDerWaalsContact CZ-C 3.49Å; F429-G431 PolarHBondContact O-N 3.08Å
430	Y	69.8	Low	74.7	Confident	66 Å²	66	53 Å²	53	26%	0.259	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	111.4	169.6	-70.3	-75.7	0	0	0	110.1	K60 T65 N387 E388 A389 F427	K60-Y430 HydrophobicContact CD-CD1 4.15Å; K60-Y430 HydrophobicContact CD-CE1 3.86Å; K60-Y430 HydrophobicContact CG-CE1 4.33Å; T65-Y430 PolarHBondContact OG1-OH 3.4Å; N387-Y430 PolarHBondContact ND2-O 3.45Å; E388-Y430 CarbonylContact O-C 3.3Å; E388-Y430 WeakPolarHBondContact O-CA 3.26Å; A389-Y430 HydrophobicContact CB-CD1 4.31Å; A389-Y430 HydrophobicContact CB-CE1 4.08Å; F427-Y430 HydrophobicContact CE1-CE2 4.41Å; F427-Y430 HydrophobicContact CE2-CD1 4.19Å; F427-Y430 HydrophobicContact CE2-CD2 4.28Å; F427-Y430 HydrophobicContact CE2-CE1 4.05Å; F427-Y430 HydrophobicContact CE2-CE2 4.13Å; F427-Y430 HydrophobicContact CE2-CG 4.3Å; F427-Y430 HydrophobicContact CZ-CD1 4.32Å; F427-Y430 AromaticContact CZ-CD2 3.6Å; F427-Y430 HydrophobicContact CZ-CD2 3.6Å; F427-Y430 HydrophobicContact CZ-CE1 4.28Å; F427-Y430 AromaticContact CZ-CE2 3.54Å; F427-Y430 HydrophobicContact CZ-CE2 3.54Å; F427-Y430 AromaticContact CZ-CG 3.99Å; F427-Y430 HydrophobicContact CZ-CG 3.99Å; F427-Y430 AromaticContact CZ-CZ 3.9Å
431	G	69.4	Low	75	Confident	8 Å²	8	58.8 Å²	58.8	8%	0.082	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	-165.4	178.8	0	0	0	0	0	111.8	E388 F429	E388-G431 CarbonylContact C-O 3.37Å; E388-G431 WeakPolarHBondContact CA-O 3.43Å; E388-G431 PolarHBondContact N-O 2.86Å; E388-G431 PolarHBondContact O-N 3.36Å; F429-G431 PolarHBondContact O-N 3.08Å
432	G	67.5	Low	75.8	Confident	29 Å²	29	55.9 Å²	55.9	30%	0.299	31%	0.307	S	S	.	.			trans	177.1	156.9	172	0	0	0	0	0	111.5	H437	G432-H437 VanDerWaalsContact CA-CD2 3.43Å; G432-H437 WeakPolarHBondContact CA-CD2 3.45Å; G432-H437 VanDerWaalsContact O-CB 3.31Å; G432-H437 WeakPolarHBondContact O-CB 3.14Å
433	E	68.4	Low	76.7	Confident	157 Å²	157	54.4 Å²	54.4	73%	0.734	30%	0.299	S	S	*	.			trans	-98.5	-6.5	-175.2	-65.1	-171.2	166.9	0	0	113.5
434	S	74.5	Confident	77.4	Confident	56 Å²	56	56.1 Å²	56.1	39%	0.392	31%	0.306	S	S	.	.	S	Bend	trans	-63.3	156	-179.4	83.6	0	0	0	0	112.5	Y436 H437 R438	S434-Y436 PolarHBondContact O-N 3.29Å; S434-Y436 VanDerWaalsContact O-N 3.17Å; S434-Y436 PolarHBondContact OG-N 3.07Å; S434-H437 PolarHBondContact O-N 3.48Å; S434-H437 VanDerWaalsContact O-N 3.08Å; S434-H437 PolarHBondContact OG-CD2 2.88Å; S434-H437 PolarHBondContact OG-N 3.04Å; S434-R438 PolarHBondContact O-N 3.27Å
435	G	74.6	Confident	78.1	Confident	61 Å²	61	57.8 Å²	57.8	63%	0.629	32%	0.318	S	S	*	.	H	α-helix	trans	-56.5	-30.5	176.1	0	0	0	0	0	113.2	A439	G435-A439 WeakPolarHBondContact O-CB 3.43Å; G435-A439 PolarHBondContact O-N 2.83Å; G435-A439 VanDerWaalsContact O-N 3.12Å
436	Y	78.6	Confident	78.7	Confident	50 Å²	50	59.8 Å²	59.8	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-46.5	174.1	171.8	-101.9	0	0	0	112.5	I51 H55 S386 S434 R438 A439 L440 L443	I51-Y436 HydrophobicContact CG2-CD2 4.3Å; I51-Y436 HydrophobicContact CG2-CE2 3.53Å; H55-Y436 HydrophobicContact CB-CE1 4.44Å; S386-Y436 VanDerWaalsContact CB-OH 3.24Å; S386-Y436 WeakPolarHBondContact CB-OH 3.25Å; S386-Y436 PolarHBondContact OG-OH 2.95Å; S434-Y436 PolarHBondContact O-N 3.29Å; S434-Y436 VanDerWaalsContact O-N 3.17Å; S434-Y436 PolarHBondContact OG-N 3.07Å; Y436-R438 VanDerWaalsContact C-N 3.31Å; Y436-R438 PolarHBondContact O-N 2.89Å; Y436-A439 CarbonylContact O-C 3.33Å; Y436-A439 WeakPolarHBondContact O-CA 3.24Å; Y436-A439 WeakPolarHBondContact O-CB 3.33Å; Y436-A439 PolarHBondContact O-N 3.08Å; Y436-L440 HydrophobicContact CE1-CD1 4.22Å; Y436-L440 PolarHBondContact O-N 3.29Å; Y436-L440 VanDerWaalsContact O-N 3.07Å; Y436-L443 HydrophobicContact CD2-CD1 4.32Å; Y436-L443 HydrophobicContact CE2-CD1 3.86Å
437	H	76.3	Confident	79.7	Confident	22 Å²	22	58.6 Å²	58.6	10%	0.102	32%	0.319	C	S	.	.	H	α-helix	trans	-66.2	-33.4	179.7	-64.2	-62.2	0	0	0	112.5	S386 N387 G432 S434 A439 L440	S386-H437 PolarHBondContact O-CE1 3.45Å; N387-H437 PolarHBondContact OD1-ND1 2.99Å; G432-H437 VanDerWaalsContact CA-CD2 3.43Å; G432-H437 WeakPolarHBondContact CA-CD2 3.45Å; G432-H437 VanDerWaalsContact O-CB 3.31Å; G432-H437 WeakPolarHBondContact O-CB 3.14Å; S434-H437 PolarHBondContact O-N 3.48Å; S434-H437 VanDerWaalsContact O-N 3.08Å; S434-H437 PolarHBondContact OG-CD2 2.88Å; S434-H437 PolarHBondContact OG-N 3.04Å; H437-A439 VanDerWaalsContact C-N 3.31Å; H437-L440 WeakPolarHBondContact O-CB 3.44Å; H437-L440 PolarHBondContact O-N 3.29Å
438	R	78.3	Confident	80.7	Confident	199 Å²	199	58.5 Å²	58.5	75%	0.751	32%	0.324	S	S	*	.	H	α-helix	trans	-67.2	-33.3	171.4	-64.5	-175.2	-171.7	177.7	2	112.1	S434 Y436 L440	S434-R438 PolarHBondContact O-N 3.27Å; Y436-R438 VanDerWaalsContact C-N 3.31Å; Y436-R438 PolarHBondContact O-N 2.89Å; R438-L440 VanDerWaalsContact C-N 3.34Å
439	A	84.6	Confident	81.9	Confident	45 Å²	45	60.2 Å²	60.2	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-79.7	-11.4	178.3	0	0	0	0	0	114	G435 Y436 H437 L441 G442 L443	G435-A439 WeakPolarHBondContact O-CB 3.43Å; G435-A439 PolarHBondContact O-N 2.83Å; G435-A439 VanDerWaalsContact O-N 3.12Å; Y436-A439 CarbonylContact O-C 3.33Å; Y436-A439 WeakPolarHBondContact O-CA 3.24Å; Y436-A439 WeakPolarHBondContact O-CB 3.33Å; Y436-A439 PolarHBondContact O-N 3.08Å; H437-A439 VanDerWaalsContact C-N 3.31Å; A439-L441 VanDerWaalsContact C-N 3.32Å; A439-L441 PolarHBondContact O-N 3.47Å; A439-G442 CarbonylContact O-C 3.57Å; A439-G442 WeakPolarHBondContact O-CA 3.34Å; A439-G442 PolarHBondContact O-N 3.31Å; A439-L443 PolarHBondContact O-N 3.28Å
440	L	84.6	Confident	83.2	Confident	21 Å²	21	56.8 Å²	56.8	11%	0.11	32%	0.315	C	S	.	.	H	α-helix	trans	-56	-42.2	-173.4	-161.1	82.8	0	0	0	113.7	L383 S386 Y436 H437 R438 G442 L443 Q444	L383-L440 HydrophobicContact CD2-CD1 4.23Å; L383-L440 WeakPolarHBondContact O-CD1 3.4Å; S386-L440 WeakPolarHBondContact OG-CD1 3.32Å; Y436-L440 HydrophobicContact CE1-CD1 4.22Å; Y436-L440 PolarHBondContact O-N 3.29Å; Y436-L440 VanDerWaalsContact O-N 3.07Å; H437-L440 WeakPolarHBondContact O-CB 3.44Å; H437-L440 PolarHBondContact O-N 3.29Å; R438-L440 VanDerWaalsContact C-N 3.34Å; L440-G442 VanDerWaalsContact C-N 3.31Å; L440-G442 PolarHBondContact O-N 2.9Å; L440-L443 PolarHBondContact O-N 3.39Å; L440-Q444 WeakPolarHBondContact O-CG 3.43Å; L440-Q444 PolarHBondContact O-N 3.37Å
441	L	84.3	Confident	84.5	Confident	128 Å²	128	55.6 Å²	55.6	67%	0.67	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-41.8	176.3	-179.1	63.6	0	0	0	111.1	A439 Q444 I445	A439-L441 VanDerWaalsContact C-N 3.32Å; A439-L441 PolarHBondContact O-N 3.47Å; L441-Q444 PolarHBondContact O-N 3.3Å; L441-I445 HydrophobicContact CD1-CD1 4.41Å; L441-I445 HydrophobicContact CG-CD1 4.1Å; L441-I445 VanDerWaalsContact O-CG1 3.3Å; L441-I445 WeakPolarHBondContact O-CG1 3.2Å; L441-I445 PolarHBondContact O-N 3.28Å
442	G	88.9	Confident	85.8	Confident	42 Å²	42	57.3 Å²	57.3	43%	0.433	32%	0.316	S	S	.	.	H	α-helix	trans	-62.3	-42.1	174.9	0	0	0	0	0	112.2	A439 L440 Q444 I445 F446	A439-G442 CarbonylContact O-C 3.57Å; A439-G442 WeakPolarHBondContact O-CA 3.34Å; A439-G442 PolarHBondContact O-N 3.31Å; L440-G442 VanDerWaalsContact C-N 3.31Å; L440-G442 PolarHBondContact O-N 2.9Å; G442-Q444 PolarHBondContact O-N 3.04Å; G442-I445 PolarHBondContact O-N 3.15Å; G442-F446 WeakPolarHBondContact O-CB 3.48Å; G442-F446 PolarHBondContact O-N 2.92Å
443	L	91.6	Very high	87.2	Confident	37 Å²	37	56 Å²	56	19%	0.194	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-38	175.9	-65.1	177.7	0	0	0	112.3	V48 L383 Y436 A439 L440 F446 N447	V48-L443 HydrophobicContact CG1-CD2 4.29Å; V48-L443 HydrophobicContact CG2-CD2 3.94Å; L383-L443 HydrophobicContact CD1-CB 4.14Å; L383-L443 HydrophobicContact CD2-CB 4.01Å; L383-L443 HydrophobicContact CD2-CD1 4Å; Y436-L443 HydrophobicContact CD2-CD1 4.32Å; Y436-L443 HydrophobicContact CE2-CD1 3.86Å; A439-L443 PolarHBondContact O-N 3.28Å; L440-L443 PolarHBondContact O-N 3.39Å; L443-F446 PolarHBondContact O-N 3.34Å; L443-N447 VanDerWaalsContact O-CB 3.31Å; L443-N447 WeakPolarHBondContact O-CB 3.33Å; L443-N447 PolarHBondContact O-N 2.93Å
444	Q	90.5	Very high	88.6	Confident	45 Å²	45	49.9 Å²	49.9	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-41.2	174.9	-73.5	-73.6	13.3	0	0	112.3	A380 L383 L440 L441 G442 F446 N447 A448	A380-Q444 PolarHBondContact O-NE2 3.06Å; L383-Q444 HydrophobicContact CB-CG 4.27Å; L383-Q444 HydrophobicContact CD1-CG 4.35Å; L440-Q444 WeakPolarHBondContact O-CG 3.43Å; L440-Q444 PolarHBondContact O-N 3.37Å; L441-Q444 PolarHBondContact O-N 3.3Å; G442-Q444 PolarHBondContact O-N 3.04Å; Q444-F446 VanDerWaalsContact C-N 3.35Å; Q444-N447 PolarHBondContact O-N 3Å; Q444-A448 PolarHBondContact O-N 2.82Å
445	I	90.6	Very high	89.6	Confident	90 Å²	90	47.9 Å²	47.9	46%	0.462	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-43.9	174.3	-68.2	166.6	0	0	0	110.1	L441 G442 A448 F449	L441-I445 HydrophobicContact CD1-CD1 4.41Å; L441-I445 HydrophobicContact CG-CD1 4.1Å; L441-I445 VanDerWaalsContact O-CG1 3.3Å; L441-I445 WeakPolarHBondContact O-CG1 3.2Å; L441-I445 PolarHBondContact O-N 3.28Å; G442-I445 PolarHBondContact O-N 3.15Å; I445-A448 PolarHBondContact O-N 3.25Å; I445-F449 WeakPolarHBondContact O-CB 3.38Å; I445-F449 PolarHBondContact O-N 3.12Å
446	F	93.9	Very high	90.7	Very high	63 Å²	63	45.5 Å²	45.5	28%	0.276	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-43.6	175.5	177.4	-106	0	0	0	112	Y45 V48 G442 L443 Q444 A448 F449 M450	Y45-F446 HydrophobicContact CD2-CE1 4.11Å; V48-F446 HydrophobicContact CG2-CD1 4.01Å; V48-F446 HydrophobicContact CG2-CE1 3.96Å; G442-F446 WeakPolarHBondContact O-CB 3.48Å; G442-F446 PolarHBondContact O-N 2.92Å; L443-F446 PolarHBondContact O-N 3.34Å; Q444-F446 VanDerWaalsContact C-N 3.35Å; F446-A448 PolarHBondContact O-N 3.46Å; F446-F449 WeakPolarHBondContact O-CB 3.42Å; F446-F449 PolarHBondContact O-N 3.5Å; F446-F449 VanDerWaalsContact O-N 3.16Å; F446-M450 HydrophobicContact CD1-CG 4.3Å; F446-M450 HydrophobicContact CD2-CG 4.22Å; F446-M450 HydrophobicContact CE1-CG 3.84Å; F446-M450 HydrophobicContact CE2-CG 3.74Å; F446-M450 HydrophobicContact CE2-SD 3.91Å; F446-M450 HydrophobicContact CG-CG 4.48Å; F446-M450 HydrophobicContact CZ-CG 3.52Å; F446-M450 HydrophobicContact CZ-SD 3.91Å; F446-M450 WeakPolarHBondContact O-CG 3.26Å; F446-M450 PolarHBondContact O-N 2.83Å
447	N	95	Very high	91.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-45.6	174.8	176.9	42.6	0	0	0	111.8	Y45 W376 A380 L383 L443 Q444 M450 F451	Y45-N447 HydrophobicContact CE2-CB 4.23Å; Y45-N447 WeakPolarHBondContact CE2-OD1 3.3Å; Y45-N447 VanDerWaalsContact CZ-OD1 3.31Å; Y45-N447 PolarHBondContact OH-OD1 3.19Å; W376-N447 PolarHBondContact O-ND2 2.92Å; A380-N447 WeakPolarHBondContact CB-ND2 3.17Å; A380-N447 PolarHBondContact N-ND2 3.4Å; L383-N447 HydrophobicContact CD1-CB 4.27Å; L443-N447 VanDerWaalsContact O-CB 3.31Å; L443-N447 WeakPolarHBondContact O-CB 3.33Å; L443-N447 PolarHBondContact O-N 2.93Å; Q444-N447 PolarHBondContact O-N 3Å; N447-M450 PolarHBondContact O-N 2.64Å; N447-F451 PolarHBondContact O-N 2.88Å
448	A	93.6	Very high	92.6	Very high	31 Å²	31	43.9 Å²	43.9	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-39.5	174.8	0	0	0	0	0	112.3	Q444 I445 F446 F451 F452	Q444-A448 PolarHBondContact O-N 2.82Å; I445-A448 PolarHBondContact O-N 3.25Å; F446-A448 PolarHBondContact O-N 3.46Å; A448-F451 WeakPolarHBondContact O-CB 3.37Å; A448-F451 PolarHBondContact O-N 3.25Å; A448-F452 WeakPolarHBondContact O-CD2 3.46Å; A448-F452 PolarHBondContact O-N 3.02Å; A448-F452 VanDerWaalsContact O-N 3.14Å
449	F	96.1	Very high	93.4	Very high	43 Å²	43	38.1 Å²	38.1	19%	0.189	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-48.3	176.1	172.6	-92.6	0	0	0	112.7	I445 F446 F451 F452 W453 L508 I512 I515	I445-F449 WeakPolarHBondContact O-CB 3.38Å; I445-F449 PolarHBondContact O-N 3.12Å; F446-F449 WeakPolarHBondContact O-CB 3.42Å; F446-F449 PolarHBondContact O-N 3.5Å; F446-F449 VanDerWaalsContact O-N 3.16Å; F449-F451 VanDerWaalsContact C-N 3.28Å; F449-F451 PolarHBondContact O-N 2.83Å; F449-F452 PolarHBondContact O-N 3.49Å; F449-W453 HydrophobicContact CD1-CE3 4.3Å; F449-W453 HydrophobicContact CE1-CD2 4.3Å; F449-W453 AromaticContact CE1-CE3 3.37Å; F449-W453 HydrophobicContact CE1-CE3 3.37Å; F449-W453 AromaticContact CE1-CZ3 3.86Å; F449-W453 HydrophobicContact CE1-CZ3 3.86Å; F449-W453 HydrophobicContact CZ-CD2 4.38Å; F449-W453 AromaticContact CZ-CE3 3.78Å; F449-W453 HydrophobicContact CZ-CE3 3.78Å; F449-W453 HydrophobicContact CZ-CZ3 4.26Å; F449-W453 WeakPolarHBondContact O-CB 3.34Å; F449-W453 PolarHBondContact O-N 2.9Å; F449-L508 HydrophobicContact CE2-CD1 4.03Å; F449-L508 HydrophobicContact CZ-CD1 3.48Å; F449-L508 VanDerWaalsContact CZ-CD1 3.48Å; F449-I512 HydrophobicContact CE2-CG1 4.12Å; F449-I515 HydrophobicContact CB-CD1 3.32Å; F449-I515 HydrophobicContact CD2-CD1 3.33Å; F449-I515 HydrophobicContact CE2-CD1 4.49Å; F449-I515 HydrophobicContact CG-CD1 3.75Å
450	M	96.7	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-37.9	177.6	-71.2	-54	-58.8	0	0	111.8	A41 Y45 F446 N447 W453 L454	A41-M450 HydrophobicContact CB-CE 3.8Å; A41-M450 HydrophobicContact CB-SD 3.86Å; Y45-M450 HydrophobicContact CD1-CB 3.87Å; Y45-M450 HydrophobicContact CD1-CE 4.42Å; Y45-M450 HydrophobicContact CD1-CG 4.37Å; Y45-M450 HydrophobicContact CD2-CB 3.77Å; Y45-M450 HydrophobicContact CD2-CG 3.87Å; Y45-M450 HydrophobicContact CE1-CB 3.91Å; Y45-M450 HydrophobicContact CE2-CB 3.86Å; Y45-M450 HydrophobicContact CE2-CG 4.41Å; Y45-M450 HydrophobicContact CG-CB 3.79Å; Y45-M450 HydrophobicContact CG-CE 4.4Å; Y45-M450 HydrophobicContact CG-CG 3.86Å; F446-M450 HydrophobicContact CD1-CG 4.3Å; F446-M450 HydrophobicContact CD2-CG 4.22Å; F446-M450 HydrophobicContact CE1-CG 3.84Å; F446-M450 HydrophobicContact CE2-CG 3.74Å; F446-M450 HydrophobicContact CE2-SD 3.91Å; F446-M450 HydrophobicContact CG-CG 4.48Å; F446-M450 HydrophobicContact CZ-CG 3.52Å; F446-M450 HydrophobicContact CZ-SD 3.91Å; F446-M450 WeakPolarHBondContact O-CG 3.26Å; F446-M450 PolarHBondContact O-N 2.83Å; N447-M450 PolarHBondContact O-N 2.64Å; M450-W453 HydrophobicContact CE-CE3 4.36Å; M450-W453 PolarHBondContact O-N 3.31Å; M450-W453 HydrophobicContact SD-CE3 3.89Å; M450-W453 HydrophobicContact SD-CZ3 4.27Å; M450-L454 HydrophobicContact CE-CD1 4.29Å; M450-L454 HydrophobicContact CE-CG 4.27Å; M450-L454 WeakPolarHBondContact O-CB 3.3Å; M450-L454 VanDerWaalsContact O-CG 3.28Å; M450-L454 WeakPolarHBondContact O-CG 3.45Å; M450-L454 PolarHBondContact O-N 3.38Å
451	F	96.4	Very high	94.6	Very high	40 Å²	40	35.4 Å²	35.4	18%	0.175	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-53.3	173.3	169.6	-106.6	0	0	0	112.4	I373 W376 N447 A448 F449 W453 A455	I373-F451 HydrophobicContact CB-CE2 4.43Å; I373-F451 HydrophobicContact CG1-CE2 3.62Å; I373-F451 HydrophobicContact CG1-CZ 4.05Å; W376-F451 HydrophobicContact CB-CB 3.96Å; W376-F451 HydrophobicContact CB-CD2 3.74Å; W376-F451 HydrophobicContact CB-CG 4.06Å; W376-F451 VanDerWaalsContact CD1-CB 3.47Å; W376-F451 AromaticContact CD1-CG 3.96Å; W376-F451 HydrophobicContact CD2-CD2 4.38Å; W376-F451 HydrophobicContact CD2-CG 4.27Å; W376-F451 HydrophobicContact CG-CB 3.72Å; W376-F451 AromaticContact CG-CD2 3.91Å; W376-F451 HydrophobicContact CG-CD2 3.91Å; W376-F451 AromaticContact CG-CG 3.8Å; W376-F451 HydrophobicContact CG-CG 3.8Å; N447-F451 PolarHBondContact O-N 2.88Å; A448-F451 WeakPolarHBondContact O-CB 3.37Å; A448-F451 PolarHBondContact O-N 3.25Å; F449-F451 VanDerWaalsContact C-N 3.28Å; F449-F451 PolarHBondContact O-N 2.83Å; F451-W453 VanDerWaalsContact C-N 3.32Å; F451-W453 PolarHBondContact O-N 3.34Å; F451-A455 WeakPolarHBondContact O-CB 3.29Å; F451-A455 PolarHBondContact O-N 3.45Å
452	F	96.4	Very high	95.1	Very high	45 Å²	45	29.5 Å²	29.5	20%	0.197	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-41.5	178.9	-76.5	-65.7	0	0	0	111.7	A448 F449 N456 A511 Q514 I515 V518	A448-F452 WeakPolarHBondContact O-CD2 3.46Å; A448-F452 PolarHBondContact O-N 3.02Å; A448-F452 VanDerWaalsContact O-N 3.14Å; F449-F452 PolarHBondContact O-N 3.49Å; F452-N456 WeakPolarHBondContact O-CB 3.39Å; F452-N456 PolarHBondContact O-N 2.94Å; F452-N456 PolarHBondContact O-ND2 2.85Å; F452-A511 HydrophobicContact CB-CB 3.97Å; F452-Q514 HydrophobicContact CD1-CB 4.03Å; F452-Q514 VanDerWaalsContact CD1-OE1 3.27Å; F452-Q514 HydrophobicContact CE1-CB 4.31Å; F452-Q514 HydrophobicContact CG-CB 4.31Å; F452-I515 HydrophobicContact CD2-CD1 4.38Å; F452-I515 HydrophobicContact CD2-CG1 3.69Å; F452-I515 HydrophobicContact CE2-CG1 4.23Å; F452-V518 HydrophobicContact CE2-CG2 4.07Å; F452-V518 HydrophobicContact CZ-CG2 3.8Å
453	W	97.8	Very high	95.4	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-48	-178.7	-167.9	9.1	0	0	0	112.3	F37 L38 A41 F449 M450 F451 N456 F457 A504 L508 A511	F37-W453 AromaticContact CD1-CH2 3.23Å; F37-W453 HydrophobicContact CD1-CH2 3.23Å; F37-W453 AromaticContact CD1-CZ2 3.96Å; F37-W453 HydrophobicContact CD1-CZ2 3.96Å; F37-W453 HydrophobicContact CD1-CZ3 4.07Å; F37-W453 AromaticContact CE1-CH2 3.32Å; F37-W453 HydrophobicContact CE1-CH2 3.32Å; F37-W453 HydrophobicContact CE1-CZ2 4.24Å; F37-W453 AromaticContact CE1-CZ3 3.7Å; F37-W453 HydrophobicContact CE1-CZ3 3.7Å; F37-W453 HydrophobicContact CG-CH2 4.23Å; F37-W453 HydrophobicContact CZ-CH2 4.4Å; F37-W453 HydrophobicContact CZ-CZ3 4.49Å; L38-W453 HydrophobicContact CB-CH2 4.38Å; L38-W453 HydrophobicContact CB-CZ2 4.17Å; L38-W453 HydrophobicContact CD1-CD2 4.23Å; L38-W453 HydrophobicContact CD1-CH2 4.19Å; L38-W453 HydrophobicContact CD1-CZ2 3.87Å; A41-W453 HydrophobicContact CB-CE3 4.4Å; A41-W453 HydrophobicContact CB-CH2 4.07Å; A41-W453 HydrophobicContact CB-CZ3 3.53Å; F449-W453 HydrophobicContact CD1-CE3 4.3Å; F449-W453 HydrophobicContact CE1-CD2 4.3Å; F449-W453 AromaticContact CE1-CE3 3.37Å; F449-W453 HydrophobicContact CE1-CE3 3.37Å; F449-W453 AromaticContact CE1-CZ3 3.86Å; F449-W453 HydrophobicContact CE1-CZ3 3.86Å; F449-W453 HydrophobicContact CZ-CD2 4.38Å; F449-W453 AromaticContact CZ-CE3 3.78Å; F449-W453 HydrophobicContact CZ-CE3 3.78Å; F449-W453 HydrophobicContact CZ-CZ3 4.26Å; F449-W453 WeakPolarHBondContact O-CB 3.34Å; F449-W453 PolarHBondContact O-N 2.9Å; M450-W453 HydrophobicContact CE-CE3 4.36Å; M450-W453 PolarHBondContact O-N 3.31Å; M450-W453 HydrophobicContact SD-CE3 3.89Å; M450-W453 HydrophobicContact SD-CZ3 4.27Å; F451-W453 VanDerWaalsContact C-N 3.32Å; F451-W453 PolarHBondContact O-N 3.34Å; W453-N456 PolarHBondContact O-N 2.78Å; W453-F457 WeakPolarHBondContact O-CB 3.37Å; W453-F457 PolarHBondContact O-N 2.99Å; W453-A504 PolarHBondContact NE1-O 2.93Å; W453-L508 HydrophobicContact CD2-CD1 3.98Å; W453-L508 HydrophobicContact CE3-CD1 4.22Å; W453-L508 HydrophobicContact CH2-CD1 4.39Å; W453-L508 HydrophobicContact CZ2-CB 4.16Å; W453-L508 HydrophobicContact CZ2-CD1 4.1Å; W453-L508 HydrophobicContact CZ2-CD2 4.32Å; W453-L508 HydrophobicContact CZ2-CG 4.43Å; W453-L508 HydrophobicContact CZ3-CD1 4.41Å; W453-A511 HydrophobicContact CB-CB 3.93Å; W453-A511 HydrophobicContact CG-CB 4.46Å
454	L	97.4	Very high	95.7	Very high	28 Å²	28	28.2 Å²	28.2	15%	0.147	14%	0.144	C	C	.	.	H	α-helix	trans	-67.6	-39.3	178.2	-66.4	176.1	0	0	0	112.3	L38 I42 Y45 M450 F457 V458	L38-L454 HydrophobicContact CD1-CD2 4.12Å; I42-L454 HydrophobicContact CD1-CD2 4.07Å; I42-L454 HydrophobicContact CG1-CD2 3.94Å; Y45-L454 HydrophobicContact CD1-CD1 3.96Å; Y45-L454 HydrophobicContact CE1-CD1 4.01Å; M450-L454 HydrophobicContact CE-CD1 4.29Å; M450-L454 HydrophobicContact CE-CG 4.27Å; M450-L454 WeakPolarHBondContact O-CB 3.3Å; M450-L454 VanDerWaalsContact O-CG 3.28Å; M450-L454 WeakPolarHBondContact O-CG 3.45Å; M450-L454 PolarHBondContact O-N 3.38Å; L454-F457 WeakPolarHBondContact O-CB 3.43Å; L454-F457 PolarHBondContact O-N 3.03Å; L454-V458 WeakPolarHBondContact O-CG2 3.39Å; L454-V458 PolarHBondContact O-N 3.35Å
455	A	96.5	Very high	95.9	Very high	13 Å²	13	26.1 Å²	26.1	11%	0.107	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-45.2	175.5	0	0	0	0	0	111.7	L369 F451 F457 V458 L459	L369-A455 HydrophobicContact CD2-CB 3.9Å; F451-A455 WeakPolarHBondContact O-CB 3.29Å; F451-A455 PolarHBondContact O-N 3.45Å; A455-F457 VanDerWaalsContact C-N 3.33Å; A455-F457 PolarHBondContact O-N 3.16Å; A455-V458 PolarHBondContact O-N 2.93Å; A455-L459 WeakPolarHBondContact O-CG 3.26Å; A455-L459 PolarHBondContact O-N 2.69Å; A455-L459 VanDerWaalsContact O-N 3.1Å
456	N	97.4	Very high	96.2	Very high	11 Å²	11	22.2 Å²	22.2	6%	0.059	12%	0.115	C	C	.	.	H	α-helix	trans	-67.2	-33.6	175.7	-73	-55	0	0	0	112.4	F452 W453 L459 A460 A507 L510 Q514	F452-N456 WeakPolarHBondContact O-CB 3.39Å; F452-N456 PolarHBondContact O-N 2.94Å; F452-N456 PolarHBondContact O-ND2 2.85Å; W453-N456 PolarHBondContact O-N 2.78Å; N456-L459 PolarHBondContact O-N 2.72Å; N456-A460 VanDerWaalsContact O-CB 3.3Å; N456-A460 WeakPolarHBondContact O-CB 3.39Å; N456-A460 PolarHBondContact O-N 3.4Å; N456-A507 HydrophobicContact CB-CB 3.8Å; N456-L510 HydrophobicContact CB-CD2 4.43Å; N456-L510 WeakPolarHBondContact OD1-CD2 3.48Å; N456-Q514 PolarHBondContact ND2-OE1 3.04Å
457	F	97.6	Very high	96.3	Very high	26 Å²	26	19.2 Å²	19.2	11%	0.114	10%	0.102	C	C	.	.	H	α-helix	trans	-62.9	-45.4	174.5	177.7	-94.9	0	0	0	111.6	L38 W453 L454 A455 L459 A460 L461 T500 L503 A504 A507	L38-F457 HydrophobicContact CD2-CD2 3.85Å; L38-F457 HydrophobicContact CD2-CE2 3.73Å; L38-F457 HydrophobicContact CD2-CG 4.33Å; L38-F457 HydrophobicContact CD2-CZ 4.15Å; W453-F457 WeakPolarHBondContact O-CB 3.37Å; W453-F457 PolarHBondContact O-N 2.99Å; L454-F457 WeakPolarHBondContact O-CB 3.43Å; L454-F457 PolarHBondContact O-N 3.03Å; A455-F457 VanDerWaalsContact C-N 3.33Å; A455-F457 PolarHBondContact O-N 3.16Å; F457-L459 VanDerWaalsContact C-N 3.33Å; F457-L459 PolarHBondContact O-N 3.28Å; F457-A460 PolarHBondContact O-N 2.86Å; F457-L461 WeakPolarHBondContact O-CB 3.44Å; F457-L461 PolarHBondContact O-N 3.47Å; F457-T500 HydrophobicContact CE2-CG2 3.96Å; F457-T500 HydrophobicContact CZ-CG2 3.88Å; F457-L503 HydrophobicContact CD2-CB 3.98Å; F457-L503 HydrophobicContact CE2-CB 3.66Å; F457-A504 HydrophobicContact CD2-CB 4.31Å; F457-A504 HydrophobicContact CE2-CB 4.42Å; F457-A507 HydrophobicContact CB-CB 4.07Å
458	V	96.6	Very high	96.3	Very high	13 Å²	13	19.3 Å²	19.3	8%	0.079	10%	0.103	C	C	.	.	H	α-helix	trans	-60	-43.4	175.4	169.4	0	0	0	0	111.2	T365 L368 L369 L454 A455 L461 G462	T365-V458 HydrophobicContact CG2-CG1 4.12Å; L368-V458 HydrophobicContact CB-CB 4.49Å; L368-V458 HydrophobicContact CB-CG1 3.59Å; L368-V458 HydrophobicContact CB-CG2 3.99Å; L368-V458 HydrophobicContact CD1-CG1 4.13Å; L369-V458 HydrophobicContact CD2-CB 4.21Å; L369-V458 HydrophobicContact CD2-CG1 4.1Å; L369-V458 HydrophobicContact CG-CG1 4.05Å; L454-V458 WeakPolarHBondContact O-CG2 3.39Å; L454-V458 PolarHBondContact O-N 3.35Å; A455-V458 PolarHBondContact O-N 2.93Å; V458-L461 PolarHBondContact O-N 3.29Å; V458-G462 PolarHBondContact O-N 3.02Å
459	L	95.6	Very high	96.3	Very high	78 Å²	78	17.9 Å²	17.9	41%	0.408	9%	0.09	S	C	.	.	H	α-helix	trans	-63.5	-44.1	175.4	-68.4	175.4	0	0	0	112	T365 L369 A455 N456 F457 L461 G462 Q463	T365-L459 HydrophobicContact CG2-CD2 4Å; L369-L459 HydrophobicContact CD1-CD2 4.09Å; A455-L459 WeakPolarHBondContact O-CG 3.26Å; A455-L459 PolarHBondContact O-N 2.69Å; A455-L459 VanDerWaalsContact O-N 3.1Å; N456-L459 PolarHBondContact O-N 2.72Å; F457-L459 VanDerWaalsContact C-N 3.33Å; F457-L459 PolarHBondContact O-N 3.28Å; L459-L461 PolarHBondContact O-N 3.2Å; L459-G462 PolarHBondContact O-N 2.96Å; L459-Q463 WeakPolarHBondContact O-CG 2.92Å; L459-Q463 PolarHBondContact O-N 3.43Å
460	A	96.6	Very high	96.3	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-61.7	-42.9	178	0	0	0	0	0	111.7	N456 F457 G462 Q463 V464 L503 Y561	N456-A460 VanDerWaalsContact O-CB 3.3Å; N456-A460 WeakPolarHBondContact O-CB 3.39Å; N456-A460 PolarHBondContact O-N 3.4Å; F457-A460 PolarHBondContact O-N 2.86Å; A460-G462 VanDerWaalsContact C-N 3.26Å; A460-G462 PolarHBondContact O-N 2.71Å; A460-Q463 PolarHBondContact O-N 3.05Å; A460-Q463 VanDerWaalsContact O-N 3.11Å; A460-V464 PolarHBondContact O-N 3.27Å; A460-L503 HydrophobicContact CB-CD2 3.58Å; A460-L503 WeakPolarHBondContact O-CD2 3.23Å; A460-Y561 HydrophobicContact CB-CD2 4.22Å; A460-Y561 HydrophobicContact CB-CE1 4.11Å; A460-Y561 HydrophobicContact CB-CE2 3.47Å; A460-Y561 VanDerWaalsContact CB-CE2 3.47Å; A460-Y561 VanDerWaalsContact CB-CZ 3.43Å; A460-Y561 WeakPolarHBondContact CB-OH 3.26Å
461	L	96.6	Very high	96.1	Very high	7 Å²	7	15.8 Å²	15.8	4%	0.037	8%	0.081	C	C	.	.	H	α-helix	trans	-57.7	-41.8	176	178.4	60.7	0	0	0	110.9	F457 V458 L459 T465 F492 A495 L496 L503	F457-L461 WeakPolarHBondContact O-CB 3.44Å; F457-L461 PolarHBondContact O-N 3.47Å; V458-L461 PolarHBondContact O-N 3.29Å; L459-L461 PolarHBondContact O-N 3.2Å; L461-T465 VanDerWaalsContact O-CB 3.23Å; L461-T465 WeakPolarHBondContact O-CB 3.5Å; L461-T465 PolarHBondContact O-N 3.33Å; L461-T465 PolarHBondContact O-OG1 3.38Å; L461-F492 HydrophobicContact CD1-CD2 4.31Å; L461-F492 HydrophobicContact CD1-CE2 4.19Å; L461-F492 HydrophobicContact CD2-CE2 3.69Å; L461-F492 HydrophobicContact CD2-CZ 4.22Å; L461-F492 HydrophobicContact CG-CD2 4.38Å; L461-F492 HydrophobicContact CG-CE2 3.97Å; L461-A495 HydrophobicContact CD1-CB 3.8Å; L461-L496 HydrophobicContact CD1-CD2 3.83Å; L461-L496 HydrophobicContact CD1-CG 4.03Å; L461-L496 HydrophobicContact CD2-CD2 3.93Å; L461-L503 HydrophobicContact CD1-CD1 4.19Å
462	G	95.1	Very high	95.9	Very high	5 Å²	5	14.3 Å²	14.3	5%	0.052	8%	0.076	C	C	.	.	H	α-helix	trans	-63.5	-43	173.5	0	0	0	0	0	114.5	Y361 V458 L459 A460 T465 L466	Y361-G462 WeakPolarHBondContact OH-CA 3.35Å; V458-G462 PolarHBondContact O-N 3.02Å; L459-G462 PolarHBondContact O-N 2.96Å; A460-G462 VanDerWaalsContact C-N 3.26Å; A460-G462 PolarHBondContact O-N 2.71Å; G462-T465 PolarHBondContact O-N 2.92Å; G462-L466 WeakPolarHBondContact O-CB 3.46Å; G462-L466 WeakPolarHBondContact O-CG 3.18Å; G462-L466 PolarHBondContact O-N 3.25Å
463	Q	96.3	Very high	95.7	Very high	47 Å²	47	12.8 Å²	12.8	22%	0.22	7%	0.069	C	C	.	.	H	α-helix	trans	-64.4	-47.7	179.6	-69.4	179.3	-30.2	0	0	112	L459 A460 A467 Y561 M660	L459-Q463 WeakPolarHBondContact O-CG 2.92Å; L459-Q463 PolarHBondContact O-N 3.43Å; A460-Q463 PolarHBondContact O-N 3.05Å; A460-Q463 VanDerWaalsContact O-N 3.11Å; Q463-A467 WeakPolarHBondContact O-CB 3.45Å; Q463-A467 PolarHBondContact O-N 3.44Å; Q463-Y561 HydrophobicContact CB-CD2 4.04Å; Q463-M660 HydrophobicContact CB-CE 3.74Å; Q463-M660 HydrophobicContact CB-SD 4.27Å; Q463-M660 HydrophobicContact CG-CE 3.96Å; Q463-M660 HydrophobicContact CG-SD 3.78Å
464	V	96.3	Very high	95.5	Very high	5 Å²	5	13.5 Å²	13.5	3%	0.03	7%	0.072	C	C	.	.	H	α-helix	trans	-64.4	-40.8	177.6	174.2	0	0	0	0	111.5	A460 G468 A495 L503 Y561 A565	A460-V464 PolarHBondContact O-N 3.27Å; V464-G468 PolarHBondContact O-N 3.36Å; V464-A495 HydrophobicContact CB-CB 4.44Å; V464-A495 HydrophobicContact CG1-CB 3.85Å; V464-L503 HydrophobicContact CB-CD2 4.08Å; V464-L503 HydrophobicContact CG2-CD2 3.42Å; V464-L503 VanDerWaalsContact CG2-CD2 3.42Å; V464-L503 HydrophobicContact CG2-CG 4.34Å; V464-Y561 VanDerWaalsContact CG2-CB 3.49Å; V464-Y561 HydrophobicContact CG2-CD1 3.88Å; V464-Y561 HydrophobicContact CG2-CG 3.8Å; V464-A565 HydrophobicContact CG1-CB 4.14Å
465	T	95.9	Very high	95.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.4	-49.6	-179.8	-62.5	0	0	0	0	111.7	Y361 L461 G462 G468 A469 L488 A491 F492	Y361-T465 HydrophobicContact CD2-CG2 4.25Å; Y361-T465 HydrophobicContact CE2-CG2 3.61Å; L461-T465 VanDerWaalsContact O-CB 3.23Å; L461-T465 WeakPolarHBondContact O-CB 3.5Å; L461-T465 PolarHBondContact O-N 3.33Å; L461-T465 PolarHBondContact O-OG1 3.38Å; G462-T465 PolarHBondContact O-N 2.92Å; T465-G468 PolarHBondContact O-N 2.95Å; T465-A469 PolarHBondContact O-N 2.78Å; T465-L488 HydrophobicContact CG2-CD1 3.83Å; T465-L488 HydrophobicContact CG2-CG 4.31Å; T465-A491 HydrophobicContact CG2-CB 4.42Å; T465-A491 VanDerWaalsContact O-CB 3.3Å; T465-A491 WeakPolarHBondContact O-CB 3.26Å; T465-F492 HydrophobicContact CG2-CB 3.72Å; T465-F492 HydrophobicContact CG2-CD2 4.2Å; T465-F492 HydrophobicContact CG2-CG 4.48Å
466	L	96	Very high	94.7	Very high	9 Å²	9	12.2 Å²	12.2	5%	0.047	6%	0.064	C	C	.	.	H	α-helix	trans	-64.5	-45.3	177.8	-70.5	173.4	0	0	0	111.3	Y361 G462 G468 A469 F470 L488 V657 M660	Y361-L466 HydrophobicContact CD1-CD1 4.36Å; Y361-L466 HydrophobicContact CD1-CG 4.33Å; Y361-L466 HydrophobicContact CG-CD2 4.28Å; Y361-L466 HydrophobicContact CG-CG 4.5Å; G462-L466 WeakPolarHBondContact O-CB 3.46Å; G462-L466 WeakPolarHBondContact O-CG 3.18Å; G462-L466 PolarHBondContact O-N 3.25Å; L466-G468 VanDerWaalsContact C-N 3.31Å; L466-G468 PolarHBondContact O-N 2.96Å; L466-A469 PolarHBondContact O-N 3.38Å; L466-F470 HydrophobicContact CB-CD2 4.33Å; L466-F470 HydrophobicContact CB-CE2 4.07Å; L466-F470 HydrophobicContact CD2-CE2 4.19Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å; L466-F470 PolarHBondContact O-N 3.46Å; L466-L488 HydrophobicContact CD2-CD1 3.94Å; L466-V657 HydrophobicContact CD1-CG1 4.49Å; L466-V657 HydrophobicContact CD1-CG2 4.32Å; L466-V657 HydrophobicContact CD2-CG1 4.11Å; L466-M660 HydrophobicContact CB-CB 4.33Å; L466-M660 HydrophobicContact CD1-CB 4.24Å; L466-M660 HydrophobicContact CD1-CG 4.28Å
467	A	96.4	Very high	93.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.1	-41	177.6	0	0	0	0	0	112	Q463 A469 F470 A471 I562 A565 T664	Q463-A467 WeakPolarHBondContact O-CB 3.45Å; Q463-A467 PolarHBondContact O-N 3.44Å; A467-A469 VanDerWaalsContact C-N 3.34Å; A467-A469 PolarHBondContact O-N 2.95Å; A467-F470 PolarHBondContact O-N 2.98Å; A467-A471 WeakPolarHBondContact O-CB 3.22Å; A467-A471 PolarHBondContact O-N 3.4Å; A467-I562 HydrophobicContact CB-CB 4.28Å; A467-I562 HydrophobicContact CB-CG1 3.87Å; A467-I562 HydrophobicContact CB-CG2 4.42Å; A467-A565 HydrophobicContact CB-CB 3.84Å; A467-T664 WeakPolarHBondContact CA-OG1 3.33Å; A467-T664 HydrophobicContact CB-CG2 4.32Å; A467-T664 WeakPolarHBondContact O-CG2 3.45Å
468	G	94.7	Very high	93.1	Very high	2 Å²	2	24.3 Å²	24.3	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-39.1	177.9	0	0	0	0	0	112.9	V464 T465 L466 S472	V464-G468 PolarHBondContact O-N 3.36Å; T465-G468 PolarHBondContact O-N 2.95Å; L466-G468 VanDerWaalsContact C-N 3.31Å; L466-G468 PolarHBondContact O-N 2.96Å; G468-S472 PolarHBondContact O-N 2.96Å; G468-S472 VanDerWaalsContact O-N 3.17Å; G468-S472 PolarHBondContact O-OG 3.21Å
469	A	94.4	Very high	92.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.5	-47.2	176.8	0	0	0	0	0	111.9	V355 T465 L466 A467 S472 Y473 P487 L488	V355-A469 HydrophobicContact CG1-CB 4.14Å; T465-A469 PolarHBondContact O-N 2.78Å; L466-A469 PolarHBondContact O-N 3.38Å; A467-A469 VanDerWaalsContact C-N 3.34Å; A467-A469 PolarHBondContact O-N 2.95Å; A469-S472 WeakPolarHBondContact O-CB 3.21Å; A469-S472 PolarHBondContact O-N 2.93Å; A469-Y473 PolarHBondContact O-N 3.46Å; A469-P487 HydrophobicContact CB-CB 4.08Å; A469-L488 HydrophobicContact CB-CD1 4.47Å
470	F	95.1	Very high	91.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-71.7	-32.2	-179.8	-63.2	-51.5	0	0	0	113.4	A351 V352 V355 L466 A467 S472 Y473 Y474 V657 C661 T664	A351-F470 HydrophobicContact CB-CD1 4.2Å; V352-F470 HydrophobicContact CG2-CE1 3.84Å; V352-F470 HydrophobicContact CG2-CZ 3.91Å; V355-F470 HydrophobicContact CB-CE1 4.34Å; L466-F470 HydrophobicContact CB-CD2 4.33Å; L466-F470 HydrophobicContact CB-CE2 4.07Å; L466-F470 HydrophobicContact CD2-CE2 4.19Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å; L466-F470 PolarHBondContact O-N 3.46Å; A467-F470 PolarHBondContact O-N 2.98Å; F470-S472 VanDerWaalsContact C-N 3.33Å; F470-Y473 WeakPolarHBondContact O-CB 3.38Å; F470-Y473 PolarHBondContact O-N 3.29Å; F470-Y474 PolarHBondContact O-N 3.38Å; F470-V657 HydrophobicContact CE2-CG1 4.26Å; F470-V657 HydrophobicContact CZ-CG1 3.98Å; F470-C661 HydrophobicContact CD1-CB 4.14Å; F470-C661 VanDerWaalsContact CD1-SG 3.55Å; F470-C661 VanDerWaalsContact CD2-CA 3.48Å; F470-C661 HydrophobicContact CD2-CB 3.65Å; F470-C661 HydrophobicContact CE1-CB 4.05Å; F470-C661 HydrophobicContact CE2-CB 3.54Å; F470-C661 HydrophobicContact CG-CB 3.96Å; F470-C661 HydrophobicContact CZ-CB 3.76Å; F470-T664 HydrophobicContact CB-CG2 3.93Å
471	A	94	Very high	91.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-39	171.4	0	0	0	0	0	111.5	P23 A467 Y473 Y474 W475 I566 T664	P23-A471 HydrophobicContact CG-CB 3.83Å; A467-A471 WeakPolarHBondContact O-CB 3.22Å; A467-A471 PolarHBondContact O-N 3.4Å; A471-Y473 VanDerWaalsContact C-N 3.26Å; A471-Y473 PolarHBondContact O-N 2.79Å; A471-Y474 PolarHBondContact O-N 3.41Å; A471-W475 VanDerWaalsContact O-CD1 3.24Å; A471-W475 PolarHBondContact O-N 2.83Å; A471-W475 VanDerWaalsContact O-N 3.17Å; A471-I566 HydrophobicContact CB-CG1 3.78Å; A471-T664 HydrophobicContact CB-CG2 4.02Å
472	S	92.1	Very high	90.4	Very high	8 Å²	8	36.8 Å²	36.8	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-38.7	174	-53.5	0	0	0	0	111.1	G468 A469 F470 A476	G468-S472 PolarHBondContact O-N 2.96Å; G468-S472 VanDerWaalsContact O-N 3.17Å; G468-S472 PolarHBondContact O-OG 3.21Å; A469-S472 WeakPolarHBondContact O-CB 3.21Å; A469-S472 PolarHBondContact O-N 2.93Å; F470-S472 VanDerWaalsContact C-N 3.33Å; S472-A476 PolarHBondContact O-N 3.5Å
473	Y	92.4	Very high	89.9	Confident	13 Å²	13	37.9 Å²	37.9	5%	0.051	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-44.7	173.6	168.5	-92	0	0	0	112.9	A351 Y354 A469 F470 A471 W475 A476 K479 L483 L665	A351-Y473 HydrophobicContact CB-CD1 3.3Å; A351-Y473 HydrophobicContact CB-CD2 4.4Å; A351-Y473 HydrophobicContact CB-CE1 3.34Å; A351-Y473 HydrophobicContact CB-CE2 4.43Å; A351-Y473 HydrophobicContact CB-CG 3.87Å; Y354-Y473 AromaticContact CD2-CD2 3.97Å; Y354-Y473 HydrophobicContact CD2-CD2 3.97Å; Y354-Y473 AromaticContact CD2-CE2 3.29Å; Y354-Y473 HydrophobicContact CD2-CE2 3.29Å; Y354-Y473 AromaticContact CE2-CE2 3.79Å; Y354-Y473 HydrophobicContact CE2-CE2 3.79Å; Y354-Y473 HydrophobicContact CG-CD2 4.22Å; Y354-Y473 AromaticContact CG-CE2 3.98Å; Y354-Y473 HydrophobicContact CG-CE2 3.98Å; A469-Y473 PolarHBondContact O-N 3.46Å; F470-Y473 WeakPolarHBondContact O-CB 3.38Å; F470-Y473 PolarHBondContact O-N 3.29Å; A471-Y473 VanDerWaalsContact C-N 3.26Å; A471-Y473 PolarHBondContact O-N 2.79Å; Y473-W475 PolarHBondContact O-N 3.46Å; Y473-A476 PolarHBondContact O-N 2.94Å; Y473-K479 HydrophobicContact CD2-CD 4.13Å; Y473-K479 HydrophobicContact CE2-CD 3.53Å; Y473-K479 HydrophobicContact CE2-CG 4.41Å; Y473-K479 VanDerWaalsContact CZ-CE 3.47Å; Y473-K479 WeakPolarHBondContact O-CE 3.3Å; Y473-K479 PolarHBondContact O-NZ 3.01Å; Y473-L483 HydrophobicContact CD2-CD2 4.28Å; Y473-L665 HydrophobicContact CD1-CD2 4.1Å
474	Y	91.8	Very high	89.2	Confident	18 Å²	18	36.9 Å²	36.9	7%	0.071	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-50.2	-176.4	-174.8	-85.5	0	0	0	111.4	F470 A471 A476 L665 C668 F669 D672 F685 M686	F470-Y474 PolarHBondContact O-N 3.38Å; A471-Y474 PolarHBondContact O-N 3.41Å; Y474-A476 VanDerWaalsContact C-N 3.3Å; Y474-A476 PolarHBondContact O-N 3.01Å; Y474-L665 HydrophobicContact CD2-CB 4.31Å; Y474-L665 HydrophobicContact CD2-CD2 3.8Å; Y474-L665 HydrophobicContact CG-CD2 4.29Å; Y474-C668 HydrophobicContact CD1-CB 3.39Å; Y474-C668 HydrophobicContact CD2-CB 3.88Å; Y474-C668 HydrophobicContact CE1-CB 3.7Å; Y474-C668 HydrophobicContact CE2-CB 4.15Å; Y474-C668 HydrophobicContact CG-CB 3.51Å; Y474-F669 HydrophobicContact CE2-CB 4.19Å; Y474-F669 WeakPolarHBondContact OH-CA 3.43Å; Y474-D672 HydrophobicContact CE1-CB 4.1Å; Y474-D672 WeakPolarHBondContact OH-CB 3.33Å; Y474-D672 PolarHBondContact OH-OD2 3.28Å; Y474-F685 HydrophobicContact CE1-CB 3.99Å; Y474-M686 WeakPolarHBondContact OH-CB 3.39Å
475	W	90.4	Very high	88.4	Confident	7 Å²	7	41 Å²	41	3%	0.027	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.6	-173.4	-65.7	109.3	0	0	0	114.6	F20 G22 A471 Y473 C668 E671 D672 F685	F20-W475 AromaticContact CE1-CD2 3.8Å; F20-W475 HydrophobicContact CE1-CD2 3.8Å; F20-W475 AromaticContact CE1-CE2 3.71Å; F20-W475 HydrophobicContact CE1-CE3 4.01Å; F20-W475 HydrophobicContact CE1-CG 4.39Å; F20-W475 HydrophobicContact CE1-CH2 4.07Å; F20-W475 AromaticContact CE1-CZ2 3.86Å; F20-W475 HydrophobicContact CE1-CZ2 3.86Å; F20-W475 HydrophobicContact CE1-CZ3 4.15Å; F20-W475 HydrophobicContact CZ-CZ2 4.43Å; G22-W475 VanDerWaalsContact CA-CG 3.47Å; A471-W475 VanDerWaalsContact O-CD1 3.24Å; A471-W475 PolarHBondContact O-N 2.83Å; A471-W475 VanDerWaalsContact O-N 3.17Å; Y473-W475 PolarHBondContact O-N 3.46Å; W475-C668 HydrophobicContact CZ2-CB 4.18Å; W475-C668 PolarHBondContact NE1-SG 3.14Å; W475-E671 HydrophobicContact CZ2-CB 4.49Å; W475-D672 HydrophobicContact CH2-CB 4.01Å; W475-D672 HydrophobicContact CZ3-CB 4.43Å; W475-F685 HydrophobicContact CE3-CB 4.29Å; W475-F685 HydrophobicContact CE3-CD1 4.01Å; W475-F685 AromaticContact CE3-CD2 3.89Å; W475-F685 HydrophobicContact CE3-CD2 3.89Å; W475-F685 HydrophobicContact CE3-CE1 4.28Å; W475-F685 HydrophobicContact CE3-CE2 4.21Å; W475-F685 AromaticContact CE3-CG 3.8Å; W475-F685 HydrophobicContact CE3-CG 3.8Å; W475-F685 HydrophobicContact CE3-CZ 4.39Å; W475-F685 HydrophobicContact CZ3-CB 4.44Å; W475-F685 AromaticContact CZ3-CD2 3.77Å; W475-F685 HydrophobicContact CZ3-CD2 3.77Å; W475-F685 HydrophobicContact CZ3-CE2 4.18Å; W475-F685 HydrophobicContact CZ3-CG 4.07Å; W475-F685 WeakPolarHBondContact O-CD1 3.39Å; W475-F685 WeakPolarHBondContact O-CE1 3.29Å
476	A	87.9	Confident	87.9	Confident	7 Å²	7	47.8 Å²	47.8	6%	0.058	25%	0.249	C	C	.	.			trans	-75.7	127	171.7	0	0	0	0	0	111.3	S472 Y473 Y474 K479 D482 L483	S472-A476 PolarHBondContact O-N 3.5Å; Y473-A476 PolarHBondContact O-N 2.94Å; Y474-A476 VanDerWaalsContact C-N 3.3Å; Y474-A476 PolarHBondContact O-N 3.01Å; A476-K479 HydrophobicContact CB-CG 4.19Å; A476-K479 PolarHBondContact O-NZ 3.1Å; A476-D482 HydrophobicContact CB-CB 3.91Å; A476-L483 HydrophobicContact CB-CD1 3.55Å
477	L	80.8	Confident	87.5	Confident	110 Å²	110	48.1 Å²	48.1	58%	0.576	25%	0.252	S	S	*	.	S	Bend	trans	-81	-46.4	176.7	-73.8	169.4	0	0	0	111.3	D482 F685	L477-D482 PolarHBondContact N-OD2 3.46Å; L477-F685 HydrophobicContact CD1-CE1 4.06Å; L477-F685 HydrophobicContact CD1-CZ 4.31Å; L477-F685 HydrophobicContact CD2-CD1 3.58Å; L477-F685 HydrophobicContact CD2-CE1 3.55Å; L477-F685 HydrophobicContact CD2-CG 4.23Å; L477-F685 HydrophobicContact CD2-CZ 4.13Å; L477-F685 HydrophobicContact CG-CD1 3.93Å; L477-F685 HydrophobicContact CG-CE1 3.49Å; L477-F685 VanDerWaalsContact CG-CE1 3.49Å; L477-F685 HydrophobicContact CG-CZ 4.19Å
478	R	81.1	Confident	87.3	Confident	181 Å²	181	48.8 Å²	48.8	68%	0.683	26%	0.256	S	S	*	.	S	Bend	trans	-101.8	116.1	175.5	-63.8	-177.8	-179.2	177.9	1.1	109.6	D481 D482	R478-D481 HydrophobicContact CB-CB 4.5Å; R478-D481 PolarHBondContact O-N 2.89Å; R478-D482 WeakPolarHBondContact CB-OD2 3.43Å; R478-D482 PolarHBondContact N-OD2 3.08Å; R478-D482 VanDerWaalsContact O-CB 3.3Å; R478-D482 WeakPolarHBondContact O-CB 3.28Å; R478-D482 PolarHBondContact O-N 2.95Å
479	K	85.1	Confident	87.1	Confident	66 Å²	66	55.2 Å²	55.2	29%	0.287	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	124.5	-180	-61.7	168.1	166.1	76.8	0	107.5	Y354 Y473 A476 L483	Y354-K479 HydrophobicContact CE1-CB 4.45Å; Y473-K479 HydrophobicContact CD2-CD 4.13Å; Y473-K479 HydrophobicContact CE2-CD 3.53Å; Y473-K479 HydrophobicContact CE2-CG 4.41Å; Y473-K479 VanDerWaalsContact CZ-CE 3.47Å; Y473-K479 WeakPolarHBondContact O-CE 3.3Å; Y473-K479 PolarHBondContact O-NZ 3.01Å; A476-K479 HydrophobicContact CB-CG 4.19Å; A476-K479 PolarHBondContact O-NZ 3.1Å; K479-L483 HydrophobicContact CB-CD1 4.36Å; K479-L483 HydrophobicContact CG-CD1 4.02Å
480	P	80.7	Confident	86.8	Confident	77 Å²	77	57.5 Å²	57.5	50%	0.5	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.1	-5.8	10.9	36.5	-35.2	0	0	0	116.4	Y354 D482 L483	Y354-P480 HydrophobicContact CD1-CB 4.41Å; Y354-P480 HydrophobicContact CE1-CB 4.31Å; P480-D482 VanDerWaalsContact C-N 3.33Å; P480-D482 PolarHBondContact O-N 3.15Å; P480-L483 WeakPolarHBondContact O-CB 3.48Å; P480-L483 PolarHBondContact O-N 3.43Å
481	D	80.3	Confident	86.7	Confident	133 Å²	133	57.6 Å²	57.6	71%	0.711	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-35.3	-166.8	-55.6	-28.2	0	0	0	115.3	R478 L483	R478-D481 HydrophobicContact CB-CB 4.5Å; R478-D481 PolarHBondContact O-N 2.89Å; D481-L483 VanDerWaalsContact C-N 3.29Å; D481-L483 PolarHBondContact O-N 3.26Å
482	D	82.3	Confident	86.7	Confident	85 Å²	85	60.5 Å²	60.5	46%	0.455	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	1.3	179.9	-61.7	-26.5	0	0	0	113	A476 L477 R478 P480	A476-D482 HydrophobicContact CB-CB 3.91Å; L477-D482 PolarHBondContact N-OD2 3.46Å; R478-D482 WeakPolarHBondContact CB-OD2 3.43Å; R478-D482 PolarHBondContact N-OD2 3.08Å; R478-D482 VanDerWaalsContact O-CB 3.3Å; R478-D482 WeakPolarHBondContact O-CB 3.28Å; R478-D482 PolarHBondContact O-N 2.95Å; P480-D482 VanDerWaalsContact C-N 3.33Å; P480-D482 PolarHBondContact O-N 3.15Å
483	L	84.1	Confident	86.7	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	33%	0.327	C	S	.	.	S	Bend	trans	-87.6	141.6	178	-84.8	76.6	0	0	0	111.4	Y473 A476 K479 P480 D481	Y473-L483 HydrophobicContact CD2-CD2 4.28Å; A476-L483 HydrophobicContact CB-CD1 3.55Å; K479-L483 HydrophobicContact CB-CD1 4.36Å; K479-L483 HydrophobicContact CG-CD1 4.02Å; P480-L483 WeakPolarHBondContact O-CB 3.48Å; P480-L483 PolarHBondContact O-N 3.43Å; D481-L483 VanDerWaalsContact C-N 3.29Å; D481-L483 PolarHBondContact O-N 3.26Å
484	P	81.1	Confident	86.7	Confident	27 Å²	27	62.2 Å²	62.2	18%	0.175	33%	0.329	C	S	.	.			trans	-62.5	143.1	169.7	26.1	-32.4	0	0	0	110.4	F486 P487	P484-F486 PolarHBondContact O-N 3.48Å; P484-F486 VanDerWaalsContact O-N 3.11Å; P484-P487 HydrophobicContact CG-CB 3.97Å; P484-P487 HydrophobicContact CG-CG 4.04Å; P484-P487 WeakPolarHBondContact O-CD 3.2Å; P484-P487 VanDerWaalsContact O-CG 3.23Å; P484-P487 WeakPolarHBondContact O-CG 3.49Å
485	A	80.4	Confident	86.8	Confident	91 Å²	91	61.4 Å²	61.4	75%	0.752	33%	0.326	S	S	*	.	S	Bend	trans	-54.5	-35.5	-176.4	0	0	0	0	0	113.8
486	F	85.4	Confident	87	Confident	142 Å²	142	64.4 Å²	64.4	62%	0.623	34%	0.342	S	S	*	.	S	Bend	trans	-129.8	79	176	-60.9	-73.8	0	0	0	110.8	P484 L488 F489 S490	P484-F486 PolarHBondContact O-N 3.48Å; P484-F486 VanDerWaalsContact O-N 3.11Å; F486-L488 VanDerWaalsContact C-N 3.29Å; F486-L488 PolarHBondContact O-N 3.48Å; F486-F489 HydrophobicContact CB-CB 4.21Å; F486-F489 HydrophobicContact CB-CD2 4.17Å; F486-F489 HydrophobicContact CD1-CD2 4.43Å; F486-F489 PolarHBondContact O-N 3.22Å; F486-S490 VanDerWaalsContact O-CB 3.24Å; F486-S490 WeakPolarHBondContact O-CB 3.38Å; F486-S490 PolarHBondContact O-N 3.17Å
487	P	87.6	Confident	87.2	Confident	16 Å²	16	73 Å²	73	10%	0.104	37%	0.373	C	S	.	.	H	α-helix	trans	-60.1	-38.6	-172.7	-20.3	30.1	0	0	0	113.1	V355 A469 P484 A491	V355-P487 HydrophobicContact CG1-CB 4.41Å; V355-P487 HydrophobicContact CG2-CG 4.39Å; A469-P487 HydrophobicContact CB-CB 4.08Å; P484-P487 HydrophobicContact CG-CB 3.97Å; P484-P487 HydrophobicContact CG-CG 4.04Å; P484-P487 WeakPolarHBondContact O-CD 3.2Å; P484-P487 VanDerWaalsContact O-CG 3.23Å; P484-P487 WeakPolarHBondContact O-CG 3.49Å; P487-A491 WeakPolarHBondContact O-CB 3.28Å; P487-A491 PolarHBondContact O-N 3.11Å
488	L	91.1	Very high	87.8	Confident	15 Å²	15	70.5 Å²	70.5	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-69	-51.6	-177.9	-169.5	72.9	0	0	0	112	V355 C357 Y361 T465 L466 A469 F486 S490 A491 F492	V355-L488 HydrophobicContact CG1-CB 4.5Å; C357-L488 HydrophobicContact CB-CD2 4Å; C357-L488 WeakPolarHBondContact O-CD2 3.37Å; Y361-L488 HydrophobicContact CD2-CD1 4.03Å; Y361-L488 HydrophobicContact CD2-CD2 4.11Å; Y361-L488 HydrophobicContact CD2-CG 4.26Å; T465-L488 HydrophobicContact CG2-CD1 3.83Å; T465-L488 HydrophobicContact CG2-CG 4.31Å; L466-L488 HydrophobicContact CD2-CD1 3.94Å; A469-L488 HydrophobicContact CB-CD1 4.47Å; F486-L488 VanDerWaalsContact C-N 3.29Å; F486-L488 PolarHBondContact O-N 3.48Å; L488-S490 VanDerWaalsContact C-N 3.35Å; L488-S490 PolarHBondContact O-N 3.07Å; L488-A491 PolarHBondContact O-N 2.87Å; L488-F492 WeakPolarHBondContact O-CB 3.48Å; L488-F492 PolarHBondContact O-N 2.71Å
489	F	90.5	Very high	88.5	Confident	136 Å²	136	62 Å²	62	60%	0.596	32%	0.324	S	S	*	.	H	α-helix	trans	-65.3	-39.7	179.2	-70.7	-75.6	0	0	0	111.9	F486 F492 G493	F486-F489 HydrophobicContact CB-CB 4.21Å; F486-F489 HydrophobicContact CB-CD2 4.17Å; F486-F489 HydrophobicContact CD1-CD2 4.43Å; F486-F489 PolarHBondContact O-N 3.22Å; F489-F492 PolarHBondContact O-N 3Å; F489-G493 PolarHBondContact O-N 3.21Å
490	S	89.3	Confident	89	Confident	48 Å²	48	60 Å²	60	34%	0.336	32%	0.318	S	S	.	.	H	α-helix	trans	-61.6	-45.3	174.3	-172.9	0	0	0	0	111.5	F486 L488 G493 R494	F486-S490 VanDerWaalsContact O-CB 3.24Å; F486-S490 WeakPolarHBondContact O-CB 3.38Å; F486-S490 PolarHBondContact O-N 3.17Å; L488-S490 VanDerWaalsContact C-N 3.35Å; L488-S490 PolarHBondContact O-N 3.07Å; S490-G493 PolarHBondContact O-N 3.36Å; S490-R494 WeakPolarHBondContact O-CG 3.31Å; S490-R494 PolarHBondContact O-N 3.42Å; S490-R494 PolarHBondContact OG-NH1 3.49Å
491	A	92.9	Very high	89.7	Confident	3 Å²	3	56.4 Å²	56.4	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-40.7	177	0	0	0	0	0	112.4	T465 P487 L488 R494 A495	T465-A491 HydrophobicContact CG2-CB 4.42Å; T465-A491 VanDerWaalsContact O-CB 3.3Å; T465-A491 WeakPolarHBondContact O-CB 3.26Å; P487-A491 WeakPolarHBondContact O-CB 3.28Å; P487-A491 PolarHBondContact O-N 3.11Å; L488-A491 PolarHBondContact O-N 2.87Å; A491-R494 PolarHBondContact O-N 2.88Å; A491-A495 WeakPolarHBondContact O-CB 3.39Å; A491-A495 PolarHBondContact O-N 2.92Å
492	F	94.1	Very high	90.5	Very high	61 Å²	61	50 Å²	50	27%	0.268	26%	0.261	S	S	.	.	H	α-helix	trans	-60.7	-48.3	175.8	-177.2	-98.4	0	0	0	111.7	Y361 L461 T465 L488 F489 R494 A495 L496	Y361-F492 HydrophobicContact CE2-CD2 4.14Å; L461-F492 HydrophobicContact CD1-CD2 4.31Å; L461-F492 HydrophobicContact CD1-CE2 4.19Å; L461-F492 HydrophobicContact CD2-CE2 3.69Å; L461-F492 HydrophobicContact CD2-CZ 4.22Å; L461-F492 HydrophobicContact CG-CD2 4.38Å; L461-F492 HydrophobicContact CG-CE2 3.97Å; T465-F492 HydrophobicContact CG2-CB 3.72Å; T465-F492 HydrophobicContact CG2-CD2 4.2Å; T465-F492 HydrophobicContact CG2-CG 4.48Å; L488-F492 WeakPolarHBondContact O-CB 3.48Å; L488-F492 PolarHBondContact O-N 2.71Å; F489-F492 PolarHBondContact O-N 3Å; F492-R494 VanDerWaalsContact C-N 3.34Å; F492-R494 PolarHBondContact O-N 3.46Å; F492-A495 WeakPolarHBondContact O-CB 3.46Å; F492-A495 PolarHBondContact O-N 2.61Å; F492-L496 HydrophobicContact CD1-CD1 4.04Å; F492-L496 HydrophobicContact CE1-CD1 3.34Å; F492-L496 HydrophobicContact CE1-CG 4.29Å; F492-L496 HydrophobicContact CE2-CD1 4.39Å; F492-L496 HydrophobicContact CZ-CD1 3.55Å; F492-L496 HydrophobicContact CZ-CG 4.32Å; F492-L496 PolarHBondContact O-N 3.02Å
493	G	91.8	Very high	91.2	Very high	35 Å²	35	46 Å²	46	36%	0.361	24%	0.239	S	C	.	.	H	α-helix	trans	-60.8	-41	176.6	0	0	0	0	0	112.5	F489 S490 R497	F489-G493 PolarHBondContact O-N 3.21Å; S490-G493 PolarHBondContact O-N 3.36Å; G493-R497 WeakPolarHBondContact O-CB 3.08Å; G493-R497 PolarHBondContact O-N 3.34Å
494	R	92.2	Very high	91.9	Very high	22 Å²	22	44.7 Å²	44.7	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-63.9	-41	174.1	-71.5	-171.8	-53.9	-106.1	9.7	112.2	S490 A491 F492 Y498	S490-R494 WeakPolarHBondContact O-CG 3.31Å; S490-R494 PolarHBondContact O-N 3.42Å; S490-R494 PolarHBondContact OG-NH1 3.49Å; A491-R494 PolarHBondContact O-N 2.88Å; F492-R494 VanDerWaalsContact C-N 3.34Å; F492-R494 PolarHBondContact O-N 3.46Å; R494-Y498 HydrophobicContact CB-CD2 4.47Å; R494-Y498 PolarHBondContact O-N 3.17Å
495	A	94.1	Very high	92.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-48.1	179.4	0	0	0	0	0	111.4	L461 V464 A491 F492 H499 T500 L503	L461-A495 HydrophobicContact CD1-CB 3.8Å; V464-A495 HydrophobicContact CB-CB 4.44Å; V464-A495 HydrophobicContact CG1-CB 3.85Å; A491-A495 WeakPolarHBondContact O-CB 3.39Å; A491-A495 PolarHBondContact O-N 2.92Å; F492-A495 WeakPolarHBondContact O-CB 3.46Å; F492-A495 PolarHBondContact O-N 2.61Å; A495-H499 CarbonylContact O-C 3.21Å; A495-H499 WeakPolarHBondContact O-CA 3.37Å; A495-H499 PolarHBondContact O-N 3.27Å; A495-T500 PolarHBondContact O-N 3.31Å; A495-L503 HydrophobicContact CB-CD1 4.34Å
496	L	93.6	Very high	93.4	Very high	70 Å²	70	41.8 Å²	41.8	37%	0.366	20%	0.2	S	C	.	.	H	α-helix	trans	-69.6	-44.2	178.1	-72.4	179.5	0	0	0	113	L461 F492 T500	L461-L496 HydrophobicContact CD1-CD2 3.83Å; L461-L496 HydrophobicContact CD1-CG 4.03Å; L461-L496 HydrophobicContact CD2-CD2 3.93Å; F492-L496 HydrophobicContact CD1-CD1 4.04Å; F492-L496 HydrophobicContact CE1-CD1 3.34Å; F492-L496 HydrophobicContact CE1-CG 4.29Å; F492-L496 HydrophobicContact CE2-CD1 4.39Å; F492-L496 HydrophobicContact CZ-CD1 3.55Å; F492-L496 HydrophobicContact CZ-CG 4.32Å; F492-L496 PolarHBondContact O-N 3.02Å; L496-T500 WeakPolarHBondContact CA-OG1 3.39Å; L496-T500 PolarHBondContact O-OG1 3.24Å
497	R	93.2	Very high	94	Very high	187 Å²	187	35 Å²	35	71%	0.706	17%	0.171	S	C	*	.	H	α-helix	trans	-70.4	-41.1	-174.3	-175.7	170.7	-177.7	160.4	0.7	113.1	G493	G493-R497 WeakPolarHBondContact O-CB 3.08Å; G493-R497 PolarHBondContact O-N 3.34Å
498	Y	93	Very high	94.4	Very high	58 Å²	58	35.6 Å²	35.6	23%	0.227	17%	0.172	C	C	.	.	H	α-helix	trans	-111.7	-27.9	-170.4	-60.6	-73.6	0	0	0	113.8	R27 C29 T30 R494	R27-Y498 HydrophobicContact CB-CD1 4.41Å; R27-Y498 HydrophobicContact CB-CG 4.29Å; R27-Y498 WeakPolarHBondContact O-CE1 3.07Å; C29-Y498 CarbonylContact C-O 3.48Å; C29-Y498 WeakPolarHBondContact CA-O 3.46Å; T30-Y498 PolarHBondContact N-O 3.47Å; T30-Y498 PolarHBondContact OG1-O 2.97Å; R494-Y498 HydrophobicContact CB-CD2 4.47Å; R494-Y498 PolarHBondContact O-N 3.17Å
499	H	95.5	Very high	94.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-119.7	10.5	-165.8	-57.7	-48.6	0	0	0	114.9	R27 T30 A495 G501 S502 L503 I564 G568	R27-H499 VanDerWaalsContact CD-NE2 3.34Å; R27-H499 WeakPolarHBondContact CD-NE2 3.49Å; R27-H499 PolarHBondContact NH1-NE2 3.44Å; T30-H499 PolarHBondContact OG1-ND1 2.91Å; A495-H499 CarbonylContact O-C 3.21Å; A495-H499 WeakPolarHBondContact O-CA 3.37Å; A495-H499 PolarHBondContact O-N 3.27Å; H499-G501 PolarHBondContact O-N 2.87Å; H499-S502 PolarHBondContact O-N 3.44Å; H499-S502 VanDerWaalsContact O-N 3.12Å; H499-L503 WeakPolarHBondContact O-CB 3.36Å; H499-L503 WeakPolarHBondContact O-CD1 3.32Å; H499-L503 VanDerWaalsContact O-CG 3.29Å; H499-L503 WeakPolarHBondContact O-CG 3.44Å; H499-L503 PolarHBondContact O-N 3.11Å; H499-I564 HydrophobicContact CB-CG2 3.91Å; H499-G568 WeakPolarHBondContact CE1-CA 3.36Å; H499-G568 PolarHBondContact CE1-O 3.22Å; H499-G568 WeakPolarHBondContact NE2-CA 3.3Å
500	T	95.9	Very high	94.9	Very high	24 Å²	24	31.2 Å²	31.2	15%	0.147	16%	0.155	C	C	.	.	H	α-helix	trans	-54.6	-38.1	176.2	-68.4	0	0	0	0	112.2	L38 F457 A495 L496 A504	L38-T500 HydrophobicContact CD2-CG2 4.34Å; F457-T500 HydrophobicContact CE2-CG2 3.96Å; F457-T500 HydrophobicContact CZ-CG2 3.88Å; A495-T500 PolarHBondContact O-N 3.31Å; L496-T500 WeakPolarHBondContact CA-OG1 3.39Å; L496-T500 PolarHBondContact O-OG1 3.24Å; T500-A504 VanDerWaalsContact O-CB 3.23Å; T500-A504 WeakPolarHBondContact O-CB 3.27Å; T500-A504 PolarHBondContact O-N 3.35Å
501	G	95.8	Very high	95.3	Very high	2 Å²	2	29 Å²	29	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-46.6	176.1	0	0	0	0	0	113.4	D31 C34 H499 A504 F505	D31-G501 VanDerWaalsContact O-CA 3.31Å; D31-G501 WeakPolarHBondContact O-CA 3.37Å; C34-G501 WeakPolarHBondContact CB-O 3.23Å; H499-G501 PolarHBondContact O-N 2.87Å; G501-A504 WeakPolarHBondContact O-CB 3.46Å; G501-A504 PolarHBondContact O-N 2.67Å; G501-F505 WeakPolarHBondContact O-CB 3.39Å; G501-F505 PolarHBondContact O-N 3.45Å
502	S	97.1	Very high	95.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.1	-38.7	-179.4	-53.9	0	0	0	0	112.3	T30 D31 H499 F505 G506	T30-S502 WeakPolarHBondContact CB-OG 3.28Å; T30-S502 PolarHBondContact OG1-OG 3.06Å; D31-S502 WeakPolarHBondContact OD2-CA 3.48Å; D31-S502 VanDerWaalsContact OD2-CB 3.25Å; D31-S502 WeakPolarHBondContact OD2-CB 3.49Å; D31-S502 PolarHBondContact OD2-OG 3.48Å; H499-S502 PolarHBondContact O-N 3.44Å; H499-S502 VanDerWaalsContact O-N 3.12Å; S502-F505 PolarHBondContact O-N 2.99Å; S502-G506 PolarHBondContact O-N 2.88Å
503	L	97.3	Very high	95.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-46.8	172	-72.2	163.3	0	0	0	110.8	F457 A460 L461 V464 A495 H499 F505 A507 Y561	F457-L503 HydrophobicContact CD2-CB 3.98Å; F457-L503 HydrophobicContact CE2-CB 3.66Å; A460-L503 HydrophobicContact CB-CD2 3.58Å; A460-L503 WeakPolarHBondContact O-CD2 3.23Å; L461-L503 HydrophobicContact CD1-CD1 4.19Å; V464-L503 HydrophobicContact CB-CD2 4.08Å; V464-L503 HydrophobicContact CG2-CD2 3.42Å; V464-L503 VanDerWaalsContact CG2-CD2 3.42Å; V464-L503 HydrophobicContact CG2-CG 4.34Å; A495-L503 HydrophobicContact CB-CD1 4.34Å; H499-L503 WeakPolarHBondContact O-CB 3.36Å; H499-L503 WeakPolarHBondContact O-CD1 3.32Å; H499-L503 VanDerWaalsContact O-CG 3.29Å; H499-L503 WeakPolarHBondContact O-CG 3.44Å; H499-L503 PolarHBondContact O-N 3.11Å; L503-F505 PolarHBondContact O-N 3.04Å; L503-A507 WeakPolarHBondContact O-CB 3.34Å; L503-A507 PolarHBondContact O-N 2.86Å; L503-Y561 HydrophobicContact CD2-CD1 4.35Å; L503-Y561 HydrophobicContact CD2-CE1 4.35Å
504	A	97.2	Very high	95.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-42	178.1	0	0	0	0	0	112	L38 W453 F457 T500 G501 A507 L508	L38-A504 HydrophobicContact CB-CB 3.98Å; L38-A504 HydrophobicContact CD2-CB 3.7Å; L38-A504 HydrophobicContact CG-CB 4.31Å; W453-A504 PolarHBondContact NE1-O 2.93Å; F457-A504 HydrophobicContact CD2-CB 4.31Å; F457-A504 HydrophobicContact CE2-CB 4.42Å; T500-A504 VanDerWaalsContact O-CB 3.23Å; T500-A504 WeakPolarHBondContact O-CB 3.27Å; T500-A504 PolarHBondContact O-N 3.35Å; G501-A504 WeakPolarHBondContact O-CB 3.46Å; G501-A504 PolarHBondContact O-N 2.67Å; A504-A507 PolarHBondContact O-N 2.89Å; A504-L508 VanDerWaalsContact O-CB 3.25Å; A504-L508 WeakPolarHBondContact O-CB 3.38Å; A504-L508 PolarHBondContact O-N 3.04Å
505	F	97.5	Very high	95.5	Very high	56 Å²	56	29.5 Å²	29.5	25%	0.246	14%	0.136	C	C	.	.	H	α-helix	trans	-66.7	-47.6	179.8	-174.6	-115.6	0	0	0	112.4	C34 G501 S502 L503 A507 L508 I509 F571	C34-F505 HydrophobicContact CB-CB 4.06Å; C34-F505 WeakPolarHBondContact SG-CD2 3.13Å; G501-F505 WeakPolarHBondContact O-CB 3.39Å; G501-F505 PolarHBondContact O-N 3.45Å; S502-F505 PolarHBondContact O-N 2.99Å; L503-F505 PolarHBondContact O-N 3.04Å; F505-A507 VanDerWaalsContact C-N 3.32Å; F505-A507 PolarHBondContact O-N 2.82Å; F505-L508 WeakPolarHBondContact O-CB 3.47Å; F505-L508 PolarHBondContact O-N 3.28Å; F505-I509 HydrophobicContact CD1-CD1 4.12Å; F505-I509 HydrophobicContact CE1-CD1 3.7Å; F505-I509 HydrophobicContact CE2-CD1 4.41Å; F505-I509 HydrophobicContact CZ-CD1 3.87Å; F505-I509 HydrophobicContact CZ-CG1 4.46Å; F505-I509 WeakPolarHBondContact O-CG1 3.46Å; F505-I509 PolarHBondContact O-N 3.05Å; F505-I509 VanDerWaalsContact O-N 3.12Å; F505-F571 HydrophobicContact CD1-CB 3.87Å; F505-F571 AromaticContact CD1-CD1 3.41Å; F505-F571 HydrophobicContact CD1-CD1 3.41Å; F505-F571 VanDerWaalsContact CD1-CD1 3.41Å; F505-F571 HydrophobicContact CD1-CE1 4.15Å; F505-F571 AromaticContact CD1-CG 3.77Å; F505-F571 HydrophobicContact CD1-CG 3.77Å; F505-F571 AromaticContact CE1-CD1 3.64Å; F505-F571 HydrophobicContact CE1-CD1 3.64Å; F505-F571 HydrophobicContact CE1-CE1 4.21Å; F505-F571 HydrophobicContact CE1-CG 4.43Å
506	G	96.4	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-40.2	174.9	0	0	0	0	0	112.6	S502 L510 N557 Y561	S502-G506 PolarHBondContact O-N 2.88Å; G506-L510 PolarHBondContact O-N 3.37Å; G506-N557 PolarHBondContact O-ND2 3.21Å; G506-Y561 WeakPolarHBondContact CA-OH 3.33Å
507	A	97.4	Very high	95.3	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-65.6	-36.2	174.6	0	0	0	0	0	113	N456 F457 L503 A504 F505 L510 A511 Y561	N456-A507 HydrophobicContact CB-CB 3.8Å; F457-A507 HydrophobicContact CB-CB 4.07Å; L503-A507 WeakPolarHBondContact O-CB 3.34Å; L503-A507 PolarHBondContact O-N 2.86Å; A504-A507 PolarHBondContact O-N 2.89Å; F505-A507 VanDerWaalsContact C-N 3.32Å; F505-A507 PolarHBondContact O-N 2.82Å; A507-L510 PolarHBondContact O-N 3.19Å; A507-A511 WeakPolarHBondContact O-CB 3.5Å; A507-A511 PolarHBondContact O-N 2.91Å; A507-Y561 PolarHBondContact N-OH 3.03Å
508	L	97.1	Very high	95.1	Very high	27 Å²	27	28.1 Å²	28.1	14%	0.141	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-48.5	178.2	177.2	60.5	0	0	0	111.3	F37 F449 W453 A504 F505 L510 A511 I512	F37-L508 HydrophobicContact CE1-CD2 4.39Å; F449-L508 HydrophobicContact CE2-CD1 4.03Å; F449-L508 HydrophobicContact CZ-CD1 3.48Å; F449-L508 VanDerWaalsContact CZ-CD1 3.48Å; W453-L508 HydrophobicContact CD2-CD1 3.98Å; W453-L508 HydrophobicContact CE3-CD1 4.22Å; W453-L508 HydrophobicContact CH2-CD1 4.39Å; W453-L508 HydrophobicContact CZ2-CB 4.16Å; W453-L508 HydrophobicContact CZ2-CD1 4.1Å; W453-L508 HydrophobicContact CZ2-CD2 4.32Å; W453-L508 HydrophobicContact CZ2-CG 4.43Å; W453-L508 HydrophobicContact CZ3-CD1 4.41Å; A504-L508 VanDerWaalsContact O-CB 3.25Å; A504-L508 WeakPolarHBondContact O-CB 3.38Å; A504-L508 PolarHBondContact O-N 3.04Å; F505-L508 WeakPolarHBondContact O-CB 3.47Å; F505-L508 PolarHBondContact O-N 3.28Å; L508-L510 VanDerWaalsContact C-N 3.27Å; L508-L510 PolarHBondContact O-N 3.45Å; L508-A511 PolarHBondContact O-N 3.34Å; L508-I512 HydrophobicContact CD1-CD1 4.1Å; L508-I512 HydrophobicContact CD1-CG1 4.33Å; L508-I512 HydrophobicContact CG-CD1 4.08Å; L508-I512 WeakPolarHBondContact O-CG1 3.5Å; L508-I512 PolarHBondContact O-N 2.77Å
509	I	96.1	Very high	94.9	Very high	49 Å²	49	29.1 Å²	29.1	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-57.2	-45.6	177.9	-63.7	167.8	0	0	0	110	F505 I512 V513 I553 F571	F505-I509 HydrophobicContact CD1-CD1 4.12Å; F505-I509 HydrophobicContact CE1-CD1 3.7Å; F505-I509 HydrophobicContact CE2-CD1 4.41Å; F505-I509 HydrophobicContact CZ-CD1 3.87Å; F505-I509 HydrophobicContact CZ-CG1 4.46Å; F505-I509 WeakPolarHBondContact O-CG1 3.46Å; F505-I509 PolarHBondContact O-N 3.05Å; F505-I509 VanDerWaalsContact O-N 3.12Å; I509-I512 PolarHBondContact O-N 2.94Å; I509-V513 WeakPolarHBondContact O-CG2 3.41Å; I509-V513 PolarHBondContact O-N 2.84Å; I509-I553 HydrophobicContact CG2-CD1 4.14Å; I509-I553 HydrophobicContact CG2-CG1 4.45Å; I509-I553 HydrophobicContact CG2-CG2 3.97Å; I509-F571 HydrophobicContact CD1-CE1 3.96Å
510	L	95.8	Very high	94.5	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-39.3	179.9	-175.2	55.4	0	0	0	112.3	N456 G506 A507 L508 V513 Q514 E550 I553 K554	N456-L510 HydrophobicContact CB-CD2 4.43Å; N456-L510 WeakPolarHBondContact OD1-CD2 3.48Å; G506-L510 PolarHBondContact O-N 3.37Å; A507-L510 PolarHBondContact O-N 3.19Å; L508-L510 VanDerWaalsContact C-N 3.27Å; L508-L510 PolarHBondContact O-N 3.45Å; L510-V513 PolarHBondContact O-N 2.86Å; L510-Q514 HydrophobicContact CD1-CG 4.48Å; L510-Q514 WeakPolarHBondContact O-CG 3.42Å; L510-Q514 PolarHBondContact O-N 3.43Å; L510-E550 HydrophobicContact CD1-CG 3.97Å; L510-I553 HydrophobicContact CB-CG2 4.16Å; L510-I553 HydrophobicContact CD1-CB 4.48Å; L510-I553 HydrophobicContact CD1-CG2 4.08Å; L510-K554 HydrophobicContact CD1-CD 4.48Å; L510-K554 HydrophobicContact CD1-CG 3.78Å; L510-K554 HydrophobicContact CD2-CG 3.8Å; L510-K554 HydrophobicContact CG-CG 4.49Å
511	A	96.4	Very high	94.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-40.8	177.9	0	0	0	0	0	112.6	F452 W453 A507 L508 V513 Q514 I515	F452-A511 HydrophobicContact CB-CB 3.97Å; W453-A511 HydrophobicContact CB-CB 3.93Å; W453-A511 HydrophobicContact CG-CB 4.46Å; A507-A511 WeakPolarHBondContact O-CB 3.5Å; A507-A511 PolarHBondContact O-N 2.91Å; L508-A511 PolarHBondContact O-N 3.34Å; A511-V513 PolarHBondContact O-N 3.23Å; A511-Q514 PolarHBondContact O-N 3.22Å; A511-I515 PolarHBondContact O-N 3.41Å
512	I	95.3	Very high	93.5	Very high	78 Å²	78	38.1 Å²	38.1	40%	0.4	18%	0.182	S	C	.	.	H	α-helix	trans	-59.4	-48.8	175.9	-68.3	165.7	0	0	0	110.5	F449 L508 I509 Q514 I515 I516	F449-I512 HydrophobicContact CE2-CG1 4.12Å; L508-I512 HydrophobicContact CD1-CD1 4.1Å; L508-I512 HydrophobicContact CD1-CG1 4.33Å; L508-I512 HydrophobicContact CG-CD1 4.08Å; L508-I512 WeakPolarHBondContact O-CG1 3.5Å; L508-I512 PolarHBondContact O-N 2.77Å; I509-I512 PolarHBondContact O-N 2.94Å; I512-Q514 VanDerWaalsContact C-N 3.31Å; I512-Q514 PolarHBondContact O-N 2.92Å; I512-I515 PolarHBondContact O-N 3.48Å; I512-I516 HydrophobicContact CG2-CD1 3.97Å; I512-I516 WeakPolarHBondContact O-CG1 3.43Å; I512-I516 PolarHBondContact O-N 3.41Å; I512-I516 VanDerWaalsContact O-N 3.07Å
513	V	95	Very high	92.8	Very high	10 Å²	10	41.5 Å²	41.5	6%	0.061	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-40.6	178.5	174.4	0	0	0	0	111.3	I509 L510 A511 I516 R517 F546 L549 E550	I509-V513 WeakPolarHBondContact O-CG2 3.41Å; I509-V513 PolarHBondContact O-N 2.84Å; L510-V513 PolarHBondContact O-N 2.86Å; A511-V513 PolarHBondContact O-N 3.23Å; V513-I516 PolarHBondContact O-N 3.05Å; V513-R517 PolarHBondContact O-N 3.15Å; V513-R517 VanDerWaalsContact O-N 3.07Å; V513-F546 HydrophobicContact CG1-CD1 4.28Å; V513-L549 HydrophobicContact CG1-CB 4.46Å; V513-L549 HydrophobicContact CG1-CD2 4.28Å; V513-L549 HydrophobicContact CG1-CG 4.21Å; V513-L549 HydrophobicContact CG2-CD2 3.89Å; V513-L549 HydrophobicContact CG2-CG 4.17Å; V513-E550 HydrophobicContact CG1-CB 3.86Å; V513-E550 HydrophobicContact CG1-CG 4.44Å
514	Q	94.4	Very high	92.1	Very high	22 Å²	22	42.9 Å²	42.9	10%	0.103	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-40.8	178.4	-76.5	178.4	-27.4	0	0	112.8	F452 N456 L510 A511 I512 R517 V518 E550	F452-Q514 HydrophobicContact CD1-CB 4.03Å; F452-Q514 VanDerWaalsContact CD1-OE1 3.27Å; F452-Q514 HydrophobicContact CE1-CB 4.31Å; F452-Q514 HydrophobicContact CG-CB 4.31Å; N456-Q514 PolarHBondContact ND2-OE1 3.04Å; L510-Q514 HydrophobicContact CD1-CG 4.48Å; L510-Q514 WeakPolarHBondContact O-CG 3.42Å; L510-Q514 PolarHBondContact O-N 3.43Å; A511-Q514 PolarHBondContact O-N 3.22Å; I512-Q514 VanDerWaalsContact C-N 3.31Å; I512-Q514 PolarHBondContact O-N 2.92Å; Q514-R517 WeakPolarHBondContact O-CB 3.27Å; Q514-R517 PolarHBondContact O-N 3.41Å; Q514-V518 WeakPolarHBondContact O-CG2 3.29Å; Q514-V518 PolarHBondContact O-N 2.96Å; Q514-E550 HydrophobicContact CG-CG 4.27Å
515	I	92.4	Very high	91.2	Very high	22 Å²	22	48.3 Å²	48.3	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-43.4	176.8	-73.3	175.3	0	0	0	111.5	F449 F452 A511 I512 R517 V518 I519	F449-I515 HydrophobicContact CB-CD1 3.32Å; F449-I515 HydrophobicContact CD2-CD1 3.33Å; F449-I515 HydrophobicContact CE2-CD1 4.49Å; F449-I515 HydrophobicContact CG-CD1 3.75Å; F452-I515 HydrophobicContact CD2-CD1 4.38Å; F452-I515 HydrophobicContact CD2-CG1 3.69Å; F452-I515 HydrophobicContact CE2-CG1 4.23Å; A511-I515 PolarHBondContact O-N 3.41Å; I512-I515 PolarHBondContact O-N 3.48Å; I515-R517 PolarHBondContact O-N 2.94Å; I515-V518 PolarHBondContact O-N 2.97Å; I515-V518 VanDerWaalsContact O-N 3.08Å; I515-I519 HydrophobicContact CG2-CD1 3.56Å; I515-I519 HydrophobicContact CG2-CG1 4.08Å; I515-I519 WeakPolarHBondContact O-CG1 3.43Å; I515-I519 PolarHBondContact O-N 3.4Å
516	I	91.8	Very high	90.2	Very high	59 Å²	59	53.6 Å²	53.6	30%	0.303	25%	0.251	S	S	.	.	H	α-helix	trans	-57.3	-42.5	176.5	-64.7	165	0	0	0	109.5	I512 V513 V518 I519 L520 F546	I512-I516 HydrophobicContact CG2-CD1 3.97Å; I512-I516 WeakPolarHBondContact O-CG1 3.43Å; I512-I516 PolarHBondContact O-N 3.41Å; I512-I516 VanDerWaalsContact O-N 3.07Å; V513-I516 PolarHBondContact O-N 3.05Å; I516-V518 PolarHBondContact O-N 3.32Å; I516-I519 PolarHBondContact O-N 3.07Å; I516-L520 HydrophobicContact CG2-CD1 4.03Å; I516-L520 HydrophobicContact CG2-CG 4.3Å; I516-L520 VanDerWaalsContact O-CG 3.26Å; I516-L520 WeakPolarHBondContact O-CG 3.45Å; I516-L520 PolarHBondContact O-N 2.87Å; I516-F546 HydrophobicContact CB-CD1 4.04Å; I516-F546 HydrophobicContact CB-CE1 3.85Å; I516-F546 HydrophobicContact CB-CZ 4.43Å; I516-F546 HydrophobicContact CD1-CE1 3.69Å; I516-F546 HydrophobicContact CD1-CZ 4.2Å; I516-F546 HydrophobicContact CG1-CE1 4.37Å; I516-F546 HydrophobicContact CG2-CD1 3.68Å; I516-F546 HydrophobicContact CG2-CD2 4.17Å; I516-F546 HydrophobicContact CG2-CE1 3.4Å; I516-F546 VanDerWaalsContact CG2-CE1 3.4Å; I516-F546 HydrophobicContact CG2-CE2 3.91Å; I516-F546 HydrophobicContact CG2-CG 4.07Å; I516-F546 HydrophobicContact CG2-CZ 3.53Å
517	R	91.7	Very high	89.2	Confident	96 Å²	96	57 Å²	57	36%	0.362	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-43.5	175.1	-174.5	-179.2	170.8	-156.5	-9.5	112.8	V513 Q514 I515 L520 E521 E550	V513-R517 PolarHBondContact O-N 3.15Å; V513-R517 VanDerWaalsContact O-N 3.07Å; Q514-R517 WeakPolarHBondContact O-CB 3.27Å; Q514-R517 PolarHBondContact O-N 3.41Å; I515-R517 PolarHBondContact O-N 2.94Å; R517-L520 PolarHBondContact O-N 2.91Å; R517-E521 PolarHBondContact O-N 3.1Å; R517-E550 VanDerWaalsContact CD-OE2 3.23Å; R517-E550 WeakPolarHBondContact CD-OE2 3.24Å; R517-E550 IonicContact CZ-OE2 3.95Å; R517-E550 IonicContact NE-OE2 2.68Å; R517-E550 IonicContact NH1-OE1 3.99Å; R517-E550 IonicContact NH1-OE2 2.81Å; R517-E550 PolarHBondContact NH1-OE2 3.5Å
518	V	89.1	Confident	87.8	Confident	75 Å²	75	63.2 Å²	63.2	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-41.7	176.4	171.7	0	0	0	0	111.3	F452 Q514 I515 I516 E521 Y522	F452-V518 HydrophobicContact CE2-CG2 4.07Å; F452-V518 HydrophobicContact CZ-CG2 3.8Å; Q514-V518 WeakPolarHBondContact O-CG2 3.29Å; Q514-V518 PolarHBondContact O-N 2.96Å; I515-V518 PolarHBondContact O-N 2.97Å; I515-V518 VanDerWaalsContact O-N 3.08Å; I516-V518 PolarHBondContact O-N 3.32Å; V518-E521 PolarHBondContact O-N 3Å; V518-Y522 PolarHBondContact O-N 3.15Å
519	I	87.5	Confident	86.2	Confident	79 Å²	79	66.5 Å²	66.5	41%	0.405	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-45.1	176.7	-68	170.7	0	0	0	110.5	I515 I516 E521 Y522 L523	I515-I519 HydrophobicContact CG2-CD1 3.56Å; I515-I519 HydrophobicContact CG2-CG1 4.08Å; I515-I519 WeakPolarHBondContact O-CG1 3.43Å; I515-I519 PolarHBondContact O-N 3.4Å; I516-I519 PolarHBondContact O-N 3.07Å; I519-E521 VanDerWaalsContact C-N 3.28Å; I519-E521 PolarHBondContact O-N 3.4Å; I519-Y522 PolarHBondContact O-N 3.42Å; I519-L523 HydrophobicContact CG2-CD1 3.9Å; I519-L523 HydrophobicContact CG2-CG 4.18Å; I519-L523 WeakPolarHBondContact O-CB 3.39Å; I519-L523 VanDerWaalsContact O-CG 3.3Å; I519-L523 WeakPolarHBondContact O-CG 3.41Å; I519-L523 PolarHBondContact O-N 3.08Å
520	L	87.8	Confident	84.7	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-38.6	175.9	-70.1	171.4	0	0	0	111.8	I516 R517 D524 M539 L542 K543 F546	I516-L520 HydrophobicContact CG2-CD1 4.03Å; I516-L520 HydrophobicContact CG2-CG 4.3Å; I516-L520 VanDerWaalsContact O-CG 3.26Å; I516-L520 WeakPolarHBondContact O-CG 3.45Å; I516-L520 PolarHBondContact O-N 2.87Å; R517-L520 PolarHBondContact O-N 2.91Å; L520-D524 WeakPolarHBondContact O-CB 3.5Å; L520-D524 PolarHBondContact O-N 3.01Å; L520-M539 HydrophobicContact CB-SD 4.07Å; L520-M539 HydrophobicContact CD2-CE 4.31Å; L520-M539 HydrophobicContact CD2-SD 3.69Å; L520-M539 HydrophobicContact CG-SD 4.49Å; L520-L542 HydrophobicContact CD1-CB 4.05Å; L520-L542 HydrophobicContact CD2-CB 4.17Å; L520-L542 HydrophobicContact CD2-CD1 4.13Å; L520-K543 HydrophobicContact CB-CG 4.25Å; L520-K543 WeakPolarHBondContact O-CE 3.41Å; L520-F546 HydrophobicContact CD1-CB 4.24Å; L520-F546 HydrophobicContact CD1-CD2 3.64Å; L520-F546 HydrophobicContact CD1-CE2 4.29Å; L520-F546 HydrophobicContact CD1-CG 4.04Å
521	E	86.6	Confident	83.5	Confident	81 Å²	81	74.6 Å²	74.6	38%	0.379	37%	0.371	S	S	.	.	H	α-helix	trans	-66	-43.2	175.2	-165.1	60.1	-142	0	0	112	R517 V518 I519 D524 Q525 K543	R517-E521 PolarHBondContact O-N 3.1Å; V518-E521 PolarHBondContact O-N 3Å; I519-E521 VanDerWaalsContact C-N 3.28Å; I519-E521 PolarHBondContact O-N 3.4Å; E521-D524 PolarHBondContact O-N 3.16Å; E521-Q525 WeakPolarHBondContact O-CG 3.05Å; E521-Q525 PolarHBondContact O-N 2.74Å; E521-Q525 VanDerWaalsContact O-N 3.15Å; E521-K543 IonicContact OE1-NZ 2.88Å; E521-K543 PolarHBondContact OE1-NZ 3.02Å; E521-K543 WeakPolarHBondContact OE2-CE 3.3Å; E521-K543 IonicContact OE2-NZ 2.96Å; E521-K543 PolarHBondContact OE2-NZ 3.29Å
522	Y	82.9	Confident	82.8	Confident	118 Å²	118	79 Å²	79	46%	0.463	40%	0.395	S	S	.	.	H	α-helix	trans	-63.4	-44.9	175.9	175.8	-103.2	0	0	0	112.4	V518 I519 Q525 R526	V518-Y522 PolarHBondContact O-N 3.15Å; I519-Y522 PolarHBondContact O-N 3.42Å; Y522-Q525 PolarHBondContact O-N 3.25Å; Y522-R526 HydrophobicContact CE1-CG 4.09Å; Y522-R526 HydrophobicContact CE2-CG 4.3Å; Y522-R526 PolarHBondContact O-N 2.78Å; Y522-R526 VanDerWaalsContact O-N 3.1Å; Y522-R526 PolarHBondContact OH-NE 3.05Å; Y522-R526 PolarHBondContact OH-NH2 2.94Å; Y522-R526 VanDerWaalsContact OH-NH2 3.08Å
523	L	82.9	Confident	82.2	Confident	71 Å²	71	84 Å²	84	37%	0.372	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-42.2	178	-71.9	176.3	0	0	0	111.4	I519 Q525 R526 L527 M539	I519-L523 HydrophobicContact CG2-CD1 3.9Å; I519-L523 HydrophobicContact CG2-CG 4.18Å; I519-L523 WeakPolarHBondContact O-CB 3.39Å; I519-L523 VanDerWaalsContact O-CG 3.3Å; I519-L523 WeakPolarHBondContact O-CG 3.41Å; I519-L523 PolarHBondContact O-N 3.08Å; L523-Q525 VanDerWaalsContact C-N 3.32Å; L523-Q525 PolarHBondContact O-N 2.83Å; L523-R526 PolarHBondContact O-N 2.93Å; L523-R526 VanDerWaalsContact O-N 3.16Å; L523-L527 HydrophobicContact CB-CD1 4.48Å; L523-L527 WeakPolarHBondContact O-CB 3.33Å; L523-L527 VanDerWaalsContact O-CG 3.23Å; L523-L527 WeakPolarHBondContact O-CG 3.24Å; L523-L527 PolarHBondContact O-N 3.47Å; L523-M539 HydrophobicContact CB-CE 3.89Å
524	D	82.4	Confident	81.7	Confident	30 Å²	30	90.7 Å²	90.7	16%	0.16	44%	0.442	C	S	.	.	H	α-helix	trans	-59.4	-43	175.6	-176.1	64.2	0	0	0	112	L520 E521 R526 L527 K528 M539 K543	L520-D524 WeakPolarHBondContact O-CB 3.5Å; L520-D524 PolarHBondContact O-N 3.01Å; E521-D524 PolarHBondContact O-N 3.16Å; D524-R526 VanDerWaalsContact C-N 3.31Å; D524-R526 PolarHBondContact O-N 3.41Å; D524-L527 PolarHBondContact O-N 3.11Å; D524-K528 WeakPolarHBondContact O-CG 3.32Å; D524-K528 PolarHBondContact O-N 3.37Å; D524-K528 VanDerWaalsContact O-N 3.08Å; D524-M539 HydrophobicContact CB-CG 3.76Å; D524-M539 HydrophobicContact CB-SD 4.43Å; D524-K543 IonicContact OD1-NZ 2.6Å; D524-K543 IonicContact OD2-NZ 3.74Å; D524-K543 PolarHBondContact OD2-NZ 2.99Å
525	Q	78.9	Confident	81	Confident	114 Å²	114	91.2 Å²	91.2	53%	0.533	45%	0.45	S	S	.	.	H	α-helix	trans	-61.9	-38.4	175.7	-70.9	-179.2	6.1	0	0	112.6	E521 Y522 L523	E521-Q525 WeakPolarHBondContact O-CG 3.05Å; E521-Q525 PolarHBondContact O-N 2.74Å; E521-Q525 VanDerWaalsContact O-N 3.15Å; Y522-Q525 PolarHBondContact O-N 3.25Å; L523-Q525 VanDerWaalsContact C-N 3.32Å; L523-Q525 PolarHBondContact O-N 2.83Å
526	R	77.3	Confident	80.6	Confident	167 Å²	167	94.8 Å²	94.8	63%	0.63	47%	0.465	S	S	*	.	H	α-helix	trans	-72.1	-35.4	176.7	-71.3	-68.4	-171.2	171.5	1.5	112.8	Y522 L523 D524 K528	Y522-R526 HydrophobicContact CE1-CG 4.09Å; Y522-R526 HydrophobicContact CE2-CG 4.3Å; Y522-R526 PolarHBondContact O-N 2.78Å; Y522-R526 VanDerWaalsContact O-N 3.1Å; Y522-R526 PolarHBondContact OH-NE 3.05Å; Y522-R526 PolarHBondContact OH-NH2 2.94Å; Y522-R526 VanDerWaalsContact OH-NH2 3.08Å; L523-R526 PolarHBondContact O-N 2.93Å; L523-R526 VanDerWaalsContact O-N 3.16Å; D524-R526 VanDerWaalsContact C-N 3.31Å; D524-R526 PolarHBondContact O-N 3.41Å; R526-K528 VanDerWaalsContact C-N 3.31Å; R526-K528 PolarHBondContact O-N 3.21Å
527	L	73.7	Confident	80.3	Confident	71 Å²	71	96.1 Å²	96.1	37%	0.372	48%	0.478	S	S	.	.	H	α-helix	trans	-82.2	-5.1	-179	-68.1	168.3	0	0	0	113.3	L523 D524 A529 A530 M539	L523-L527 HydrophobicContact CB-CD1 4.48Å; L523-L527 WeakPolarHBondContact O-CB 3.33Å; L523-L527 VanDerWaalsContact O-CG 3.23Å; L523-L527 WeakPolarHBondContact O-CG 3.24Å; L523-L527 PolarHBondContact O-N 3.47Å; D524-L527 PolarHBondContact O-N 3.11Å; L527-A529 PolarHBondContact O-N 3.18Å; L527-A530 PolarHBondContact O-N 3.23Å; L527-M539 HydrophobicContact CD1-CE 4.02Å
528	K	68	Low	80	Confident	132 Å²	132	95.6 Å²	95.6	57%	0.574	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.9	172.7	-82.9	172.2	-171.1	-178.7	0	113.4	D524 R526 A530	D524-K528 WeakPolarHBondContact O-CG 3.32Å; D524-K528 PolarHBondContact O-N 3.37Å; D524-K528 VanDerWaalsContact O-N 3.08Å; R526-K528 VanDerWaalsContact C-N 3.31Å; R526-K528 PolarHBondContact O-N 3.21Å; K528-A530 VanDerWaalsContact C-N 3.33Å
529	A	63.3	Low	79.9	Confident	96 Å²	96	92.9 Å²	92.9	79%	0.793	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.5	175.2	0	0	0	0	0	113.7	L527	L527-A529 PolarHBondContact O-N 3.18Å
530	A	65.7	Low	79.8	Confident	45 Å²	45	93.5 Å²	93.5	37%	0.372	47%	0.472	S	S	.	.	S	Bend	trans	-96.6	128.8	178.8	0	0	0	0	0	110.9	L527 K528 N532	L527-A530 PolarHBondContact O-N 3.23Å; K528-A530 VanDerWaalsContact C-N 3.33Å; A530-N532 VanDerWaalsContact C-N 3.27Å; A530-N532 PolarHBondContact O-N 3.1Å
531	E	69.8	Low	79.9	Confident	184 Å²	184	96 Å²	96	86%	0.86	49%	0.491	S	S	*	.			trans	-85.3	26.9	-176	-64.3	-153	147.7	0	0	115	K533	E531-K533 PolarHBondContact O-N 3.24Å
532	N	81.8	Confident	80	Confident	94 Å²	94	95 Å²	95	50%	0.503	49%	0.488	S	S	.	.			trans	-84.2	108.8	179.6	-166.6	-24.3	0	0	0	112.1	A530 F534 A535 K536	A530-N532 VanDerWaalsContact C-N 3.27Å; A530-N532 PolarHBondContact O-N 3.1Å; N532-F534 VanDerWaalsContact C-N 3.34Å; N532-F534 PolarHBondContact O-N 2.93Å; N532-F534 PolarHBondContact OD1-N 3.49Å; N532-A535 HydrophobicContact CB-CB 4.1Å; N532-A535 PolarHBondContact O-N 3.35Å; N532-K536 PolarHBondContact O-N 3.27Å
533	K	82.9	Confident	80.3	Confident	183 Å²	183	91.1 Å²	91.1	80%	0.796	47%	0.473	S	S	*	.	H	α-helix	trans	-60.5	-36.7	179.6	-65.2	-179.5	-178.2	177.5	0	113.3	E531 K536 C537	E531-K533 PolarHBondContact O-N 3.24Å; K533-K536 PolarHBondContact O-N 3.09Å; K533-C537 PolarHBondContact O-N 3.23Å; K533-C537 VanDerWaalsContact O-N 3.11Å
534	F	83.8	Confident	80.6	Confident	149 Å²	149	91.3 Å²	91.3	65%	0.654	48%	0.479	S	S	*	.	H	α-helix	trans	-67	-44.7	179.2	177.2	-100.3	0	0	0	111.5	N532 K536 C537 L538	N532-F534 VanDerWaalsContact C-N 3.34Å; N532-F534 PolarHBondContact O-N 2.93Å; N532-F534 PolarHBondContact OD1-N 3.49Å; F534-K536 VanDerWaalsContact C-N 3.3Å; F534-K536 PolarHBondContact O-N 2.91Å; F534-C537 PolarHBondContact O-N 3.21Å; F534-L538 HydrophobicContact CE1-CD2 4.41Å; F534-L538 PolarHBondContact O-N 3.08Å
535	A	81.7	Confident	81.1	Confident	33 Å²	33	93.2 Å²	93.2	27%	0.273	49%	0.494	S	S	.	.	H	α-helix	trans	-60.8	-39.5	177.2	0	0	0	0	0	112	N532 M539	N532-A535 HydrophobicContact CB-CB 4.1Å; N532-A535 PolarHBondContact O-N 3.35Å; A535-M539 VanDerWaalsContact O-CB 3.27Å; A535-M539 WeakPolarHBondContact O-CB 3.47Å; A535-M539 PolarHBondContact O-N 3.31Å
536	K	83.1	Confident	81.7	Confident	98 Å²	98	90 Å²	90	43%	0.426	48%	0.479	S	S	.	.	H	α-helix	trans	-63.4	-42.6	174.8	-70.2	179.6	-179.6	179.1	0	112.3	N532 K533 F534 T540	N532-K536 PolarHBondContact O-N 3.27Å; K533-K536 PolarHBondContact O-N 3.09Å; F534-K536 VanDerWaalsContact C-N 3.3Å; F534-K536 PolarHBondContact O-N 2.91Å; K536-T540 WeakPolarHBondContact O-CB 3.47Å; K536-T540 PolarHBondContact O-N 2.89Å; K536-T540 PolarHBondContact O-OG1 3.34Å
537	C	84.9	Confident	82.3	Confident	86 Å²	86	87.7 Å²	87.7	58%	0.581	47%	0.47	S	S	*	.	H	α-helix	trans	-63.3	-50.3	176.3	-175.7	0	0	0	0	111.7	K533 F534 M539 T540 C541	K533-C537 PolarHBondContact O-N 3.23Å; K533-C537 VanDerWaalsContact O-N 3.11Å; F534-C537 PolarHBondContact O-N 3.21Å; C537-M539 VanDerWaalsContact C-N 3.34Å; C537-M539 PolarHBondContact O-N 3.3Å; C537-T540 PolarHBondContact O-N 3.15Å; C537-C541 PolarHBondContact O-N 2.83Å
538	L	86.8	Confident	83.2	Confident	86 Å²	86	87.2 Å²	87.2	45%	0.45	47%	0.472	S	S	.	.	H	α-helix	trans	-59.3	-44.4	178.6	179.4	62.3	0	0	0	111.8	F534 T540 C541 L542	F534-L538 HydrophobicContact CE1-CD2 4.41Å; F534-L538 PolarHBondContact O-N 3.08Å; L538-T540 VanDerWaalsContact C-N 3.34Å; L538-T540 PolarHBondContact O-N 2.63Å; L538-C541 PolarHBondContact O-N 3.36Å; L538-L542 HydrophobicContact CD1-CD1 4.22Å; L538-L542 HydrophobicContact CD1-CG 4.21Å; L538-L542 HydrophobicContact CG-CD1 4.08Å; L538-L542 HydrophobicContact CG-CG 4.46Å; L538-L542 WeakPolarHBondContact O-CG 3.08Å; L538-L542 PolarHBondContact O-N 2.96Å
539	M	86	Confident	84.4	Confident	18 Å²	18	84.1 Å²	84.1	9%	0.089	46%	0.461	C	S	.	.	H	α-helix	trans	-62.4	-41.8	178.1	-169.6	57.4	66.7	0	0	111.7	L520 L523 D524 L527 A535 C537 C541 L542 K543	L520-M539 HydrophobicContact CB-SD 4.07Å; L520-M539 HydrophobicContact CD2-CE 4.31Å; L520-M539 HydrophobicContact CD2-SD 3.69Å; L520-M539 HydrophobicContact CG-SD 4.49Å; L523-M539 HydrophobicContact CB-CE 3.89Å; D524-M539 HydrophobicContact CB-CG 3.76Å; D524-M539 HydrophobicContact CB-SD 4.43Å; L527-M539 HydrophobicContact CD1-CE 4.02Å; A535-M539 VanDerWaalsContact O-CB 3.27Å; A535-M539 WeakPolarHBondContact O-CB 3.47Å; A535-M539 PolarHBondContact O-N 3.31Å; C537-M539 VanDerWaalsContact C-N 3.34Å; C537-M539 PolarHBondContact O-N 3.3Å; M539-C541 PolarHBondContact O-N 2.99Å; M539-L542 PolarHBondContact O-N 3.4Å; M539-K543 HydrophobicContact CG-CD 4.48Å; M539-K543 WeakPolarHBondContact O-CB 3.36Å; M539-K543 VanDerWaalsContact O-CG 3.26Å; M539-K543 WeakPolarHBondContact O-CG 3.4Å; M539-K543 PolarHBondContact O-N 3.22Å
540	T	85.3	Confident	85.8	Confident	91 Å²	91	80 Å²	80	56%	0.558	43%	0.426	S	S	*	.	H	α-helix	trans	-63	-42.9	176.2	-55.5	0	0	0	0	111.5	K536 C537 L538 C544	K536-T540 WeakPolarHBondContact O-CB 3.47Å; K536-T540 PolarHBondContact O-N 2.89Å; K536-T540 PolarHBondContact O-OG1 3.34Å; C537-T540 PolarHBondContact O-N 3.15Å; L538-T540 VanDerWaalsContact C-N 3.34Å; L538-T540 PolarHBondContact O-N 2.63Å; T540-C544 PolarHBondContact O-N 3.36Å; T540-C544 VanDerWaalsContact O-N 3.1Å
541	C	89.3	Confident	87	Confident	70 Å²	70	83.1 Å²	83.1	47%	0.473	43%	0.431	S	S	.	.	H	α-helix	trans	-62.6	-50.4	176.5	-175.9	0	0	0	0	111.7	C537 L538 M539 K543 C544 C545	C537-C541 PolarHBondContact O-N 2.83Å; L538-C541 PolarHBondContact O-N 3.36Å; M539-C541 PolarHBondContact O-N 2.99Å; C541-K543 PolarHBondContact O-N 2.91Å; C541-C544 WeakPolarHBondContact O-CB 3.37Å; C541-C544 PolarHBondContact O-N 2.95Å; C541-C544 VanDerWaalsContact O-N 3.15Å; C541-C545 PolarHBondContact O-N 2.94Å; C541-C545 PolarHBondContact O-SG 3.43Å; C541-C545 VanDerWaalsContact O-SG 3.34Å
542	L	89.8	Confident	88.1	Confident	59 Å²	59	78.9 Å²	78.9	31%	0.309	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-43.6	178.8	-71.4	174.8	0	0	0	112	L520 L538 M539 C544 C545 F546	L520-L542 HydrophobicContact CD1-CB 4.05Å; L520-L542 HydrophobicContact CD2-CB 4.17Å; L520-L542 HydrophobicContact CD2-CD1 4.13Å; L538-L542 HydrophobicContact CD1-CD1 4.22Å; L538-L542 HydrophobicContact CD1-CG 4.21Å; L538-L542 HydrophobicContact CG-CD1 4.08Å; L538-L542 HydrophobicContact CG-CG 4.46Å; L538-L542 WeakPolarHBondContact O-CG 3.08Å; L538-L542 PolarHBondContact O-N 2.96Å; M539-L542 PolarHBondContact O-N 3.4Å; L542-C544 VanDerWaalsContact C-N 3.31Å; L542-C544 PolarHBondContact O-N 3.43Å; L542-C545 PolarHBondContact O-N 3.05Å; L542-F546 HydrophobicContact CD2-CE2 4.44Å; L542-F546 WeakPolarHBondContact O-CB 3.36Å; L542-F546 WeakPolarHBondContact O-CD2 3.44Å; L542-F546 PolarHBondContact O-N 3.38Å
543	K	88.8	Confident	88.7	Confident	36 Å²	36	75.4 Å²	75.4	16%	0.157	39%	0.391	C	S	.	.	H	α-helix	trans	-57.5	-44	174.9	-76.7	-178.1	178.6	-159.3	0	111.8	L520 E521 D524 M539 C541 W547	L520-K543 HydrophobicContact CB-CG 4.25Å; L520-K543 WeakPolarHBondContact O-CE 3.41Å; E521-K543 IonicContact OE1-NZ 2.88Å; E521-K543 PolarHBondContact OE1-NZ 3.02Å; E521-K543 WeakPolarHBondContact OE2-CE 3.3Å; E521-K543 IonicContact OE2-NZ 2.96Å; E521-K543 PolarHBondContact OE2-NZ 3.29Å; D524-K543 IonicContact OD1-NZ 2.6Å; D524-K543 IonicContact OD2-NZ 3.74Å; D524-K543 PolarHBondContact OD2-NZ 2.99Å; M539-K543 HydrophobicContact CG-CD 4.48Å; M539-K543 WeakPolarHBondContact O-CB 3.36Å; M539-K543 VanDerWaalsContact O-CG 3.26Å; M539-K543 WeakPolarHBondContact O-CG 3.4Å; M539-K543 PolarHBondContact O-N 3.22Å; C541-K543 PolarHBondContact O-N 2.91Å; K543-W547 WeakPolarHBondContact O-CB 3.48Å; K543-W547 PolarHBondContact O-N 2.89Å
544	C	90	Very high	89.2	Confident	75 Å²	75	70.3 Å²	70.3	51%	0.507	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-49.1	176.4	-173.9	0	0	0	0	111.6	T540 C541 L542 F546 W547 C548	T540-C544 PolarHBondContact O-N 3.36Å; T540-C544 VanDerWaalsContact O-N 3.1Å; C541-C544 WeakPolarHBondContact O-CB 3.37Å; C541-C544 PolarHBondContact O-N 2.95Å; C541-C544 VanDerWaalsContact O-N 3.15Å; L542-C544 VanDerWaalsContact C-N 3.31Å; L542-C544 PolarHBondContact O-N 3.43Å; C544-F546 PolarHBondContact O-N 2.97Å; C544-W547 PolarHBondContact O-N 3.28Å; C544-C548 PolarHBondContact O-N 3.31Å; C544-C548 PolarHBondContact O-SG 2.03Å; C544-C548 VanDerWaalsContact O-SG 3.37Å
545	C	91.9	Very high	89.6	Confident	70 Å²	70	66.7 Å²	66.7	47%	0.473	35%	0.353	S	S	.	.	H	α-helix	trans	-60.3	-46.5	179.6	-68.3	0	0	0	0	112.6	C541 L542 W547 C548 L549	C541-C545 PolarHBondContact O-N 2.94Å; C541-C545 PolarHBondContact O-SG 3.43Å; C541-C545 VanDerWaalsContact O-SG 3.34Å; L542-C545 PolarHBondContact O-N 3.05Å; C545-W547 VanDerWaalsContact C-N 3.35Å; C545-C548 PolarHBondContact O-N 3.44Å; C545-L549 WeakPolarHBondContact O-CB 3.33Å; C545-L549 PolarHBondContact O-N 2.91Å
546	F	91.3	Very high	90.2	Very high	46 Å²	46	66.6 Å²	66.6	20%	0.202	35%	0.348	C	S	.	.	H	α-helix	trans	-70.6	-30.9	178.7	-85.7	-85.3	0	0	0	112.7	V513 I516 L520 L542 C544 L549 E550	V513-F546 HydrophobicContact CG1-CD1 4.28Å; I516-F546 HydrophobicContact CB-CD1 4.04Å; I516-F546 HydrophobicContact CB-CE1 3.85Å; I516-F546 HydrophobicContact CB-CZ 4.43Å; I516-F546 HydrophobicContact CD1-CE1 3.69Å; I516-F546 HydrophobicContact CD1-CZ 4.2Å; I516-F546 HydrophobicContact CG1-CE1 4.37Å; I516-F546 HydrophobicContact CG2-CD1 3.68Å; I516-F546 HydrophobicContact CG2-CD2 4.17Å; I516-F546 HydrophobicContact CG2-CE1 3.4Å; I516-F546 VanDerWaalsContact CG2-CE1 3.4Å; I516-F546 HydrophobicContact CG2-CE2 3.91Å; I516-F546 HydrophobicContact CG2-CG 4.07Å; I516-F546 HydrophobicContact CG2-CZ 3.53Å; L520-F546 HydrophobicContact CD1-CB 4.24Å; L520-F546 HydrophobicContact CD1-CD2 3.64Å; L520-F546 HydrophobicContact CD1-CE2 4.29Å; L520-F546 HydrophobicContact CD1-CG 4.04Å; L542-F546 HydrophobicContact CD2-CE2 4.44Å; L542-F546 WeakPolarHBondContact O-CB 3.36Å; L542-F546 WeakPolarHBondContact O-CD2 3.44Å; L542-F546 PolarHBondContact O-N 3.38Å; C544-F546 PolarHBondContact O-N 2.97Å; F546-L549 HydrophobicContact CD1-CD2 4.25Å; F546-L549 HydrophobicContact CE1-CD2 4.22Å; F546-L549 PolarHBondContact O-N 3Å; F546-E550 WeakPolarHBondContact O-CB 3.47Å; F546-E550 PolarHBondContact O-N 3.36Å
547	W	91.6	Very high	90.8	Very high	120 Å²	120	62.1 Å²	62.1	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-45.2	170.2	-178.9	88.2	0	0	0	111.6	K543 C544 C545 E550 K551	K543-W547 WeakPolarHBondContact O-CB 3.48Å; K543-W547 PolarHBondContact O-N 2.89Å; C544-W547 PolarHBondContact O-N 3.28Å; C545-W547 VanDerWaalsContact C-N 3.35Å; W547-E550 PolarHBondContact O-N 2.99Å; W547-K551 HydrophobicContact CD2-CG 4.49Å; W547-K551 HydrophobicContact CZ2-CG 4.42Å; W547-K551 WeakPolarHBondContact O-CG 3.32Å; W547-K551 PolarHBondContact O-N 2.91Å; W547-K551 VanDerWaalsContact O-N 3.13Å
548	C	91.1	Very high	91.2	Very high	61 Å²	61	61.3 Å²	61.3	41%	0.412	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-43.6	174	-71.2	0	0	0	0	111.7	C544 C545 K551 F552	C544-C548 PolarHBondContact O-N 3.31Å; C544-C548 PolarHBondContact O-SG 2.03Å; C544-C548 VanDerWaalsContact O-SG 3.37Å; C545-C548 PolarHBondContact O-N 3.44Å; C548-K551 PolarHBondContact O-N 3.08Å; C548-F552 WeakPolarHBondContact O-CB 3.42Å; C548-F552 PolarHBondContact O-N 2.97Å
549	L	93.4	Very high	91.6	Very high	66 Å²	66	57.8 Å²	57.8	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-45.1	177.2	-177.7	62.2	0	0	0	111.4	V513 C545 F546 K551 F552 I553	V513-L549 HydrophobicContact CG1-CB 4.46Å; V513-L549 HydrophobicContact CG1-CD2 4.28Å; V513-L549 HydrophobicContact CG1-CG 4.21Å; V513-L549 HydrophobicContact CG2-CD2 3.89Å; V513-L549 HydrophobicContact CG2-CG 4.17Å; C545-L549 WeakPolarHBondContact O-CB 3.33Å; C545-L549 PolarHBondContact O-N 2.91Å; F546-L549 HydrophobicContact CD1-CD2 4.25Å; F546-L549 HydrophobicContact CE1-CD2 4.22Å; F546-L549 PolarHBondContact O-N 3Å; L549-K551 VanDerWaalsContact C-N 3.28Å; L549-K551 PolarHBondContact O-N 3.36Å; L549-F552 PolarHBondContact O-N 2.95Å; L549-I553 HydrophobicContact CD1-CD1 4.28Å; L549-I553 HydrophobicContact CD1-CG1 3.96Å; L549-I553 HydrophobicContact CG-CG1 4.22Å; L549-I553 WeakPolarHBondContact O-CB 3.09Å; L549-I553 VanDerWaalsContact O-CG1 3.3Å; L549-I553 WeakPolarHBondContact O-CG1 3.33Å; L549-I553 PolarHBondContact O-N 2.92Å
550	E	93.6	Very high	92.1	Very high	10 Å²	10	57 Å²	57	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-43.2	176.3	-170.1	-166.8	150.8	0	0	111.2	L510 V513 Q514 R517 F546 W547 K554	L510-E550 HydrophobicContact CD1-CG 3.97Å; V513-E550 HydrophobicContact CG1-CB 3.86Å; V513-E550 HydrophobicContact CG1-CG 4.44Å; Q514-E550 HydrophobicContact CG-CG 4.27Å; R517-E550 VanDerWaalsContact CD-OE2 3.23Å; R517-E550 WeakPolarHBondContact CD-OE2 3.24Å; R517-E550 IonicContact CZ-OE2 3.95Å; R517-E550 IonicContact NE-OE2 2.68Å; R517-E550 IonicContact NH1-OE1 3.99Å; R517-E550 IonicContact NH1-OE2 2.81Å; R517-E550 PolarHBondContact NH1-OE2 3.5Å; F546-E550 WeakPolarHBondContact O-CB 3.47Å; F546-E550 PolarHBondContact O-N 3.36Å; W547-E550 PolarHBondContact O-N 2.99Å; E550-K554 HydrophobicContact CG-CD 4.33Å; E550-K554 WeakPolarHBondContact O-CB 2.96Å; E550-K554 VanDerWaalsContact O-CG 3.29Å; E550-K554 WeakPolarHBondContact O-CG 3.04Å; E550-K554 PolarHBondContact O-N 3.01Å; E550-K554 WeakPolarHBondContact OE1-CE 3.39Å; E550-K554 IonicContact OE1-NZ 3.22Å; E550-K554 PolarHBondContact OE1-NZ 3.14Å
551	K	90.6	Very high	92.7	Very high	111 Å²	111	52.8 Å²	52.8	48%	0.483	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-43.9	177.1	-68.5	-65	-175.2	175.6	0	112.1	W547 C548 L549 K554 F555	W547-K551 HydrophobicContact CD2-CG 4.49Å; W547-K551 HydrophobicContact CZ2-CG 4.42Å; W547-K551 WeakPolarHBondContact O-CG 3.32Å; W547-K551 PolarHBondContact O-N 2.91Å; W547-K551 VanDerWaalsContact O-N 3.13Å; C548-K551 PolarHBondContact O-N 3.08Å; L549-K551 VanDerWaalsContact C-N 3.28Å; L549-K551 PolarHBondContact O-N 3.36Å; K551-K554 PolarHBondContact O-N 2.88Å; K551-F555 PolarHBondContact O-N 3.47Å
552	F	92.1	Very high	93	Very high	95 Å²	95	49.5 Å²	49.5	42%	0.417	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-46.1	177.4	177.8	-103.7	0	0	0	112.1	C548 L549 K554 F555 L556 F579	C548-F552 WeakPolarHBondContact O-CB 3.42Å; C548-F552 PolarHBondContact O-N 2.97Å; L549-F552 PolarHBondContact O-N 2.95Å; F552-K554 PolarHBondContact O-N 3.42Å; F552-F555 WeakPolarHBondContact O-CB 3.07Å; F552-F555 PolarHBondContact O-N 2.99Å; F552-L556 PolarHBondContact O-N 2.89Å; F552-F579 HydrophobicContact CE2-CE2 4.31Å; F552-F579 HydrophobicContact CZ-CE2 4.32Å
553	I	94.7	Very high	93.3	Very high	20 Å²	20	46.9 Å²	46.9	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-40.5	177.4	-64.8	-59.8	0	0	0	110.9	I509 L510 L549 F555 L556 N557	I509-I553 HydrophobicContact CG2-CD1 4.14Å; I509-I553 HydrophobicContact CG2-CG1 4.45Å; I509-I553 HydrophobicContact CG2-CG2 3.97Å; L510-I553 HydrophobicContact CB-CG2 4.16Å; L510-I553 HydrophobicContact CD1-CB 4.48Å; L510-I553 HydrophobicContact CD1-CG2 4.08Å; L549-I553 HydrophobicContact CD1-CD1 4.28Å; L549-I553 HydrophobicContact CD1-CG1 3.96Å; L549-I553 HydrophobicContact CG-CG1 4.22Å; L549-I553 WeakPolarHBondContact O-CB 3.09Å; L549-I553 VanDerWaalsContact O-CG1 3.3Å; L549-I553 WeakPolarHBondContact O-CG1 3.33Å; L549-I553 PolarHBondContact O-N 2.92Å; I553-F555 VanDerWaalsContact C-N 3.32Å; I553-F555 PolarHBondContact O-N 3.36Å; I553-L556 PolarHBondContact O-N 3.19Å; I553-N557 VanDerWaalsContact O-CB 3.26Å; I553-N557 WeakPolarHBondContact O-CB 3.5Å; I553-N557 VanDerWaalsContact O-CG 3.24Å; I553-N557 PolarHBondContact O-N 2.88Å; I553-N557 PolarHBondContact O-OD1 3.48Å
554	K	93.9	Very high	93.6	Very high	77 Å²	77	45.2 Å²	45.2	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-59.1	-43	173.3	-80.1	174.2	171.1	175.2	0	112.2	L510 E550 K551 F552 R558	L510-K554 HydrophobicContact CD1-CD 4.48Å; L510-K554 HydrophobicContact CD1-CG 3.78Å; L510-K554 HydrophobicContact CD2-CG 3.8Å; L510-K554 HydrophobicContact CG-CG 4.49Å; E550-K554 HydrophobicContact CG-CD 4.33Å; E550-K554 WeakPolarHBondContact O-CB 2.96Å; E550-K554 VanDerWaalsContact O-CG 3.29Å; E550-K554 WeakPolarHBondContact O-CG 3.04Å; E550-K554 PolarHBondContact O-N 3.01Å; E550-K554 WeakPolarHBondContact OE1-CE 3.39Å; E550-K554 IonicContact OE1-NZ 3.22Å; E550-K554 PolarHBondContact OE1-NZ 3.14Å; K551-K554 PolarHBondContact O-N 2.88Å; F552-K554 PolarHBondContact O-N 3.42Å; K554-R558 WeakPolarHBondContact O-CB 3.24Å; K554-R558 PolarHBondContact O-N 3.3Å
555	F	91.5	Very high	93.9	Very high	72 Å²	72	41.8 Å²	41.8	32%	0.316	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-48	175.2	171.3	-95.6	0	0	0	111.6	K551 F552 I553 R558 N559 L582	K551-F555 PolarHBondContact O-N 3.47Å; F552-F555 WeakPolarHBondContact O-CB 3.07Å; F552-F555 PolarHBondContact O-N 2.99Å; I553-F555 VanDerWaalsContact C-N 3.32Å; I553-F555 PolarHBondContact O-N 3.36Å; F555-R558 PolarHBondContact O-N 3.38Å; F555-N559 WeakPolarHBondContact CE2-ND2 3.25Å; F555-N559 PolarHBondContact O-N 3.34Å; F555-N559 PolarHBondContact O-ND2 3.24Å; F555-L582 HydrophobicContact CE1-CD1 4.22Å; F555-L582 HydrophobicContact CZ-CD1 3.75Å
556	L	93.9	Very high	93.9	Very high	31 Å²	31	38.4 Å²	38.4	16%	0.162	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-49.1	179.4	-174.8	67.6	0	0	0	111.5	F552 I553 R558 N559 A560 A575 F579	F552-L556 PolarHBondContact O-N 2.89Å; I553-L556 PolarHBondContact O-N 3.19Å; L556-R558 PolarHBondContact O-N 2.97Å; L556-N559 PolarHBondContact O-N 2.83Å; L556-A560 VanDerWaalsContact O-CB 3.28Å; L556-A560 WeakPolarHBondContact O-CB 3.3Å; L556-A560 PolarHBondContact O-N 3.2Å; L556-A575 HydrophobicContact CD1-CB 4.11Å; L556-A575 HydrophobicContact CD2-CB 4.4Å; L556-A575 HydrophobicContact CG-CB 4.16Å; L556-F579 HydrophobicContact CD1-CB 4.09Å; L556-F579 HydrophobicContact CD1-CD2 4.47Å
557	N	95.8	Very high	93.9	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-50	178.6	-77.6	8.4	0	0	0	111.2	G506 I553 N559 A560 Y561 F571	G506-N557 PolarHBondContact O-ND2 3.21Å; I553-N557 VanDerWaalsContact O-CB 3.26Å; I553-N557 WeakPolarHBondContact O-CB 3.5Å; I553-N557 VanDerWaalsContact O-CG 3.24Å; I553-N557 PolarHBondContact O-N 2.88Å; I553-N557 PolarHBondContact O-OD1 3.48Å; N557-N559 VanDerWaalsContact C-N 3.31Å; N557-N559 PolarHBondContact O-N 3.07Å; N557-A560 PolarHBondContact O-N 2.93Å; N557-Y561 HydrophobicContact CB-CD2 4.38Å; N557-Y561 HydrophobicContact CB-CE2 3.74Å; N557-Y561 WeakPolarHBondContact O-CB 3.38Å; N557-Y561 WeakPolarHBondContact O-CD2 3.41Å; N557-Y561 PolarHBondContact O-N 3.48Å; N557-F571 WeakPolarHBondContact OD1-CZ 3.41Å
558	R	94.6	Very high	93.9	Very high	69 Å²	69	32.5 Å²	32.5	26%	0.26	16%	0.155	S	C	.	.	H	α-helix	trans	-55.8	-45.8	-179.1	-176.4	171.6	179.6	166.2	-3.5	111.7	K554 F555 L556 I562 G659 M660 D663	K554-R558 WeakPolarHBondContact O-CB 3.24Å; K554-R558 PolarHBondContact O-N 3.3Å; F555-R558 PolarHBondContact O-N 3.38Å; L556-R558 PolarHBondContact O-N 2.97Å; R558-I562 WeakPolarHBondContact O-CG1 3.47Å; R558-I562 PolarHBondContact O-N 2.02Å; R558-G659 VanDerWaalsContact NH2-C 3.34Å; R558-G659 PolarHBondContact NH2-O 3.23Å; R558-M660 HydrophobicContact CG-CE 4.47Å; R558-M660 HydrophobicContact CG-SD 4.05Å; R558-M660 PolarHBondContact NE-SD 3.15Å; R558-M660 VanDerWaalsContact NE-SD 3.41Å; R558-D663 IonicContact CZ-OD2 3.33Å; R558-D663 IonicContact NE-OD2 3.87Å; R558-D663 PolarHBondContact NE-OD2 3.36Å; R558-D663 IonicContact NH1-OD2 3.85Å; R558-D663 IonicContact NH2-OD2 2.83Å; R558-D663 PolarHBondContact NH2-OD2 3.5Å
559	N	95	Very high	94	Very high	13 Å²	13	31.8 Å²	31.8	7%	0.07	15%	0.149	C	C	.	.	H	α-helix	trans	-75.6	-34.9	179.9	-67.4	-72.9	0	0	0	112.9	F555 L556 N557 Y561 I562 M563 A578 L582	F555-N559 WeakPolarHBondContact CE2-ND2 3.25Å; F555-N559 PolarHBondContact O-N 3.34Å; F555-N559 PolarHBondContact O-ND2 3.24Å; L556-N559 PolarHBondContact O-N 2.83Å; N557-N559 VanDerWaalsContact C-N 3.31Å; N557-N559 PolarHBondContact O-N 3.07Å; N559-Y561 VanDerWaalsContact C-N 3.34Å; N559-I562 PolarHBondContact O-N 2.87Å; N559-M563 PolarHBondContact O-N 3.4Å; N559-A578 HydrophobicContact CB-CB 3.92Å; N559-L582 HydrophobicContact CB-CD1 3.82Å; N559-L582 VanDerWaalsContact CG-CD1 3.41Å
560	A	96.8	Very high	94	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-44.3	172.9	0	0	0	0	0	111.1	L556 N557 I562 M563 I564 F571 A575	L556-A560 VanDerWaalsContact O-CB 3.28Å; L556-A560 WeakPolarHBondContact O-CB 3.3Å; L556-A560 PolarHBondContact O-N 3.2Å; N557-A560 PolarHBondContact O-N 2.93Å; A560-I562 VanDerWaalsContact C-N 3.29Å; A560-I562 PolarHBondContact O-N 3.22Å; A560-M563 WeakPolarHBondContact O-CB 3.27Å; A560-M563 PolarHBondContact O-N 2.93Å; A560-I564 WeakPolarHBondContact O-CG1 3.4Å; A560-I564 PolarHBondContact O-N 2.95Å; A560-F571 HydrophobicContact CB-CD2 4.37Å; A560-F571 HydrophobicContact CB-CE2 3.99Å; A560-F571 HydrophobicContact CB-CZ 4.46Å; A560-A575 HydrophobicContact CB-CB 3.77Å
561	Y	97.2	Very high	94.1	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-35.3	177.5	-65.8	-29.5	0	0	0	113.1	A460 Q463 V464 L503 G506 A507 N557 N559 I564 A565 F571	A460-Y561 HydrophobicContact CB-CD2 4.22Å; A460-Y561 HydrophobicContact CB-CE1 4.11Å; A460-Y561 HydrophobicContact CB-CE2 3.47Å; A460-Y561 VanDerWaalsContact CB-CE2 3.47Å; A460-Y561 VanDerWaalsContact CB-CZ 3.43Å; A460-Y561 WeakPolarHBondContact CB-OH 3.26Å; Q463-Y561 HydrophobicContact CB-CD2 4.04Å; V464-Y561 VanDerWaalsContact CG2-CB 3.49Å; V464-Y561 HydrophobicContact CG2-CD1 3.88Å; V464-Y561 HydrophobicContact CG2-CG 3.8Å; L503-Y561 HydrophobicContact CD2-CD1 4.35Å; L503-Y561 HydrophobicContact CD2-CE1 4.35Å; G506-Y561 WeakPolarHBondContact CA-OH 3.33Å; A507-Y561 PolarHBondContact N-OH 3.03Å; N557-Y561 HydrophobicContact CB-CD2 4.38Å; N557-Y561 HydrophobicContact CB-CE2 3.74Å; N557-Y561 WeakPolarHBondContact O-CB 3.38Å; N557-Y561 WeakPolarHBondContact O-CD2 3.41Å; N557-Y561 PolarHBondContact O-N 3.48Å; N559-Y561 VanDerWaalsContact C-N 3.34Å; Y561-I564 HydrophobicContact CD1-CD1 4.08Å; Y561-I564 PolarHBondContact O-N 2.65Å; Y561-A565 WeakPolarHBondContact O-CB 3.32Å; Y561-A565 PolarHBondContact O-N 3.41Å; Y561-F571 HydrophobicContact CE1-CD2 4.12Å; Y561-F571 HydrophobicContact CE1-CE2 4Å
562	I	96.3	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-45.5	172.4	-62.3	166.3	0	0	0	110.3	A467 R558 N559 A560 I564 A565 I566 M660 D663 T664 L667	A467-I562 HydrophobicContact CB-CB 4.28Å; A467-I562 HydrophobicContact CB-CG1 3.87Å; A467-I562 HydrophobicContact CB-CG2 4.42Å; R558-I562 WeakPolarHBondContact O-CG1 3.47Å; R558-I562 PolarHBondContact O-N 2.02Å; N559-I562 PolarHBondContact O-N 2.87Å; A560-I562 VanDerWaalsContact C-N 3.29Å; A560-I562 PolarHBondContact O-N 3.22Å; I562-I564 PolarHBondContact O-N 3.47Å; I562-A565 WeakPolarHBondContact O-CB 3.19Å; I562-A565 PolarHBondContact O-N 3.34Å; I562-A565 VanDerWaalsContact O-N 3.16Å; I562-I566 HydrophobicContact CG2-CD1 4.03Å; I562-I566 WeakPolarHBondContact O-CG1 3.16Å; I562-I566 PolarHBondContact O-N 3.22Å; I562-I566 VanDerWaalsContact O-N 3.07Å; I562-M660 HydrophobicContact CG1-CE 4.36Å; I562-D663 HydrophobicContact CD1-CB 3.82Å; I562-T664 HydrophobicContact CG2-CG2 4.17Å; I562-L667 HydrophobicContact CB-CD2 3.9Å; I562-L667 HydrophobicContact CG2-CB 4.18Å; I562-L667 HydrophobicContact CG2-CD2 3.44Å; I562-L667 VanDerWaalsContact CG2-CD2 3.44Å; I562-L667 HydrophobicContact CG2-CG 4.44Å
563	M	94.9	Very high	94.3	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-39.4	177.1	-68	-60.2	-81	0	0	112.7	N559 A560 A565 I566 Y567 N577 A578 L667	N559-M563 PolarHBondContact O-N 3.4Å; A560-M563 WeakPolarHBondContact O-CB 3.27Å; A560-M563 PolarHBondContact O-N 2.93Å; M563-A565 VanDerWaalsContact C-N 3.28Å; M563-A565 PolarHBondContact O-N 3.38Å; M563-I566 PolarHBondContact O-N 3.26Å; M563-Y567 HydrophobicContact CE-CD2 3.81Å; M563-Y567 HydrophobicContact CE-CE2 3.28Å; M563-Y567 WeakPolarHBondContact O-CD2 3.38Å; M563-Y567 PolarHBondContact O-N 3.25Å; M563-Y567 HydrophobicContact SD-CD2 4.25Å; M563-Y567 HydrophobicContact SD-CE2 3.82Å; M563-N577 HydrophobicContact CE-CB 3.76Å; M563-A578 HydrophobicContact CG-CB 3.65Å; M563-L667 HydrophobicContact CG-CD2 3.86Å; M563-L667 HydrophobicContact SD-CD2 3.49Å; M563-L667 WeakPolarHBondContact SD-CD2 3.5Å; M563-L667 HydrophobicContact SD-CG 4.49Å
564	I	95.7	Very high	94.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.9	-42.2	173	-64.5	170.3	0	0	0	109.8	R27 H499 A560 Y561 I562 I566 G568 F571 S574	R27-I564 PolarHBondContact NH1-O 2.97Å; H499-I564 HydrophobicContact CB-CG2 3.91Å; A560-I564 WeakPolarHBondContact O-CG1 3.4Å; A560-I564 PolarHBondContact O-N 2.95Å; Y561-I564 HydrophobicContact CD1-CD1 4.08Å; Y561-I564 PolarHBondContact O-N 2.65Å; I562-I564 PolarHBondContact O-N 3.47Å; I564-I566 VanDerWaalsContact C-N 3.29Å; I564-I566 PolarHBondContact O-N 3.38Å; I564-G568 VanDerWaalsContact O-CA 3.24Å; I564-G568 WeakPolarHBondContact O-CA 3.34Å; I564-G568 PolarHBondContact O-N 3.08Å; I564-F571 HydrophobicContact CD1-CD2 4.32Å; I564-S574 VanDerWaalsContact CG1-CB 3.48Å; I564-S574 VanDerWaalsContact CG1-OG 3.22Å; I564-S574 WeakPolarHBondContact CG1-OG 3.37Å; I564-S574 PolarHBondContact N-OG 3.43Å
565	A	95.4	Very high	94.4	Very high	3 Å²	3	23.4 Å²	23.4	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-35.7	179.1	0	0	0	0	0	112.5	R27 V464 A467 Y561 I562 M563	R27-A565 PolarHBondContact NH1-O 2.97Å; R27-A565 PolarHBondContact NH2-O 2.94Å; V464-A565 HydrophobicContact CG1-CB 4.14Å; A467-A565 HydrophobicContact CB-CB 3.84Å; Y561-A565 WeakPolarHBondContact O-CB 3.32Å; Y561-A565 PolarHBondContact O-N 3.41Å; I562-A565 WeakPolarHBondContact O-CB 3.19Å; I562-A565 PolarHBondContact O-N 3.34Å; I562-A565 VanDerWaalsContact O-N 3.16Å; M563-A565 VanDerWaalsContact C-N 3.28Å; M563-A565 PolarHBondContact O-N 3.38Å
566	I	92.7	Very high	94.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-78.1	-52.6	178.4	-62.3	165.7	0	0	0	111.4	F20 P23 I24 R27 A471 I562 M563 I564	F20-I566 HydrophobicContact CE2-CG2 4Å; F20-I566 HydrophobicContact CZ-CG2 3.7Å; P23-I566 VanDerWaalsContact CA-O 3.28Å; P23-I566 WeakPolarHBondContact CA-O 3.44Å; I24-I566 PolarHBondContact N-O 2.65Å; R27-I566 PolarHBondContact NH2-O 2.88Å; R27-I566 VanDerWaalsContact NH2-O 3.08Å; A471-I566 HydrophobicContact CB-CG1 3.78Å; I562-I566 HydrophobicContact CG2-CD1 4.03Å; I562-I566 WeakPolarHBondContact O-CG1 3.16Å; I562-I566 PolarHBondContact O-N 3.22Å; I562-I566 VanDerWaalsContact O-N 3.07Å; M563-I566 PolarHBondContact O-N 3.26Å; I564-I566 VanDerWaalsContact C-N 3.29Å; I564-I566 PolarHBondContact O-N 3.38Å
567	Y	90.9	Very high	94.4	Very high	32 Å²	32	28.9 Å²	28.9	13%	0.125	15%	0.147	C	C	.	.	H	α-helix	trans	-102.2	-21.9	-167.5	-65.4	-88.1	0	0	0	114.7	F20 I24 M563 T569 E671 R675	F20-Y567 HydrophobicContact CE2-CD1 4.4Å; F20-Y567 HydrophobicContact CE2-CE1 4.11Å; I24-Y567 HydrophobicContact CD1-CD1 4.3Å; M563-Y567 HydrophobicContact CE-CD2 3.81Å; M563-Y567 HydrophobicContact CE-CE2 3.28Å; M563-Y567 WeakPolarHBondContact O-CD2 3.38Å; M563-Y567 PolarHBondContact O-N 3.25Å; M563-Y567 HydrophobicContact SD-CD2 4.25Å; M563-Y567 HydrophobicContact SD-CE2 3.82Å; Y567-T569 VanDerWaalsContact C-N 3.29Å; Y567-T569 PolarHBondContact O-N 3.49Å; Y567-E671 WeakPolarHBondContact CE2-OE2 3.42Å; Y567-E671 PolarHBondContact OH-OE1 2.68Å; Y567-E671 PolarHBondContact OH-OE2 3.06Å; Y567-R675 VanDerWaalsContact CZ-NH2 3.27Å; Y567-R675 PolarHBondContact OH-NH2 3Å
568	G	91.1	Very high	94.3	Very high	10 Å²	10	28.7 Å²	28.7	10%	0.103	15%	0.146	C	C	.	.			trans	65.1	30.5	-174.5	0	0	0	0	0	114.3	R27 T30 H499 I564	R27-G568 VanDerWaalsContact NH1-CA 3.34Å; T30-G568 VanDerWaalsContact CG2-O 3.28Å; T30-G568 WeakPolarHBondContact CG2-O 3.32Å; H499-G568 WeakPolarHBondContact CE1-CA 3.36Å; H499-G568 PolarHBondContact CE1-O 3.22Å; H499-G568 WeakPolarHBondContact NE2-CA 3.3Å; I564-G568 VanDerWaalsContact O-CA 3.24Å; I564-G568 WeakPolarHBondContact O-CA 3.34Å; I564-G568 PolarHBondContact O-N 3.08Å
569	T	93.1	Very high	94.2	Very high	45 Å²	45	27.8 Å²	27.8	28%	0.276	14%	0.144	S	C	.	.			trans	-87	168.4	172.8	59.5	0	0	0	0	111	Y567 S574	Y567-T569 VanDerWaalsContact C-N 3.29Å; Y567-T569 PolarHBondContact O-N 3.49Å; T569-S574 PolarHBondContact OG1-OG 3.05Å
570	N	94.3	Very high	94	Very high	59 Å²	59	29.5 Å²	29.5	32%	0.316	15%	0.151	S	C	.	.			trans	-64.7	166.9	176.9	68	45.3	0	0	0	112.8	D31 C572 T573 S574	D31-N570 WeakPolarHBondContact OD1-CB 3.18Å; D31-N570 WeakPolarHBondContact OD2-CA 3.4Å; D31-N570 WeakPolarHBondContact OD2-CB 3.24Å; N570-C572 PolarHBondContact O-N 2.98Å; N570-C572 PolarHBondContact OD1-N 3.07Å; N570-T573 VanDerWaalsContact OD1-CB 3.22Å; N570-T573 WeakPolarHBondContact OD1-CB 3.47Å; N570-T573 PolarHBondContact OD1-N 3.45Å; N570-T573 PolarHBondContact OD1-OG1 3.38Å; N570-S574 WeakPolarHBondContact O-CB 3.43Å; N570-S574 PolarHBondContact O-N 3.28Å; N570-S574 PolarHBondContact O-OG 3.23Å
571	F	95.4	Very high	93.6	Very high	7 Å²	7	29.8 Å²	29.8	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-49.6	-173.9	178	-90.2	0	0	0	113	D31 F505 I509 N557 A560 Y561 I564 T573 S574 A575	D31-F571 PolarHBondContact OD2-N 2.66Å; F505-F571 HydrophobicContact CD1-CB 3.87Å; F505-F571 AromaticContact CD1-CD1 3.41Å; F505-F571 HydrophobicContact CD1-CD1 3.41Å; F505-F571 VanDerWaalsContact CD1-CD1 3.41Å; F505-F571 HydrophobicContact CD1-CE1 4.15Å; F505-F571 AromaticContact CD1-CG 3.77Å; F505-F571 HydrophobicContact CD1-CG 3.77Å; F505-F571 AromaticContact CE1-CD1 3.64Å; F505-F571 HydrophobicContact CE1-CD1 3.64Å; F505-F571 HydrophobicContact CE1-CE1 4.21Å; F505-F571 HydrophobicContact CE1-CG 4.43Å; I509-F571 HydrophobicContact CD1-CE1 3.96Å; N557-F571 WeakPolarHBondContact OD1-CZ 3.41Å; A560-F571 HydrophobicContact CB-CD2 4.37Å; A560-F571 HydrophobicContact CB-CE2 3.99Å; A560-F571 HydrophobicContact CB-CZ 4.46Å; Y561-F571 HydrophobicContact CE1-CD2 4.12Å; Y561-F571 HydrophobicContact CE1-CE2 4Å; I564-F571 HydrophobicContact CD1-CD2 4.32Å; F571-T573 PolarHBondContact O-N 3.37Å; F571-S574 PolarHBondContact O-N 3.11Å; F571-A575 HydrophobicContact CE1-CB 4.23Å; F571-A575 HydrophobicContact CZ-CB 4.45Å; F571-A575 VanDerWaalsContact O-CB 3.24Å; F571-A575 WeakPolarHBondContact O-CB 3.46Å; F571-A575 PolarHBondContact O-N 3.4Å
572	C	94.6	Very high	93.3	Very high	73 Å²	73	30 Å²	30	49%	0.493	15%	0.153	S	C	.	.	H	α-helix	trans	-64.1	-42.6	-175.6	-68.6	0	0	0	0	112.3	N570 A575 R576	N570-C572 PolarHBondContact O-N 2.98Å; N570-C572 PolarHBondContact OD1-N 3.07Å; C572-A575 PolarHBondContact O-N 2.75Å; C572-R576 WeakPolarHBondContact O-CB 3.26Å; C572-R576 PolarHBondContact O-N 2.8Å
573	T	93.8	Very high	92.8	Very high	56 Å²	56	32.3 Å²	32.3	34%	0.344	17%	0.165	S	C	.	.	H	α-helix	trans	-63.8	-46.1	176	-61.9	0	0	0	0	110.8	N570 F571 R576 N577	N570-T573 VanDerWaalsContact OD1-CB 3.22Å; N570-T573 WeakPolarHBondContact OD1-CB 3.47Å; N570-T573 PolarHBondContact OD1-N 3.45Å; N570-T573 PolarHBondContact OD1-OG1 3.38Å; F571-T573 PolarHBondContact O-N 3.37Å; T573-R576 PolarHBondContact O-N 3.32Å; T573-N577 WeakPolarHBondContact O-CB 3.15Å; T573-N577 PolarHBondContact O-N 2.95Å; T573-N577 PolarHBondContact O-OD1 2.84Å
574	S	95.6	Very high	92.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-42.8	177.2	-81.1	0	0	0	0	112.9	I564 T569 N570 F571 N577 A578	I564-S574 VanDerWaalsContact CG1-CB 3.48Å; I564-S574 VanDerWaalsContact CG1-OG 3.22Å; I564-S574 WeakPolarHBondContact CG1-OG 3.37Å; I564-S574 PolarHBondContact N-OG 3.43Å; T569-S574 PolarHBondContact OG1-OG 3.05Å; N570-S574 WeakPolarHBondContact O-CB 3.43Å; N570-S574 PolarHBondContact O-N 3.28Å; N570-S574 PolarHBondContact O-OG 3.23Å; F571-S574 PolarHBondContact O-N 3.11Å; S574-N577 PolarHBondContact O-N 2.92Å; S574-A578 VanDerWaalsContact O-CB 3.22Å; S574-A578 WeakPolarHBondContact O-CB 3.27Å; S574-A578 PolarHBondContact O-N 3.31Å
575	A	94.9	Very high	91.9	Very high	8 Å²	8	35.1 Å²	35.1	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-44.1	177.4	0	0	0	0	0	111.7	L556 A560 F571 C572 F579	L556-A575 HydrophobicContact CD1-CB 4.11Å; L556-A575 HydrophobicContact CD2-CB 4.4Å; L556-A575 HydrophobicContact CG-CB 4.16Å; A560-A575 HydrophobicContact CB-CB 3.77Å; F571-A575 HydrophobicContact CE1-CB 4.23Å; F571-A575 HydrophobicContact CZ-CB 4.45Å; F571-A575 VanDerWaalsContact O-CB 3.24Å; F571-A575 WeakPolarHBondContact O-CB 3.46Å; F571-A575 PolarHBondContact O-N 3.4Å; C572-A575 PolarHBondContact O-N 2.75Å; A575-F579 WeakPolarHBondContact O-CB 3.39Å; A575-F579 PolarHBondContact O-N 3.29Å
576	R	94.1	Very high	91.3	Very high	161 Å²	161	38.8 Å²	38.8	61%	0.608	20%	0.196	S	C	*	.	H	α-helix	trans	-60.7	-49.7	175.2	-179.4	-177.9	176.9	-173.8	-1.3	111.6	C572 T573 F579 F580	C572-R576 WeakPolarHBondContact O-CB 3.26Å; C572-R576 PolarHBondContact O-N 2.8Å; T573-R576 PolarHBondContact O-N 3.32Å; R576-F579 PolarHBondContact O-N 3.13Å; R576-F580 HydrophobicContact CG-CD2 4.11Å; R576-F580 HydrophobicContact CG-CE2 3.9Å; R576-F580 HydrophobicContact CG-CZ 4.21Å; R576-F580 WeakPolarHBondContact O-CB 2.97Å; R576-F580 WeakPolarHBondContact O-CG 3.35Å; R576-F580 PolarHBondContact O-N 3.08Å
577	N	91.4	Very high	90.7	Very high	58 Å²	58	43.7 Å²	43.7	31%	0.31	22%	0.221	S	C	.	.	H	α-helix	trans	-64.9	-43.4	-177.7	-67.5	-6.7	0	0	0	111.4	M563 T573 S574 F580 L581	M563-N577 HydrophobicContact CE-CB 3.76Å; T573-N577 WeakPolarHBondContact O-CB 3.15Å; T573-N577 PolarHBondContact O-N 2.95Å; T573-N577 PolarHBondContact O-OD1 2.84Å; S574-N577 PolarHBondContact O-N 2.92Å; N577-F580 PolarHBondContact O-N 2.79Å; N577-L581 WeakPolarHBondContact O-CB 3.28Å; N577-L581 PolarHBondContact O-N 2.79Å
578	A	93	Very high	90.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-50.5	174.3	0	0	0	0	0	111.4	N559 M563 S574 F580 L581 L582	N559-A578 HydrophobicContact CB-CB 3.92Å; M563-A578 HydrophobicContact CG-CB 3.65Å; S574-A578 VanDerWaalsContact O-CB 3.22Å; S574-A578 WeakPolarHBondContact O-CB 3.27Å; S574-A578 PolarHBondContact O-N 3.31Å; A578-F580 PolarHBondContact O-N 2.78Å; A578-L581 PolarHBondContact O-N 2.82Å; A578-L582 WeakPolarHBondContact O-CB 3.4Å; A578-L582 WeakPolarHBondContact O-CG 3.44Å; A578-L582 PolarHBondContact O-N 3.11Å
579	F	92.3	Very high	89.8	Confident	49 Å²	49	46.8 Å²	46.8	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-45	-178.6	179.1	-102.2	0	0	0	112.1	F552 L556 A575 R576 L582 M583	F552-F579 HydrophobicContact CE2-CE2 4.31Å; F552-F579 HydrophobicContact CZ-CE2 4.32Å; L556-F579 HydrophobicContact CD1-CB 4.09Å; L556-F579 HydrophobicContact CD1-CD2 4.47Å; A575-F579 WeakPolarHBondContact O-CB 3.39Å; A575-F579 PolarHBondContact O-N 3.29Å; R576-F579 PolarHBondContact O-N 3.13Å; F579-L582 PolarHBondContact O-N 2.79Å; F579-M583 HydrophobicContact CD1-CG 4.23Å; F579-M583 HydrophobicContact CD2-CE 4.3Å; F579-M583 HydrophobicContact CD2-CG 4.31Å; F579-M583 HydrophobicContact CE1-CE 4.5Å; F579-M583 HydrophobicContact CE1-CG 3.82Å; F579-M583 HydrophobicContact CE2-CE 3.32Å; F579-M583 HydrophobicContact CE2-CG 3.94Å; F579-M583 HydrophobicContact CE2-SD 4.47Å; F579-M583 HydrophobicContact CG-CG 4.45Å; F579-M583 HydrophobicContact CZ-CE 3.45Å; F579-M583 VanDerWaalsContact CZ-CE 3.45Å; F579-M583 HydrophobicContact CZ-CG 3.67Å; F579-M583 HydrophobicContact CZ-SD 4.3Å; F579-M583 WeakPolarHBondContact O-CB 3.34Å; F579-M583 WeakPolarHBondContact O-CG 3.37Å; F579-M583 PolarHBondContact O-N 3.48Å
580	F	90.8	Very high	89.1	Confident	50 Å²	50	47 Å²	47	22%	0.219	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-40	178.1	-77.2	-1.6	0	0	0	113.2	Y10 R576 N577 A578 L582 M583 R584	Y10-F580 HydrophobicContact CD1-CD1 4.2Å; Y10-F580 HydrophobicContact CD1-CE1 4.42Å; Y10-F580 VanDerWaalsContact O-CB 3.27Å; Y10-F580 WeakPolarHBondContact O-CB 3.45Å; Y10-F580 WeakPolarHBondContact O-CD2 3.46Å; Y10-F580 WeakPolarHBondContact O-CG 3.36Å; R576-F580 HydrophobicContact CG-CD2 4.11Å; R576-F580 HydrophobicContact CG-CE2 3.9Å; R576-F580 HydrophobicContact CG-CZ 4.21Å; R576-F580 WeakPolarHBondContact O-CB 2.97Å; R576-F580 WeakPolarHBondContact O-CG 3.35Å; R576-F580 PolarHBondContact O-N 3.08Å; N577-F580 PolarHBondContact O-N 2.79Å; A578-F580 PolarHBondContact O-N 2.78Å; F580-L582 VanDerWaalsContact C-N 3.32Å; F580-L582 PolarHBondContact O-N 3.26Å; F580-M583 PolarHBondContact O-N 2.94Å; F580-R584 VanDerWaalsContact O-CG 3.32Å; F580-R584 WeakPolarHBondContact O-CG 2.92Å; F580-R584 PolarHBondContact O-N 3.37Å; F580-R584 VanDerWaalsContact O-N 3.17Å; F580-R584 PolarHBondContact O-NE 2.74Å
581	L	88.9	Confident	88.3	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-43	173.2	-177.9	64.1	0	0	0	112.1	N577 A578 N585 L667 L670 E671 E674	N577-L581 WeakPolarHBondContact O-CB 3.28Å; N577-L581 PolarHBondContact O-N 2.79Å; A578-L581 PolarHBondContact O-N 2.82Å; L581-N585 PolarHBondContact O-ND2 2.98Å; L581-L667 HydrophobicContact CD2-CD1 4.03Å; L581-L667 HydrophobicContact CD2-CG 3.92Å; L581-L670 HydrophobicContact CD1-CB 4.09Å; L581-L670 HydrophobicContact CD2-CB 4.31Å; L581-L670 HydrophobicContact CG-CB 4.16Å; L581-E671 HydrophobicContact CD2-CB 4.31Å; L581-E674 VanDerWaalsContact CD1-OE1 3.32Å; L581-E674 WeakPolarHBondContact CD1-OE1 3.31Å
582	L	89.7	Confident	87.6	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-71.9	-41.1	179.7	-64.7	169.7	0	0	0	112.2	F555 N559 A578 F579 F580 R584 N585 I586 V589 L667 L670	F555-L582 HydrophobicContact CE1-CD1 4.22Å; F555-L582 HydrophobicContact CZ-CD1 3.75Å; N559-L582 HydrophobicContact CB-CD1 3.82Å; N559-L582 VanDerWaalsContact CG-CD1 3.41Å; A578-L582 WeakPolarHBondContact O-CB 3.4Å; A578-L582 WeakPolarHBondContact O-CG 3.44Å; A578-L582 PolarHBondContact O-N 3.11Å; F579-L582 PolarHBondContact O-N 2.79Å; F580-L582 VanDerWaalsContact C-N 3.32Å; F580-L582 PolarHBondContact O-N 3.26Å; L582-R584 PolarHBondContact O-N 2.81Å; L582-N585 CarbonylContact O-C 3.52Å; L582-N585 PolarHBondContact O-N 3.02Å; L582-I586 VanDerWaalsContact O-CA 3.29Å; L582-I586 WeakPolarHBondContact O-CA 3.32Å; L582-I586 PolarHBondContact O-N 2.94Å; L582-V589 HydrophobicContact CB-CG2 4.2Å; L582-V589 HydrophobicContact CD2-CB 4.38Å; L582-V589 HydrophobicContact CD2-CG1 3.85Å; L582-V589 HydrophobicContact CD2-CG2 3.55Å; L582-V589 HydrophobicContact CG-CG2 4.49Å; L582-L667 HydrophobicContact CD1-CD1 4.41Å; L582-L667 HydrophobicContact CD2-CD1 3.72Å; L582-L667 HydrophobicContact CG-CD1 4.07Å; L582-L670 HydrophobicContact CD2-CD1 4.06Å
583	M	86.6	Confident	87	Confident	49 Å²	49	44.1 Å²	44.1	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-37.1	-180	-80.1	-62.5	173.2	0	0	112.9	Y10 F579 F580 N585 I586	Y10-M583 HydrophobicContact CD1-CB 3.65Å; Y10-M583 HydrophobicContact CD1-CG 4.16Å; Y10-M583 HydrophobicContact CD2-CB 4.29Å; Y10-M583 HydrophobicContact CE1-CB 3.81Å; Y10-M583 HydrophobicContact CE1-CG 3.97Å; Y10-M583 HydrophobicContact CE2-CB 4.43Å; Y10-M583 HydrophobicContact CG-CB 3.9Å; F579-M583 HydrophobicContact CD1-CG 4.23Å; F579-M583 HydrophobicContact CD2-CE 4.3Å; F579-M583 HydrophobicContact CD2-CG 4.31Å; F579-M583 HydrophobicContact CE1-CE 4.5Å; F579-M583 HydrophobicContact CE1-CG 3.82Å; F579-M583 HydrophobicContact CE2-CE 3.32Å; F579-M583 HydrophobicContact CE2-CG 3.94Å; F579-M583 HydrophobicContact CE2-SD 4.47Å; F579-M583 HydrophobicContact CG-CG 4.45Å; F579-M583 HydrophobicContact CZ-CE 3.45Å; F579-M583 VanDerWaalsContact CZ-CE 3.45Å; F579-M583 HydrophobicContact CZ-CG 3.67Å; F579-M583 HydrophobicContact CZ-SD 4.3Å; F579-M583 WeakPolarHBondContact O-CB 3.34Å; F579-M583 WeakPolarHBondContact O-CG 3.37Å; F579-M583 PolarHBondContact O-N 3.48Å; F580-M583 PolarHBondContact O-N 2.94Å; M583-N585 PolarHBondContact O-N 3.09Å; M583-I586 HydrophobicContact CE-CD1 4.41Å; M583-I586 PolarHBondContact O-N 3.38Å; M583-I586 HydrophobicContact SD-CD1 3.79Å; M583-I586 HydrophobicContact SD-CG1 4.48Å
584	R	86.6	Confident	86.4	Confident	34 Å²	34	48 Å²	48	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-27.5	173.6	-69.8	175.3	-64.9	148.6	2.5	112.4	F580 L582 E674	F580-R584 VanDerWaalsContact O-CG 3.32Å; F580-R584 WeakPolarHBondContact O-CG 2.92Å; F580-R584 PolarHBondContact O-N 3.37Å; F580-R584 VanDerWaalsContact O-N 3.17Å; F580-R584 PolarHBondContact O-NE 2.74Å; L582-R584 PolarHBondContact O-N 2.81Å; R584-E674 VanDerWaalsContact CZ-CD 3.5Å; R584-E674 IonicContact CZ-OE1 3.66Å; R584-E674 IonicContact CZ-OE2 2.74Å; R584-E674 IonicContact NE-OE1 3.36Å; R584-E674 IonicContact NH1-OE1 3.95Å; R584-E674 PolarHBondContact NH1-OE1 3.15Å; R584-E674 IonicContact NH1-OE2 2.79Å; R584-E674 PolarHBondContact NH1-OE2 3.15Å; R584-E674 VanDerWaalsContact NH2-CD 3.31Å; R584-E674 IonicContact NH2-OE1 3Å; R584-E674 PolarHBondContact NH2-OE1 2.82Å; R584-E674 IonicContact NH2-OE2 3.25Å; R584-E674 PolarHBondContact NH2-OE2 3.25Å
585	N	84.3	Confident	85.8	Confident	31 Å²	31	48.5 Å²	48.5	17%	0.166	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	24.6	-179.4	-70.3	-80.2	0	0	0	113.7	L581 L582 M583 I587 R588 V589 L670	L581-N585 PolarHBondContact O-ND2 2.98Å; L582-N585 CarbonylContact O-C 3.52Å; L582-N585 PolarHBondContact O-N 3.02Å; M583-N585 PolarHBondContact O-N 3.09Å; N585-I587 VanDerWaalsContact C-N 3.32Å; N585-I587 PolarHBondContact O-N 3.21Å; N585-I587 VanDerWaalsContact O-N 3.08Å; N585-R588 WeakPolarHBondContact O-CB 3.4Å; N585-R588 PolarHBondContact O-N 2.91Å; N585-V589 HydrophobicContact CB-CG2 4.26Å; N585-V589 WeakPolarHBondContact O-CG2 3.43Å; N585-V589 PolarHBondContact O-N 3.39Å; N585-L670 HydrophobicContact CB-CD1 4.07Å; N585-L670 HydrophobicContact CB-CD2 3.82Å
586	I	83.6	Confident	85.4	Confident	80 Å²	80	48.3 Å²	48.3	41%	0.41	23%	0.231	S	C	.	.	H	α-helix	trans	-53.1	-40.8	-164.7	-168.5	174.5	0	0	0	114.7	L582 M583 R588 V589 A590	L582-I586 VanDerWaalsContact O-CA 3.29Å; L582-I586 WeakPolarHBondContact O-CA 3.32Å; L582-I586 PolarHBondContact O-N 2.94Å; M583-I586 HydrophobicContact CE-CD1 4.41Å; M583-I586 PolarHBondContact O-N 3.38Å; M583-I586 HydrophobicContact SD-CD1 3.79Å; M583-I586 HydrophobicContact SD-CG1 4.48Å; I586-R588 VanDerWaalsContact C-N 3.34Å; I586-R588 PolarHBondContact O-N 3.21Å; I586-V589 PolarHBondContact O-N 2.93Å; I586-A590 VanDerWaalsContact O-CB 3.31Å; I586-A590 WeakPolarHBondContact O-CB 3.29Å; I586-A590 PolarHBondContact O-N 2.93Å
587	I	79.1	Confident	85	Confident	103 Å²	103	44.4 Å²	44.4	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-40.6	-179.8	-60.3	173.9	0	0	0	110.7	N585 V591	N585-I587 VanDerWaalsContact C-N 3.32Å; N585-I587 PolarHBondContact O-N 3.21Å; N585-I587 VanDerWaalsContact O-N 3.08Å; I587-V591 WeakPolarHBondContact O-CB 3.26Å; I587-V591 VanDerWaalsContact O-CG2 3.28Å; I587-V591 WeakPolarHBondContact O-CG2 3Å; I587-V591 PolarHBondContact O-N 2.9Å
588	R	80.4	Confident	84.6	Confident	91 Å²	91	45.1 Å²	45.1	34%	0.343	22%	0.223	S	C	.	.	H	α-helix	trans	-67.9	-43.2	178.1	-63.6	-175.6	-177.3	-163.6	1.5	110.2	N585 I586 L592 F666	N585-R588 WeakPolarHBondContact O-CB 3.4Å; N585-R588 PolarHBondContact O-N 2.91Å; I586-R588 VanDerWaalsContact C-N 3.34Å; I586-R588 PolarHBondContact O-N 3.21Å; R588-L592 WeakPolarHBondContact O-CB 3.37Å; R588-L592 PolarHBondContact O-N 3.29Å; R588-L592 VanDerWaalsContact O-N 3.09Å; R588-F666 HydrophobicContact CB-CZ 4.39Å
589	V	82.7	Confident	84.1	Confident	15 Å²	15	45.4 Å²	45.4	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-57.6	179.3	178.1	0	0	0	0	110.6	L582 N585 I586 V591 L592 D593 F666 L670	L582-V589 HydrophobicContact CB-CG2 4.2Å; L582-V589 HydrophobicContact CD2-CB 4.38Å; L582-V589 HydrophobicContact CD2-CG1 3.85Å; L582-V589 HydrophobicContact CD2-CG2 3.55Å; L582-V589 HydrophobicContact CG-CG2 4.49Å; N585-V589 HydrophobicContact CB-CG2 4.26Å; N585-V589 WeakPolarHBondContact O-CG2 3.43Å; N585-V589 PolarHBondContact O-N 3.39Å; I586-V589 PolarHBondContact O-N 2.93Å; V589-V591 VanDerWaalsContact C-N 3.33Å; V589-V591 PolarHBondContact O-N 2.03Å; V589-L592 PolarHBondContact O-N 3.46Å; V589-D593 WeakPolarHBondContact O-CB 3.48Å; V589-D593 PolarHBondContact O-N 2.86Å; V589-F666 HydrophobicContact CB-CE1 4.06Å; V589-F666 HydrophobicContact CB-CZ 4.37Å; V589-F666 HydrophobicContact CG1-CE1 4.27Å; V589-F666 HydrophobicContact CG2-CE1 3.7Å; V589-F666 HydrophobicContact CG2-CZ 3.95Å; V589-L670 HydrophobicContact CG2-CD1 3.97Å
590	A	79.2	Confident	83.9	Confident	49 Å²	49	43.6 Å²	43.6	41%	0.405	22%	0.217	S	C	.	.	H	α-helix	trans	-61.1	-41.4	-173.8	0	0	0	0	0	112.3	I586 K594	I586-A590 VanDerWaalsContact O-CB 3.31Å; I586-A590 WeakPolarHBondContact O-CB 3.29Å; I586-A590 PolarHBondContact O-N 2.93Å; A590-K594 WeakPolarHBondContact O-CG 3.34Å; A590-K594 PolarHBondContact O-N 2.8Å
591	V	76.6	Confident	83.7	Confident	27 Å²	27	45.2 Å²	45.2	16%	0.164	23%	0.227	C	C	.	.	H	α-helix	trans	-69.7	-42.6	178.3	176.8	0	0	0	0	111.4	L334 R337 I587 V589 K594 V595	L334-V591 HydrophobicContact CD1-CG1 4.31Å; L334-V591 HydrophobicContact CD2-CG1 3.74Å; L334-V591 HydrophobicContact CD2-CG2 4.19Å; L334-V591 HydrophobicContact CG-CG1 4.43Å; R337-V591 HydrophobicContact CB-CB 4.44Å; R337-V591 HydrophobicContact CB-CG1 3.38Å; R337-V591 HydrophobicContact CG-CB 4.42Å; R337-V591 HydrophobicContact CG-CG1 3.7Å; I587-V591 WeakPolarHBondContact O-CB 3.26Å; I587-V591 VanDerWaalsContact O-CG2 3.28Å; I587-V591 WeakPolarHBondContact O-CG2 3Å; I587-V591 PolarHBondContact O-N 2.9Å; V589-V591 VanDerWaalsContact C-N 3.33Å; V589-V591 PolarHBondContact O-N 2.03Å; V591-K594 PolarHBondContact O-N 2.81Å; V591-V595 HydrophobicContact CG1-CG2 4.18Å; V591-V595 WeakPolarHBondContact O-CB 3.43Å; V591-V595 VanDerWaalsContact O-CG2 3.27Å; V591-V595 WeakPolarHBondContact O-CG2 3.09Å; V591-V595 PolarHBondContact O-N 3.43Å
592	L	81	Confident	83.5	Confident	9 Å²	9	45.6 Å²	45.6	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-45	-177.1	-169.7	131	0	0	0	111.9	I340 L344 R588 V589 K594 V595 T596 V662 F666	I340-L592 HydrophobicContact CG2-CD1 4.01Å; L344-L592 HydrophobicContact CD1-CD1 3.32Å; L344-L592 HydrophobicContact CD1-CD2 4.1Å; L344-L592 HydrophobicContact CD1-CG 4.3Å; L344-L592 HydrophobicContact CG-CD1 4.32Å; R588-L592 WeakPolarHBondContact O-CB 3.37Å; R588-L592 PolarHBondContact O-N 3.29Å; R588-L592 VanDerWaalsContact O-N 3.09Å; V589-L592 PolarHBondContact O-N 3.46Å; L592-K594 PolarHBondContact O-N 3.39Å; L592-V595 PolarHBondContact O-N 3.49Å; L592-T596 HydrophobicContact CD2-CG2 4.08Å; L592-T596 HydrophobicContact CG-CG2 4.28Å; L592-T596 WeakPolarHBondContact O-CB 3.43Å; L592-T596 VanDerWaalsContact O-CG2 3.22Å; L592-T596 WeakPolarHBondContact O-CG2 3.48Å; L592-T596 PolarHBondContact O-N 2.96Å; L592-T596 PolarHBondContact O-OG1 2.95Å; L592-V662 HydrophobicContact CD2-CG1 4.22Å; L592-F666 HydrophobicContact CB-CZ 4.47Å; L592-F666 HydrophobicContact CD1-CD2 4Å; L592-F666 HydrophobicContact CD1-CE2 3.97Å; L592-F666 HydrophobicContact CD2-CB 4.38Å; L592-F666 HydrophobicContact CD2-CD1 4.2Å; L592-F666 HydrophobicContact CD2-CD2 4.09Å; L592-F666 HydrophobicContact CD2-CE2 4.43Å; L592-F666 HydrophobicContact CD2-CG 3.96Å
593	D	82.1	Confident	83.4	Confident	44 Å²	44	45.2 Å²	45.2	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-54.6	-52.2	174.9	-176.3	69.1	0	0	0	110.5	V589 V595 T596 D597	V589-D593 WeakPolarHBondContact O-CB 3.48Å; V589-D593 PolarHBondContact O-N 2.86Å; D593-V595 PolarHBondContact O-N 2.71Å; D593-T596 PolarHBondContact O-N 3.31Å; D593-T596 PolarHBondContact O-OG1 3.34Å; D593-D597 WeakPolarHBondContact O-CB 3.48Å; D593-D597 PolarHBondContact O-N 3.03Å
594	K	82.4	Confident	83.6	Confident	138 Å²	138	44.4 Å²	44.4	60%	0.6	22%	0.222	S	C	*	.	H	α-helix	trans	-63.9	-39.9	179.9	-64.5	-63.4	173.6	-166.1	0	114.2	A590 V591 L592 F598	A590-K594 WeakPolarHBondContact O-CG 3.34Å; A590-K594 PolarHBondContact O-N 2.8Å; V591-K594 PolarHBondContact O-N 2.81Å; L592-K594 PolarHBondContact O-N 3.39Å; K594-F598 WeakPolarHBondContact O-CB 3.48Å; K594-F598 PolarHBondContact O-N 3.25Å; K594-F598 VanDerWaalsContact O-N 3.08Å
595	V	82.9	Confident	83.7	Confident	10 Å²	10	47.5 Å²	47.5	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-45.3	177.9	170.5	0	0	0	0	110.5	L334 I338 A341 V591 L592 D593 F598 L599	L334-V595 HydrophobicContact CD1-CG2 4.11Å; I338-V595 HydrophobicContact CG1-CG1 3.99Å; I338-V595 HydrophobicContact CG1-CG2 4.06Å; A341-V595 HydrophobicContact CB-CB 4.3Å; A341-V595 HydrophobicContact CB-CG1 3.66Å; V591-V595 HydrophobicContact CG1-CG2 4.18Å; V591-V595 WeakPolarHBondContact O-CB 3.43Å; V591-V595 VanDerWaalsContact O-CG2 3.27Å; V591-V595 WeakPolarHBondContact O-CG2 3.09Å; V591-V595 PolarHBondContact O-N 3.43Å; L592-V595 PolarHBondContact O-N 3.49Å; D593-V595 PolarHBondContact O-N 2.71Å; V595-F598 PolarHBondContact O-N 2.93Å; V595-L599 HydrophobicContact CG1-CD1 3.98Å; V595-L599 HydrophobicContact CG1-CG 4.37Å; V595-L599 VanDerWaalsContact O-CG 3.27Å; V595-L599 WeakPolarHBondContact O-CG 3.06Å; V595-L599 PolarHBondContact O-N 3.44Å
596	T	84.9	Confident	83.9	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-42.1	-179.2	56.1	0	0	0	0	111.6	A341 I345 L592 D593 F598 L599 F600 V662	A341-T596 HydrophobicContact CB-CG2 4.21Å; I345-T596 HydrophobicContact CD1-CG2 4.34Å; I345-T596 HydrophobicContact CG1-CG2 4.48Å; L592-T596 HydrophobicContact CD2-CG2 4.08Å; L592-T596 HydrophobicContact CG-CG2 4.28Å; L592-T596 WeakPolarHBondContact O-CB 3.43Å; L592-T596 VanDerWaalsContact O-CG2 3.22Å; L592-T596 WeakPolarHBondContact O-CG2 3.48Å; L592-T596 PolarHBondContact O-N 2.96Å; L592-T596 PolarHBondContact O-OG1 2.95Å; D593-T596 PolarHBondContact O-N 3.31Å; D593-T596 PolarHBondContact O-OG1 3.34Å; T596-F598 PolarHBondContact O-N 3.01Å; T596-L599 PolarHBondContact O-N 3.23Å; T596-F600 WeakPolarHBondContact O-CD2 3.39Å; T596-F600 VanDerWaalsContact O-CG 3.28Å; T596-F600 WeakPolarHBondContact O-CG 3.41Å; T596-F600 PolarHBondContact O-N 3.48Å; T596-V662 HydrophobicContact CG2-CG1 3.93Å
597	D	85.6	Confident	84.3	Confident	80 Å²	80	45.5 Å²	45.5	43%	0.428	23%	0.231	S	C	.	.	H	α-helix	trans	-58.3	-45.6	173	-88.6	-8.7	0	0	0	112.3	D593 F600 L601	D593-D597 WeakPolarHBondContact O-CB 3.48Å; D593-D597 PolarHBondContact O-N 3.03Å; D597-F600 PolarHBondContact O-N 2.88Å; D597-L601 WeakPolarHBondContact O-CB 3.15Å; D597-L601 PolarHBondContact O-N 3.16Å
598	F	83.3	Confident	85	Confident	72 Å²	72	41.4 Å²	41.4	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-61.5	-45.3	177	175.2	-102.4	0	0	0	111.9	K594 V595 T596 L601 L602	K594-F598 WeakPolarHBondContact O-CB 3.48Å; K594-F598 PolarHBondContact O-N 3.25Å; K594-F598 VanDerWaalsContact O-N 3.08Å; V595-F598 PolarHBondContact O-N 2.93Å; T596-F598 PolarHBondContact O-N 3.01Å; F598-L601 WeakPolarHBondContact O-CB 3.06Å; F598-L601 PolarHBondContact O-N 3.39Å; F598-L602 HydrophobicContact CE1-CD2 4.42Å; F598-L602 PolarHBondContact O-N 3.46Å
599	L	83	Confident	85.4	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-40.2	179	-67.3	176.9	0	0	0	112.2	V259 I345 V595 T596 L602 G603	V259-L599 HydrophobicContact CB-CD2 4.38Å; V259-L599 HydrophobicContact CG1-CD1 4.16Å; V259-L599 HydrophobicContact CG1-CD2 3.63Å; V259-L599 HydrophobicContact CG2-CD1 3.96Å; V259-L599 HydrophobicContact CG2-CD2 4.06Å; I345-L599 HydrophobicContact CD1-CD1 3.6Å; V595-L599 HydrophobicContact CG1-CD1 3.98Å; V595-L599 HydrophobicContact CG1-CG 4.37Å; V595-L599 VanDerWaalsContact O-CG 3.27Å; V595-L599 WeakPolarHBondContact O-CG 3.06Å; V595-L599 PolarHBondContact O-N 3.44Å; T596-L599 PolarHBondContact O-N 3.23Å; L599-L602 PolarHBondContact O-N 3.48Å; L599-G603 PolarHBondContact O-N 2.03Å
600	F	87.7	Confident	85.8	Confident	11 Å²	11	39.8 Å²	39.8	5%	0.048	22%	0.219	C	C	.	.	H	α-helix	trans	-70.1	-33.8	175.4	-62.4	-26.6	0	0	0	112.4	T596 D597 K604 F655 Y658 V662	T596-F600 WeakPolarHBondContact O-CD2 3.39Å; T596-F600 VanDerWaalsContact O-CG 3.28Å; T596-F600 WeakPolarHBondContact O-CG 3.41Å; T596-F600 PolarHBondContact O-N 3.48Å; D597-F600 PolarHBondContact O-N 2.88Å; F600-K604 WeakPolarHBondContact O-CD 3.48Å; F600-K604 WeakPolarHBondContact O-CG 3.21Å; F600-K604 PolarHBondContact O-N 3.07Å; F600-F655 HydrophobicContact CB-CB 4.44Å; F600-F655 HydrophobicContact CB-CD1 3.85Å; F600-F655 HydrophobicContact CB-CE1 4.42Å; F600-F655 HydrophobicContact CB-CG 4.29Å; F600-F655 AromaticContact CD1-CD1 3.49Å; F600-F655 HydrophobicContact CD1-CD1 3.49Å; F600-F655 VanDerWaalsContact CD1-CD1 3.49Å; F600-F655 AromaticContact CD1-CE1 3.83Å; F600-F655 HydrophobicContact CD1-CE1 3.83Å; F600-F655 HydrophobicContact CE1-CD1 4.29Å; F600-F655 AromaticContact CG-CD1 3.81Å; F600-F655 HydrophobicContact CG-CD1 3.81Å; F600-F655 HydrophobicContact CG-CE1 4.45Å; F600-Y658 AromaticContact CE1-CD1 3.61Å; F600-Y658 HydrophobicContact CE1-CD1 3.61Å; F600-Y658 HydrophobicContact CE1-CE1 4.07Å; F600-Y658 HydrophobicContact CE1-CG 4.42Å; F600-Y658 HydrophobicContact CE2-CD1 4.5Å; F600-Y658 AromaticContact CZ-CD1 3.46Å; F600-Y658 HydrophobicContact CZ-CD1 3.46Å; F600-Y658 VanDerWaalsContact CZ-CD1 3.46Å; F600-Y658 HydrophobicContact CZ-CE1 4.1Å; F600-Y658 HydrophobicContact CZ-CG 4.4Å; F600-V662 HydrophobicContact CZ-CG2 4.06Å
601	L	87.6	Confident	86.4	Confident	83 Å²	83	37.7 Å²	37.7	44%	0.435	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-47.5	171.9	177.2	65.1	0	0	0	110.7	D597 F598 G603 K604 L605	D597-L601 WeakPolarHBondContact O-CB 3.15Å; D597-L601 PolarHBondContact O-N 3.16Å; F598-L601 WeakPolarHBondContact O-CB 3.06Å; F598-L601 PolarHBondContact O-N 3.39Å; L601-G603 PolarHBondContact O-N 3.37Å; L601-K604 WeakPolarHBondContact O-CB 3.45Å; L601-K604 PolarHBondContact O-N 3.37Å; L601-L605 HydrophobicContact CD1-CD1 4.48Å; L601-L605 HydrophobicContact CD1-CG 4.43Å; L601-L605 HydrophobicContact CG-CD1 4.26Å; L601-L605 WeakPolarHBondContact O-CG 3.44Å; L601-L605 PolarHBondContact O-N 3.22Å
602	L	83.7	Confident	87.1	Confident	14 Å²	14	36.8 Å²	36.8	7%	0.073	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-42	-179.7	-173.9	48.2	0	0	0	112.2	M262 V266 F598 L599 K604 L605 L606	M262-L602 HydrophobicContact CB-CD2 3.54Å; M262-L602 HydrophobicContact CB-CG 4Å; M262-L602 HydrophobicContact CG-CD2 4.45Å; M262-L602 HydrophobicContact CG-CG 4.42Å; M262-L602 HydrophobicContact SD-CG 4.21Å; V266-L602 HydrophobicContact CG2-CD1 3.34Å; V266-L602 HydrophobicContact CG2-CD2 3.57Å; V266-L602 HydrophobicContact CG2-CG 4.11Å; F598-L602 HydrophobicContact CE1-CD2 4.42Å; F598-L602 PolarHBondContact O-N 3.46Å; L599-L602 PolarHBondContact O-N 3.48Å; L602-K604 PolarHBondContact O-N 3.19Å; L602-L605 PolarHBondContact O-N 3.5Å; L602-L606 WeakPolarHBondContact O-CB 3.41Å; L602-L606 PolarHBondContact O-N 3.04Å
603	G	88	Confident	87.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-42.6	172.6	0	0	0	0	0	112.9	L599 L601 L606 I607	L599-G603 PolarHBondContact O-N 2.03Å; L601-G603 PolarHBondContact O-N 3.37Å; G603-L606 PolarHBondContact O-N 3.23Å; G603-I607 WeakPolarHBondContact O-CD1 3.34Å; G603-I607 WeakPolarHBondContact O-CG1 3.49Å; G603-I607 PolarHBondContact O-N 3.3Å; G603-I607 VanDerWaalsContact O-N 3.12Å
604	K	91.1	Very high	87.8	Confident	31 Å²	31	43.4 Å²	43.4	14%	0.135	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-47.1	174.5	-68.8	163.5	-166.6	173.5	0	111.4	F600 L601 L602 L606 I607 V608 A651 F655	F600-K604 WeakPolarHBondContact O-CD 3.48Å; F600-K604 WeakPolarHBondContact O-CG 3.21Å; F600-K604 PolarHBondContact O-N 3.07Å; L601-K604 WeakPolarHBondContact O-CB 3.45Å; L601-K604 PolarHBondContact O-N 3.37Å; L602-K604 PolarHBondContact O-N 3.19Å; K604-L606 VanDerWaalsContact C-N 3.33Å; K604-L606 PolarHBondContact O-N 3.25Å; K604-I607 PolarHBondContact O-N 2.81Å; K604-V608 WeakPolarHBondContact O-CB 3.48Å; K604-V608 WeakPolarHBondContact O-CG2 3.38Å; K604-V608 PolarHBondContact O-N 3.16Å; K604-A651 HydrophobicContact CG-CB 4.23Å; K604-F655 HydrophobicContact CB-CE2 4.49Å; K604-F655 HydrophobicContact CD-CD2 4.26Å; K604-F655 VanDerWaalsContact CE-CB 3.42Å; K604-F655 HydrophobicContact CG-CD2 3.37Å; K604-F655 HydrophobicContact CG-CE2 3.73Å; K604-F655 HydrophobicContact CG-CG 4.17Å
605	L	89.4	Confident	88.1	Confident	99 Å²	99	37.2 Å²	37.2	52%	0.518	21%	0.206	S	C	.	.	H	α-helix	trans	-63.3	-38.7	-180	-70	177.2	0	0	0	112.1	L601 L602 G609	L601-L605 HydrophobicContact CD1-CD1 4.48Å; L601-L605 HydrophobicContact CD1-CG 4.43Å; L601-L605 HydrophobicContact CG-CD1 4.26Å; L601-L605 WeakPolarHBondContact O-CG 3.44Å; L601-L605 PolarHBondContact O-N 3.22Å; L602-L605 PolarHBondContact O-N 3.5Å; L605-G609 WeakPolarHBondContact O-CA 3.15Å; L605-G609 PolarHBondContact O-N 2.83Å
606	L	88.1	Confident	88.4	Confident	66 Å²	66	40.6 Å²	40.6	35%	0.346	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-46.3	177.1	-172.7	154.5	0	0	0	111.5	M262 L602 G603 K604 S610	M262-L606 HydrophobicContact CG-CD1 4.38Å; L602-L606 WeakPolarHBondContact O-CB 3.41Å; L602-L606 PolarHBondContact O-N 3.04Å; G603-L606 PolarHBondContact O-N 3.23Å; K604-L606 VanDerWaalsContact C-N 3.33Å; K604-L606 PolarHBondContact O-N 3.25Å; L606-S610 WeakPolarHBondContact O-CB 3.39Å; L606-S610 PolarHBondContact O-N 2.99Å; L606-S610 PolarHBondContact O-OG 3.1Å
607	I	91.6	Very high	88.5	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-50.1	177.5	-67.7	160.9	0	0	0	110.2	M243 F247 G603 K604 G609 S610 V611 A651 F655	M243-I607 HydrophobicContact CE-CG2 4.28Å; F247-I607 HydrophobicContact CB-CD1 4.05Å; F247-I607 HydrophobicContact CB-CG1 4.5Å; F247-I607 HydrophobicContact CD1-CD1 4.4Å; F247-I607 HydrophobicContact CG-CD1 4.11Å; G603-I607 WeakPolarHBondContact O-CD1 3.34Å; G603-I607 WeakPolarHBondContact O-CG1 3.49Å; G603-I607 PolarHBondContact O-N 3.3Å; G603-I607 VanDerWaalsContact O-N 3.12Å; K604-I607 PolarHBondContact O-N 2.81Å; I607-G609 PolarHBondContact O-N 3.07Å; I607-S610 WeakPolarHBondContact CA-OG 3.43Å; I607-S610 PolarHBondContact O-N 2.05Å; I607-S610 PolarHBondContact O-OG 3.35Å; I607-V611 WeakPolarHBondContact O-CG2 3.46Å; I607-V611 PolarHBondContact O-N 2.9Å; I607-A651 HydrophobicContact CD1-CB 4.44Å; I607-A651 HydrophobicContact CG2-CB 4.37Å; I607-F655 HydrophobicContact CD1-CE2 3.82Å; I607-F655 HydrophobicContact CD1-CZ 4.24Å
608	V	93.9	Very high	88.5	Confident	17 Å²	17	42.5 Å²	42.5	10%	0.103	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-41.1	-178.4	175.2	0	0	0	0	111.6	K604 G612 I644 Y648	K604-V608 WeakPolarHBondContact O-CB 3.48Å; K604-V608 WeakPolarHBondContact O-CG2 3.38Å; K604-V608 PolarHBondContact O-N 3.16Å; V608-G612 PolarHBondContact O-N 3.3Å; V608-I644 HydrophobicContact CG1-CB 4.46Å; V608-I644 HydrophobicContact CG1-CG2 3.69Å; V608-Y648 VanDerWaalsContact CG2-CA 3.44Å; V608-Y648 HydrophobicContact CG2-CD2 4.22Å; V608-Y648 HydrophobicContact CG2-CG 4.49Å
609	G	89.3	Confident	88.6	Confident	33 Å²	33	39.5 Å²	39.5	34%	0.34	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-45.1	177.2	0	0	0	0	0	112.2	L605 I607 G612 I613	L605-G609 WeakPolarHBondContact O-CA 3.15Å; L605-G609 PolarHBondContact O-N 2.83Å; I607-G609 PolarHBondContact O-N 3.07Å; G609-G612 PolarHBondContact O-N 3.48Å; G609-I613 WeakPolarHBondContact O-CB 3.26Å; G609-I613 WeakPolarHBondContact O-CD1 3.45Å; G609-I613 WeakPolarHBondContact O-CG1 3.33Å; G609-I613 PolarHBondContact O-N 3.2Å
610	S	89.8	Confident	88.6	Confident	39 Å²	39	40.6 Å²	40.6	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-64.5	-45.7	177.7	49.1	0	0	0	0	112.5	M243 L606 I607 I613 L614	M243-S610 VanDerWaalsContact CE-OG 3.28Å; M243-S610 WeakPolarHBondContact CE-OG 3.48Å; L606-S610 WeakPolarHBondContact O-CB 3.39Å; L606-S610 PolarHBondContact O-N 2.99Å; L606-S610 PolarHBondContact O-OG 3.1Å; I607-S610 WeakPolarHBondContact CA-OG 3.43Å; I607-S610 PolarHBondContact O-N 2.05Å; I607-S610 PolarHBondContact O-OG 3.35Å; S610-I613 PolarHBondContact O-N 3.35Å; S610-L614 VanDerWaalsContact O-CG 3.31Å; S610-L614 WeakPolarHBondContact O-CG 3.04Å; S610-L614 PolarHBondContact O-N 3.42Å; S610-L614 VanDerWaalsContact O-N 3.12Å
611	V	93.1	Very high	88.2	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.03	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-42.7	173.5	-172.9	0	0	0	0	111.1	A240 M243 I607 I613 L614 A615 V643 S647	A240-V611 HydrophobicContact CB-CG1 4.47Å; A240-V611 HydrophobicContact CB-CG2 3.76Å; M243-V611 HydrophobicContact CE-CB 4.32Å; M243-V611 HydrophobicContact CE-CG2 3.13Å; I607-V611 WeakPolarHBondContact O-CG2 3.46Å; I607-V611 PolarHBondContact O-N 2.9Å; V611-I613 PolarHBondContact O-N 3.16Å; V611-L614 PolarHBondContact O-N 3Å; V611-A615 WeakPolarHBondContact O-CB 3.28Å; V611-A615 PolarHBondContact O-N 3.2Å; V611-V643 HydrophobicContact CG1-CG1 3.44Å; V611-V643 VanDerWaalsContact CG1-CG1 3.44Å; V611-S647 WeakPolarHBondContact CG1-OG 3.31Å
612	G	89.9	Confident	87.7	Confident	8 Å²	8	47.8 Å²	47.8	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-41.2	-179.2	0	0	0	0	0	112.9	V608 G609 A615 F616	V608-G612 PolarHBondContact O-N 3.3Å; G609-G612 PolarHBondContact O-N 3.48Å; G612-A615 PolarHBondContact O-N 3.44Å; G612-F616 WeakPolarHBondContact O-CB 3.32Å; G612-F616 PolarHBondContact O-N 2.97Å
613	I	89.2	Confident	87.2	Confident	97 Å²	97	49.8 Å²	49.8	50%	0.497	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-47.3	174.4	-70.9	165.8	0	0	0	110.3	G609 S610 V611 A615 F616 F617	G609-I613 WeakPolarHBondContact O-CB 3.26Å; G609-I613 WeakPolarHBondContact O-CD1 3.45Å; G609-I613 WeakPolarHBondContact O-CG1 3.33Å; G609-I613 PolarHBondContact O-N 3.2Å; S610-I613 PolarHBondContact O-N 3.35Å; V611-I613 PolarHBondContact O-N 3.16Å; I613-A615 VanDerWaalsContact C-N 3.34Å; I613-A615 PolarHBondContact O-N 2.79Å; I613-F616 PolarHBondContact O-N 3.49Å; I613-F617 HydrophobicContact CG2-CD2 3.6Å; I613-F617 HydrophobicContact CG2-CE2 3.5Å; I613-F617 VanDerWaalsContact CG2-CE2 3.5Å; I613-F617 WeakPolarHBondContact O-CD2 3.43Å; I613-F617 PolarHBondContact O-N 3.03Å
614	L	89.1	Confident	86	Confident	95 Å²	95	60.6 Å²	60.6	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-44.3	177	-70	171.2	0	0	0	111.6	S610 V611 F617 F618	S610-L614 VanDerWaalsContact O-CG 3.31Å; S610-L614 WeakPolarHBondContact O-CG 3.04Å; S610-L614 PolarHBondContact O-N 3.42Å; S610-L614 VanDerWaalsContact O-N 3.12Å; V611-L614 PolarHBondContact O-N 3Å; L614-F617 PolarHBondContact O-N 3.28Å; L614-F618 WeakPolarHBondContact O-CB 3.42Å; L614-F618 PolarHBondContact O-N 2.94Å
615	A	89.6	Confident	84.7	Confident	9 Å²	9	66.9 Å²	66.9	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-42.5	176.1	0	0	0	0	0	111.7	V611 G612 I613 F618 F619 I640 V643	V611-A615 WeakPolarHBondContact O-CB 3.28Å; V611-A615 PolarHBondContact O-N 3.2Å; G612-A615 PolarHBondContact O-N 3.44Å; I613-A615 VanDerWaalsContact C-N 3.34Å; I613-A615 PolarHBondContact O-N 2.79Å; A615-F618 PolarHBondContact O-N 3.27Å; A615-F619 HydrophobicContact CB-CD2 4.31Å; A615-F619 HydrophobicContact CB-CE2 4.45Å; A615-F619 WeakPolarHBondContact O-CD2 3.22Å; A615-F619 PolarHBondContact O-N 3.44Å; A615-I640 HydrophobicContact CB-CG1 4.48Å; A615-V643 HydrophobicContact CB-CB 4.41Å; A615-V643 HydrophobicContact CB-CG1 4.11Å
616	F	87.9	Confident	83.4	Confident	81 Å²	81	64.1 Å²	64.1	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-60.4	-49.9	176.5	176	-94.6	0	0	0	111.9	G612 I613 F618 T620 I640	G612-F616 WeakPolarHBondContact O-CB 3.32Å; G612-F616 PolarHBondContact O-N 2.97Å; I613-F616 PolarHBondContact O-N 3.49Å; F616-F618 VanDerWaalsContact C-N 3.27Å; F616-F618 PolarHBondContact O-N 3.39Å; F616-T620 HydrophobicContact CD2-CG2 4.03Å; F616-T620 HydrophobicContact CE1-CG2 4.45Å; F616-T620 HydrophobicContact CE2-CG2 3.78Å; F616-T620 HydrophobicContact CG-CG2 4.47Å; F616-T620 HydrophobicContact CZ-CG2 4.01Å; F616-T620 WeakPolarHBondContact O-CB 3.41Å; F616-T620 VanDerWaalsContact O-CG2 3.29Å; F616-T620 WeakPolarHBondContact O-CG2 3.26Å; F616-T620 PolarHBondContact O-N 3.3Å; F616-T620 VanDerWaalsContact O-N 3.09Å; F616-T620 PolarHBondContact O-OG1 2.84Å; F616-I640 HydrophobicContact CB-CD1 4.34Å; F616-I640 HydrophobicContact CD2-CD1 4.09Å
617	F	87	Confident	82.3	Confident	89 Å²	89	65.8 Å²	65.8	39%	0.39	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-34.1	179.1	-80.6	-68.5	0	0	0	112.7	I613 L614 R622 I623	I613-F617 HydrophobicContact CG2-CD2 3.6Å; I613-F617 HydrophobicContact CG2-CE2 3.5Å; I613-F617 VanDerWaalsContact CG2-CE2 3.5Å; I613-F617 WeakPolarHBondContact O-CD2 3.43Å; I613-F617 PolarHBondContact O-N 3.03Å; L614-F617 PolarHBondContact O-N 3.28Å; F617-R622 HydrophobicContact CD1-CB 3.91Å; F617-R622 PolarHBondContact O-N 3.4Å; F617-I623 HydrophobicContact CB-CD1 3.85Å; F617-I623 HydrophobicContact CB-CG1 3.85Å
618	F	86	Confident	81	Confident	33 Å²	33	73.5 Å²	73.5	15%	0.145	36%	0.361	C	S	.	.	H	α-helix	trans	-69.7	-55.4	176.7	179.9	-94	0	0	0	112.5	W232 L614 A615 F616 T620 H621 I623 V626 A630	W232-F618 HydrophobicContact CB-CE1 4.24Å; W232-F618 AromaticContact CD2-CE1 3.8Å; W232-F618 HydrophobicContact CD2-CE1 3.8Å; W232-F618 HydrophobicContact CD2-CE2 4.43Å; W232-F618 AromaticContact CD2-CZ 3.4Å; W232-F618 HydrophobicContact CD2-CZ 3.4Å; W232-F618 VanDerWaalsContact CD2-CZ 3.4Å; W232-F618 AromaticContact CE2-CZ 3.61Å; W232-F618 HydrophobicContact CE3-CE1 4.04Å; W232-F618 HydrophobicContact CE3-CE2 4.07Å; W232-F618 AromaticContact CE3-CZ 3.43Å; W232-F618 HydrophobicContact CE3-CZ 3.43Å; W232-F618 VanDerWaalsContact CE3-CZ 3.43Å; W232-F618 AromaticContact CG-CE1 3.9Å; W232-F618 HydrophobicContact CG-CE1 3.9Å; W232-F618 HydrophobicContact CG-CZ 4Å; W232-F618 HydrophobicContact CH2-CE2 4.23Å; W232-F618 AromaticContact CH2-CZ 3.94Å; W232-F618 HydrophobicContact CH2-CZ 3.94Å; W232-F618 AromaticContact CZ2-CZ 3.9Å; W232-F618 HydrophobicContact CZ2-CZ 3.9Å; W232-F618 AromaticContact CZ3-CE2 3.96Å; W232-F618 HydrophobicContact CZ3-CE2 3.96Å; W232-F618 AromaticContact CZ3-CZ 3.7Å; W232-F618 HydrophobicContact CZ3-CZ 3.7Å; L614-F618 WeakPolarHBondContact O-CB 3.42Å; L614-F618 PolarHBondContact O-N 2.94Å; A615-F618 PolarHBondContact O-N 3.27Å; F616-F618 VanDerWaalsContact C-N 3.27Å; F616-F618 PolarHBondContact O-N 3.39Å; F618-T620 PolarHBondContact O-N 2.61Å; F618-H621 PolarHBondContact O-N 2.89Å; F618-I623 HydrophobicContact CB-CD1 4.49Å; F618-V626 HydrophobicContact CD2-CG1 3.93Å; F618-V626 HydrophobicContact CE2-CG1 3.46Å; F618-V626 VanDerWaalsContact CE2-CG1 3.46Å; F618-A630 HydrophobicContact CE1-CB 4.4Å; F618-A630 HydrophobicContact CZ-CB 4.3Å
619	F	84.7	Confident	79.9	Confident	9 Å²	9	75.9 Å²	75.9	4%	0.039	38%	0.376	C	S	.	.	H	α-helix	trans	-74.7	-8.8	-176.4	-72.1	-66.1	0	0	0	114.4	W232 A615 L633 P639 I640	W232-F619 HydrophobicContact CB-CE1 4.38Å; W232-F619 HydrophobicContact CB-CZ 4.11Å; A615-F619 HydrophobicContact CB-CD2 4.31Å; A615-F619 HydrophobicContact CB-CE2 4.45Å; A615-F619 WeakPolarHBondContact O-CD2 3.22Å; A615-F619 PolarHBondContact O-N 3.44Å; F619-L633 HydrophobicContact CD1-CD1 3.6Å; F619-L633 HydrophobicContact CE1-CD1 4.16Å; F619-L633 HydrophobicContact CG-CD1 4.41Å; F619-P639 HydrophobicContact CD1-CB 4.35Å; F619-P639 HydrophobicContact CD2-CB 4.3Å; F619-P639 HydrophobicContact CE1-CB 3.9Å; F619-P639 HydrophobicContact CE1-CG 4.45Å; F619-P639 HydrophobicContact CE2-CB 3.85Å; F619-P639 HydrophobicContact CZ-CB 3.63Å; F619-I640 HydrophobicContact CB-CD1 4.09Å; F619-I640 HydrophobicContact CB-CG1 4.02Å; F619-I640 HydrophobicContact CD2-CG1 3.67Å; F619-I640 HydrophobicContact CG-CG1 4.21Å
620	T	83.7	Confident	79.1	Confident	31 Å²	31	74.8 Å²	74.8	19%	0.19	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.5	173.1	59.6	0	0	0	0	113.5	F616 F618 R622 Y636	F616-T620 HydrophobicContact CD2-CG2 4.03Å; F616-T620 HydrophobicContact CE1-CG2 4.45Å; F616-T620 HydrophobicContact CE2-CG2 3.78Å; F616-T620 HydrophobicContact CG-CG2 4.47Å; F616-T620 HydrophobicContact CZ-CG2 4.01Å; F616-T620 WeakPolarHBondContact O-CB 3.41Å; F616-T620 VanDerWaalsContact O-CG2 3.29Å; F616-T620 WeakPolarHBondContact O-CG2 3.26Å; F616-T620 PolarHBondContact O-N 3.3Å; F616-T620 VanDerWaalsContact O-N 3.09Å; F616-T620 PolarHBondContact O-OG1 2.84Å; F618-T620 PolarHBondContact O-N 2.61Å; T620-R622 PolarHBondContact O-N 2.86Å; T620-R622 VanDerWaalsContact O-N 3.08Å; T620-Y636 HydrophobicContact CG2-CD2 3.91Å; T620-Y636 HydrophobicContact CG2-CE2 4.14Å
621	H	79.6	Confident	78.4	Confident	67 Å²	67	73.5 Å²	73.5	31%	0.31	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	24.3	177.7	-60	72.6	0	0	0	114.1	F618 Q627 A630	F618-H621 PolarHBondContact O-N 2.89Å; H621-Q627 HydrophobicContact CB-CG 4.42Å; H621-Q627 PolarHBondContact CD2-O 2.58Å; H621-A630 WeakPolarHBondContact NE2-CB 3.39Å; H621-A630 PolarHBondContact NE2-O 3.37Å
622	R	77.2	Confident	77.7	Confident	177 Å²	177	78.9 Å²	78.9	67%	0.668	39%	0.389	S	S	*	.			trans	-83.8	-12	-178	-70.9	-164.5	-177.5	-149.4	2.7	113.6	F617 T620	F617-R622 HydrophobicContact CD1-CB 3.91Å; F617-R622 PolarHBondContact O-N 3.4Å; T620-R622 PolarHBondContact O-N 2.86Å; T620-R622 VanDerWaalsContact O-N 3.08Å
623	I	72.6	Confident	77.2	Confident	56 Å²	56	80.2 Å²	80.2	29%	0.287	39%	0.394	S	S	.	.			trans	-90.6	106.7	176	-56.6	174.2	0	0	0	109.1	F617 F618 I625 V626 Q627	F617-I623 HydrophobicContact CB-CD1 3.85Å; F617-I623 HydrophobicContact CB-CG1 3.85Å; F618-I623 HydrophobicContact CB-CD1 4.49Å; I623-I625 HydrophobicContact CG2-CB 4.24Å; I623-I625 PolarHBondContact O-N 3.47Å; I623-I625 VanDerWaalsContact O-N 3.1Å; I623-V626 HydrophobicContact CG2-CB 4.36Å; I623-V626 HydrophobicContact CG2-CG2 3.93Å; I623-V626 PolarHBondContact O-N 3.38Å; I623-V626 VanDerWaalsContact O-N 3.11Å; I623-Q627 PolarHBondContact O-N 3.45Å
624	R	62.2	Low	76.7	Confident	228 Å²	228	79.5 Å²	79.5	86%	0.86	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.7	-178.2	-65.4	-175.9	-178.8	-178.5	-0.4	114.5	V626	R624-V626 VanDerWaalsContact C-N 3.3Å; R624-V626 PolarHBondContact O-N 3.26Å
625	I	63.8	Low	76.4	Confident	163 Å²	163	77.9 Å²	77.9	84%	0.836	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-20	-177.4	-59.6	168	0	0	0	111.9	I623	I623-I625 HydrophobicContact CG2-CB 4.24Å; I623-I625 PolarHBondContact O-N 3.47Å; I623-I625 VanDerWaalsContact O-N 3.1Å
626	V	64	Low	76.1	Confident	40 Å²	40	83.2 Å²	83.2	24%	0.242	40%	0.398	C	S	.	.	S	Bend	trans	-130.3	9.2	-164.2	-163.9	0	0	0	0	111.7	F618 I623 R624 D628 T629 A630	F618-V626 HydrophobicContact CD2-CG1 3.93Å; F618-V626 HydrophobicContact CE2-CG1 3.46Å; F618-V626 VanDerWaalsContact CE2-CG1 3.46Å; I623-V626 HydrophobicContact CG2-CB 4.36Å; I623-V626 HydrophobicContact CG2-CG2 3.93Å; I623-V626 PolarHBondContact O-N 3.38Å; I623-V626 VanDerWaalsContact O-N 3.11Å; R624-V626 VanDerWaalsContact C-N 3.3Å; R624-V626 PolarHBondContact O-N 3.26Å; V626-D628 VanDerWaalsContact C-N 3.29Å; V626-D628 PolarHBondContact O-N 3.44Å; V626-T629 WeakPolarHBondContact CG1-OG1 3.47Å; V626-T629 PolarHBondContact O-N 2.78Å; V626-T629 VanDerWaalsContact O-N 3.08Å; V626-T629 PolarHBondContact O-OG1 3.21Å; V626-A630 PolarHBondContact O-N 3.47Å
627	Q	64.7	Low	75.9	Confident	102 Å²	102	84.9 Å²	84.9	48%	0.477	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.7	-170.2	-168.2	166.9	-8.6	0	0	113.3	H621 I623	H621-Q627 HydrophobicContact CB-CG 4.42Å; H621-Q627 PolarHBondContact CD2-O 2.58Å; I623-Q627 PolarHBondContact O-N 3.45Å
628	D	63.8	Low	75.8	Confident	164 Å²	164	81 Å²	81	88%	0.877	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.4	-178.6	-58.8	-37.7	0	0	0	114.1	V626	V626-D628 VanDerWaalsContact C-N 3.29Å; V626-D628 PolarHBondContact O-N 3.44Å
629	T	71.6	Confident	75.9	Confident	68 Å²	68	79.4 Å²	79.4	42%	0.417	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-17.2	-176.9	67.5	0	0	0	0	113.4	V626	V626-T629 WeakPolarHBondContact CG1-OG1 3.47Å; V626-T629 PolarHBondContact O-N 2.78Å; V626-T629 VanDerWaalsContact O-N 3.08Å; V626-T629 PolarHBondContact O-OG1 3.21Å
630	A	71.6	Confident	76.1	Confident	10 Å²	10	79.7 Å²	79.7	8%	0.083	38%	0.38	C	S	.	.	S	Bend	trans	-78.8	126.9	-180	0	0	0	0	0	110.4	F618 H621 V626	F618-A630 HydrophobicContact CE1-CB 4.4Å; F618-A630 HydrophobicContact CZ-CB 4.3Å; H621-A630 WeakPolarHBondContact NE2-CB 3.39Å; H621-A630 PolarHBondContact NE2-O 3.37Å; V626-A630 PolarHBondContact O-N 3.47Å
631	P	75.3	Confident	76.4	Confident	12 Å²	12	82.3 Å²	82.3	8%	0.078	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-69.4	147.7	-175	27.3	-33.6	0	0	0	111.9	V228 L633	V228-P631 HydrophobicContact CG1-CB 3.42Å; V228-P631 VanDerWaalsContact CG1-CB 3.42Å; V228-P631 HydrophobicContact CG1-CG 4.25Å; P631-L633 HydrophobicContact CG-CD2 4.38Å; P631-L633 HydrophobicContact CG-CG 4.44Å; P631-L633 PolarHBondContact O-N 3.24Å
632	P	77.4	Confident	76.9	Confident	117 Å²	117	81 Å²	81	76%	0.76	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-67.4	131	166.4	29.4	-32.7	0	0	0	109.3
633	L	80.7	Confident	77.7	Confident	36 Å²	36	72.7 Å²	72.7	19%	0.188	36%	0.358	C	S	.	.			trans	-127	144	-176.5	-64.1	167.9	0	0	0	110.2	D225 F619 P631 P639	D225-L633 HydrophobicContact CB-CD2 3.92Å; F619-L633 HydrophobicContact CD1-CD1 3.6Å; F619-L633 HydrophobicContact CE1-CD1 4.16Å; F619-L633 HydrophobicContact CG-CD1 4.41Å; P631-L633 HydrophobicContact CG-CD2 4.38Å; P631-L633 HydrophobicContact CG-CG 4.44Å; P631-L633 PolarHBondContact O-N 3.24Å; L633-P639 HydrophobicContact CD1-CG 3.91Å; L633-P639 HydrophobicContact CD2-CG 4.44Å
634	N	78.4	Confident	78.6	Confident	82 Å²	82	72.7 Å²	72.7	44%	0.439	36%	0.358	S	S	.	.	S	Bend	trans	-67.5	-43.9	171.5	-64.5	-84.7	0	0	0	110.4	R221 D225	R221-N634 HydrophobicContact CB-CB 4.24Å; D225-N634 WeakPolarHBondContact OD1-CB 3.44Å; D225-N634 PolarHBondContact OD1-N 3.05Å; D225-N634 PolarHBondContact OD1-ND2 3.16Å
635	Y	82.1	Confident	80.1	Confident	62 Å²	62	65.4 Å²	65.4	24%	0.243	34%	0.339	C	S	.	.			trans	-132.2	87.3	-178.8	-61.9	-71.4	0	0	0	111.1	L218 R221 D225 W637 V638 P639	L218-Y635 HydrophobicContact CD1-CD2 4.14Å; L218-Y635 HydrophobicContact CD1-CE1 4.37Å; L218-Y635 HydrophobicContact CD1-CE2 3.62Å; R221-Y635 HydrophobicContact CB-CD2 4.11Å; R221-Y635 HydrophobicContact CB-CE2 3.72Å; R221-Y635 HydrophobicContact CG-CE2 4.38Å; R221-Y635 PolarHBondContact NH1-OH 3.2Å; D225-Y635 PolarHBondContact OD2-N 2.88Å; Y635-W637 AromaticContact CD1-NE1 3.55Å; Y635-W637 AromaticContact CG-NE1 3.87Å; Y635-W637 PolarHBondContact O-N 3.02Å; Y635-V638 WeakPolarHBondContact O-CB 3.32Å; Y635-V638 PolarHBondContact O-N 3.03Å; Y635-P639 WeakPolarHBondContact O-CD 3.43Å
636	Y	83.2	Confident	81.4	Confident	120 Å²	120	58.4 Å²	58.4	47%	0.471	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-27	178.9	66.3	-93.2	0	0	0	114.2	T620 V638 I640	T620-Y636 HydrophobicContact CG2-CD2 3.91Å; T620-Y636 HydrophobicContact CG2-CE2 4.14Å; Y636-V638 VanDerWaalsContact C-N 3.25Å; Y636-V638 PolarHBondContact O-N 3.13Å; Y636-I640 HydrophobicContact CD2-CD1 3.92Å; Y636-I640 VanDerWaalsContact O-CD1 3.27Å; Y636-I640 WeakPolarHBondContact O-CD1 3.04Å; Y636-I640 VanDerWaalsContact O-CG1 3.31Å; Y636-I640 WeakPolarHBondContact O-CG1 3.44Å
637	W	83.6	Confident	82.9	Confident	117 Å²	117	56.5 Å²	56.5	44%	0.443	30%	0.295	S	S	.	.	H	α-helix	trans	-68.7	-22	179.1	67.1	-94.8	0	0	0	113.3	Y635 L641	Y635-W637 AromaticContact CD1-NE1 3.55Å; Y635-W637 AromaticContact CG-NE1 3.87Å; Y635-W637 PolarHBondContact O-N 3.02Å; W637-L641 HydrophobicContact CE3-CB 4.48Å; W637-L641 HydrophobicContact CE3-CD2 4.24Å; W637-L641 HydrophobicContact CZ3-CD2 3.88Å; W637-L641 VanDerWaalsContact O-CB 3.29Å; W637-L641 WeakPolarHBondContact O-CB 3.07Å; W637-L641 PolarHBondContact O-N 3.17Å
638	V	84.9	Confident	84.3	Confident	6 Å²	6	56.2 Å²	56.2	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-69.8	-56.6	-175.4	170.4	0	0	0	0	110.9	I222 Y226 Y635 Y636 I640 L641 T642	I222-V638 HydrophobicContact CD1-CG2 4.32Å; I222-V638 HydrophobicContact CG1-CG1 4.3Å; I222-V638 HydrophobicContact CG1-CG2 3.9Å; I222-V638 HydrophobicContact CG2-CG1 3.96Å; Y226-V638 HydrophobicContact CE2-CG1 3.98Å; Y635-V638 WeakPolarHBondContact O-CB 3.32Å; Y635-V638 PolarHBondContact O-N 3.03Å; Y636-V638 VanDerWaalsContact C-N 3.25Å; Y636-V638 PolarHBondContact O-N 3.13Å; V638-I640 VanDerWaalsContact C-N 3.28Å; V638-I640 PolarHBondContact O-N 2.76Å; V638-L641 PolarHBondContact O-N 2.97Å; V638-T642 PolarHBondContact O-N 3.16Å; V638-T642 PolarHBondContact O-OG1 3.28Å
639	P	87.9	Confident	85.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-37.6	173.6	-28.2	37.8	0	0	0	113.5	S229 I233 F619 L633 Y635 T642 V643	S229-P639 WeakPolarHBondContact OG-CG 3.39Å; I233-P639 HydrophobicContact CD1-CB 4.02Å; I233-P639 HydrophobicContact CG1-CB 4.09Å; F619-P639 HydrophobicContact CD1-CB 4.35Å; F619-P639 HydrophobicContact CD2-CB 4.3Å; F619-P639 HydrophobicContact CE1-CB 3.9Å; F619-P639 HydrophobicContact CE1-CG 4.45Å; F619-P639 HydrophobicContact CE2-CB 3.85Å; F619-P639 HydrophobicContact CZ-CB 3.63Å; L633-P639 HydrophobicContact CD1-CG 3.91Å; L633-P639 HydrophobicContact CD2-CG 4.44Å; Y635-P639 WeakPolarHBondContact O-CD 3.43Å; P639-T642 PolarHBondContact O-N 3.07Å; P639-V643 WeakPolarHBondContact O-CG2 3.24Å; P639-V643 PolarHBondContact O-N 2.85Å
640	I	89.1	Confident	86.5	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-49	176.8	-64.6	166.9	0	0	0	110.4	A615 F616 F619 Y636 V638 T642 V643 I644	A615-I640 HydrophobicContact CB-CG1 4.48Å; F616-I640 HydrophobicContact CB-CD1 4.34Å; F616-I640 HydrophobicContact CD2-CD1 4.09Å; F619-I640 HydrophobicContact CB-CD1 4.09Å; F619-I640 HydrophobicContact CB-CG1 4.02Å; F619-I640 HydrophobicContact CD2-CG1 3.67Å; F619-I640 HydrophobicContact CG-CG1 4.21Å; Y636-I640 HydrophobicContact CD2-CD1 3.92Å; Y636-I640 VanDerWaalsContact O-CD1 3.27Å; Y636-I640 WeakPolarHBondContact O-CD1 3.04Å; Y636-I640 VanDerWaalsContact O-CG1 3.31Å; Y636-I640 WeakPolarHBondContact O-CG1 3.44Å; V638-I640 VanDerWaalsContact C-N 3.28Å; V638-I640 PolarHBondContact O-N 2.76Å; I640-T642 VanDerWaalsContact C-N 3.27Å; I640-T642 PolarHBondContact O-N 3.22Å; I640-V643 PolarHBondContact O-N 3.12Å; I640-I644 HydrophobicContact CG2-CD1 3.74Å; I640-I644 HydrophobicContact CG2-CG1 4.37Å; I640-I644 WeakPolarHBondContact O-CB 3.26Å; I640-I644 VanDerWaalsContact O-CG1 3.3Å; I640-I644 WeakPolarHBondContact O-CG1 3.31Å; I640-I644 PolarHBondContact O-N 2.9Å
641	L	89.9	Confident	87.5	Confident	87 Å²	87	52 Å²	52	46%	0.455	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-40.6	178.4	-178	63.6	0	0	0	110.9	W637 V638 I644 V645	W637-L641 HydrophobicContact CE3-CB 4.48Å; W637-L641 HydrophobicContact CE3-CD2 4.24Å; W637-L641 HydrophobicContact CZ3-CD2 3.88Å; W637-L641 VanDerWaalsContact O-CB 3.29Å; W637-L641 WeakPolarHBondContact O-CB 3.07Å; W637-L641 PolarHBondContact O-N 3.17Å; V638-L641 PolarHBondContact O-N 2.97Å; L641-I644 PolarHBondContact O-N 3.06Å; L641-V645 HydrophobicContact CD1-CG2 4.21Å; L641-V645 HydrophobicContact CG-CG2 4.4Å; L641-V645 WeakPolarHBondContact O-CB 3.28Å; L641-V645 VanDerWaalsContact O-CG2 3.28Å; L641-V645 WeakPolarHBondContact O-CG2 3.33Å; L641-V645 PolarHBondContact O-N 2.8Å
642	T	89.9	Confident	88.3	Confident	40 Å²	40	55.4 Å²	55.4	25%	0.245	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-42.8	177.7	-52.8	0	0	0	0	112.1	Y226 I233 V638 P639 I640 V645 G646	Y226-T642 HydrophobicContact CE1-CG2 4.02Å; Y226-T642 PolarHBondContact OH-OG1 2.8Å; I233-T642 HydrophobicContact CG2-CG2 4.09Å; V638-T642 PolarHBondContact O-N 3.16Å; V638-T642 PolarHBondContact O-OG1 3.28Å; P639-T642 PolarHBondContact O-N 3.07Å; I640-T642 VanDerWaalsContact C-N 3.27Å; I640-T642 PolarHBondContact O-N 3.22Å; T642-V645 PolarHBondContact O-N 2.84Å; T642-G646 PolarHBondContact O-N 3.4Å
643	V	94	Very high	88.9	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-42.1	174.5	172	0	0	0	0	110.7	I233 V611 A615 P639 I640 S647	I233-V643 HydrophobicContact CB-CG2 4.31Å; I233-V643 HydrophobicContact CG1-CG2 4.29Å; I233-V643 HydrophobicContact CG2-CG2 4.03Å; V611-V643 HydrophobicContact CG1-CG1 3.44Å; V611-V643 VanDerWaalsContact CG1-CG1 3.44Å; A615-V643 HydrophobicContact CB-CB 4.41Å; A615-V643 HydrophobicContact CB-CG1 4.11Å; P639-V643 WeakPolarHBondContact O-CG2 3.24Å; P639-V643 PolarHBondContact O-N 2.85Å; I640-V643 PolarHBondContact O-N 3.12Å; V643-S647 WeakPolarHBondContact O-CB 3.18Å; V643-S647 PolarHBondContact O-N 2.04Å; V643-S647 PolarHBondContact O-OG 3.02Å
644	I	93	Very high	89.3	Confident	56 Å²	56	50 Å²	50	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-50.7	176.8	-73.7	172.1	0	0	0	110.9	V608 I640 L641 S647 Y648	V608-I644 HydrophobicContact CG1-CB 4.46Å; V608-I644 HydrophobicContact CG1-CG2 3.69Å; I640-I644 HydrophobicContact CG2-CD1 3.74Å; I640-I644 HydrophobicContact CG2-CG1 4.37Å; I640-I644 WeakPolarHBondContact O-CB 3.26Å; I640-I644 VanDerWaalsContact O-CG1 3.3Å; I640-I644 WeakPolarHBondContact O-CG1 3.31Å; I640-I644 PolarHBondContact O-N 2.9Å; L641-I644 PolarHBondContact O-N 3.06Å; I644-S647 PolarHBondContact O-N 2.96Å; I644-Y648 PolarHBondContact O-N 3.38Å
645	V	93.4	Very high	89.9	Confident	75 Å²	75	46.3 Å²	46.3	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-46.4	-180	171.2	0	0	0	0	110.6	L641 T642 S647 Y648 L649	L641-V645 HydrophobicContact CD1-CG2 4.21Å; L641-V645 HydrophobicContact CG-CG2 4.4Å; L641-V645 WeakPolarHBondContact O-CB 3.28Å; L641-V645 VanDerWaalsContact O-CG2 3.28Å; L641-V645 WeakPolarHBondContact O-CG2 3.33Å; L641-V645 PolarHBondContact O-N 2.8Å; T642-V645 PolarHBondContact O-N 2.84Å; V645-S647 PolarHBondContact O-N 2.78Å; V645-Y648 WeakPolarHBondContact O-CB 3.44Å; V645-Y648 PolarHBondContact O-N 2.79Å; V645-L649 HydrophobicContact CG1-CD1 4.45Å; V645-L649 WeakPolarHBondContact O-CG 3.42Å; V645-L649 PolarHBondContact O-N 2.68Å
646	G	91.4	Very high	90.3	Very high	15 Å²	15	45.6 Å²	45.6	16%	0.155	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-40.3	177.7	0	0	0	0	0	112.5	T642 Y648 L649 I650	T642-G646 PolarHBondContact O-N 3.4Å; G646-Y648 VanDerWaalsContact C-N 3.3Å; G646-Y648 PolarHBondContact O-N 3.38Å; G646-L649 PolarHBondContact O-N 2.79Å; G646-I650 VanDerWaalsContact O-CG1 3.31Å; G646-I650 WeakPolarHBondContact O-CG1 3.18Å; G646-I650 PolarHBondContact O-N 2.84Å
647	S	94.8	Very high	90.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-39.3	173.6	-60.4	0	0	0	0	111.7	A240 V611 V643 I644 V645 I650 A651	A240-S647 VanDerWaalsContact CB-OG 3.26Å; A240-S647 WeakPolarHBondContact CB-OG 3.48Å; V611-S647 WeakPolarHBondContact CG1-OG 3.31Å; V643-S647 WeakPolarHBondContact O-CB 3.18Å; V643-S647 PolarHBondContact O-N 2.04Å; V643-S647 PolarHBondContact O-OG 3.02Å; I644-S647 PolarHBondContact O-N 2.96Å; V645-S647 PolarHBondContact O-N 2.78Å; S647-I650 PolarHBondContact O-N 3.2Å; S647-A651 VanDerWaalsContact O-CB 3.3Å; S647-A651 WeakPolarHBondContact O-CB 3.08Å; S647-A651 PolarHBondContact O-N 2.8Å
648	Y	94.1	Very high	91	Very high	97 Å²	97	34.3 Å²	34.3	38%	0.38	19%	0.185	S	C	.	.	H	α-helix	trans	-64.2	-43.2	175.3	178.5	-91.3	0	0	0	111.6	V608 I644 V645 G646 A651 H652	V608-Y648 VanDerWaalsContact CG2-CA 3.44Å; V608-Y648 HydrophobicContact CG2-CD2 4.22Å; V608-Y648 HydrophobicContact CG2-CG 4.49Å; I644-Y648 PolarHBondContact O-N 3.38Å; V645-Y648 WeakPolarHBondContact O-CB 3.44Å; V645-Y648 PolarHBondContact O-N 2.79Å; G646-Y648 VanDerWaalsContact C-N 3.3Å; G646-Y648 PolarHBondContact O-N 3.38Å; Y648-A651 PolarHBondContact O-N 3.01Å; Y648-H652 HydrophobicContact CE1-CB 4.45Å; Y648-H652 WeakPolarHBondContact O-CB 3.39Å; Y648-H652 PolarHBondContact O-N 3.28Å
649	L	91.1	Very high	91.3	Very high	109 Å²	109	34.3 Å²	34.3	57%	0.571	19%	0.186	S	C	*	.	H	α-helix	trans	-63.2	-43.3	177.3	-67.9	176.5	0	0	0	111.8	V645 G646 H652 G653	V645-L649 HydrophobicContact CG1-CD1 4.45Å; V645-L649 WeakPolarHBondContact O-CG 3.42Å; V645-L649 PolarHBondContact O-N 2.68Å; G646-L649 PolarHBondContact O-N 2.79Å; L649-H652 PolarHBondContact O-N 2.97Å; L649-G653 PolarHBondContact O-N 3.21Å
650	I	91	Very high	91.6	Very high	45 Å²	45	34.8 Å²	34.8	23%	0.231	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-55.3	176.2	-69.3	169.6	0	0	0	109.9	L237 A240 M241 G646 S647 H652 G653 F654	L237-I650 HydrophobicContact CB-CD1 3.95Å; L237-I650 HydrophobicContact CD2-CD1 4.06Å; L237-I650 WeakPolarHBondContact O-CD1 3.34Å; A240-I650 HydrophobicContact CB-CD1 4.43Å; M241-I650 HydrophobicContact CB-CG2 4.1Å; G646-I650 VanDerWaalsContact O-CG1 3.31Å; G646-I650 WeakPolarHBondContact O-CG1 3.18Å; G646-I650 PolarHBondContact O-N 2.84Å; S647-I650 PolarHBondContact O-N 3.2Å; I650-H652 VanDerWaalsContact C-N 3.29Å; I650-H652 PolarHBondContact O-N 2.78Å; I650-G653 PolarHBondContact O-N 3.03Å; I650-F654 HydrophobicContact CG2-CD2 3.77Å; I650-F654 HydrophobicContact CG2-CE2 3.6Å; I650-F654 VanDerWaalsContact O-CD2 3.25Å; I650-F654 WeakPolarHBondContact O-CD2 3.49Å; I650-F654 PolarHBondContact O-N 2.73Å; I650-F654 VanDerWaalsContact O-N 3.08Å
651	A	92.8	Very high	91.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.6	-44.8	178.1	0	0	0	0	0	111	K604 I607 S647 Y648 G653 F654 F655	K604-A651 HydrophobicContact CG-CB 4.23Å; I607-A651 HydrophobicContact CD1-CB 4.44Å; I607-A651 HydrophobicContact CG2-CB 4.37Å; S647-A651 VanDerWaalsContact O-CB 3.3Å; S647-A651 WeakPolarHBondContact O-CB 3.08Å; S647-A651 PolarHBondContact O-N 2.8Å; Y648-A651 PolarHBondContact O-N 3.01Å; A651-G653 VanDerWaalsContact C-N 3.33Å; A651-G653 PolarHBondContact O-N 3.46Å; A651-F654 PolarHBondContact O-N 3.21Å; A651-F655 HydrophobicContact CB-CD2 4.38Å; A651-F655 HydrophobicContact CB-CE2 4.48Å; A651-F655 WeakPolarHBondContact O-CD2 3.22Å; A651-F655 PolarHBondContact O-N 3.03Å
652	H	91.5	Very high	92	Very high	83 Å²	83	30 Å²	30	38%	0.384	16%	0.163	S	C	.	.	H	α-helix	trans	-57	-44.6	175.9	-178.6	-81	0	0	0	112.2	Y648 L649 I650 S656	Y648-H652 HydrophobicContact CE1-CB 4.45Å; Y648-H652 WeakPolarHBondContact O-CB 3.39Å; Y648-H652 PolarHBondContact O-N 3.28Å; L649-H652 PolarHBondContact O-N 2.97Å; I650-H652 VanDerWaalsContact C-N 3.29Å; I650-H652 PolarHBondContact O-N 2.78Å; H652-S656 VanDerWaalsContact O-CB 3.26Å; H652-S656 WeakPolarHBondContact O-CB 3.38Å; H652-S656 PolarHBondContact O-N 2.8Å
653	G	89.8	Confident	92.1	Very high	13 Å²	13	28.8 Å²	28.8	13%	0.134	16%	0.155	C	C	.	.	H	α-helix	trans	-56.2	-52.9	174.8	0	0	0	0	0	112.2	P362 L649 I650 A651 S656 V657	P362-G653 WeakPolarHBondContact CG-O 3.42Å; L649-G653 PolarHBondContact O-N 3.21Å; I650-G653 PolarHBondContact O-N 3.03Å; A651-G653 VanDerWaalsContact C-N 3.33Å; A651-G653 PolarHBondContact O-N 3.46Å; G653-S656 PolarHBondContact O-N 3.37Å; G653-S656 PolarHBondContact O-OG 2.97Å; G653-V657 PolarHBondContact O-N 3.19Å
654	F	89.7	Confident	92.1	Very high	27 Å²	27	28.7 Å²	28.7	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-49.3	178.4	-81.2	-74.2	0	0	0	113	M241 I248 L359 I650 A651 S656 V657 Y658	M241-F654 HydrophobicContact CG-CE2 3.91Å; M241-F654 HydrophobicContact CG-CZ 3.91Å; I248-F654 HydrophobicContact CD1-CB 3.79Å; I248-F654 HydrophobicContact CD1-CD1 3.92Å; I248-F654 HydrophobicContact CD1-CG 4.21Å; L359-F654 HydrophobicContact CB-CD1 4.42Å; L359-F654 HydrophobicContact CB-CE1 4.15Å; L359-F654 HydrophobicContact CD2-CD1 4.16Å; I650-F654 HydrophobicContact CG2-CD2 3.77Å; I650-F654 HydrophobicContact CG2-CE2 3.6Å; I650-F654 VanDerWaalsContact O-CD2 3.25Å; I650-F654 WeakPolarHBondContact O-CD2 3.49Å; I650-F654 PolarHBondContact O-N 2.73Å; I650-F654 VanDerWaalsContact O-N 3.08Å; A651-F654 PolarHBondContact O-N 3.21Å; F654-S656 VanDerWaalsContact C-N 3.28Å; F654-S656 PolarHBondContact O-N 3.42Å; F654-V657 PolarHBondContact O-N 2.93Å; F654-Y658 PolarHBondContact O-N 3.29Å
655	F	90.6	Very high	92.1	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.018	14%	0.142	C	C	.	.	H	α-helix	trans	-67.9	-25.9	178.3	-78.4	-72.4	0	0	0	113.1	F247 F600 K604 I607 A651 Y658 G659	F247-F655 HydrophobicContact CD1-CE1 4.17Å; F247-F655 AromaticContact CD1-CZ 3.65Å; F247-F655 HydrophobicContact CD1-CZ 3.65Å; F247-F655 AromaticContact CE1-CE1 3.8Å; F247-F655 HydrophobicContact CE1-CE1 3.8Å; F247-F655 AromaticContact CE1-CZ 3.45Å; F247-F655 HydrophobicContact CE1-CZ 3.45Å; F247-F655 VanDerWaalsContact CE1-CZ 3.45Å; F247-F655 HydrophobicContact CZ-CZ 4.36Å; F600-F655 HydrophobicContact CB-CB 4.44Å; F600-F655 HydrophobicContact CB-CD1 3.85Å; F600-F655 HydrophobicContact CB-CE1 4.42Å; F600-F655 HydrophobicContact CB-CG 4.29Å; F600-F655 AromaticContact CD1-CD1 3.49Å; F600-F655 HydrophobicContact CD1-CD1 3.49Å; F600-F655 VanDerWaalsContact CD1-CD1 3.49Å; F600-F655 AromaticContact CD1-CE1 3.83Å; F600-F655 HydrophobicContact CD1-CE1 3.83Å; F600-F655 HydrophobicContact CE1-CD1 4.29Å; F600-F655 AromaticContact CG-CD1 3.81Å; F600-F655 HydrophobicContact CG-CD1 3.81Å; F600-F655 HydrophobicContact CG-CE1 4.45Å; K604-F655 HydrophobicContact CB-CE2 4.49Å; K604-F655 HydrophobicContact CD-CD2 4.26Å; K604-F655 VanDerWaalsContact CE-CB 3.42Å; K604-F655 HydrophobicContact CG-CD2 3.37Å; K604-F655 HydrophobicContact CG-CE2 3.73Å; K604-F655 HydrophobicContact CG-CG 4.17Å; I607-F655 HydrophobicContact CD1-CE2 3.82Å; I607-F655 HydrophobicContact CD1-CZ 4.24Å; A651-F655 HydrophobicContact CB-CD2 4.38Å; A651-F655 HydrophobicContact CB-CE2 4.48Å; A651-F655 WeakPolarHBondContact O-CD2 3.22Å; A651-F655 PolarHBondContact O-N 3.03Å; F655-Y658 PolarHBondContact O-N 3.45Å; F655-G659 PolarHBondContact O-N 2.97Å
656	S	90.4	Very high	92	Very high	47 Å²	47	23.1 Å²	23.1	33%	0.329	12%	0.123	S	C	.	.	H	α-helix	trans	-66.1	-39.1	176.5	75.5	0	0	0	0	112	H652 G653 F654 Y658 G659 M660	H652-S656 VanDerWaalsContact O-CB 3.26Å; H652-S656 WeakPolarHBondContact O-CB 3.38Å; H652-S656 PolarHBondContact O-N 2.8Å; G653-S656 PolarHBondContact O-N 3.37Å; G653-S656 PolarHBondContact O-OG 2.97Å; F654-S656 VanDerWaalsContact C-N 3.28Å; F654-S656 PolarHBondContact O-N 3.42Å; S656-Y658 VanDerWaalsContact C-N 3.31Å; S656-Y658 PolarHBondContact O-N 3.36Å; S656-G659 PolarHBondContact O-N 2.92Å; S656-M660 PolarHBondContact O-N 2.96Å
657	V	92.3	Very high	92	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-44.1	173.5	178.4	0	0	0	0	109.9	S358 L359 P362 L466 F470 G653 F654 M660 C661	S358-V657 WeakPolarHBondContact O-CG2 3.35Å; L359-V657 HydrophobicContact CD2-CG1 4.3Å; P362-V657 HydrophobicContact CG-CG2 3.35Å; L466-V657 HydrophobicContact CD1-CG1 4.49Å; L466-V657 HydrophobicContact CD1-CG2 4.32Å; L466-V657 HydrophobicContact CD2-CG1 4.11Å; F470-V657 HydrophobicContact CE2-CG1 4.26Å; F470-V657 HydrophobicContact CZ-CG1 3.98Å; G653-V657 PolarHBondContact O-N 3.19Å; F654-V657 PolarHBondContact O-N 2.93Å; V657-M660 PolarHBondContact O-N 3.48Å; V657-C661 PolarHBondContact O-N 3.25Å
658	Y	90.2	Very high	91.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.5	-41.2	179.5	-149.1	-79.5	0	0	0	112.4	I248 I345 A348 S349 V352 F600 F654 F655 S656 C661 V662	I248-Y658 HydrophobicContact CG2-CD2 4.34Å; I248-Y658 HydrophobicContact CG2-CE2 4.19Å; I345-Y658 HydrophobicContact CB-CE1 4.41Å; I345-Y658 HydrophobicContact CG2-CE1 3.9Å; I345-Y658 PolarHBondContact O-OH 3.1Å; A348-Y658 HydrophobicContact CB-CD1 4.33Å; A348-Y658 HydrophobicContact CB-CE1 3.72Å; S349-Y658 VanDerWaalsContact CA-OH 3.22Å; S349-Y658 WeakPolarHBondContact CA-OH 3.48Å; S349-Y658 WeakPolarHBondContact CB-OH 3.17Å; S349-Y658 PolarHBondContact N-OH 2.86Å; V352-Y658 HydrophobicContact CG2-CD2 4.21Å; V352-Y658 HydrophobicContact CG2-CE2 4.47Å; F600-Y658 AromaticContact CE1-CD1 3.61Å; F600-Y658 HydrophobicContact CE1-CD1 3.61Å; F600-Y658 HydrophobicContact CE1-CE1 4.07Å; F600-Y658 HydrophobicContact CE1-CG 4.42Å; F600-Y658 HydrophobicContact CE2-CD1 4.5Å; F600-Y658 AromaticContact CZ-CD1 3.46Å; F600-Y658 HydrophobicContact CZ-CD1 3.46Å; F600-Y658 VanDerWaalsContact CZ-CD1 3.46Å; F600-Y658 HydrophobicContact CZ-CE1 4.1Å; F600-Y658 HydrophobicContact CZ-CG 4.4Å; F654-Y658 PolarHBondContact O-N 3.29Å; F655-Y658 PolarHBondContact O-N 3.45Å; S656-Y658 VanDerWaalsContact C-N 3.31Å; S656-Y658 PolarHBondContact O-N 3.36Å; Y658-C661 WeakPolarHBondContact O-CB 3.34Å; Y658-C661 PolarHBondContact O-N 3.15Å; Y658-V662 HydrophobicContact CD1-CG2 3.92Å; Y658-V662 HydrophobicContact CE1-CG2 3.98Å; Y658-V662 WeakPolarHBondContact O-CG2 3.12Å; Y658-V662 PolarHBondContact O-N 2.92Å
659	G	91.3	Very high	91.7	Very high	6 Å²	6	18 Å²	18	6%	0.062	10%	0.098	C	C	.	.	H	α-helix	trans	-60.6	-44.1	173.3	0	0	0	0	0	112.1	R558 F655 S656 C661 V662 D663	R558-G659 VanDerWaalsContact NH2-C 3.34Å; R558-G659 PolarHBondContact NH2-O 3.23Å; F655-G659 PolarHBondContact O-N 2.97Å; S656-G659 PolarHBondContact O-N 2.92Å; G659-C661 VanDerWaalsContact C-N 3.31Å; G659-C661 PolarHBondContact O-N 3.2Å; G659-V662 PolarHBondContact O-N 2.97Å; G659-D663 VanDerWaalsContact O-CG 3.26Å; G659-D663 PolarHBondContact O-N 3.1Å
660	M	93.4	Very high	91.6	Very high	10 Å²	10	12.8 Å²	12.8	5%	0.049	7%	0.071	C	C	.	.	H	α-helix	trans	-62.4	-37.7	173.7	-74.5	-56.6	-52.9	0	0	112.5	Q463 L466 R558 I562 S656 V657 T664	Q463-M660 HydrophobicContact CB-CE 3.74Å; Q463-M660 HydrophobicContact CB-SD 4.27Å; Q463-M660 HydrophobicContact CG-CE 3.96Å; Q463-M660 HydrophobicContact CG-SD 3.78Å; L466-M660 HydrophobicContact CB-CB 4.33Å; L466-M660 HydrophobicContact CD1-CB 4.24Å; L466-M660 HydrophobicContact CD1-CG 4.28Å; R558-M660 HydrophobicContact CG-CE 4.47Å; R558-M660 HydrophobicContact CG-SD 4.05Å; R558-M660 PolarHBondContact NE-SD 3.15Å; R558-M660 VanDerWaalsContact NE-SD 3.41Å; I562-M660 HydrophobicContact CG1-CE 4.36Å; S656-M660 PolarHBondContact O-N 2.96Å; V657-M660 PolarHBondContact O-N 3.48Å; M660-T664 WeakPolarHBondContact O-CB 3.39Å; M660-T664 PolarHBondContact O-N 3.29Å; M660-T664 PolarHBondContact O-OG1 2.92Å
661	C	94.1	Very high	91.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.5	-51.5	173.9	-174	0	0	0	0	111.3	A348 V352 F470 V657 Y658 G659 D663 T664 L665	A348-C661 HydrophobicContact CB-CB 4.3Å; V352-C661 HydrophobicContact CG2-CB 4.19Å; F470-C661 HydrophobicContact CD1-CB 4.14Å; F470-C661 VanDerWaalsContact CD1-SG 3.55Å; F470-C661 VanDerWaalsContact CD2-CA 3.48Å; F470-C661 HydrophobicContact CD2-CB 3.65Å; F470-C661 HydrophobicContact CE1-CB 4.05Å; F470-C661 HydrophobicContact CE2-CB 3.54Å; F470-C661 HydrophobicContact CG-CB 3.96Å; F470-C661 HydrophobicContact CZ-CB 3.76Å; V657-C661 PolarHBondContact O-N 3.25Å; Y658-C661 WeakPolarHBondContact O-CB 3.34Å; Y658-C661 PolarHBondContact O-N 3.15Å; G659-C661 VanDerWaalsContact C-N 3.31Å; G659-C661 PolarHBondContact O-N 3.2Å; C661-D663 VanDerWaalsContact C-N 3.34Å; C661-D663 PolarHBondContact O-N 2.81Å; C661-T664 PolarHBondContact O-N 3.35Å; C661-L665 VanDerWaalsContact O-CG 3.29Å; C661-L665 WeakPolarHBondContact O-CG 3.32Å; C661-L665 PolarHBondContact O-N 3.3Å
662	V	92.3	Very high	91.3	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58.1	-46.1	-179.1	168.9	0	0	0	0	111.1	I345 A348 L592 T596 F600 Y658 G659 T664 L665 F666	I345-V662 HydrophobicContact CG1-CG2 4.34Å; A348-V662 HydrophobicContact CB-CG2 3.56Å; L592-V662 HydrophobicContact CD2-CG1 4.22Å; T596-V662 HydrophobicContact CG2-CG1 3.93Å; F600-V662 HydrophobicContact CZ-CG2 4.06Å; Y658-V662 HydrophobicContact CD1-CG2 3.92Å; Y658-V662 HydrophobicContact CE1-CG2 3.98Å; Y658-V662 WeakPolarHBondContact O-CG2 3.12Å; Y658-V662 PolarHBondContact O-N 2.92Å; G659-V662 PolarHBondContact O-N 2.97Å; V662-T664 PolarHBondContact O-N 3.35Å; V662-L665 PolarHBondContact O-N 3.18Å; V662-F666 WeakPolarHBondContact O-CB 3.18Å; V662-F666 PolarHBondContact O-N 3Å
663	D	92.6	Very high	91.1	Very high	15 Å²	15	8.7 Å²	8.7	8%	0.08	5%	0.052	C	C	.	.	H	α-helix	trans	-64	-41.8	178.6	-63.5	-16.7	0	0	0	112.3	R558 I562 G659 C661 F666 L667	R558-D663 IonicContact CZ-OD2 3.33Å; R558-D663 IonicContact NE-OD2 3.87Å; R558-D663 PolarHBondContact NE-OD2 3.36Å; R558-D663 IonicContact NH1-OD2 3.85Å; R558-D663 IonicContact NH2-OD2 2.83Å; R558-D663 PolarHBondContact NH2-OD2 3.5Å; I562-D663 HydrophobicContact CD1-CB 3.82Å; G659-D663 VanDerWaalsContact O-CG 3.26Å; G659-D663 PolarHBondContact O-N 3.1Å; C661-D663 VanDerWaalsContact C-N 3.34Å; C661-D663 PolarHBondContact O-N 2.81Å; D663-F666 PolarHBondContact O-N 2.81Å; D663-L667 WeakPolarHBondContact O-CB 3.45Å; D663-L667 PolarHBondContact O-N 3.1Å
664	T	94.9	Very high	90.9	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-63.4	-48.5	179.4	-58.6	0	0	0	0	110.6	A467 F470 A471 I562 M660 C661 V662 F666 L667 C668	A467-T664 WeakPolarHBondContact CA-OG1 3.33Å; A467-T664 HydrophobicContact CB-CG2 4.32Å; A467-T664 WeakPolarHBondContact O-CG2 3.45Å; F470-T664 HydrophobicContact CB-CG2 3.93Å; A471-T664 HydrophobicContact CB-CG2 4.02Å; I562-T664 HydrophobicContact CG2-CG2 4.17Å; M660-T664 WeakPolarHBondContact O-CB 3.39Å; M660-T664 PolarHBondContact O-N 3.29Å; M660-T664 PolarHBondContact O-OG1 2.92Å; C661-T664 PolarHBondContact O-N 3.35Å; V662-T664 PolarHBondContact O-N 3.35Å; T664-F666 VanDerWaalsContact C-N 3.3Å; T664-F666 PolarHBondContact O-N 3.22Å; T664-L667 PolarHBondContact O-N 3.45Å; T664-C668 WeakPolarHBondContact O-CB 3.44Å; T664-C668 PolarHBondContact O-N 3.41Å; T664-C668 PolarHBondContact O-SG 3.37Å
665	L	93.2	Very high	90.7	Very high	3 Å²	3	9.6 Å²	9.6	2%	0.016	5%	0.052	C	C	.	.	H	α-helix	trans	-64.6	-37.6	177.6	-61.6	-175.8	0	0	0	111.1	E347 A348 A351 Y473 Y474 C661 V662 F669	E347-L665 HydrophobicContact CB-CD1 4.4Å; A348-L665 HydrophobicContact CB-CD1 3.97Å; A351-L665 HydrophobicContact CB-CD1 4.16Å; Y473-L665 HydrophobicContact CD1-CD2 4.1Å; Y474-L665 HydrophobicContact CD2-CB 4.31Å; Y474-L665 HydrophobicContact CD2-CD2 3.8Å; Y474-L665 HydrophobicContact CG-CD2 4.29Å; C661-L665 VanDerWaalsContact O-CG 3.29Å; C661-L665 WeakPolarHBondContact O-CG 3.32Å; C661-L665 PolarHBondContact O-N 3.3Å; V662-L665 PolarHBondContact O-N 3.18Å; L665-F669 WeakPolarHBondContact O-CB 3.48Å; L665-F669 PolarHBondContact O-N 2.96Å
666	F	90.9	Very high	90.5	Very high	12 Å²	12	9.9 Å²	9.9	5%	0.053	5%	0.054	C	C	.	.	H	α-helix	trans	-66.3	-43.4	178	179.3	-118.7	0	0	0	111.9	L344 R588 V589 L592 V662 D663 T664 F669 L670	L344-F666 HydrophobicContact CD1-CB 4.02Å; L344-F666 HydrophobicContact CD1-CD2 3.58Å; L344-F666 HydrophobicContact CD1-CE2 4.49Å; L344-F666 HydrophobicContact CD1-CG 4.18Å; R588-F666 HydrophobicContact CB-CZ 4.39Å; V589-F666 HydrophobicContact CB-CE1 4.06Å; V589-F666 HydrophobicContact CB-CZ 4.37Å; V589-F666 HydrophobicContact CG1-CE1 4.27Å; V589-F666 HydrophobicContact CG2-CE1 3.7Å; V589-F666 HydrophobicContact CG2-CZ 3.95Å; L592-F666 HydrophobicContact CB-CZ 4.47Å; L592-F666 HydrophobicContact CD1-CD2 4Å; L592-F666 HydrophobicContact CD1-CE2 3.97Å; L592-F666 HydrophobicContact CD2-CB 4.38Å; L592-F666 HydrophobicContact CD2-CD1 4.2Å; L592-F666 HydrophobicContact CD2-CD2 4.09Å; L592-F666 HydrophobicContact CD2-CE2 4.43Å; L592-F666 HydrophobicContact CD2-CG 3.96Å; V662-F666 WeakPolarHBondContact O-CB 3.18Å; V662-F666 PolarHBondContact O-N 3Å; D663-F666 PolarHBondContact O-N 2.81Å; T664-F666 VanDerWaalsContact C-N 3.3Å; T664-F666 PolarHBondContact O-N 3.22Å; F666-F669 AromaticContact CD2-CD1 3.85Å; F666-F669 HydrophobicContact CD2-CD1 3.85Å; F666-F669 HydrophobicContact CD2-CE1 4.4Å; F666-F669 HydrophobicContact CE2-CD1 4.09Å; F666-F669 HydrophobicContact CE2-CE1 4.24Å; F666-F669 WeakPolarHBondContact O-CB 3.46Å; F666-F669 PolarHBondContact O-N 3.11Å; F666-L670 HydrophobicContact CD1-CD1 4.32Å; F666-L670 HydrophobicContact CE1-CD1 3.77Å; F666-L670 HydrophobicContact CE1-CG 4.34Å; F666-L670 HydrophobicContact CE2-CD1 4.4Å; F666-L670 HydrophobicContact CE2-CD2 4.05Å; F666-L670 HydrophobicContact CE2-CG 4.13Å; F666-L670 HydrophobicContact CZ-CD1 3.81Å; F666-L670 HydrophobicContact CZ-CD2 4.05Å; F666-L670 HydrophobicContact CZ-CG 4.04Å; F666-L670 WeakPolarHBondContact O-CG 3.49Å; F666-L670 PolarHBondContact O-N 3.38Å
667	L	91.8	Very high	90.3	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-64.3	-45.8	176	-156.3	84.8	0	0	0	111.1	I562 M563 L581 L582 D663 T664 F669 L670 E671	I562-L667 HydrophobicContact CB-CD2 3.9Å; I562-L667 HydrophobicContact CG2-CB 4.18Å; I562-L667 HydrophobicContact CG2-CD2 3.44Å; I562-L667 VanDerWaalsContact CG2-CD2 3.44Å; I562-L667 HydrophobicContact CG2-CG 4.44Å; M563-L667 HydrophobicContact CG-CD2 3.86Å; M563-L667 HydrophobicContact SD-CD2 3.49Å; M563-L667 WeakPolarHBondContact SD-CD2 3.5Å; M563-L667 HydrophobicContact SD-CG 4.49Å; L581-L667 HydrophobicContact CD2-CD1 4.03Å; L581-L667 HydrophobicContact CD2-CG 3.92Å; L582-L667 HydrophobicContact CD1-CD1 4.41Å; L582-L667 HydrophobicContact CD2-CD1 3.72Å; L582-L667 HydrophobicContact CG-CD1 4.07Å; D663-L667 WeakPolarHBondContact O-CB 3.45Å; D663-L667 PolarHBondContact O-N 3.1Å; T664-L667 PolarHBondContact O-N 3.45Å; L667-F669 PolarHBondContact O-N 3.18Å; L667-L670 PolarHBondContact O-N 2.77Å; L667-E671 PolarHBondContact O-N 2.86Å
668	C	92.3	Very high	89.8	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.4	-37.1	174.6	-63.9	0	0	0	0	111.4	Y474 W475 T664 E671 D672	Y474-C668 HydrophobicContact CD1-CB 3.39Å; Y474-C668 HydrophobicContact CD2-CB 3.88Å; Y474-C668 HydrophobicContact CE1-CB 3.7Å; Y474-C668 HydrophobicContact CE2-CB 4.15Å; Y474-C668 HydrophobicContact CG-CB 3.51Å; W475-C668 HydrophobicContact CZ2-CB 4.18Å; W475-C668 PolarHBondContact NE1-SG 3.14Å; T664-C668 WeakPolarHBondContact O-CB 3.44Å; T664-C668 PolarHBondContact O-N 3.41Å; T664-C668 PolarHBondContact O-SG 3.37Å; C668-E671 PolarHBondContact O-N 2.97Å; C668-D672 VanDerWaalsContact O-CB 3.28Å; C668-D672 WeakPolarHBondContact O-CB 3.42Å; C668-D672 PolarHBondContact O-N 3.1Å
669	F	89.8	Confident	89.4	Confident	2 Å²	2	13.2 Å²	13.2	1%	0.009	7%	0.071	C	C	.	.	H	α-helix	trans	-65.8	-44.3	175.6	158.3	-103.3	0	0	0	113.4	Y474 L665 F666 L667 E671 D672 L673 M686 L690 L694	Y474-F669 HydrophobicContact CE2-CB 4.19Å; Y474-F669 WeakPolarHBondContact OH-CA 3.43Å; L665-F669 WeakPolarHBondContact O-CB 3.48Å; L665-F669 PolarHBondContact O-N 2.96Å; F666-F669 AromaticContact CD2-CD1 3.85Å; F666-F669 HydrophobicContact CD2-CD1 3.85Å; F666-F669 HydrophobicContact CD2-CE1 4.4Å; F666-F669 HydrophobicContact CE2-CD1 4.09Å; F666-F669 HydrophobicContact CE2-CE1 4.24Å; F666-F669 WeakPolarHBondContact O-CB 3.46Å; F666-F669 PolarHBondContact O-N 3.11Å; L667-F669 PolarHBondContact O-N 3.18Å; F669-E671 PolarHBondContact O-N 3.05Å; F669-D672 PolarHBondContact O-N 3.39Å; F669-L673 HydrophobicContact CD2-CD1 4.43Å; F669-L673 HydrophobicContact CD2-CG 4.33Å; F669-L673 HydrophobicContact CE1-CD1 3.87Å; F669-L673 HydrophobicContact CE2-CD1 3.64Å; F669-L673 HydrophobicContact CE2-CD2 4.21Å; F669-L673 HydrophobicContact CE2-CG 3.78Å; F669-L673 HydrophobicContact CZ-CD1 3.32Å; F669-L673 HydrophobicContact CZ-CG 4.02Å; F669-L673 WeakPolarHBondContact O-CG 3.37Å; F669-L673 PolarHBondContact O-N 3.22Å; F669-M686 HydrophobicContact CD2-CB 4.45Å; F669-M686 HydrophobicContact CD2-CE 3.87Å; F669-M686 HydrophobicContact CD2-SD 4.07Å; F669-M686 HydrophobicContact CE2-CE 3.82Å; F669-M686 HydrophobicContact CE2-SD 3.81Å; F669-L690 HydrophobicContact CD2-CD2 3.37Å; F669-L690 HydrophobicContact CD2-CG 4.42Å; F669-L690 HydrophobicContact CE2-CD2 3.56Å; F669-L690 HydrophobicContact CE2-CG 4.15Å; F669-L690 HydrophobicContact CG-CD2 3.99Å; F669-L690 HydrophobicContact CZ-CD2 4.31Å; F669-L694 HydrophobicContact CE2-CD1 3.28Å; F669-L694 HydrophobicContact CZ-CD1 3.29Å
670	L	88.6	Confident	88.9	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.6	-38.4	174.9	-70	-179.3	0	0	0	110.9	L581 L582 N585 V589 F666 L667 L673 E674	L581-L670 HydrophobicContact CD1-CB 4.09Å; L581-L670 HydrophobicContact CD2-CB 4.31Å; L581-L670 HydrophobicContact CG-CB 4.16Å; L582-L670 HydrophobicContact CD2-CD1 4.06Å; N585-L670 HydrophobicContact CB-CD1 4.07Å; N585-L670 HydrophobicContact CB-CD2 3.82Å; V589-L670 HydrophobicContact CG2-CD1 3.97Å; F666-L670 HydrophobicContact CD1-CD1 4.32Å; F666-L670 HydrophobicContact CE1-CD1 3.77Å; F666-L670 HydrophobicContact CE1-CG 4.34Å; F666-L670 HydrophobicContact CE2-CD1 4.4Å; F666-L670 HydrophobicContact CE2-CD2 4.05Å; F666-L670 HydrophobicContact CE2-CG 4.13Å; F666-L670 HydrophobicContact CZ-CD1 3.81Å; F666-L670 HydrophobicContact CZ-CD2 4.05Å; F666-L670 HydrophobicContact CZ-CG 4.04Å; F666-L670 WeakPolarHBondContact O-CG 3.49Å; F666-L670 PolarHBondContact O-N 3.38Å; L667-L670 PolarHBondContact O-N 2.77Å; L670-L673 PolarHBondContact O-N 3.45Å; L670-E674 PolarHBondContact O-N 3.44Å
671	E	89.1	Confident	88.2	Confident	3 Å²	3	22.7 Å²	22.7	1%	0.014	13%	0.125	C	C	.	.	H	α-helix	trans	-71.9	-40.3	178	-160.6	-176	123.2	0	0	113	W475 Y567 L581 L667 C668 F669 L673 E674 R675	W475-E671 HydrophobicContact CZ2-CB 4.49Å; Y567-E671 WeakPolarHBondContact CE2-OE2 3.42Å; Y567-E671 PolarHBondContact OH-OE1 2.68Å; Y567-E671 PolarHBondContact OH-OE2 3.06Å; L581-E671 HydrophobicContact CD2-CB 4.31Å; L667-E671 PolarHBondContact O-N 2.86Å; C668-E671 PolarHBondContact O-N 2.97Å; F669-E671 PolarHBondContact O-N 3.05Å; E671-L673 PolarHBondContact O-N 2.93Å; E671-E674 PolarHBondContact O-N 3.2Å; E671-R675 HydrophobicContact CG-CG 4.41Å; E671-R675 WeakPolarHBondContact O-CG 3.14Å; E671-R675 PolarHBondContact O-N 3.26Å; E671-R675 IonicContact OE1-CZ 2.92Å; E671-R675 IonicContact OE1-NE 3.04Å; E671-R675 PolarHBondContact OE1-NE 3.3Å; E671-R675 IonicContact OE1-NH1 3.87Å; E671-R675 IonicContact OE1-NH2 2.85Å; E671-R675 PolarHBondContact OE1-NH2 2.84Å
672	D	89.3	Confident	87.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.1	-37.6	173.6	-171.4	23.6	0	0	0	111	Y474 W475 C668 F669 E674 N676 F685 M686	Y474-D672 HydrophobicContact CE1-CB 4.1Å; Y474-D672 WeakPolarHBondContact OH-CB 3.33Å; Y474-D672 PolarHBondContact OH-OD2 3.28Å; W475-D672 HydrophobicContact CH2-CB 4.01Å; W475-D672 HydrophobicContact CZ3-CB 4.43Å; C668-D672 VanDerWaalsContact O-CB 3.28Å; C668-D672 WeakPolarHBondContact O-CB 3.42Å; C668-D672 PolarHBondContact O-N 3.1Å; F669-D672 PolarHBondContact O-N 3.39Å; D672-E674 VanDerWaalsContact C-N 3.32Å; D672-E674 PolarHBondContact O-N 3.31Å; D672-N676 WeakPolarHBondContact O-CB 3.46Å; D672-N676 PolarHBondContact O-N 2.8Å; D672-N676 PolarHBondContact OD1-ND2 2.59Å; D672-F685 PolarHBondContact OD1-N 3.34Å; D672-F685 PolarHBondContact OD2-N 3.47Å; D672-M686 PolarHBondContact OD2-N 3.39Å
673	L	86	Confident	87.4	Confident	40 Å²	40	28.9 Å²	28.9	21%	0.209	15%	0.152	C	C	.	.	H	α-helix	trans	-66.9	-27.2	173.9	-76.3	178.4	0	0	0	114.4	F669 L670 E671 Y684 M686	F669-L673 HydrophobicContact CD2-CD1 4.43Å; F669-L673 HydrophobicContact CD2-CG 4.33Å; F669-L673 HydrophobicContact CE1-CD1 3.87Å; F669-L673 HydrophobicContact CE2-CD1 3.64Å; F669-L673 HydrophobicContact CE2-CD2 4.21Å; F669-L673 HydrophobicContact CE2-CG 3.78Å; F669-L673 HydrophobicContact CZ-CD1 3.32Å; F669-L673 HydrophobicContact CZ-CG 4.02Å; F669-L673 WeakPolarHBondContact O-CG 3.37Å; F669-L673 PolarHBondContact O-N 3.22Å; L670-L673 PolarHBondContact O-N 3.45Å; E671-L673 PolarHBondContact O-N 2.93Å; L673-Y684 HydrophobicContact CD2-CE1 4.29Å; L673-M686 HydrophobicContact CD2-CE 3.78Å; L673-M686 HydrophobicContact CG-CE 4.16Å
674	E	86.6	Confident	87.1	Confident	43 Å²	43	28.7 Å²	28.7	20%	0.201	15%	0.151	C	C	.	.	H	α-helix	trans	-86.2	-35.3	178.9	-71.6	-173.6	-177.5	0	0	112.3	P13 Q14 L581 R584 L670 E671 D672	P13-E674 WeakPolarHBondContact CA-OE2 3.45Å; P13-E674 HydrophobicContact CB-CB 4.26Å; P13-E674 HydrophobicContact CB-CG 4.35Å; Q14-E674 PolarHBondContact N-OE2 2.76Å; L581-E674 VanDerWaalsContact CD1-OE1 3.32Å; L581-E674 WeakPolarHBondContact CD1-OE1 3.31Å; R584-E674 VanDerWaalsContact CZ-CD 3.5Å; R584-E674 IonicContact CZ-OE1 3.66Å; R584-E674 IonicContact CZ-OE2 2.74Å; R584-E674 IonicContact NE-OE1 3.36Å; R584-E674 IonicContact NH1-OE1 3.95Å; R584-E674 PolarHBondContact NH1-OE1 3.15Å; R584-E674 IonicContact NH1-OE2 2.79Å; R584-E674 PolarHBondContact NH1-OE2 3.15Å; R584-E674 VanDerWaalsContact NH2-CD 3.31Å; R584-E674 IonicContact NH2-OE1 3Å; R584-E674 PolarHBondContact NH2-OE1 2.82Å; R584-E674 IonicContact NH2-OE2 3.25Å; R584-E674 PolarHBondContact NH2-OE2 3.25Å; L670-E674 PolarHBondContact O-N 3.44Å; E671-E674 PolarHBondContact O-N 3.2Å; D672-E674 VanDerWaalsContact C-N 3.32Å; D672-E674 PolarHBondContact O-N 3.31Å
675	R	85.6	Confident	86.7	Confident	15 Å²	15	30.6 Å²	30.6	6%	0.057	16%	0.159	C	C	.	.	H	α-helix	trans	-86.6	-40.2	-174.6	-69.6	175.7	172.1	-137.3	8.2	113.7	Q14 Y567 E671	Q14-R675 HydrophobicContact CB-CG 4.11Å; Q14-R675 HydrophobicContact CG-CG 4.21Å; Y567-R675 VanDerWaalsContact CZ-NH2 3.27Å; Y567-R675 PolarHBondContact OH-NH2 3Å; E671-R675 HydrophobicContact CG-CG 4.41Å; E671-R675 WeakPolarHBondContact O-CG 3.14Å; E671-R675 PolarHBondContact O-N 3.26Å; E671-R675 IonicContact OE1-CZ 2.92Å; E671-R675 IonicContact OE1-NE 3.04Å; E671-R675 PolarHBondContact OE1-NE 3.3Å; E671-R675 IonicContact OE1-NH1 3.87Å; E671-R675 IonicContact OE1-NH2 2.85Å; E671-R675 PolarHBondContact OE1-NH2 2.84Å
676	N	86.9	Confident	86.3	Confident	10 Å²	10	30.7 Å²	30.7	5%	0.053	16%	0.159	C	C	.	.			trans	-106.9	143.3	-169.4	-64.7	-47.6	0	0	0	110.6	Y16 D672 R682 Y684	Y16-N676 WeakPolarHBondContact CD2-OD1 3.47Å; D672-N676 WeakPolarHBondContact O-CB 3.46Å; D672-N676 PolarHBondContact O-N 2.8Å; D672-N676 PolarHBondContact OD1-ND2 2.59Å; N676-R682 HydrophobicContact CB-CB 4.49Å; N676-Y684 HydrophobicContact CB-CD1 3.86Å; N676-Y684 HydrophobicContact CB-CE1 4.16Å; N676-Y684 WeakPolarHBondContact O-CE1 3.27Å; N676-Y684 PolarHBondContact O-OH 3.06Å
677	D	84.8	Confident	85.9	Confident	88 Å²	88	31.2 Å²	31.2	47%	0.471	17%	0.165	S	C	.	.			trans	-111.1	-9.6	179.3	63.1	6.3	0	0	0	112.7	S679 R682 Y684	D677-S679 WeakPolarHBondContact OD1-CB 3.46Å; D677-S679 PolarHBondContact OD1-N 3.36Å; D677-S679 PolarHBondContact OD1-OG 3.23Å; D677-R682 PolarHBondContact N-O 3.47Å; D677-R682 WeakPolarHBondContact OD1-CB 3.22Å; D677-Y684 VanDerWaalsContact C-CE2 3.47Å; D677-Y684 WeakPolarHBondContact O-CE2 3.24Å; D677-Y684 PolarHBondContact O-OH 3.3Å
678	G	81.7	Confident	85.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	91.1	8.5	-177	0	0	0	0	0	113.6	R682 N698 K699	G678-R682 WeakPolarHBondContact CA-O 3.24Å; G678-R682 PolarHBondContact N-O 2.71Å; G678-N698 CarbonylContact O-C 3.34Å; G678-N698 VanDerWaalsContact O-CA 3.3Å; G678-N698 WeakPolarHBondContact O-CA 3.38Å; G678-K699 PolarHBondContact O-N 3.26Å
679	S	83.3	Confident	84.5	Confident	29 Å²	29	37.5 Å²	37.5	20%	0.203	21%	0.207	C	C	.	.	S	Bend	trans	-66.4	167.6	169.3	60.6	0	0	0	0	112	D677 E681 R682 P683	D677-S679 WeakPolarHBondContact OD1-CB 3.46Å; D677-S679 PolarHBondContact OD1-N 3.36Å; D677-S679 PolarHBondContact OD1-OG 3.23Å; S679-E681 PolarHBondContact O-N 3.4Å; S679-R682 PolarHBondContact N-O 3.27Å; S679-R682 CarbonylContact O-C 3.54Å; S679-R682 PolarHBondContact O-N 3.28Å; S679-R682 WeakPolarHBondContact OG-CB 3.41Å; S679-R682 PolarHBondContact OG-N 3.25Å; S679-P683 VanDerWaalsContact O-N 3.15Å
680	A	79.4	Confident	84	Confident	67 Å²	67	37.7 Å²	37.7	55%	0.554	21%	0.207	S	C	*	.	S	Bend	trans	-61.8	-32.3	175.5	0	0	0	0	0	112.1	A701	A680-A701 HydrophobicContact CB-CB 4.19Å
681	E	79.8	Confident	83.8	Confident	148 Å²	148	39.4 Å²	39.4	69%	0.692	22%	0.215	S	C	*	.	S	Bend	trans	-77.4	-33.2	175.4	-63	177.9	-174.8	0	0	112.2	Y16 S679 P683	Y16-E681 PolarHBondContact OH-O 3.31Å; S679-E681 PolarHBondContact O-N 3.4Å; E681-P683 VanDerWaalsContact C-CD 3.46Å; E681-P683 WeakPolarHBondContact O-CD 3.45Å
682	R	83.6	Confident	83.4	Confident	96 Å²	96	47.7 Å²	47.7	36%	0.362	25%	0.251	S	S	.	.	S	Bend	trans	-126.7	65.1	-175.8	-42.1	-174.8	176.3	173.6	0.9	112.2	Y16 N676 D677 G678 S679	Y16-R682 HydrophobicContact CD1-CG 4.09Å; Y16-R682 VanDerWaalsContact CD1-NE 3.35Å; Y16-R682 HydrophobicContact CD2-CB 3.9Å; Y16-R682 HydrophobicContact CD2-CG 3.6Å; Y16-R682 HydrophobicContact CE1-CG 4.02Å; Y16-R682 HydrophobicContact CE2-CB 3.76Å; Y16-R682 HydrophobicContact CE2-CG 3.51Å; Y16-R682 HydrophobicContact CG-CG 3.89Å; N676-R682 HydrophobicContact CB-CB 4.49Å; D677-R682 PolarHBondContact N-O 3.47Å; D677-R682 WeakPolarHBondContact OD1-CB 3.22Å; G678-R682 WeakPolarHBondContact CA-O 3.24Å; G678-R682 PolarHBondContact N-O 2.71Å; S679-R682 PolarHBondContact N-O 3.27Å; S679-R682 CarbonylContact O-C 3.54Å; S679-R682 PolarHBondContact O-N 3.28Å; S679-R682 WeakPolarHBondContact OG-CB 3.41Å; S679-R682 PolarHBondContact OG-N 3.25Å
683	P	85.4	Confident	82.8	Confident	34 Å²	34	51.2 Å²	51.2	22%	0.221	27%	0.269	C	S	.	.			trans	-71.9	145.1	-178.2	30	-35.1	0	0	0	111.2	S679 E681 F685	S679-P683 VanDerWaalsContact O-N 3.15Å; E681-P683 VanDerWaalsContact C-CD 3.46Å; E681-P683 WeakPolarHBondContact O-CD 3.45Å; P683-F685 WeakPolarHBondContact O-CD2 3.4Å
684	Y	86.6	Confident	82.5	Confident	11 Å²	11	51 Å²	51	4%	0.043	27%	0.268	C	S	.	.			trans	-69.9	134	168.9	-64.2	-71.1	0	0	0	110.9	L673 N676 D677 M686 K696 N698	L673-Y684 HydrophobicContact CD2-CE1 4.29Å; N676-Y684 HydrophobicContact CB-CD1 3.86Å; N676-Y684 HydrophobicContact CB-CE1 4.16Å; N676-Y684 WeakPolarHBondContact O-CE1 3.27Å; N676-Y684 PolarHBondContact O-OH 3.06Å; D677-Y684 VanDerWaalsContact C-CE2 3.47Å; D677-Y684 WeakPolarHBondContact O-CE2 3.24Å; D677-Y684 PolarHBondContact O-OH 3.3Å; Y684-M686 HydrophobicContact CD1-CE 3.55Å; Y684-M686 HydrophobicContact CE1-CE 4.19Å; Y684-M686 HydrophobicContact CG-CE 3.96Å; Y684-K696 HydrophobicContact CD2-CB 4.48Å; Y684-K696 HydrophobicContact CE2-CB 4.12Å; Y684-K696 HydrophobicContact CE2-CD 4.37Å; Y684-N698 WeakPolarHBondContact CB-OD1 3.22Å; Y684-N698 VanDerWaalsContact CD2-OD1 3.28Å; Y684-N698 WeakPolarHBondContact CD2-OD1 3.16Å; Y684-N698 PolarHBondContact N-OD1 2.86Å; Y684-N698 PolarHBondContact O-ND2 2.92Å; Y684-N698 VanDerWaalsContact O-ND2 3.1Å
685	F	85.8	Confident	82.1	Confident	40 Å²	40	56.1 Å²	56.1	18%	0.175	30%	0.297	C	S	.	.			trans	-84	-20.7	177.8	-72.7	-106.4	0	0	0	112.6	Y474 W475 L477 D672 P683	Y474-F685 HydrophobicContact CE1-CB 3.99Å; W475-F685 HydrophobicContact CE3-CB 4.29Å; W475-F685 HydrophobicContact CE3-CD1 4.01Å; W475-F685 AromaticContact CE3-CD2 3.89Å; W475-F685 HydrophobicContact CE3-CD2 3.89Å; W475-F685 HydrophobicContact CE3-CE1 4.28Å; W475-F685 HydrophobicContact CE3-CE2 4.21Å; W475-F685 AromaticContact CE3-CG 3.8Å; W475-F685 HydrophobicContact CE3-CG 3.8Å; W475-F685 HydrophobicContact CE3-CZ 4.39Å; W475-F685 HydrophobicContact CZ3-CB 4.44Å; W475-F685 AromaticContact CZ3-CD2 3.77Å; W475-F685 HydrophobicContact CZ3-CD2 3.77Å; W475-F685 HydrophobicContact CZ3-CE2 4.18Å; W475-F685 HydrophobicContact CZ3-CG 4.07Å; W475-F685 WeakPolarHBondContact O-CD1 3.39Å; W475-F685 WeakPolarHBondContact O-CE1 3.29Å; L477-F685 HydrophobicContact CD1-CE1 4.06Å; L477-F685 HydrophobicContact CD1-CZ 4.31Å; L477-F685 HydrophobicContact CD2-CD1 3.58Å; L477-F685 HydrophobicContact CD2-CE1 3.55Å; L477-F685 HydrophobicContact CD2-CG 4.23Å; L477-F685 HydrophobicContact CD2-CZ 4.13Å; L477-F685 HydrophobicContact CG-CD1 3.93Å; L477-F685 HydrophobicContact CG-CE1 3.49Å; L477-F685 VanDerWaalsContact CG-CE1 3.49Å; L477-F685 HydrophobicContact CG-CZ 4.19Å; D672-F685 PolarHBondContact OD1-N 3.34Å; D672-F685 PolarHBondContact OD2-N 3.47Å; P683-F685 WeakPolarHBondContact O-CD2 3.4Å
686	M	84.8	Confident	81.8	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.025	31%	0.312	C	S	.	.	S	Bend	trans	-59.6	155.7	177.6	78.7	-173	72.4	0	0	113.7	Y474 F669 D672 L673 Y684 L690 K691 L694	Y474-M686 WeakPolarHBondContact OH-CB 3.39Å; F669-M686 HydrophobicContact CD2-CB 4.45Å; F669-M686 HydrophobicContact CD2-CE 3.87Å; F669-M686 HydrophobicContact CD2-SD 4.07Å; F669-M686 HydrophobicContact CE2-CE 3.82Å; F669-M686 HydrophobicContact CE2-SD 3.81Å; D672-M686 PolarHBondContact OD2-N 3.39Å; L673-M686 HydrophobicContact CD2-CE 3.78Å; L673-M686 HydrophobicContact CG-CE 4.16Å; Y684-M686 HydrophobicContact CD1-CE 3.55Å; Y684-M686 HydrophobicContact CE1-CE 4.19Å; Y684-M686 HydrophobicContact CG-CE 3.96Å; M686-L690 HydrophobicContact CB-CB 4.49Å; M686-L690 HydrophobicContact CB-CD2 3.96Å; M686-L690 HydrophobicContact CG-CB 4.39Å; M686-L690 HydrophobicContact CG-CD2 4.41Å; M686-L690 HydrophobicContact SD-CB 4.41Å; M686-L690 HydrophobicContact SD-CD2 4.16Å; M686-L690 HydrophobicContact SD-CG 4.24Å; M686-K691 HydrophobicContact CG-CD 4.49Å; M686-K691 HydrophobicContact CG-CG 3.71Å; M686-K691 VanDerWaalsContact O-CE 3.28Å; M686-K691 WeakPolarHBondContact O-CE 3.41Å; M686-K691 PolarHBondContact O-NZ 3.14Å; M686-K691 HydrophobicContact SD-CG 4.04Å; M686-L694 HydrophobicContact SD-CD1 4.16Å
687	S	81.9	Confident	81.4	Confident	24 Å²	24	64.1 Å²	64.1	17%	0.168	34%	0.341	C	S	.	.			trans	-64.3	157.4	-176.2	83.5	0	0	0	0	113.5	E347 T689 L690 K691	E347-S687 VanDerWaalsContact CD-OG 3.26Å; E347-S687 WeakPolarHBondContact OE1-CB 3.2Å; E347-S687 PolarHBondContact OE1-OG 3.32Å; S687-T689 PolarHBondContact O-N 2.93Å; S687-L690 PolarHBondContact O-N 3.3Å; S687-L690 VanDerWaalsContact O-N 3.15Å; S687-L690 PolarHBondContact OG-N 3.46Å; S687-K691 PolarHBondContact O-N 3.26Å
688	S	79.4	Confident	81.2	Confident	76 Å²	76	62.5 Å²	62.5	53%	0.531	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-33.4	178.1	57.6	0	0	0	0	112.7	K692	S688-K692 WeakPolarHBondContact O-CG 3.44Å; S688-K692 PolarHBondContact O-N 3.1Å
689	T	77.1	Confident	80.9	Confident	57 Å²	57	69.8 Å²	69.8	35%	0.35	36%	0.364	S	S	.	.	H	α-helix	trans	-64.9	-45.6	174.9	-54.9	0	0	0	0	111.3	S687 K692 L693	S687-T689 PolarHBondContact O-N 2.93Å; T689-K692 PolarHBondContact O-N 2.92Å; T689-L693 WeakPolarHBondContact O-CB 2.96Å; T689-L693 PolarHBondContact O-N 3.02Å; T689-L693 VanDerWaalsContact O-N 3.07Å
690	L	79	Confident	79.8	Confident	5 Å²	5	78 Å²	78	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-68	-40	179.8	-162.2	66.4	0	0	0	111.6	I340 A343 L344 F669 M686 S687 L693 L694	I340-L690 HydrophobicContact CG2-CD1 4.46Å; A343-L690 HydrophobicContact CB-CD1 4.16Å; L344-L690 HydrophobicContact CD2-CD1 4.12Å; L344-L690 HydrophobicContact CD2-CD2 3.81Å; F669-L690 HydrophobicContact CD2-CD2 3.37Å; F669-L690 HydrophobicContact CD2-CG 4.42Å; F669-L690 HydrophobicContact CE2-CD2 3.56Å; F669-L690 HydrophobicContact CE2-CG 4.15Å; F669-L690 HydrophobicContact CG-CD2 3.99Å; F669-L690 HydrophobicContact CZ-CD2 4.31Å; M686-L690 HydrophobicContact CB-CB 4.49Å; M686-L690 HydrophobicContact CB-CD2 3.96Å; M686-L690 HydrophobicContact CG-CB 4.39Å; M686-L690 HydrophobicContact CG-CD2 4.41Å; M686-L690 HydrophobicContact SD-CB 4.41Å; M686-L690 HydrophobicContact SD-CD2 4.16Å; M686-L690 HydrophobicContact SD-CG 4.24Å; S687-L690 PolarHBondContact O-N 3.3Å; S687-L690 VanDerWaalsContact O-N 3.15Å; S687-L690 PolarHBondContact OG-N 3.46Å; L690-L693 PolarHBondContact O-N 2.99Å; L690-L694 HydrophobicContact CD1-CD1 4.45Å; L690-L694 HydrophobicContact CG-CD1 4Å; L690-L694 WeakPolarHBondContact O-CG 3.45Å; L690-L694 PolarHBondContact O-N 3Å
691	K	83.1	Confident	78.3	Confident	37 Å²	37	78.1 Å²	78.1	16%	0.161	40%	0.397	C	S	.	.	H	α-helix	trans	-53.3	-53.2	171.4	-92.1	-175.7	-72	-149.4	0	112.3	M686 S687 L693 L694 N695 K696 N698	M686-K691 HydrophobicContact CG-CD 4.49Å; M686-K691 HydrophobicContact CG-CG 3.71Å; M686-K691 VanDerWaalsContact O-CE 3.28Å; M686-K691 WeakPolarHBondContact O-CE 3.41Å; M686-K691 PolarHBondContact O-NZ 3.14Å; M686-K691 HydrophobicContact SD-CG 4.04Å; S687-K691 PolarHBondContact O-N 3.26Å; K691-L693 VanDerWaalsContact C-N 3.31Å; K691-L693 PolarHBondContact O-N 3.19Å; K691-L694 PolarHBondContact O-N 3Å; K691-N695 PolarHBondContact O-N 3.03Å; K691-N695 VanDerWaalsContact O-N 3.09Å; K691-K696 CarbonylContact C-O 3.47Å; K691-K696 VanDerWaalsContact C-O 3.3Å; K691-K696 WeakPolarHBondContact CB-O 3.26Å; K691-K696 PolarHBondContact O-N 3.42Å; K691-K696 VanDerWaalsContact O-O 3.11Å; K691-N698 PolarHBondContact NZ-ND2 2.82Å; K691-N698 VanDerWaalsContact NZ-ND2 3.19Å
692	K	80.8	Confident	76.5	Confident	177 Å²	177	75.6 Å²	75.6	77%	0.77	40%	0.401	S	S	*	.	H	α-helix	trans	-58.4	-42.8	177.2	-74.9	178.7	-179.7	-173.5	0	112.1	S688 T689 L694 N695	S688-K692 WeakPolarHBondContact O-CG 3.44Å; S688-K692 PolarHBondContact O-N 3.1Å; T689-K692 PolarHBondContact O-N 2.92Å; K692-L694 VanDerWaalsContact C-N 3.28Å; K692-L694 PolarHBondContact O-N 3.41Å; K692-N695 PolarHBondContact O-N 3.46Å
693	L	78.4	Confident	74.5	Confident	73 Å²	73	80.4 Å²	80.4	38%	0.382	43%	0.428	S	S	.	.	H	α-helix	trans	-70.3	-25	-175.9	-162.2	131.2	0	0	0	113.5	L339 I340 T689 L690 K691	L339-L693 HydrophobicContact CB-CD1 4.1Å; I340-L693 HydrophobicContact CB-CD2 4.16Å; I340-L693 HydrophobicContact CD1-CD2 4.27Å; I340-L693 HydrophobicContact CG1-CD2 3.21Å; T689-L693 WeakPolarHBondContact O-CB 2.96Å; T689-L693 PolarHBondContact O-N 3.02Å; T689-L693 VanDerWaalsContact O-N 3.07Å; L690-L693 PolarHBondContact O-N 2.99Å; K691-L693 VanDerWaalsContact C-N 3.31Å; K691-L693 PolarHBondContact O-N 3.19Å
694	L	77.8	Confident	72.2	Confident	37 Å²	37	87.7 Å²	87.7	19%	0.194	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	3.3	176.1	-64.4	167.6	0	0	0	113.4	F669 M686 L690 K691 K692 K696	F669-L694 HydrophobicContact CE2-CD1 3.28Å; F669-L694 HydrophobicContact CZ-CD1 3.29Å; M686-L694 HydrophobicContact SD-CD1 4.16Å; L690-L694 HydrophobicContact CD1-CD1 4.45Å; L690-L694 HydrophobicContact CG-CD1 4Å; L690-L694 WeakPolarHBondContact O-CG 3.45Å; L690-L694 PolarHBondContact O-N 3Å; K691-L694 PolarHBondContact O-N 3Å; K692-L694 VanDerWaalsContact C-N 3.28Å; K692-L694 PolarHBondContact O-N 3.41Å; L694-K696 VanDerWaalsContact C-N 3.29Å; L694-K696 HydrophobicContact CB-CG 4.17Å; L694-K696 PolarHBondContact O-N 3.34Å
695	N	78.6	Confident	71.5	Confident	150 Å²	150	91.5 Å²	91.5	80%	0.802	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	44.5	-173.7	-157	22.1	0	0	0	112.9	K691 K692	K691-N695 PolarHBondContact O-N 3.03Å; K691-N695 VanDerWaalsContact O-N 3.09Å; K692-N695 PolarHBondContact O-N 3.46Å
696	K	81	Confident	70.7	Confident	87 Å²	87	94.2 Å²	94.2	38%	0.378	52%	0.518	S	S	.	.			trans	-116.4	142.7	176.2	-65.6	-66.4	-173.6	168.7	0	109.8	Y684 K691 L694	Y684-K696 HydrophobicContact CD2-CB 4.48Å; Y684-K696 HydrophobicContact CE2-CB 4.12Å; Y684-K696 HydrophobicContact CE2-CD 4.37Å; K691-K696 CarbonylContact C-O 3.47Å; K691-K696 VanDerWaalsContact C-O 3.3Å; K691-K696 WeakPolarHBondContact CB-O 3.26Å; K691-K696 PolarHBondContact O-N 3.42Å; K691-K696 VanDerWaalsContact O-O 3.11Å; L694-K696 VanDerWaalsContact C-N 3.29Å; L694-K696 HydrophobicContact CB-CG 4.17Å; L694-K696 PolarHBondContact O-N 3.34Å
697	T	77.8	Confident	70	Confident	105 Å²	105	99.2 Å²	99.2	64%	0.644	55%	0.546	S	S	*	.			trans	-137.7	148	178.7	47.3	0	0	0	0	110.6
698	N	80.2	Confident	69.3	Low	54 Å²	54	103.6 Å²	103.6	29%	0.289	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-82.9	124.2	165.1	-68.4	-6.7	0	0	0	106.9	G678 Y684 K691	G678-N698 CarbonylContact O-C 3.34Å; G678-N698 VanDerWaalsContact O-CA 3.3Å; G678-N698 WeakPolarHBondContact O-CA 3.38Å; Y684-N698 WeakPolarHBondContact CB-OD1 3.22Å; Y684-N698 VanDerWaalsContact CD2-OD1 3.28Å; Y684-N698 WeakPolarHBondContact CD2-OD1 3.16Å; Y684-N698 PolarHBondContact N-OD1 2.86Å; Y684-N698 PolarHBondContact O-ND2 2.92Å; Y684-N698 VanDerWaalsContact O-ND2 3.1Å; K691-N698 PolarHBondContact NZ-ND2 2.82Å; K691-N698 VanDerWaalsContact NZ-ND2 3.19Å
699	K	76.4	Confident	68.6	Low	154 Å²	154	105.3 Å²	105.3	67%	0.67	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.9	172.8	-62.9	179.4	-179.2	177.7	0	107.6	G678	G678-K699 PolarHBondContact O-N 3.26Å
700	K	58.3	Low	68.1	Low	201 Å²	201	108.5 Å²	108.5	87%	0.874	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-63.1	140.7	169.6	-73.6	-174.5	174.3	-173.1	0	107.9	A702	K700-A702 PolarHBondContact O-N 3.31Å
701	A	48.9	Very low	67.3	Low	70 Å²	70	115.9 Å²	115.9	58%	0.579	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-56	133.3	167.2	0	0	0	0	0	107.7	A680 E703	A680-A701 HydrophobicContact CB-CB 4.19Å; A701-E703 PolarHBondContact O-N 3.37Å; A701-E703 VanDerWaalsContact O-N 3.1Å
702	A	42.1	Very low	66.1	Low	95 Å²	95	122 Å²	122	79%	0.785	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-59.7	117.2	168.6	0	0	0	0	0	106.4	K700 S704	K700-A702 PolarHBondContact O-N 3.31Å; A702-S704 PolarHBondContact O-N 3.18Å
703	E	42.3	Very low	64.8	Low	197 Å²	197	117.4 Å²	117.4	92%	0.921	65%	0.651	S	S	*	*			trans	-62.1	107.1	168.6	-71.9	169.2	179.3	0	0	106	A701	A701-E703 PolarHBondContact O-N 3.37Å; A701-E703 VanDerWaalsContact O-N 3.1Å
704	S	36.6	Very low	63.6	Low	186 Å²	186	121.5 Å²	121.5	100%	1.301	68%	0.676	S	S	*	*			trans	-90.2	0	172	61.4	0	0	0	0	110.1	A702	A702-S704 PolarHBondContact O-N 3.18Å

Retrieved 704 of 704 residues in 1348.1 ms (Link to these results)

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