A0A5K4FB20_SCHMA Loading...

Fucosyltransferase

AlphaFold DB , UniProt , Accession A0A5K4FB20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 434 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	30.2	Very low	32.1	Very low	241 Å²	241	149.4 Å²	149.4	100%	1.187	80%	0.804	S	S	*	*				0	107.5	0	-87.7	179.6	-77.7	0	0	108.4
2	C	32.2	Very low	33.5	Very low	135 Å²	135	147.8 Å²	147.8	91%	0.912	80%	0.795	S	S	*	*			trans	-165.3	108.9	133.3	-100	0	0	0	0	105.7
3	E	25.7	Very low	34.9	Very low	174 Å²	174	148.8 Å²	148.8	81%	0.813	79%	0.788	S	S	*	*			trans	-55.6	154.7	162.7	-61.1	168.4	141.4	0	0	109.6
4	V	32.7	Very low	36.2	Very low	139 Å²	139	150 Å²	150	84%	0.842	78%	0.778	S	S	*	*				-171.6	124.1	108.4	168.2	0	0	0	0	107.7
5	F	27.2	Very low	37.7	Very low	177 Å²	177	143.4 Å²	143.4	78%	0.776	75%	0.75	S	S	*	*			trans	-61.8	127	171.4	-80.9	-103.4	0	0	0	111.5	I7	F5-I7 HydrophobicContact CD1-CD1 4.45Å; F5-I7 HydrophobicContact CD1-CG1 4.32Å
6	G	32	Very low	39.4	Very low	71 Å²	71	142.7 Å²	142.7	73%	0.732	75%	0.746	S	S	*	*			trans	-118.8	82	161.8	0	0	0	0	0	109.4	V8	G6-V8 PolarHBondContact O-N 3.33Å; G6-V8 VanDerWaalsContact O-N 3.1Å
7	I	29.2	Very low	41.4	Very low	132 Å²	132	142.4 Å²	142.4	68%	0.677	74%	0.737	S	S	*	*			trans	-68.2	103.5	173	-64.5	169.4	0	0	0	107.8	F5 V9	F5-I7 HydrophobicContact CD1-CD1 4.45Å; F5-I7 HydrophobicContact CD1-CG1 4.32Å; I7-V9 HydrophobicContact CG2-CG2 3.55Å; I7-V9 PolarHBondContact O-N 2.96Å
8	V	33.1	Very low	43.4	Very low	120 Å²	120	139.2 Å²	139.2	73%	0.727	73%	0.725	S	S	*	*			trans	-87.9	93	163.6	-179.1	0	0	0	0	107.2	G6 R10	G6-V8 PolarHBondContact O-N 3.33Å; G6-V8 VanDerWaalsContact O-N 3.1Å; V8-R10 VanDerWaalsContact C-N 3.26Å; V8-R10 HydrophobicContact CG1-CB 4.27Å; V8-R10 PolarHBondContact O-N 3.39Å
9	V	31.4	Very low	45.2	Very low	129 Å²	129	139 Å²	139	78%	0.782	72%	0.718	S	S	*	*			trans	-67.3	87.6	166.3	-177.1	0	0	0	0	107.8	I7 N11	I7-V9 HydrophobicContact CG2-CG2 3.55Å; I7-V9 PolarHBondContact O-N 2.96Å; V9-N11 VanDerWaalsContact C-N 3.34Å; V9-N11 PolarHBondContact O-N 3.03Å; V9-N11 VanDerWaalsContact O-N 3.17Å
10	R	36.9	Very low	47	Very low	220 Å²	220	137.9 Å²	137.9	83%	0.83	71%	0.712	S	S	*	*			trans	-88.3	75.3	175.6	-141.8	179.9	-163.5	-173.8	4.8	110.2	V8 D12	V8-R10 VanDerWaalsContact C-N 3.26Å; V8-R10 HydrophobicContact CG1-CB 4.27Å; V8-R10 PolarHBondContact O-N 3.39Å; R10-D12 PolarHBondContact O-N 2.82Å; R10-D12 VanDerWaalsContact O-N 3.08Å
11	N	42.1	Very low	48.7	Very low	105 Å²	105	136.8 Å²	136.8	56%	0.561	71%	0.707	S	S	*	*			trans	38.6	56.1	147.6	-127.8	-2.5	0	0	0	118.4	V9 K13 Y14	V9-N11 VanDerWaalsContact C-N 3.34Å; V9-N11 PolarHBondContact O-N 3.03Å; V9-N11 VanDerWaalsContact O-N 3.17Å; N11-K13 PolarHBondContact O-N 2.81Å; N11-K13 VanDerWaalsContact O-N 3.09Å; N11-Y14 PolarHBondContact O-N 3.04Å
12	D	49.9	Very low	51.3	Low	130 Å²	130	129 Å²	129	70%	0.695	67%	0.673	S	S	*	*	H	α-helix	trans	-60.7	-16.2	173.7	-88.4	-38.1	0	0	0	114.3	R10 Y14 S15 L16	R10-D12 PolarHBondContact O-N 2.82Å; R10-D12 VanDerWaalsContact O-N 3.08Å; D12-Y14 VanDerWaalsContact C-N 3.26Å; D12-Y14 PolarHBondContact O-N 3.19Å; D12-S15 PolarHBondContact O-N 2.8Å; D12-L16 PolarHBondContact O-N 3.27Å
13	K	51.7	Low	53.8	Low	162 Å²	162	125.5 Å²	125.5	70%	0.704	65%	0.65	S	S	*	*	H	α-helix	trans	-63.6	-29.9	-178	-133.9	177	-172.7	176.9	0	112.9	N11 K17	N11-K13 PolarHBondContact O-N 2.81Å; N11-K13 VanDerWaalsContact O-N 3.09Å; K13-K17 WeakPolarHBondContact O-CG 3.13Å; K13-K17 PolarHBondContact O-N 3.36Å
14	Y	52	Low	56.8	Low	165 Å²	165	120.7 Å²	120.7	65%	0.647	63%	0.632	S	S	*	*	H	α-helix	trans	-77.6	-39.4	174.5	-85.3	-87.9	0	0	0	112	N11 D12 L16 K17 V18	N11-Y14 PolarHBondContact O-N 3.04Å; D12-Y14 VanDerWaalsContact C-N 3.26Å; D12-Y14 PolarHBondContact O-N 3.19Å; Y14-L16 VanDerWaalsContact C-N 3.35Å; Y14-L16 PolarHBondContact O-N 3.4Å; Y14-K17 PolarHBondContact O-N 3.19Å; Y14-V18 VanDerWaalsContact O-CG2 3.3Å; Y14-V18 WeakPolarHBondContact O-CG2 3.42Å; Y14-V18 PolarHBondContact O-N 3.47Å
15	S	60	Low	59.4	Low	51 Å²	51	117.7 Å²	117.7	36%	0.357	62%	0.618	S	S	.	*	H	α-helix	trans	-60.1	-43.7	176.8	180	0	0	0	0	111.7	D12 V18 K19	D12-S15 PolarHBondContact O-N 2.8Å; S15-V18 PolarHBondContact O-N 3.22Å; S15-K19 WeakPolarHBondContact O-CG 3.35Å; S15-K19 PolarHBondContact O-N 3.42Å
16	L	65	Low	62.5	Low	132 Å²	132	113.6 Å²	113.6	69%	0.691	60%	0.603	S	S	*	*	H	α-helix	trans	-66.6	-41.7	179.2	-155.2	83.6	0	0	0	112.5	D12 Y14 K19 L20	D12-L16 PolarHBondContact O-N 3.27Å; Y14-L16 VanDerWaalsContact C-N 3.35Å; Y14-L16 PolarHBondContact O-N 3.4Å; L16-K19 PolarHBondContact O-N 3.28Å; L16-L20 WeakPolarHBondContact O-CB 3.29Å; L16-L20 PolarHBondContact O-N 2.94Å
17	K	73.4	Confident	65.3	Low	138 Å²	138	114.9 Å²	114.9	60%	0.6	59%	0.592	S	S	*	*	H	α-helix	trans	-63.1	-41.7	176.4	-78.5	-175.3	176.3	-173.2	0	111.9	K13 Y14 L20 L21	K13-K17 WeakPolarHBondContact O-CG 3.13Å; K13-K17 PolarHBondContact O-N 3.36Å; Y14-K17 PolarHBondContact O-N 3.19Å; K17-L20 PolarHBondContact O-N 2.74Å; K17-L21 WeakPolarHBondContact O-CB 3.39Å; K17-L21 VanDerWaalsContact O-CG 3.3Å; K17-L21 WeakPolarHBondContact O-CG 3.35Å; K17-L21 PolarHBondContact O-N 2.76Å
18	V	76.6	Confident	68.3	Low	85 Å²	85	113.7 Å²	113.7	52%	0.515	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-45	177.4	174	0	0	0	0	110.7	Y14 S15 L20 L21 V22	Y14-V18 VanDerWaalsContact O-CG2 3.3Å; Y14-V18 WeakPolarHBondContact O-CG2 3.42Å; Y14-V18 PolarHBondContact O-N 3.47Å; S15-V18 PolarHBondContact O-N 3.22Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 2.95Å; V18-L21 PolarHBondContact O-N 3.07Å; V18-V22 HydrophobicContact CG1-CG2 4.41Å; V18-V22 VanDerWaalsContact O-CG2 3.3Å; V18-V22 WeakPolarHBondContact O-CG2 3.37Å; V18-V22 PolarHBondContact O-N 3.33Å
19	K	77	Confident	71	Confident	135 Å²	135	112.8 Å²	112.8	59%	0.587	58%	0.577	S	S	*	*	H	α-helix	trans	-60.5	-41.4	176.4	-73.7	179.8	-178.3	-177	0	112.5	S15 L16 V22 S23	S15-K19 WeakPolarHBondContact O-CG 3.35Å; S15-K19 PolarHBondContact O-N 3.42Å; L16-K19 PolarHBondContact O-N 3.28Å; K19-V22 PolarHBondContact O-N 3.39Å; K19-S23 WeakPolarHBondContact O-CB 3.43Å; K19-S23 PolarHBondContact O-N 3.14Å; K19-S23 PolarHBondContact O-OG 2.5Å
20	L	82.1	Confident	73.8	Confident	116 Å²	116	111 Å²	111	61%	0.607	56%	0.562	S	S	*	*	H	α-helix	trans	-65	-44.7	177.3	-171.5	70.4	0	0	0	111.5	L16 K17 V18 V22 S23 V24	L16-L20 WeakPolarHBondContact O-CB 3.29Å; L16-L20 PolarHBondContact O-N 2.94Å; K17-L20 PolarHBondContact O-N 2.74Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 2.95Å; L20-V22 PolarHBondContact O-N 3.41Å; L20-S23 PolarHBondContact O-N 2.8Å; L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 2.9Å
21	L	82.4	Confident	76.2	Confident	116 Å²	116	104.6 Å²	104.6	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-61.4	-43.2	176.6	-75.5	165.6	0	0	0	112.1	K17 V18 S23 V24 S25	K17-L21 WeakPolarHBondContact O-CB 3.39Å; K17-L21 VanDerWaalsContact O-CG 3.3Å; K17-L21 WeakPolarHBondContact O-CG 3.35Å; K17-L21 PolarHBondContact O-N 2.76Å; V18-L21 PolarHBondContact O-N 3.07Å; L21-S23 VanDerWaalsContact C-N 3.34Å; L21-S23 PolarHBondContact O-N 2.98Å; L21-V24 PolarHBondContact O-N 3.41Å; L21-S25 WeakPolarHBondContact O-CB 2.81Å; L21-S25 PolarHBondContact O-N 3.13Å; L21-S25 PolarHBondContact O-OG 3.29Å; L21-S25 VanDerWaalsContact O-OG 3.06Å
22	V	85.3	Confident	78.3	Confident	78 Å²	78	105.8 Å²	105.8	47%	0.473	54%	0.54	S	S	.	.	H	α-helix	trans	-62.4	-42.9	175.8	172.7	0	0	0	0	111	V18 K19 L20 S25 I26	V18-V22 HydrophobicContact CG1-CG2 4.41Å; V18-V22 VanDerWaalsContact O-CG2 3.3Å; V18-V22 WeakPolarHBondContact O-CG2 3.37Å; V18-V22 PolarHBondContact O-N 3.33Å; K19-V22 PolarHBondContact O-N 3.39Å; L20-V22 PolarHBondContact O-N 3.41Å; V22-S25 PolarHBondContact O-N 2.9Å; V22-I26 HydrophobicContact CG1-CD1 3.84Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.35Å; V22-I26 PolarHBondContact O-N 3.1Å
23	S	83.7	Confident	80.1	Confident	61 Å²	61	103.7 Å²	103.7	43%	0.427	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-43.7	179.3	-54	0	0	0	0	112	K19 L20 L21 I26 I27	K19-S23 WeakPolarHBondContact O-CB 3.43Å; K19-S23 PolarHBondContact O-N 3.14Å; K19-S23 PolarHBondContact O-OG 2.5Å; L20-S23 PolarHBondContact O-N 2.8Å; L21-S23 VanDerWaalsContact C-N 3.34Å; L21-S23 PolarHBondContact O-N 2.98Å; S23-I26 PolarHBondContact O-N 2.74Å; S23-I27 WeakPolarHBondContact O-CG1 3.21Å; S23-I27 PolarHBondContact O-N 2.01Å
24	V	88.7	Confident	81.6	Confident	72 Å²	72	100.4 Å²	100.4	44%	0.436	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-43.3	176.3	172.8	0	0	0	0	111	L20 L21 I26 I27 L28	L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 2.9Å; L21-V24 PolarHBondContact O-N 3.41Å; V24-I26 PolarHBondContact O-N 2.84Å; V24-I27 PolarHBondContact O-N 3.36Å; V24-L28 HydrophobicContact CG1-CD1 3.97Å; V24-L28 HydrophobicContact CG1-CG 4.4Å; V24-L28 WeakPolarHBondContact O-CG 3.24Å; V24-L28 PolarHBondContact O-N 2.85Å
25	S	88.5	Confident	83	Confident	77 Å²	77	97.4 Å²	97.4	54%	0.538	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-38.8	177	-65.3	0	0	0	0	112.9	L21 V22 L28 L29	L21-S25 WeakPolarHBondContact O-CB 2.81Å; L21-S25 PolarHBondContact O-N 3.13Å; L21-S25 PolarHBondContact O-OG 3.29Å; L21-S25 VanDerWaalsContact O-OG 3.06Å; V22-S25 PolarHBondContact O-N 2.9Å; S25-L28 PolarHBondContact O-N 2.84Å; S25-L29 WeakPolarHBondContact O-CB 3.48Å; S25-L29 PolarHBondContact O-N 3.31Å
26	I	91.4	Very high	83.9	Confident	91 Å²	91	97.5 Å²	97.5	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-44.1	175.5	-69.3	166.3	0	0	0	110.8	V22 S23 V24 L28 L29 I30	V22-I26 HydrophobicContact CG1-CD1 3.84Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.35Å; V22-I26 PolarHBondContact O-N 3.1Å; S23-I26 PolarHBondContact O-N 2.74Å; V24-I26 PolarHBondContact O-N 2.84Å; I26-L28 PolarHBondContact O-N 2.86Å; I26-L29 WeakPolarHBondContact O-CB 3.36Å; I26-L29 PolarHBondContact O-N 3.1Å; I26-I30 HydrophobicContact CG2-CD1 3.86Å; I26-I30 HydrophobicContact CG2-CG1 4.48Å; I26-I30 VanDerWaalsContact O-CG1 3.3Å; I26-I30 WeakPolarHBondContact O-CG1 2.98Å; I26-I30 PolarHBondContact O-N 3.44Å
27	I	91.5	Very high	84.6	Confident	98 Å²	98	93.1 Å²	93.1	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-44.7	177.9	-68.4	166.8	0	0	0	110.6	S23 V24 L29 I30 I31	S23-I27 WeakPolarHBondContact O-CG1 3.21Å; S23-I27 PolarHBondContact O-N 2.01Å; V24-I27 PolarHBondContact O-N 3.36Å; I27-L29 VanDerWaalsContact C-N 3.33Å; I27-L29 PolarHBondContact O-N 2.86Å; I27-I30 PolarHBondContact O-N 3.49Å; I27-I31 HydrophobicContact CG2-CD1 3.84Å; I27-I31 HydrophobicContact CG2-CG1 4.45Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.36Å; I27-I31 PolarHBondContact O-N 3.01Å
28	L	91	Very high	84.7	Confident	107 Å²	107	89.8 Å²	89.8	56%	0.56	49%	0.486	S	S	*	.	H	α-helix	trans	-63.3	-39.2	176.8	-70.6	172.7	0	0	0	112	V24 S25 I26 I31 W32	V24-L28 HydrophobicContact CG1-CD1 3.97Å; V24-L28 HydrophobicContact CG1-CG 4.4Å; V24-L28 WeakPolarHBondContact O-CG 3.24Å; V24-L28 PolarHBondContact O-N 2.85Å; S25-L28 PolarHBondContact O-N 2.84Å; I26-L28 PolarHBondContact O-N 2.86Å; L28-I31 PolarHBondContact O-N 3.12Å; L28-W32 WeakPolarHBondContact O-CB 3.5Å; L28-W32 PolarHBondContact O-N 3.08Å
29	L	90.4	Very high	84.5	Confident	100 Å²	100	88.8 Å²	88.8	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-43.2	174.5	-168.3	82	0	0	0	111.3	S25 I26 I27 W32 L33	S25-L29 WeakPolarHBondContact O-CB 3.48Å; S25-L29 PolarHBondContact O-N 3.31Å; I26-L29 WeakPolarHBondContact O-CB 3.36Å; I26-L29 PolarHBondContact O-N 3.1Å; I27-L29 VanDerWaalsContact C-N 3.33Å; I27-L29 PolarHBondContact O-N 2.86Å; L29-W32 PolarHBondContact O-N 2.91Å; L29-L33 HydrophobicContact CD2-CD1 4.43Å; L29-L33 HydrophobicContact CG-CD1 4.25Å; L29-L33 WeakPolarHBondContact O-CB 3.29Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.44Å; L29-L33 PolarHBondContact O-N 2.9Å
30	I	90.6	Very high	84.4	Confident	92 Å²	92	86.6 Å²	86.6	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.7	-68	166.2	0	0	0	110.5	I26 I27 W32 L33 V34	I26-I30 HydrophobicContact CG2-CD1 3.86Å; I26-I30 HydrophobicContact CG2-CG1 4.48Å; I26-I30 VanDerWaalsContact O-CG1 3.3Å; I26-I30 WeakPolarHBondContact O-CG1 2.98Å; I26-I30 PolarHBondContact O-N 3.44Å; I27-I30 PolarHBondContact O-N 3.49Å; I30-W32 VanDerWaalsContact C-N 3.26Å; I30-W32 PolarHBondContact O-N 2.98Å; I30-L33 PolarHBondContact O-N 2.7Å; I30-V34 HydrophobicContact CG2-CG2 4.22Å; I30-V34 WeakPolarHBondContact O-CB 2.84Å; I30-V34 VanDerWaalsContact O-CG2 3.27Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 3.15Å
31	I	86	Confident	83.9	Confident	85 Å²	85	85.5 Å²	85.5	44%	0.436	47%	0.471	S	S	.	.	H	α-helix	trans	-58.7	-41.1	176.3	-69.6	168.9	0	0	0	110.5	I27 L28 V34 N35	I27-I31 HydrophobicContact CG2-CD1 3.84Å; I27-I31 HydrophobicContact CG2-CG1 4.45Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.36Å; I27-I31 PolarHBondContact O-N 3.01Å; L28-I31 PolarHBondContact O-N 3.12Å; I31-V34 PolarHBondContact O-N 3.35Å; I31-N35 WeakPolarHBondContact O-CB 3.45Å; I31-N35 PolarHBondContact O-N 2.92Å; I31-N35 PolarHBondContact O-ND2 3.31Å
32	W	87.8	Confident	83	Confident	130 Å²	130	84.8 Å²	84.8	49%	0.492	47%	0.465	S	S	.	.	H	α-helix	trans	-66.9	-44.6	177.2	-171.9	83.5	0	0	0	112.2	L28 L29 I30 V34 V36 V37	L28-W32 WeakPolarHBondContact O-CB 3.5Å; L28-W32 PolarHBondContact O-N 3.08Å; L29-W32 PolarHBondContact O-N 2.91Å; I30-W32 VanDerWaalsContact C-N 3.26Å; I30-W32 PolarHBondContact O-N 2.98Å; W32-V34 VanDerWaalsContact C-N 3.32Å; W32-V34 PolarHBondContact O-N 2.93Å; W32-V36 HydrophobicContact CD2-CB 4.38Å; W32-V36 HydrophobicContact CG-CB 4.11Å; W32-V36 HydrophobicContact CG-CG2 4.16Å; W32-V36 WeakPolarHBondContact O-CA 3.4Å; W32-V36 VanDerWaalsContact O-CB 3.25Å; W32-V36 WeakPolarHBondContact O-CB 3.37Å; W32-V36 PolarHBondContact O-N 3.32Å; W32-V37 HydrophobicContact CE3-CG2 4.04Å; W32-V37 HydrophobicContact CH2-CG2 4.16Å; W32-V37 HydrophobicContact CZ3-CG2 3.75Å; W32-V37 PolarHBondContact O-N 3.25Å
33	L	86.6	Confident	82.1	Confident	86 Å²	86	88.5 Å²	88.5	45%	0.45	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-35.1	175.9	-72.7	172.4	0	0	0	112.7	L29 I30 V37 P38	L29-L33 HydrophobicContact CD2-CD1 4.43Å; L29-L33 HydrophobicContact CG-CD1 4.25Å; L29-L33 WeakPolarHBondContact O-CB 3.29Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.44Å; L29-L33 PolarHBondContact O-N 2.9Å; I30-L33 PolarHBondContact O-N 2.7Å; L33-V37 HydrophobicContact CD2-CG2 3.91Å; L33-P38 WeakPolarHBondContact O-CD 3.25Å
34	V	83.8	Confident	80.8	Confident	94 Å²	94	92.3 Å²	92.3	57%	0.57	48%	0.479	S	S	*	.	H	α-helix	trans	-81.4	-36.4	-178.8	173.6	0	0	0	0	112.2	I30 I31 W32 P38	I30-V34 HydrophobicContact CG2-CG2 4.22Å; I30-V34 WeakPolarHBondContact O-CB 2.84Å; I30-V34 VanDerWaalsContact O-CG2 3.27Å; I30-V34 WeakPolarHBondContact O-CG2 3.33Å; I30-V34 PolarHBondContact O-N 3.15Å; I31-V34 PolarHBondContact O-N 3.35Å; W32-V34 VanDerWaalsContact C-N 3.32Å; W32-V34 PolarHBondContact O-N 2.93Å; V34-P38 WeakPolarHBondContact O-CD 3.43Å; V34-P38 VanDerWaalsContact O-CG 3.31Å; V34-P38 WeakPolarHBondContact O-CG 3.06Å
35	N	80.9	Confident	79.2	Confident	102 Å²	102	92.5 Å²	92.5	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-104.4	-34.1	-172.5	-61.7	-66.9	0	0	0	113.9	I31 S39	I31-N35 WeakPolarHBondContact O-CB 3.45Å; I31-N35 PolarHBondContact O-N 2.92Å; I31-N35 PolarHBondContact O-ND2 3.31Å; N35-S39 PolarHBondContact O-OG 2.85Å
36	V	78.8	Confident	77.4	Confident	52 Å²	52	92.9 Å²	92.9	32%	0.315	47%	0.473	S	S	.	.	H	α-helix	trans	-96.2	-38.6	-172.1	-173.5	0	0	0	0	111.7	W32 S39 L40	W32-V36 HydrophobicContact CD2-CB 4.38Å; W32-V36 HydrophobicContact CG-CB 4.11Å; W32-V36 HydrophobicContact CG-CG2 4.16Å; W32-V36 WeakPolarHBondContact O-CA 3.4Å; W32-V36 VanDerWaalsContact O-CB 3.25Å; W32-V36 WeakPolarHBondContact O-CB 3.37Å; W32-V36 PolarHBondContact O-N 3.32Å; V36-S39 WeakPolarHBondContact CA-OG 3.38Å; V36-S39 PolarHBondContact O-N 3.05Å; V36-S39 PolarHBondContact O-OG 2.78Å; V36-L40 HydrophobicContact CG1-CD1 3.91Å; V36-L40 HydrophobicContact CG1-CG 4.27Å; V36-L40 WeakPolarHBondContact O-CB 3.25Å; V36-L40 WeakPolarHBondContact O-CG 3.42Å; V36-L40 PolarHBondContact O-N 2.82Å
37	V	79.6	Confident	75.2	Confident	41 Å²	41	93.7 Å²	93.7	25%	0.248	48%	0.475	C	S	.	.	H	α-helix	trans	-65.1	-44.5	179.3	175.1	0	0	0	0	112.3	W32 L33 S39 L40 I41	W32-V37 HydrophobicContact CE3-CG2 4.04Å; W32-V37 HydrophobicContact CH2-CG2 4.16Å; W32-V37 HydrophobicContact CZ3-CG2 3.75Å; W32-V37 PolarHBondContact O-N 3.25Å; L33-V37 HydrophobicContact CD2-CG2 3.91Å; V37-S39 VanDerWaalsContact C-N 3.31Å; V37-S39 PolarHBondContact O-N 2.96Å; V37-L40 PolarHBondContact O-N 3.04Å; V37-I41 HydrophobicContact CG1-CD1 3.64Å; V37-I41 HydrophobicContact CG1-CG1 4.2Å; V37-I41 WeakPolarHBondContact O-CB 3.37Å; V37-I41 VanDerWaalsContact O-CG1 3.28Å; V37-I41 WeakPolarHBondContact O-CG1 3.42Å; V37-I41 PolarHBondContact O-N 3.38Å
38	P	76.4	Confident	72.8	Confident	67 Å²	67	93.3 Å²	93.3	44%	0.435	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-35.6	176.7	-26.1	37.9	0	0	0	112.9	L33 V34 I41 Q42	L33-P38 WeakPolarHBondContact O-CD 3.25Å; V34-P38 WeakPolarHBondContact O-CD 3.43Å; V34-P38 VanDerWaalsContact O-CG 3.31Å; V34-P38 WeakPolarHBondContact O-CG 3.06Å; P38-I41 PolarHBondContact O-N 3.36Å; P38-Q42 VanDerWaalsContact O-CB 3.27Å; P38-Q42 WeakPolarHBondContact O-CB 3.25Å; P38-Q42 PolarHBondContact O-N 3.26Å
39	S	73.2	Confident	70.5	Confident	65 Å²	65	93.5 Å²	93.5	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-69.7	-36.2	176.1	46.3	0	0	0	0	112.3	N35 V36 V37 W43	N35-S39 PolarHBondContact O-OG 2.85Å; V36-S39 WeakPolarHBondContact CA-OG 3.38Å; V36-S39 PolarHBondContact O-N 3.05Å; V36-S39 PolarHBondContact O-OG 2.78Å; V37-S39 VanDerWaalsContact C-N 3.31Å; V37-S39 PolarHBondContact O-N 2.96Å; S39-W43 VanDerWaalsContact O-CB 3.26Å; S39-W43 WeakPolarHBondContact O-CB 3.26Å; S39-W43 PolarHBondContact O-N 2.96Å
40	L	73.4	Confident	68	Low	88 Å²	88	94.9 Å²	94.9	46%	0.461	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-39.5	171.9	-74.1	170.5	0	0	0	112.7	V36 V37 W43 K44	V36-L40 HydrophobicContact CG1-CD1 3.91Å; V36-L40 HydrophobicContact CG1-CG 4.27Å; V36-L40 WeakPolarHBondContact O-CB 3.25Å; V36-L40 WeakPolarHBondContact O-CG 3.42Å; V36-L40 PolarHBondContact O-N 2.82Å; V37-L40 PolarHBondContact O-N 3.04Å; L40-W43 PolarHBondContact O-N 3.38Å; L40-K44 WeakPolarHBondContact O-CB 3.4Å; L40-K44 PolarHBondContact O-N 3.23Å
41	I	72.2	Confident	65.3	Low	93 Å²	93	95.8 Å²	95.8	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-46.2	174.1	-69.3	169.2	0	0	0	109.5	V37 P38 W43 K44 I45	V37-I41 HydrophobicContact CG1-CD1 3.64Å; V37-I41 HydrophobicContact CG1-CG1 4.2Å; V37-I41 WeakPolarHBondContact O-CB 3.37Å; V37-I41 VanDerWaalsContact O-CG1 3.28Å; V37-I41 WeakPolarHBondContact O-CG1 3.42Å; V37-I41 PolarHBondContact O-N 3.38Å; P38-I41 PolarHBondContact O-N 3.36Å; I41-W43 VanDerWaalsContact C-N 3.33Å; I41-W43 PolarHBondContact O-N 3.28Å; I41-K44 PolarHBondContact O-N 2.86Å; I41-I45 HydrophobicContact CG2-CD1 3.68Å; I41-I45 HydrophobicContact CG2-CG1 4.27Å; I41-I45 VanDerWaalsContact O-CG1 3.28Å; I41-I45 WeakPolarHBondContact O-CG1 3.27Å; I41-I45 PolarHBondContact O-N 3.23Å
42	Q	63.8	Low	62.9	Low	102 Å²	102	103.5 Å²	103.5	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-41.9	176.6	-165.8	68.3	18.4	0	0	111.6	P38 K44 I45 N46	P38-Q42 VanDerWaalsContact O-CB 3.27Å; P38-Q42 WeakPolarHBondContact O-CB 3.25Å; P38-Q42 PolarHBondContact O-N 3.26Å; Q42-K44 VanDerWaalsContact C-N 3.33Å; Q42-K44 PolarHBondContact O-N 2.88Å; Q42-I45 PolarHBondContact O-N 3.18Å; Q42-N46 WeakPolarHBondContact O-CB 3.49Å; Q42-N46 PolarHBondContact O-N 3.34Å; Q42-N46 PolarHBondContact O-ND2 3.13Å
43	W	65.6	Low	60.3	Low	155 Å²	155	102.2 Å²	102.2	59%	0.587	51%	0.512	S	S	*	.	H	α-helix	trans	-61.5	-40.5	175.2	-179.7	78.8	0	0	0	112	S39 L40 I41 N46 Q47	S39-W43 VanDerWaalsContact O-CB 3.26Å; S39-W43 WeakPolarHBondContact O-CB 3.26Å; S39-W43 PolarHBondContact O-N 2.96Å; L40-W43 PolarHBondContact O-N 3.38Å; I41-W43 VanDerWaalsContact C-N 3.33Å; I41-W43 PolarHBondContact O-N 3.28Å; W43-N46 PolarHBondContact O-N 2.72Å; W43-Q47 HydrophobicContact CZ2-CG 4.47Å; W43-Q47 WeakPolarHBondContact O-CG 3.29Å; W43-Q47 PolarHBondContact O-N 3.12Å
44	K	56.7	Low	57.6	Low	141 Å²	141	101.9 Å²	101.9	61%	0.613	52%	0.515	S	S	*	.	H	α-helix	trans	-74.3	-36.1	178.1	-161.9	167.1	-175	-179.5	0	112.9	L40 I41 Q42 N46 Q47 V48	L40-K44 WeakPolarHBondContact O-CB 3.4Å; L40-K44 PolarHBondContact O-N 3.23Å; I41-K44 PolarHBondContact O-N 2.86Å; Q42-K44 VanDerWaalsContact C-N 3.33Å; Q42-K44 PolarHBondContact O-N 2.88Å; K44-N46 VanDerWaalsContact C-N 3.31Å; K44-Q47 WeakPolarHBondContact O-CB 3.5Å; K44-Q47 PolarHBondContact O-N 2.74Å; K44-Q47 VanDerWaalsContact O-N 3.08Å; K44-V48 WeakPolarHBondContact O-CG2 3.26Å; K44-V48 PolarHBondContact O-N 2.82Å
45	I	55.2	Low	55.2	Low	76 Å²	76	105.3 Å²	105.3	39%	0.39	53%	0.525	S	S	.	.	H	α-helix	trans	-60.7	-44.1	171.6	-70	168.5	0	0	0	109.7	I41 Q42 Q47 V48 D49	I41-I45 HydrophobicContact CG2-CD1 3.68Å; I41-I45 HydrophobicContact CG2-CG1 4.27Å; I41-I45 VanDerWaalsContact O-CG1 3.28Å; I41-I45 WeakPolarHBondContact O-CG1 3.27Å; I41-I45 PolarHBondContact O-N 3.23Å; Q42-I45 PolarHBondContact O-N 3.18Å; I45-Q47 PolarHBondContact O-N 2.77Å; I45-V48 PolarHBondContact O-N 3.14Å; I45-D49 PolarHBondContact O-N 3.12Å
46	N	50.4	Low	53	Low	86 Å²	86	106.2 Å²	106.2	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-23.4	175.1	-69.5	-17.7	0	0	0	113.2	Q42 W43 K44 H50	Q42-N46 WeakPolarHBondContact O-CB 3.49Å; Q42-N46 PolarHBondContact O-N 3.34Å; Q42-N46 PolarHBondContact O-ND2 3.13Å; W43-N46 PolarHBondContact O-N 2.72Å; K44-N46 VanDerWaalsContact C-N 3.31Å; N46-H50 PolarHBondContact O-CD2 3.21Å; N46-H50 VanDerWaalsContact O-CD2 3.25Å
47	Q	44.6	Very low	51.2	Low	108 Å²	108	105.8 Å²	105.8	51%	0.505	53%	0.53	S	S	.	.	H	α-helix	trans	-81.4	-41.1	173.9	-69.8	-109.7	-35.4	0	0	112.3	W43 K44 I45 D49 H50	W43-Q47 HydrophobicContact CZ2-CG 4.47Å; W43-Q47 WeakPolarHBondContact O-CG 3.29Å; W43-Q47 PolarHBondContact O-N 3.12Å; K44-Q47 WeakPolarHBondContact O-CB 3.5Å; K44-Q47 PolarHBondContact O-N 2.74Å; K44-Q47 VanDerWaalsContact O-N 3.08Å; I45-Q47 PolarHBondContact O-N 2.77Å; Q47-D49 VanDerWaalsContact C-N 3.29Å; Q47-D49 PolarHBondContact O-N 2.97Å; Q47-H50 WeakPolarHBondContact O-CB 3.45Å; Q47-H50 PolarHBondContact O-N 3.4Å; Q47-H50 VanDerWaalsContact O-N 3.15Å
48	V	42.8	Very low	48.9	Very low	90 Å²	90	107.3 Å²	107.3	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-29.5	-179.4	175.1	0	0	0	0	112.1	K44 I45 H50 D51	K44-V48 WeakPolarHBondContact O-CG2 3.26Å; K44-V48 PolarHBondContact O-N 2.82Å; I45-V48 PolarHBondContact O-N 3.14Å; V48-H50 PolarHBondContact O-N 3.04Å; V48-D51 PolarHBondContact O-N 3.17Å
49	D	41.2	Very low	46.9	Very low	110 Å²	110	109.5 Å²	109.5	59%	0.588	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-6.8	175.5	-88.4	-18.6	0	0	0	114	I45 Q47	I45-D49 PolarHBondContact O-N 3.12Å; Q47-D49 VanDerWaalsContact C-N 3.29Å; Q47-D49 PolarHBondContact O-N 2.97Å
50	H	39.1	Very low	45.1	Very low	130 Å²	130	112.6 Å²	112.6	60%	0.602	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-13.8	172.4	-75.8	-57	0	0	0	114	N46 Q47 V48 R52	N46-H50 PolarHBondContact O-CD2 3.21Å; N46-H50 VanDerWaalsContact O-CD2 3.25Å; Q47-H50 WeakPolarHBondContact O-CB 3.45Å; Q47-H50 PolarHBondContact O-N 3.4Å; Q47-H50 VanDerWaalsContact O-N 3.15Å; V48-H50 PolarHBondContact O-N 3.04Å; H50-R52 VanDerWaalsContact C-N 3.29Å; H50-R52 PolarHBondContact O-N 3.44Å
51	D	34.1	Very low	43.5	Very low	110 Å²	110	112.5 Å²	112.5	59%	0.588	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	6.3	-173.4	-71	-12.7	0	0	0	115	V48	V48-D51 PolarHBondContact O-N 3.17Å
52	R	34.9	Very low	41.8	Very low	248 Å²	248	111.4 Å²	111.4	94%	0.936	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	30	174.7	-82.9	-169.6	-175.6	174.7	4.1	114.3	H50	H50-R52 VanDerWaalsContact C-N 3.29Å; H50-R52 PolarHBondContact O-N 3.44Å
53	M	32.1	Very low	40.2	Very low	102 Å²	102	113.2 Å²	113.2	50%	0.502	58%	0.576	S	S	.	*	S	Bend	trans	-103.9	144.1	163.8	-69.7	-160.7	93.8	0	0	110.8	E55	M53-E55 PolarHBondContact O-N 3.27Å
54	P	31.4	Very low	38.8	Very low	79 Å²	79	109.4 Å²	109.4	51%	0.513	57%	0.566	S	S	.	*			trans	-58.4	134.2	176.2	-17.4	28.9	0	0	0	110.4	T56 I57	P54-T56 PolarHBondContact O-N 3.09Å; P54-I57 PolarHBondContact O-N 3.08Å
55	E	32.7	Very low	37.9	Very low	167 Å²	167	107.7 Å²	107.7	78%	0.78	57%	0.572	S	S	*	*	H	α-helix	trans	-46.2	-20.1	-175.4	-69.8	173.2	150.5	0	0	115.1	M53 I57	M53-E55 PolarHBondContact O-N 3.27Å; E55-I57 VanDerWaalsContact C-N 3.34Å; E55-I57 PolarHBondContact O-N 3.17Å
56	T	34.9	Very low	37.6	Very low	120 Å²	120	107.5 Å²	107.5	74%	0.736	57%	0.571	S	S	*	*	H	α-helix	trans	-71.4	-23	178.8	0.7	0	0	0	0	114.1	P54	P54-T56 PolarHBondContact O-N 3.09Å
57	I	40.4	Very low	37.4	Very low	44 Å²	44	108.9 Å²	108.9	23%	0.226	58%	0.583	C	S	.	*	H	α-helix	trans	-107.2	-20.7	-177.5	-66.9	-179.1	0	0	0	113.1	P54 E55 V59 L60 C61 Y93	P54-I57 PolarHBondContact O-N 3.08Å; E55-I57 VanDerWaalsContact C-N 3.34Å; E55-I57 PolarHBondContact O-N 3.17Å; I57-V59 PolarHBondContact O-N 3.1Å; I57-L60 WeakPolarHBondContact O-CA 3.49Å; I57-L60 PolarHBondContact O-N 3.44Å; I57-C61 HydrophobicContact CG2-CB 4.35Å; I57-C61 PolarHBondContact O-N 3.38Å; I57-Y93 HydrophobicContact CD1-CE2 4.19Å
58	E	32.8	Very low	37.8	Very low	73 Å²	73	111.3 Å²	111.3	34%	0.341	60%	0.599	S	S	.	*	H	α-helix	trans	-54.3	-42.5	169.4	-116.2	-169.3	143.4	0	0	110.5	L60 C61 S62	E58-L60 PolarHBondContact O-N 2.65Å; E58-L60 VanDerWaalsContact O-N 3.13Å; E58-C61 PolarHBondContact O-N 2.91Å; E58-S62 WeakPolarHBondContact O-CB 2.91Å; E58-S62 PolarHBondContact O-N 3.15Å; E58-S62 PolarHBondContact O-OG 3.11Å
59	V	32.6	Very low	38.7	Very low	113 Å²	113	109.1 Å²	109.1	69%	0.685	58%	0.583	S	S	*	*	H	α-helix	trans	-60.5	-27.8	176	-177.8	0	0	0	0	113.1	I57	I57-V59 PolarHBondContact O-N 3.1Å
60	L	36.3	Very low	40.5	Very low	130 Å²	130	106.6 Å²	106.6	68%	0.681	57%	0.574	S	S	*	*	H	α-helix	trans	-90.2	-27	179.2	-128.4	90.5	0	0	0	113.6	I57 E58	I57-L60 WeakPolarHBondContact O-CA 3.49Å; I57-L60 PolarHBondContact O-N 3.44Å; E58-L60 PolarHBondContact O-N 2.65Å; E58-L60 VanDerWaalsContact O-N 3.13Å
61	C	38.8	Very low	42.2	Very low	86 Å²	86	104.7 Å²	104.7	58%	0.581	57%	0.565	S	S	*	*	H	α-helix	trans	-110.2	-29	-171.2	-74.2	0	0	0	0	114.7	I57 E58	I57-C61 HydrophobicContact CG2-CB 4.35Å; I57-C61 PolarHBondContact O-N 3.38Å; E58-C61 PolarHBondContact O-N 2.91Å
62	S	36.7	Very low	44.2	Very low	70 Å²	70	103.7 Å²	103.7	49%	0.49	57%	0.567	S	S	.	*	S	Bend	trans	-90.5	-9.4	-170.6	65.4	0	0	0	0	115.6	E58	E58-S62 WeakPolarHBondContact O-CB 2.91Å; E58-S62 PolarHBondContact O-N 3.15Å; E58-S62 PolarHBondContact O-OG 3.11Å
63	N	30.4	Very low	46.6	Very low	139 Å²	139	95.6 Å²	95.6	74%	0.743	54%	0.542	S	S	*	.	S	Bend	trans	-115	27.1	-170.5	-86.9	-29.4	0	0	0	117.2
64	I	37.5	Very low	48.9	Very low	76 Å²	76	91 Å²	91	39%	0.39	52%	0.52	S	S	.	.			trans	-125.9	104	176.3	-53.5	179.9	0	0	0	110.4	I66 Q69 I77	I64-I66 WeakPolarHBondContact O-CG1 3.41Å; I64-I66 PolarHBondContact O-N 3.29Å; I64-I66 VanDerWaalsContact O-N 3.15Å; I64-Q69 HydrophobicContact CG2-CG 4.49Å; I64-Q69 VanDerWaalsContact CG2-NE2 3.31Å; I64-I77 HydrophobicContact CD1-CD1 4.46Å
65	S	37.9	Very low	51.1	Low	104 Å²	104	87.9 Å²	87.9	73%	0.727	50%	0.5	S	S	*	.			trans	-62	113.2	161.9	63.1	0	0	0	0	108.8	T67	S65-T67 PolarHBondContact O-N 2.94Å; S65-T67 VanDerWaalsContact O-N 3.15Å
66	I	47.9	Very low	53.4	Low	73 Å²	73	82.5 Å²	82.5	37%	0.374	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	12.9	-164.1	-39.2	179	0	0	0	112.8	I64 K106	I64-I66 WeakPolarHBondContact O-CG1 3.41Å; I64-I66 PolarHBondContact O-N 3.29Å; I64-I66 VanDerWaalsContact O-N 3.15Å; I66-K106 VanDerWaalsContact CG2-NZ 3.3Å; I66-K106 PolarHBondContact O-NZ 3.35Å
67	T	46.7	Very low	55.6	Low	115 Å²	115	78.1 Å²	78.1	71%	0.706	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-10.5	-166.8	52.3	0	0	0	0	115.5	S65	S65-T67 PolarHBondContact O-N 2.94Å; S65-T67 VanDerWaalsContact O-N 3.15Å
68	N	52	Low	57.3	Low	159 Å²	159	76 Å²	76	85%	0.85	44%	0.442	S	S	*	.	S	Bend	trans	-145.6	40.1	-177.3	-78.8	-26.4	0	0	0	114.2
69	Q	63.4	Low	59.4	Low	44 Å²	44	76.5 Å²	76.5	21%	0.206	44%	0.444	C	S	.	.			trans	-75.3	136.5	176.8	-68.1	-167	-50.6	0	0	111.4	I64 D73 L74	I64-Q69 HydrophobicContact CG2-CG 4.49Å; I64-Q69 VanDerWaalsContact CG2-NE2 3.31Å; Q69-D73 HydrophobicContact CB-CB 4.24Å; Q69-L74 HydrophobicContact CB-CD2 4.22Å; Q69-L74 HydrophobicContact CB-CG 3.96Å; Q69-L74 VanDerWaalsContact OE1-CD2 3.27Å
70	S	77.5	Confident	61.4	Low	56 Å²	56	77.1 Å²	77.1	39%	0.392	44%	0.438	S	S	.	.			trans	-69	157.8	172.7	73	0	0	0	0	110.7	S72 D73 L74	S70-S72 PolarHBondContact O-N 3.13Å; S70-D73 WeakPolarHBondContact CB-OD2 3.44Å; S70-D73 PolarHBondContact N-OD2 3.1Å; S70-D73 WeakPolarHBondContact O-CB 3.42Å; S70-D73 PolarHBondContact O-N 3.15Å; S70-D73 PolarHBondContact OG-N 3.22Å; S70-D73 PolarHBondContact OG-OD2 3.22Å; S70-L74 PolarHBondContact O-N 3.07Å
71	E	75.8	Confident	63	Low	90 Å²	90	73 Å²	73	42%	0.421	42%	0.416	S	S	.	.	H	α-helix	trans	-50.6	-43.5	173.9	-179.2	-173.7	148.2	0	0	111.6	D73 L74 A75 L107	E71-D73 VanDerWaalsContact C-N 3.32Å; E71-D73 PolarHBondContact O-N 2.94Å; E71-L74 PolarHBondContact O-N 2.79Å; E71-A75 VanDerWaalsContact O-CB 3.31Å; E71-A75 WeakPolarHBondContact O-CB 3.33Å; E71-A75 PolarHBondContact O-N 2.93Å; E71-L107 HydrophobicContact CG-CD1 3.93Å
72	S	76.7	Confident	64.3	Low	89 Å²	89	69 Å²	69	62%	0.622	39%	0.389	S	S	*	.	H	α-helix	trans	-63	-35.2	178.1	-175.3	0	0	0	0	112.8	S70 S76	S70-S72 PolarHBondContact O-N 3.13Å; S72-S76 VanDerWaalsContact O-CB 3.25Å; S72-S76 WeakPolarHBondContact O-CB 3.38Å; S72-S76 PolarHBondContact O-N 2.96Å
73	D	83.7	Confident	65.5	Low	78 Å²	78	67.5 Å²	67.5	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-71.7	-45.1	178.3	-63.4	-43.7	0	0	0	110.8	Q69 S70 E71 S76 I77	Q69-D73 HydrophobicContact CB-CB 4.24Å; S70-D73 WeakPolarHBondContact CB-OD2 3.44Å; S70-D73 PolarHBondContact N-OD2 3.1Å; S70-D73 WeakPolarHBondContact O-CB 3.42Å; S70-D73 PolarHBondContact O-N 3.15Å; S70-D73 PolarHBondContact OG-N 3.22Å; S70-D73 PolarHBondContact OG-OD2 3.22Å; E71-D73 VanDerWaalsContact C-N 3.32Å; E71-D73 PolarHBondContact O-N 2.94Å; D73-S76 PolarHBondContact O-N 2.88Å; D73-I77 VanDerWaalsContact O-CG1 3.3Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.39Å
74	L	80.2	Confident	66.3	Low	6 Å²	6	64.7 Å²	64.7	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-60.9	-47.6	176.4	-73.6	168.9	0	0	0	111	Q69 S70 E71 S76 I77 L78 R103 K106 L107	Q69-L74 HydrophobicContact CB-CD2 4.22Å; Q69-L74 HydrophobicContact CB-CG 3.96Å; Q69-L74 VanDerWaalsContact OE1-CD2 3.27Å; S70-L74 PolarHBondContact O-N 3.07Å; E71-L74 PolarHBondContact O-N 2.79Å; L74-S76 VanDerWaalsContact C-N 3.33Å; L74-S76 PolarHBondContact O-N 2.93Å; L74-I77 PolarHBondContact O-N 3Å; L74-L78 WeakPolarHBondContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CG 3.43Å; L74-L78 PolarHBondContact O-N 3.35Å; L74-R103 HydrophobicContact CD2-CB 4.49Å; L74-R103 HydrophobicContact CD2-CG 4.41Å; L74-K106 HydrophobicContact CD1-CB 3.9Å; L74-L107 HydrophobicContact CB-CD1 4.48Å
75	A	78.4	Confident	66.5	Low	13 Å²	13	67.1 Å²	67.1	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-60.1	-41.2	176.9	0	0	0	0	0	112	E71 H79 F409	E71-A75 VanDerWaalsContact O-CB 3.31Å; E71-A75 WeakPolarHBondContact O-CB 3.33Å; E71-A75 PolarHBondContact O-N 2.93Å; A75-H79 WeakPolarHBondContact O-CB 3.44Å; A75-H79 PolarHBondContact O-N 2.9Å; A75-F409 WeakPolarHBondContact O-CB 3.48Å
76	S	80.5	Confident	66.4	Low	54 Å²	54	65 Å²	65	38%	0.378	37%	0.365	S	S	.	.	H	α-helix	trans	-65.5	-39.9	176.5	-177.3	0	0	0	0	112.8	S72 D73 L74 K80	S72-S76 VanDerWaalsContact O-CB 3.25Å; S72-S76 WeakPolarHBondContact O-CB 3.38Å; S72-S76 PolarHBondContact O-N 2.96Å; D73-S76 PolarHBondContact O-N 2.88Å; L74-S76 VanDerWaalsContact C-N 3.33Å; L74-S76 PolarHBondContact O-N 2.93Å; S76-K80 WeakPolarHBondContact O-CG 3.41Å; S76-K80 PolarHBondContact O-N 3.18Å
77	I	80.5	Confident	65.9	Low	28 Å²	28	70.6 Å²	70.6	14%	0.144	39%	0.387	C	S	.	.	H	α-helix	trans	-66.1	-49.5	176.3	-72.7	167.9	0	0	0	110.7	I64 D73 L74 H79 K80 I81	I64-I77 HydrophobicContact CD1-CD1 4.46Å; D73-I77 VanDerWaalsContact O-CG1 3.3Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.39Å; L74-I77 PolarHBondContact O-N 3Å; I77-H79 VanDerWaalsContact C-N 3.31Å; I77-H79 PolarHBondContact O-N 2.93Å; I77-K80 PolarHBondContact O-N 3.42Å; I77-K80 VanDerWaalsContact O-N 3.12Å; I77-I81 HydrophobicContact CG2-CD1 3.76Å; I77-I81 WeakPolarHBondContact O-CG1 3.41Å; I77-I81 PolarHBondContact O-N 3.09Å
78	L	77.6	Confident	65.4	Low	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-63.5	-39.1	177.4	-70.4	164.3	0	0	0	110.9	L74 K80 I81 Y82 E100 R103 L104 L107 F409	L74-L78 WeakPolarHBondContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CG 3.43Å; L74-L78 PolarHBondContact O-N 3.35Å; L78-K80 VanDerWaalsContact C-N 3.34Å; L78-K80 PolarHBondContact O-N 2.94Å; L78-I81 PolarHBondContact O-N 3.41Å; L78-Y82 HydrophobicContact CB-CD2 4.3Å; L78-Y82 HydrophobicContact CD2-CD2 4.37Å; L78-Y82 HydrophobicContact CD2-CE2 3.81Å; L78-Y82 WeakPolarHBondContact O-CB 3.19Å; L78-Y82 VanDerWaalsContact O-CD2 3.29Å; L78-Y82 WeakPolarHBondContact O-CD2 3.44Å; L78-Y82 PolarHBondContact O-N 3.31Å; L78-E100 WeakPolarHBondContact CD2-OE2 3.39Å; L78-R103 HydrophobicContact CD2-CB 4.05Å; L78-R103 HydrophobicContact CG-CB 4.48Å; L78-L104 HydrophobicContact CD1-CD2 4.05Å; L78-L104 HydrophobicContact CD2-CD2 4.04Å; L78-L104 HydrophobicContact CD2-CG 4.22Å; L78-L107 HydrophobicContact CD1-CB 4.14Å; L78-L107 HydrophobicContact CD1-CD2 3.44Å; L78-L107 VanDerWaalsContact CD1-CD2 3.44Å; L78-L107 HydrophobicContact CD1-CG 4.4Å; L78-F409 HydrophobicContact CB-CB 4.07Å; L78-F409 HydrophobicContact CB-CD1 4.12Å; L78-F409 HydrophobicContact CB-CG 4.08Å; L78-F409 HydrophobicContact CD1-CD1 4.38Å
79	H	76.1	Confident	64.6	Low	83 Å²	83	66 Å²	66	38%	0.384	37%	0.367	S	S	.	.	H	α-helix	trans	-58.2	-45.9	172.1	-177.5	75.2	0	0	0	110.6	A75 I77 I81 S83 F409	A75-H79 WeakPolarHBondContact O-CB 3.44Å; A75-H79 PolarHBondContact O-N 2.9Å; I77-H79 VanDerWaalsContact C-N 3.31Å; I77-H79 PolarHBondContact O-N 2.93Å; H79-I81 VanDerWaalsContact C-N 3.3Å; H79-I81 PolarHBondContact O-N 3.38Å; H79-S83 VanDerWaalsContact O-CA 3.28Å; H79-S83 WeakPolarHBondContact O-CA 3.44Å; H79-S83 WeakPolarHBondContact O-CB 3.32Å; H79-S83 PolarHBondContact O-N 2.89Å; H79-F409 HydrophobicContact CB-CB 4.3Å; H79-F409 PolarHBondContact ND1-O 2.78Å
80	K	75.4	Confident	63.3	Low	127 Å²	127	66.4 Å²	66.4	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-64.1	-34.9	177.1	-72.3	170.3	-175.3	174.6	0	113	S76 I77 L78 I85	S76-K80 WeakPolarHBondContact O-CG 3.41Å; S76-K80 PolarHBondContact O-N 3.18Å; I77-K80 PolarHBondContact O-N 3.42Å; I77-K80 VanDerWaalsContact O-N 3.12Å; L78-K80 VanDerWaalsContact C-N 3.34Å; L78-K80 PolarHBondContact O-N 2.94Å; K80-I85 HydrophobicContact CB-CD1 4.47Å; K80-I85 WeakPolarHBondContact O-CD1 3.45Å; K80-I85 WeakPolarHBondContact O-CG1 3.33Å
81	I	70.2	Confident	61.4	Low	43 Å²	43	66.3 Å²	66.3	22%	0.221	37%	0.365	C	S	.	.	H	α-helix	trans	-74.8	-45.2	-177.8	-73	163.7	0	0	0	111.8	I77 L78 H79 L95 E100	I77-I81 HydrophobicContact CG2-CD1 3.76Å; I77-I81 WeakPolarHBondContact O-CG1 3.41Å; I77-I81 PolarHBondContact O-N 3.09Å; L78-I81 PolarHBondContact O-N 3.41Å; H79-I81 VanDerWaalsContact C-N 3.3Å; H79-I81 PolarHBondContact O-N 3.38Å; I81-L95 HydrophobicContact CG2-CD2 3.39Å; I81-E100 VanDerWaalsContact CD1-OE1 3.29Å; I81-E100 WeakPolarHBondContact CD1-OE1 3.11Å; I81-E100 VanDerWaalsContact CD1-OE2 3.27Å; I81-E100 WeakPolarHBondContact CD1-OE2 3.41Å; I81-E100 HydrophobicContact CG2-CG 4.42Å
82	Y	66.4	Low	59.4	Low	2 Å²	2	70.2 Å²	70.2	1%	0.008	38%	0.381	C	S	.	.	H	α-helix	trans	-82.8	-43.3	179.5	-70.7	-68.5	0	0	0	111.4	L78 L95 L104 F198 T207 F409 Y412	L78-Y82 HydrophobicContact CB-CD2 4.3Å; L78-Y82 HydrophobicContact CD2-CD2 4.37Å; L78-Y82 HydrophobicContact CD2-CE2 3.81Å; L78-Y82 WeakPolarHBondContact O-CB 3.19Å; L78-Y82 VanDerWaalsContact O-CD2 3.29Å; L78-Y82 WeakPolarHBondContact O-CD2 3.44Å; L78-Y82 PolarHBondContact O-N 3.31Å; Y82-L95 HydrophobicContact CD1-CD1 4.34Å; Y82-L95 HydrophobicContact CE1-CD1 3.94Å; Y82-L104 HydrophobicContact CE2-CD2 4.46Å; Y82-F198 HydrophobicContact CD1-CE1 4.41Å; Y82-T207 HydrophobicContact CD1-CG2 4.45Å; Y82-T207 HydrophobicContact CE1-CG2 3.74Å; Y82-F409 HydrophobicContact CD2-CD2 4.23Å; Y82-F409 AromaticContact CD2-CE2 3.71Å; Y82-F409 HydrophobicContact CD2-CE2 3.71Å; Y82-F409 AromaticContact CD2-CZ 3.92Å; Y82-F409 HydrophobicContact CD2-CZ 3.92Å; Y82-F409 HydrophobicContact CE2-CE2 4.45Å; Y82-F409 HydrophobicContact CE2-CZ 4.2Å; Y82-F409 HydrophobicContact CG-CE2 4.02Å; Y82-F409 HydrophobicContact CG-CZ 4.5Å; Y82-Y412 VanDerWaalsContact C-CD2 3.47Å; Y82-Y412 HydrophobicContact CD1-CD1 4.14Å; Y82-Y412 HydrophobicContact CD1-CE1 4.01Å; Y82-Y412 WeakPolarHBondContact O-CD2 3.47Å; Y82-Y412 WeakPolarHBondContact O-CE2 3.43Å
83	S	61.2	Low	57.5	Low	39 Å²	39	72.6 Å²	72.6	27%	0.273	38%	0.377	S	S	.	.	S	Bend	trans	-51.1	137.3	178	-172.6	0	0	0	0	110.3	H79 I85	H79-S83 VanDerWaalsContact O-CA 3.28Å; H79-S83 WeakPolarHBondContact O-CA 3.44Å; H79-S83 WeakPolarHBondContact O-CB 3.32Å; H79-S83 PolarHBondContact O-N 2.89Å; S83-I85 VanDerWaalsContact C-N 3.25Å; S83-I85 PolarHBondContact O-N 3.08Å
84	P	47.7	Very low	55.2	Low	79 Å²	79	71.6 Å²	71.6	51%	0.513	38%	0.375	S	S	.	.			trans	-66.4	82.3	-171.8	25.5	-34.6	0	0	0	110.9	S86 P415	P84-S86 VanDerWaalsContact C-N 3.3Å; P84-S86 PolarHBondContact O-N 3.47Å; P84-P415 HydrophobicContact CB-CG 4.4Å
85	I	40.9	Very low	53.4	Low	127 Å²	127	72.4 Å²	72.4	65%	0.651	38%	0.379	S	S	*	.			trans	-65.9	97.6	170.6	-65.7	-175.6	0	0	0	107.2	K80 S83	K80-I85 HydrophobicContact CB-CD1 4.47Å; K80-I85 WeakPolarHBondContact O-CD1 3.45Å; K80-I85 WeakPolarHBondContact O-CG1 3.33Å; S83-I85 VanDerWaalsContact C-N 3.25Å; S83-I85 PolarHBondContact O-N 3.08Å
86	S	35.7	Very low	51.7	Low	60 Å²	60	81.2 Å²	81.2	42%	0.42	41%	0.41	S	S	.	.			trans	78.1	122.3	170.7	83.6	0	0	0	0	117.4	P84 T88	P84-S86 VanDerWaalsContact C-N 3.3Å; P84-S86 PolarHBondContact O-N 3.47Å; S86-T88 PolarHBondContact O-N 2.89Å
87	K	38	Very low	50.2	Low	191 Å²	191	80 Å²	80	83%	0.83	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	2.9	177.2	-69.4	178.7	174.3	178.2	0	115.6	K416	K87-K416 PolarHBondContact O-NZ 3.42Å
88	T	36.4	Very low	49	Very low	125 Å²	125	83 Å²	83	77%	0.767	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-7.5	-164.9	44.6	0	0	0	0	116	S86	S86-T88 PolarHBondContact O-N 2.89Å
89	S	34.5	Very low	47.8	Very low	52 Å²	52	87.3 Å²	87.3	36%	0.364	44%	0.444	S	S	.	.			trans	-141.3	124.3	169.8	58	0	0	0	0	109.4	Q91	S89-Q91 PolarHBondContact O-N 2.73Å; S89-Q91 VanDerWaalsContact O-N 3.13Å
90	V	37	Very low	47.4	Very low	53 Å²	53	84 Å²	84	32%	0.321	43%	0.428	S	S	.	.	S	Bend	trans	-51.4	123.2	151.9	-175.2	0	0	0	0	105.4	K92 W420	V90-K92 PolarHBondContact O-N 3.18Å; V90-K92 VanDerWaalsContact O-N 3.08Å; V90-W420 HydrophobicContact CG1-CB 3.98Å; V90-W420 HydrophobicContact CG1-CG 3.6Å; V90-W420 HydrophobicContact CG2-CB 3.93Å; V90-W420 HydrophobicContact CG2-CG 4.45Å
91	Q	37.3	Very low	47.5	Very low	53 Å²	53	80.7 Å²	80.7	25%	0.248	42%	0.415	C	S	.	.			trans	-19.8	106.7	-171.2	-87.6	164	-27	0	0	113.3	S89 Y93	S89-Q91 PolarHBondContact O-N 2.73Å; S89-Q91 VanDerWaalsContact O-N 3.13Å; Q91-Y93 PolarHBondContact O-N 3.08Å
92	K	33.5	Very low	48.1	Very low	172 Å²	172	82.3 Å²	82.3	75%	0.748	42%	0.424	S	S	*	.	S	Bend	trans	-69.3	-2.8	-179.4	-147.4	179.7	-176	-175.8	0	113	V90	V90-K92 PolarHBondContact O-N 3.18Å; V90-K92 VanDerWaalsContact O-N 3.08Å
93	Y	37.3	Very low	48.9	Very low	139 Å²	139	83.9 Å²	83.9	55%	0.545	43%	0.43	S	S	.	.	S	Bend	trans	-128.8	124.7	175.3	-59.3	-74.6	0	0	0	108.2	I57 Q91 L95	I57-Y93 HydrophobicContact CD1-CE2 4.19Å; Q91-Y93 PolarHBondContact O-N 3.08Å; Y93-L95 PolarHBondContact O-N 3.07Å; Y93-L95 VanDerWaalsContact O-N 3.14Å
94	P	34.9	Very low	50.2	Low	57 Å²	57	82 Å²	82	37%	0.37	42%	0.417	S	S	.	.			trans	-57.9	122.9	168.3	24.9	-31.9	0	0	0	107.8	R96 L204	P94-R96 PolarHBondContact O-N 2.97Å; P94-L204 WeakPolarHBondContact CA-O 3.27Å; P94-L204 HydrophobicContact CB-CB 3.76Å; P94-L204 WeakPolarHBondContact CB-O 3.32Å; P94-L204 HydrophobicContact CG-CB 4.33Å
95	L	41.7	Very low	52.2	Low	23 Å²	23	80.8 Å²	80.8	12%	0.12	40%	0.404	C	S	.	.			trans	-54.8	106.6	169.2	-73.5	169.5	0	0	0	106.1	I81 Y82 Y93 F97	I81-L95 HydrophobicContact CG2-CD2 3.39Å; Y82-L95 HydrophobicContact CD1-CD1 4.34Å; Y82-L95 HydrophobicContact CE1-CD1 3.94Å; Y93-L95 PolarHBondContact O-N 3.07Å; Y93-L95 VanDerWaalsContact O-N 3.14Å; L95-F97 PolarHBondContact O-N 3.44Å
96	R	43.4	Very low	54.6	Low	198 Å²	198	78.1 Å²	78.1	75%	0.747	39%	0.388	S	S	*	.			trans	-71.6	91.1	173.2	-77.9	-169.7	179.4	-177.6	1.3	106.6	P94 S98 L99	P94-R96 PolarHBondContact O-N 2.97Å; R96-S98 PolarHBondContact O-N 3.1Å; R96-L99 PolarHBondContact O-N 3.21Å
97	F	49	Very low	57.1	Low	28 Å²	28	75.2 Å²	75.2	12%	0.123	37%	0.368	C	S	.	.	H	α-helix	trans	-49.8	-33.1	-175.6	-170.7	-98.4	0	0	0	111.9	L95 L99 E100 E101 L104 I208 A398	L95-F97 PolarHBondContact O-N 3.44Å; F97-L99 PolarHBondContact O-N 3.37Å; F97-E100 CarbonylContact O-C 3.58Å; F97-E100 PolarHBondContact O-N 3.28Å; F97-E100 VanDerWaalsContact O-N 3.14Å; F97-E101 HydrophobicContact CD1-CB 4Å; F97-E101 HydrophobicContact CD1-CG 4.44Å; F97-E101 HydrophobicContact CE1-CB 3.66Å; F97-E101 VanDerWaalsContact CE1-CD 3.43Å; F97-E101 HydrophobicContact CE1-CG 3.73Å; F97-E101 HydrophobicContact CZ-CB 4.08Å; F97-E101 HydrophobicContact CZ-CG 4.22Å; F97-E101 WeakPolarHBondContact O-CA 3.44Å; F97-E101 WeakPolarHBondContact O-CB 3.39Å; F97-E101 PolarHBondContact O-N 3.2Å; F97-L104 HydrophobicContact CE2-CD1 4.13Å; F97-L104 HydrophobicContact CZ-CD1 4.41Å; F97-I208 HydrophobicContact CE2-CG1 4.3Å; F97-A398 HydrophobicContact CD1-CB 4.48Å; F97-A398 HydrophobicContact CE1-CB 3.5Å; F97-A398 VanDerWaalsContact CE1-CB 3.5Å; F97-A398 HydrophobicContact CE2-CB 3.66Å; F97-A398 HydrophobicContact CZ-CB 3.04Å
98	S	54.1	Low	59.6	Low	92 Å²	92	66.6 Å²	66.6	64%	0.643	33%	0.33	S	S	*	.	H	α-helix	trans	-60.2	-34.3	178.3	60.2	0	0	0	0	115.7	R96	R96-S98 PolarHBondContact O-N 3.1Å
99	L	53.4	Low	62.3	Low	90 Å²	90	65.1 Å²	65.1	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-77.5	-36.4	175.8	-173.3	69.6	0	0	0	111.2	R96 F97	R96-L99 PolarHBondContact O-N 3.21Å; F97-L99 PolarHBondContact O-N 3.37Å
100	E	67.4	Low	64.9	Low	13 Å²	13	64.6 Å²	64.6	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-78.4	-27.8	-179.7	-62.6	-51.5	136.3	0	0	112.8	L78 I81 F97 R103 L104	L78-E100 WeakPolarHBondContact CD2-OE2 3.39Å; I81-E100 VanDerWaalsContact CD1-OE1 3.29Å; I81-E100 WeakPolarHBondContact CD1-OE1 3.11Å; I81-E100 VanDerWaalsContact CD1-OE2 3.27Å; I81-E100 WeakPolarHBondContact CD1-OE2 3.41Å; I81-E100 HydrophobicContact CG2-CG 4.42Å; F97-E100 CarbonylContact O-C 3.58Å; F97-E100 PolarHBondContact O-N 3.28Å; F97-E100 VanDerWaalsContact O-N 3.14Å; E100-R103 PolarHBondContact O-N 3.27Å; E100-R103 IonicContact OE1-CZ 3.96Å; E100-R103 IonicContact OE1-NH1 3.06Å; E100-R103 PolarHBondContact OE1-NH1 3.05Å; E100-R103 WeakPolarHBondContact OE2-CD 3.34Å; E100-R103 IonicContact OE2-NH1 2.77Å; E100-L104 WeakPolarHBondContact O-CB 3.21Å; E100-L104 VanDerWaalsContact O-CG 3.28Å; E100-L104 WeakPolarHBondContact O-CG 3.41Å; E100-L104 PolarHBondContact O-N 3.28Å
101	E	76.6	Confident	67.3	Low	59 Å²	59	63.1 Å²	63.1	28%	0.276	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-47.8	175.4	-175.8	166.9	-154.2	0	0	109.8	F97 R103 L104 E105 L401	F97-E101 HydrophobicContact CD1-CB 4Å; F97-E101 HydrophobicContact CD1-CG 4.44Å; F97-E101 HydrophobicContact CE1-CB 3.66Å; F97-E101 VanDerWaalsContact CE1-CD 3.43Å; F97-E101 HydrophobicContact CE1-CG 3.73Å; F97-E101 HydrophobicContact CZ-CB 4.08Å; F97-E101 HydrophobicContact CZ-CG 4.22Å; F97-E101 WeakPolarHBondContact O-CA 3.44Å; F97-E101 WeakPolarHBondContact O-CB 3.39Å; F97-E101 PolarHBondContact O-N 3.2Å; E101-R103 VanDerWaalsContact C-N 3.29Å; E101-R103 PolarHBondContact O-N 2.9Å; E101-L104 CarbonylContact O-C 3.47Å; E101-L104 PolarHBondContact O-N 3.22Å; E101-L104 VanDerWaalsContact O-N 3.12Å; E101-E105 HydrophobicContact CG-CG 4.48Å; E101-E105 WeakPolarHBondContact O-CB 3.08Å; E101-E105 VanDerWaalsContact O-CG 3.28Å; E101-E105 WeakPolarHBondContact O-CG 3.1Å; E101-E105 PolarHBondContact O-N 3.24Å; E101-L401 HydrophobicContact CG-CD1 4.27Å
102	N	83.4	Confident	68.8	Low	77 Å²	77	68.5 Å²	68.5	41%	0.412	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-38.3	176.1	-169.1	-48.5	0	0	0	112.2	K106	N102-K106 WeakPolarHBondContact O-CB 3.49Å; N102-K106 WeakPolarHBondContact O-CG 3.06Å; N102-K106 PolarHBondContact O-N 3.29Å; N102-K106 WeakPolarHBondContact OD1-CE 3.49Å; N102-K106 PolarHBondContact OD1-NZ 2.95Å
103	R	84.4	Confident	70.3	Confident	34 Å²	34	66.6 Å²	66.6	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-41.5	175.3	-73.2	176.2	167.4	161.9	-4	111.9	L74 L78 E100 E101 K106 L107	L74-R103 HydrophobicContact CD2-CB 4.49Å; L74-R103 HydrophobicContact CD2-CG 4.41Å; L78-R103 HydrophobicContact CD2-CB 4.05Å; L78-R103 HydrophobicContact CG-CB 4.48Å; E100-R103 PolarHBondContact O-N 3.27Å; E100-R103 IonicContact OE1-CZ 3.96Å; E100-R103 IonicContact OE1-NH1 3.06Å; E100-R103 PolarHBondContact OE1-NH1 3.05Å; E100-R103 WeakPolarHBondContact OE2-CD 3.34Å; E100-R103 IonicContact OE2-NH1 2.77Å; E101-R103 VanDerWaalsContact C-N 3.29Å; E101-R103 PolarHBondContact O-N 2.9Å; R103-K106 PolarHBondContact O-N 3.37Å; R103-L107 WeakPolarHBondContact O-CB 3.46Å; R103-L107 PolarHBondContact O-N 2.99Å
104	L	87.2	Confident	71.7	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-39.9	175.8	-72.5	171.6	0	0	0	111.6	L78 Y82 F97 E100 E101 L107 Y108 L401 L402 F409	L78-L104 HydrophobicContact CD1-CD2 4.05Å; L78-L104 HydrophobicContact CD2-CD2 4.04Å; L78-L104 HydrophobicContact CD2-CG 4.22Å; Y82-L104 HydrophobicContact CE2-CD2 4.46Å; F97-L104 HydrophobicContact CE2-CD1 4.13Å; F97-L104 HydrophobicContact CZ-CD1 4.41Å; E100-L104 WeakPolarHBondContact O-CB 3.21Å; E100-L104 VanDerWaalsContact O-CG 3.28Å; E100-L104 WeakPolarHBondContact O-CG 3.41Å; E100-L104 PolarHBondContact O-N 3.28Å; E101-L104 CarbonylContact O-C 3.47Å; E101-L104 PolarHBondContact O-N 3.22Å; E101-L104 VanDerWaalsContact O-N 3.12Å; L104-L107 PolarHBondContact O-N 3.26Å; L104-Y108 WeakPolarHBondContact O-CB 3.33Å; L104-Y108 PolarHBondContact O-N 3.26Å; L104-L401 HydrophobicContact CB-CB 4.47Å; L104-L402 HydrophobicContact CD1-CD2 3.81Å; L104-L402 HydrophobicContact CD1-CG 4.25Å; L104-L402 HydrophobicContact CD2-CD2 4Å; L104-F409 HydrophobicContact CD2-CE1 3.94Å
105	E	90.6	Very high	73.9	Confident	53 Å²	53	66.5 Å²	66.5	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-48.1	174.2	-73.7	176.7	162.2	0	0	111.1	E101 L107 Y108 D109 H138 L401	E101-E105 HydrophobicContact CG-CG 4.48Å; E101-E105 WeakPolarHBondContact O-CB 3.08Å; E101-E105 VanDerWaalsContact O-CG 3.28Å; E101-E105 WeakPolarHBondContact O-CG 3.1Å; E101-E105 PolarHBondContact O-N 3.24Å; E105-L107 PolarHBondContact O-N 3.44Å; E105-Y108 WeakPolarHBondContact O-CB 3.3Å; E105-Y108 PolarHBondContact O-N 2.94Å; E105-D109 VanDerWaalsContact O-CG 3.28Å; E105-D109 PolarHBondContact O-N 3.06Å; E105-H138 HydrophobicContact CG-CB 4.17Å; E105-H138 IonicContact OE1-CG 3.91Å; E105-L401 HydrophobicContact CG-CD1 3.9Å; E105-L401 HydrophobicContact CG-CD2 4.14Å
106	K	90.1	Very high	76.3	Confident	71 Å²	71	69.7 Å²	69.7	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-43.3	175.8	-75.8	175.8	177.2	173.5	0	112.6	I66 L74 N102 R103 D109 S110	I66-K106 VanDerWaalsContact CG2-NZ 3.3Å; I66-K106 PolarHBondContact O-NZ 3.35Å; L74-K106 HydrophobicContact CD1-CB 3.9Å; N102-K106 WeakPolarHBondContact O-CB 3.49Å; N102-K106 WeakPolarHBondContact O-CG 3.06Å; N102-K106 PolarHBondContact O-N 3.29Å; N102-K106 WeakPolarHBondContact OD1-CE 3.49Å; N102-K106 PolarHBondContact OD1-NZ 2.95Å; R103-K106 PolarHBondContact O-N 3.37Å; K106-D109 PolarHBondContact O-N 3.24Å; K106-S110 WeakPolarHBondContact O-CB 3.49Å; K106-S110 PolarHBondContact O-N 2.97Å; K106-S110 PolarHBondContact O-OG 2.99Å
107	L	89	Confident	78.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-45.4	174.8	177.4	61.5	0	0	0	110.4	E71 L74 L78 R103 L104 E105 D109 S110 L111 T405 A408 F409	E71-L107 HydrophobicContact CG-CD1 3.93Å; L74-L107 HydrophobicContact CB-CD1 4.48Å; L78-L107 HydrophobicContact CD1-CB 4.14Å; L78-L107 HydrophobicContact CD1-CD2 3.44Å; L78-L107 VanDerWaalsContact CD1-CD2 3.44Å; L78-L107 HydrophobicContact CD1-CG 4.4Å; R103-L107 WeakPolarHBondContact O-CB 3.46Å; R103-L107 PolarHBondContact O-N 2.99Å; L104-L107 PolarHBondContact O-N 3.26Å; E105-L107 PolarHBondContact O-N 3.44Å; L107-D109 VanDerWaalsContact C-N 3.26Å; L107-D109 PolarHBondContact O-N 3.48Å; L107-S110 PolarHBondContact O-N 3.49Å; L107-S110 VanDerWaalsContact O-N 3.16Å; L107-S110 PolarHBondContact O-OG 3.29Å; L107-L111 HydrophobicContact CD1-CG 4.44Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 3.47Å; L107-T405 HydrophobicContact CB-CG2 4.41Å; L107-T405 HydrophobicContact CD2-CG2 4.18Å; L107-T405 HydrophobicContact CG-CG2 4.1Å; L107-A408 HydrophobicContact CD1-CB 4.36Å; L107-A408 HydrophobicContact CD2-CB 4.26Å; L107-F409 HydrophobicContact CD2-CD1 4Å
108	Y	91.3	Very high	81.1	Confident	10 Å²	10	64.1 Å²	64.1	4%	0.039	34%	0.342	C	S	.	.	H	α-helix	trans	-57.6	-39.2	176.1	174.8	-105.6	0	0	0	112.4	L104 E105 K115 H138 A139 L401 H404	L104-Y108 WeakPolarHBondContact O-CB 3.33Å; L104-Y108 PolarHBondContact O-N 3.26Å; E105-Y108 WeakPolarHBondContact O-CB 3.3Å; E105-Y108 PolarHBondContact O-N 2.94Å; Y108-K115 HydrophobicContact CE1-CD 4.14Å; Y108-K115 HydrophobicContact CE2-CD 3.76Å; Y108-K115 VanDerWaalsContact CE2-CE 3.5Å; Y108-K115 HydrophobicContact CE2-CG 4.17Å; Y108-K115 VanDerWaalsContact CZ-CE 3.47Å; Y108-K115 VanDerWaalsContact CZ-NZ 3.34Å; Y108-K115 WeakPolarHBondContact O-CE 3.3Å; Y108-K115 PolarHBondContact O-NZ 3.35Å; Y108-K115 WeakPolarHBondContact OH-CD 3.3Å; Y108-H138 AromaticContact CD1-CD2 3.72Å; Y108-A139 HydrophobicContact CD1-CB 4.24Å; Y108-A139 HydrophobicContact CD2-CB 4.1Å; Y108-A139 HydrophobicContact CE1-CB 3.8Å; Y108-A139 HydrophobicContact CE2-CB 3.67Å; Y108-A139 HydrophobicContact CG-CB 4.34Å; Y108-A139 VanDerWaalsContact CZ-CB 3.47Å; Y108-L401 HydrophobicContact CD1-CD2 4.29Å; Y108-L401 HydrophobicContact CG-CD2 3.99Å; Y108-H404 HydrophobicContact CD2-CB 3.62Å; Y108-H404 HydrophobicContact CE2-CB 3.64Å; Y108-H404 AromaticContact CE2-CG 3.6Å; Y108-H404 AromaticContact CE2-ND1 3.95Å
109	D	91.4	Very high	83.2	Confident	93 Å²	93	61.3 Å²	61.3	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-74.6	-31.9	177.6	-68.4	-20	0	0	0	112.7	E105 K106 L107 K115 H138	E105-D109 VanDerWaalsContact O-CG 3.28Å; E105-D109 PolarHBondContact O-N 3.06Å; K106-D109 PolarHBondContact O-N 3.24Å; L107-D109 VanDerWaalsContact C-N 3.26Å; L107-D109 PolarHBondContact O-N 3.48Å; D109-K115 IonicContact OD1-NZ 3.42Å; D109-H138 VanDerWaalsContact CG-NE2 3.33Å; D109-H138 IonicContact OD1-CD2 3.09Å; D109-H138 IonicContact OD1-CE1 2.75Å; D109-H138 IonicContact OD1-NE2 2.79Å; D109-H138 PolarHBondContact OD1-NE2 2.72Å; D109-H138 IonicContact OD2-CE1 3.93Å; D109-H138 PolarHBondContact OD2-CE1 3.37Å; D109-H138 IonicContact OD2-NE2 3.94Å; D109-H138 PolarHBondContact OD2-NE2 3.03Å
110	S	89.7	Confident	85.3	Confident	41 Å²	41	57 Å²	57	29%	0.287	30%	0.299	S	S	.	.	H	α-helix	trans	-74.9	-27.2	177.2	71.7	0	0	0	0	113.5	K106 L107 N112	K106-S110 WeakPolarHBondContact O-CB 3.49Å; K106-S110 PolarHBondContact O-N 2.97Å; K106-S110 PolarHBondContact O-OG 2.99Å; L107-S110 PolarHBondContact O-N 3.49Å; L107-S110 VanDerWaalsContact O-N 3.16Å; L107-S110 PolarHBondContact O-OG 3.29Å; S110-N112 PolarHBondContact O-N 3.44Å
111	L	87.5	Confident	86.7	Confident	22 Å²	22	56.4 Å²	56.4	12%	0.115	30%	0.296	C	S	.	.			trans	-62.6	102.8	177.5	-71.9	171.2	0	0	0	110.3	L107 M113 H404 T405 A408	L107-L111 HydrophobicContact CD1-CG 4.44Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 3.47Å; L111-M113 PolarHBondContact O-N 2.94Å; L111-H404 WeakPolarHBondContact CD1-O 2.69Å; L111-T405 HydrophobicContact CD1-CG2 4.05Å; L111-A408 HydrophobicContact CD2-CB 4Å
112	N	68.4	Low	87.6	Confident	167 Å²	167	54.9 Å²	54.9	89%	0.893	29%	0.29	S	S	*	.			trans	-78.3	48	178.8	-163.1	27.3	0	0	0	112.1	S110	S110-N112 PolarHBondContact O-N 3.44Å
113	M	65.6	Low	88.2	Confident	131 Å²	131	52.9 Å²	52.9	65%	0.645	28%	0.277	S	S	*	.	S	Bend	trans	-106	147.9	178.5	-64.7	-173.7	75.5	0	0	110.1	L111 K115	L111-M113 PolarHBondContact O-N 2.94Å; M113-K115 VanDerWaalsContact C-N 3.26Å; M113-K115 PolarHBondContact O-N 3.46Å
114	N	67.5	Low	88.6	Confident	147 Å²	147	51.8 Å²	51.8	79%	0.786	28%	0.276	S	S	*	.			trans	-66.3	96.1	165.4	-157.7	6	0	0	0	106.8	T116	N114-T116 PolarHBondContact O-N 3.41Å
115	K	80.7	Confident	88.8	Confident	47 Å²	47	57.9 Å²	57.9	20%	0.204	30%	0.304	C	S	.	.			trans	-57.3	96.9	-177.7	-69	161.7	169.7	-173.8	0	107.7	Y108 D109 M113 K141	Y108-K115 HydrophobicContact CE1-CD 4.14Å; Y108-K115 HydrophobicContact CE2-CD 3.76Å; Y108-K115 VanDerWaalsContact CE2-CE 3.5Å; Y108-K115 HydrophobicContact CE2-CG 4.17Å; Y108-K115 VanDerWaalsContact CZ-CE 3.47Å; Y108-K115 VanDerWaalsContact CZ-NZ 3.34Å; Y108-K115 WeakPolarHBondContact O-CE 3.3Å; Y108-K115 PolarHBondContact O-NZ 3.35Å; Y108-K115 WeakPolarHBondContact OH-CD 3.3Å; D109-K115 IonicContact OD1-NZ 3.42Å; M113-K115 VanDerWaalsContact C-N 3.26Å; M113-K115 PolarHBondContact O-N 3.46Å; K115-K141 HydrophobicContact CB-CD 3.84Å; K115-K141 WeakPolarHBondContact O-CD 3.34Å; K115-K141 WeakPolarHBondContact O-CE 3.44Å; K115-K141 PolarHBondContact O-NZ 2.84Å
116	T	92.2	Very high	88.8	Confident	91 Å²	91	61.1 Å²	61.1	56%	0.558	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-75.4	157.7	175.5	51.2	0	0	0	0	109.1	N114 K118 H404	N114-T116 PolarHBondContact O-N 3.41Å; T116-K118 PolarHBondContact O-N 2.99Å; T116-H404 PolarHBondContact O-CE1 2.85Å
117	V	96	Very high	88.6	Confident	84 Å²	84	62.6 Å²	62.6	51%	0.509	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.4	121.1	177.5	179.4	0	0	0	0	109	K141 A143	V117-K141 WeakPolarHBondContact CA-O 3.47Å; V117-A143 HydrophobicContact CG1-CB 3.89Å
118	K	96.3	Very high	88.5	Confident	24 Å²	24	63.9 Å²	63.9	10%	0.104	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125.4	173.5	-68	-69.5	-179.7	177.9	0	110.2	T116 K141 C142 A143 D155 A403	T116-K118 PolarHBondContact O-N 2.99Å; K118-K141 PolarHBondContact N-O 3.14Å; K118-C142 CarbonylContact O-C 3.53Å; K118-C142 VanDerWaalsContact O-CA 3.22Å; K118-C142 WeakPolarHBondContact O-CA 3.47Å; K118-A143 PolarHBondContact O-N 2.88Å; K118-D155 WeakPolarHBondContact CA-OD2 3.42Å; K118-D155 HydrophobicContact CB-CB 4.48Å; K118-D155 HydrophobicContact CD-CB 3.88Å; K118-D155 VanDerWaalsContact CD-CG 3.48Å; K118-D155 VanDerWaalsContact CD-OD1 3.3Å; K118-D155 WeakPolarHBondContact CD-OD1 3.22Å; K118-D155 IonicContact NZ-OD1 2.89Å; K118-D155 PolarHBondContact NZ-OD1 2.89Å; K118-D155 VanDerWaalsContact NZ-OD1 3.09Å; K118-A403 HydrophobicContact CB-CB 4.24Å; K118-A403 WeakPolarHBondContact CE-O 3.3Å; K118-A403 HydrophobicContact CG-CB 4.27Å
119	T	97.9	Very high	88.2	Confident	34 Å²	34	70.7 Å²	70.7	21%	0.209	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.5	-177.7	-58	0	0	0	0	110.3	I145 A154 D155 A156	T119-I145 HydrophobicContact CG2-CD1 3.8Å; T119-I145 HydrophobicContact CG2-CG1 3.83Å; T119-I145 HydrophobicContact CG2-CG2 4.23Å; T119-A154 CarbonylContact O-C 3.41Å; T119-D155 PolarHBondContact N-OD2 3.3Å; T119-D155 PolarHBondContact O-N 2.9Å; T119-A156 PolarHBondContact O-N 3.01Å; T119-A156 VanDerWaalsContact O-N 3.13Å
120	F	98	Very high	87.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	146.6	166.1	-71.7	-96.9	0	0	0	110.3	F134 C142 A143 V144 I145 A156 I158 F176 M399 A403	F120-F134 AromaticContact CD2-CZ 3.97Å; F120-F134 HydrophobicContact CD2-CZ 3.97Å; F120-F134 HydrophobicContact CE2-CE1 4.43Å; F120-F134 HydrophobicContact CE2-CZ 4.27Å; F120-C142 HydrophobicContact CD2-CB 4.14Å; F120-C142 HydrophobicContact CE2-CB 3.92Å; F120-A143 PolarHBondContact N-O 3.19Å; F120-V144 HydrophobicContact CB-CG2 4.07Å; F120-V144 CarbonylContact O-C 3.45Å; F120-V144 VanDerWaalsContact O-CA 3.31Å; F120-V144 WeakPolarHBondContact O-CA 3.49Å; F120-I145 WeakPolarHBondContact O-CG1 3.39Å; F120-I145 PolarHBondContact O-N 3.49Å; F120-A156 CarbonylContact C-O 3.57Å; F120-A156 VanDerWaalsContact CA-O 3.25Å; F120-A156 WeakPolarHBondContact CA-O 3.25Å; F120-A156 HydrophobicContact CD1-CB 3.5Å; F120-A156 VanDerWaalsContact CD1-CB 3.5Å; F120-A156 HydrophobicContact CE1-CB 3.52Å; F120-A156 HydrophobicContact CG-CB 4.17Å; F120-A156 HydrophobicContact CZ-CB 4.2Å; F120-I158 HydrophobicContact CB-CD1 3.95Å; F120-I158 HydrophobicContact CB-CG1 4.36Å; F120-I158 HydrophobicContact CD1-CD1 4.11Å; F120-I158 HydrophobicContact CD1-CG1 3.91Å; F120-I158 HydrophobicContact CG-CD1 4.38Å; F120-F176 HydrophobicContact CE1-CD2 4Å; F120-F176 AromaticContact CE1-CE2 3.74Å; F120-F176 HydrophobicContact CE1-CE2 3.74Å; F120-F176 HydrophobicContact CE1-CZ 4.17Å; F120-F176 HydrophobicContact CZ-CE2 4.42Å; F120-M399 HydrophobicContact CD1-CE 3.74Å; F120-M399 HydrophobicContact CE1-CB 3.93Å; F120-M399 HydrophobicContact CE1-CE 3.73Å; F120-M399 HydrophobicContact CG-CE 4.5Å; F120-M399 HydrophobicContact CZ-CB 3.84Å; F120-M399 HydrophobicContact CZ-CE 4.48Å; F120-M399 WeakPolarHBondContact CZ-O 3.42Å; F120-A403 HydrophobicContact CE1-CB 4.49Å; F120-A403 HydrophobicContact CE2-CB 3.94Å; F120-A403 HydrophobicContact CZ-CB 3.55Å
121	L	97.4	Very high	87.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.8	170.5	-178.6	148.6	0	0	0	110.1	Y123 I145 D147 R150 W151 A154 A156 L157 I158	L121-Y123 HydrophobicContact CD2-CD2 3.64Å; L121-Y123 HydrophobicContact CD2-CG 4.21Å; L121-Y123 PolarHBondContact O-N 3.46Å; L121-I145 VanDerWaalsContact CA-O 3.32Å; L121-I145 WeakPolarHBondContact CA-O 3.34Å; L121-I145 HydrophobicContact CB-CD1 4.35Å; L121-I145 HydrophobicContact CB-CG1 3.86Å; L121-I145 HydrophobicContact CD1-CD1 3.76Å; L121-I145 HydrophobicContact CD1-CG1 3.91Å; L121-I145 HydrophobicContact CG-CD1 4.43Å; L121-I145 HydrophobicContact CG-CG1 4.04Å; L121-D147 WeakPolarHBondContact CD1-O 3.3Å; L121-R150 HydrophobicContact CD1-CB 4.17Å; L121-W151 HydrophobicContact CD1-CB 4.28Å; L121-W151 HydrophobicContact CD2-CB 4.36Å; L121-A154 HydrophobicContact CB-CB 3.65Å; L121-A156 PolarHBondContact N-O 3.41Å; L121-L157 HydrophobicContact CB-CD2 3.93Å; L121-L157 HydrophobicContact CD2-CD2 4Å; L121-L157 HydrophobicContact CG-CD2 4.49Å; L121-L157 CarbonylContact O-C 3.54Å; L121-L157 WeakPolarHBondContact O-CA 3.01Å; L121-I158 PolarHBondContact O-N 3.02Å
122	N	96	Very high	87.9	Confident	27 Å²	27	70 Å²	70	14%	0.144	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	111	169.4	-177.1	9.8	0	0	0	109.2	I128 I145 T146 T160	N122-I128 HydrophobicContact CB-CD1 4.4Å; N122-I145 PolarHBondContact N-O 3.33Å; N122-T146 HydrophobicContact CB-CG2 4.47Å; N122-T160 WeakPolarHBondContact OD1-CG2 3.16Å
123	Y	95.4	Very high	89.2	Confident	34 Å²	34	65.8 Å²	65.8	13%	0.133	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	89	-178.7	-160.1	-85	0	0	0	109.7	L121 M148 W151 I158 L159 K163 P165	L121-Y123 HydrophobicContact CD2-CD2 3.64Å; L121-Y123 HydrophobicContact CD2-CG 4.21Å; L121-Y123 PolarHBondContact O-N 3.46Å; Y123-M148 HydrophobicContact CD2-CB 4.07Å; Y123-M148 HydrophobicContact CD2-CG 3.98Å; Y123-M148 HydrophobicContact CD2-SD 4.36Å; Y123-M148 HydrophobicContact CE2-CB 3.85Å; Y123-M148 HydrophobicContact CE2-CG 4.16Å; Y123-M148 HydrophobicContact CE2-SD 4.37Å; Y123-M148 HydrophobicContact CG-CG 4.49Å; Y123-M148 HydrophobicContact CG-SD 4.46Å; Y123-W151 HydrophobicContact CD2-CB 4.14Å; Y123-W151 HydrophobicContact CE2-CB 4.12Å; Y123-W151 HydrophobicContact CE2-CG 4.43Å; Y123-I158 PolarHBondContact N-O 3.26Å; Y123-L159 HydrophobicContact CD1-CD2 4.14Å; Y123-L159 HydrophobicContact CG-CD2 4.28Å; Y123-K163 WeakPolarHBondContact CD1-O 3.01Å; Y123-K163 HydrophobicContact CE1-CB 4.25Å; Y123-P165 HydrophobicContact CE2-CB 3.95Å; Y123-P165 HydrophobicContact CE2-CG 4.29Å; Y123-P165 VanDerWaalsContact OH-CA 3.26Å; Y123-P165 WeakPolarHBondContact OH-CA 3.35Å
124	G	92.4	Very high	90.6	Very high	12 Å²	12	59.9 Å²	59.9	12%	0.124	31%	0.312	C	S	.	.	S	Bend	trans	156.9	174.5	178.8	0	0	0	0	0	112	E161	G124-E161 WeakPolarHBondContact CA-OE1 3.27Å
125	H	91.6	Very high	91.9	Very high	127 Å²	127	56.9 Å²	56.9	59%	0.588	30%	0.303	S	S	*	.	S	Bend	trans	-103.7	-9.2	-175.8	-54.2	74.9	0	0	0	112.2	E161 K163	H125-E161 IonicContact CE1-OE1 3.87Å; H125-E161 IonicContact CG-OE1 2.84Å; H125-E161 PolarHBondContact N-OE1 3.4Å; H125-E161 IonicContact ND1-OE1 2.76Å; H125-E161 PolarHBondContact ND1-OE1 2.67Å; H125-K163 PolarHBondContact ND1-NZ 2.88Å
126	R	90.5	Very high	92.5	Very high	122 Å²	122	63.6 Å²	63.6	46%	0.46	33%	0.332	S	S	.	.	S	Bend	trans	-73.7	133.2	177.4	-64.3	-81.9	-175	-157.3	0.7	108.9	I128 E161 I186	R126-I128 PolarHBondContact O-N 3.37Å; R126-E161 HydrophobicContact CG-CB 4.39Å; R126-I186 HydrophobicContact CG-CD1 4.31Å
127	T	85.8	Confident	92.5	Very high	102 Å²	102	59.9 Å²	59.9	63%	0.626	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-67.3	129.8	173.6	-53.7	0	0	0	0	109.7	F129	T127-F129 HydrophobicContact CG2-CD1 4.33Å; T127-F129 HydrophobicContact CG2-CE1 4.3Å
128	I	87.8	Confident	92.3	Very high	27 Å²	27	60 Å²	60	14%	0.138	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-89.9	118.4	165.8	-54.3	168	0	0	0	106.7	N122 R126 M132 I158 T160 L178	N122-I128 HydrophobicContact CB-CD1 4.4Å; R126-I128 PolarHBondContact O-N 3.37Å; I128-M132 HydrophobicContact CB-CE 4.35Å; I128-M132 HydrophobicContact CD1-CE 3.71Å; I128-M132 HydrophobicContact CG2-CE 3.53Å; I128-I158 HydrophobicContact CD1-CG2 3.8Å; I128-T160 HydrophobicContact CD1-CG2 3.67Å; I128-T160 HydrophobicContact CG1-CG2 3.57Å; I128-L178 HydrophobicContact CD1-CD1 4.37Å; I128-L178 HydrophobicContact CG2-CD1 4.05Å; I128-L178 HydrophobicContact CG2-CD2 4.37Å
129	F	84.3	Confident	92.2	Very high	152 Å²	152	58.9 Å²	58.9	67%	0.667	30%	0.299	S	S	*	.			trans	-81	-24.8	-175.6	-62.3	-81.1	0	0	0	113	T127 Y391	T127-F129 HydrophobicContact CG2-CD1 4.33Å; T127-F129 HydrophobicContact CG2-CE1 4.3Å; F129-Y391 HydrophobicContact CB-CE1 3.63Å
130	T	84.9	Confident	92	Very high	10 Å²	10	59.8 Å²	59.8	6%	0.061	31%	0.307	C	S	.	.	S	Bend	trans	-68.4	127.9	173.7	-52.5	0	0	0	0	109.5	M132 P395	T130-M132 PolarHBondContact O-N 3.49Å; T130-M132 VanDerWaalsContact O-N 3.14Å; T130-P395 HydrophobicContact CG2-CG 4.39Å
131	P	85.4	Confident	91.9	Very high	92 Å²	92	63.8 Å²	63.8	60%	0.597	33%	0.325	S	S	*	.			trans	-58.7	119.1	170	-20.7	32.8	0	0	0	109.4	D133	P131-D133 PolarHBondContact O-N 3.22Å
132	M	92.5	Very high	91.9	Very high	40 Å²	40	64.4 Å²	64.4	20%	0.197	33%	0.329	C	S	.	.			trans	-76.4	50.7	174.1	-68.1	-74.2	174.9	0	0	111.2	I128 T130 V144 I158 L178 Q396 M399	I128-M132 HydrophobicContact CB-CE 4.35Å; I128-M132 HydrophobicContact CD1-CE 3.71Å; I128-M132 HydrophobicContact CG2-CE 3.53Å; T130-M132 PolarHBondContact O-N 3.49Å; T130-M132 VanDerWaalsContact O-N 3.14Å; M132-V144 HydrophobicContact CB-CB 4.32Å; M132-V144 HydrophobicContact CB-CG2 3.5Å; M132-V144 HydrophobicContact CG-CG2 4.02Å; M132-V144 HydrophobicContact SD-CG2 4.44Å; M132-I158 HydrophobicContact CE-CD1 4.04Å; M132-I158 HydrophobicContact SD-CD1 4.25Å; M132-L178 HydrophobicContact CE-CD1 3.66Å; M132-Q396 HydrophobicContact SD-CB 3.86Å; M132-M399 HydrophobicContact CE-CE 4.2Å; M132-M399 HydrophobicContact CE-SD 4.34Å; M132-M399 HydrophobicContact SD-CE 4.1Å; M132-M399 HydrophobicContact SD-SD 4.41Å
133	D	94.1	Very high	92	Very high	78 Å²	78	65 Å²	65	42%	0.417	34%	0.337	S	S	.	.			trans	-95.4	115	177.1	178.7	10.8	0	0	0	109.4	P131 S135 Q396	P131-D133 PolarHBondContact O-N 3.22Å; D133-S135 VanDerWaalsContact CG-OG 3.29Å; D133-S135 WeakPolarHBondContact OD1-CB 3.43Å; D133-S135 PolarHBondContact OD1-N 2.04Å; D133-S135 PolarHBondContact OD1-OG 3.32Å; D133-S135 PolarHBondContact OD2-OG 3.26Å; D133-Q396 WeakPolarHBondContact O-CG 3.33Å; D133-Q396 PolarHBondContact O-NE2 3.24Å
134	F	95.8	Very high	92.1	Very high	7 Å²	7	65.6 Å²	65.6	3%	0.031	35%	0.345	C	S	.	.			trans	-95.4	-4	-179.5	-53.4	-83.6	0	0	0	113.1	F120 K136 C137 S140 C142 V144 Q396 C400	F120-F134 AromaticContact CD2-CZ 3.97Å; F120-F134 HydrophobicContact CD2-CZ 3.97Å; F120-F134 HydrophobicContact CE2-CE1 4.43Å; F120-F134 HydrophobicContact CE2-CZ 4.27Å; F134-K136 PolarHBondContact O-N 2.93Å; F134-K136 VanDerWaalsContact O-N 3.09Å; F134-C137 WeakPolarHBondContact O-CB 3.49Å; F134-C137 PolarHBondContact O-N 3.23Å; F134-S140 VanDerWaalsContact O-CA 3.29Å; F134-S140 WeakPolarHBondContact O-CA 3.31Å; F134-S140 WeakPolarHBondContact O-CB 3.27Å; F134-C142 HydrophobicContact CB-CB 4.37Å; F134-C142 HydrophobicContact CD1-CB 3.81Å; F134-C142 HydrophobicContact CD2-CB 3.73Å; F134-C142 WeakPolarHBondContact CD2-O 3.46Å; F134-C142 HydrophobicContact CE1-CB 3.88Å; F134-C142 HydrophobicContact CE2-CB 3.8Å; F134-C142 HydrophobicContact CG-CB 3.72Å; F134-C142 HydrophobicContact CZ-CB 3.89Å; F134-V144 HydrophobicContact CE2-CG2 3.53Å; F134-V144 HydrophobicContact CZ-CG2 3.78Å; F134-Q396 HydrophobicContact CD1-CB 3.98Å; F134-Q396 HydrophobicContact CD1-CG 4Å; F134-Q396 WeakPolarHBondContact CD1-O 3.44Å; F134-Q396 HydrophobicContact CE1-CB 3.59Å; F134-Q396 HydrophobicContact CE1-CG 4.13Å; F134-Q396 WeakPolarHBondContact CE1-O 3.47Å; F134-Q396 HydrophobicContact CZ-CB 4.26Å; F134-C400 HydrophobicContact CD1-CB 3.72Å; F134-C400 HydrophobicContact CE1-CB 4Å
135	S	95.1	Very high	92.3	Very high	84 Å²	84	66.5 Å²	66.5	59%	0.587	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.8	-170.8	63.1	0	0	0	0	114.2	D133	D133-S135 VanDerWaalsContact CG-OG 3.29Å; D133-S135 WeakPolarHBondContact OD1-CB 3.43Å; D133-S135 PolarHBondContact OD1-N 2.04Å; D133-S135 PolarHBondContact OD1-OG 3.32Å; D133-S135 PolarHBondContact OD2-OG 3.26Å
136	K	92.3	Very high	92.4	Very high	189 Å²	189	65.6 Å²	65.6	82%	0.822	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-0.4	179.7	-60.9	-178.4	-177.4	175.8	0	114	F134	F134-K136 PolarHBondContact O-N 2.93Å; F134-K136 VanDerWaalsContact O-N 3.09Å
137	C	93.4	Very high	92.6	Very high	12 Å²	12	63.1 Å²	63.1	8%	0.081	35%	0.346	C	S	.	.	S	Bend	trans	-83.7	153	-178.9	-58.8	0	0	0	0	111.4	F134 A139 C397	F134-C137 WeakPolarHBondContact O-CB 3.49Å; F134-C137 PolarHBondContact O-N 3.23Å; C137-A139 WeakPolarHBondContact CB-O 3.46Å; C137-A139 PolarHBondContact O-N 3.43Å; C137-C397 VanDerWaalsContact CA-SG 3.55Å; C137-C397 HydrophobicContact CB-CB 3.6Å; C137-C397 WeakPolarHBondContact CB-SG 3.4Å; C137-C397 WeakPolarHBondContact SG-CA 3.47Å; C137-C397 WeakPolarHBondContact SG-CB 3.34Å; C137-C397 CovalentContact SG-SG 2.04Å; C137-C397 PolarHBondContact SG-SG 3.45Å
138	H	91.7	Very high	93.1	Very high	87 Å²	87	60.9 Å²	60.9	40%	0.403	33%	0.329	S	S	.	.	S	Bend	trans	-56.9	-50	174.7	-170.4	84.2	0	0	0	111.4	E105 Y108 D109	E105-H138 HydrophobicContact CG-CB 4.17Å; E105-H138 IonicContact OE1-CG 3.91Å; Y108-H138 AromaticContact CD1-CD2 3.72Å; D109-H138 VanDerWaalsContact CG-NE2 3.33Å; D109-H138 IonicContact OD1-CD2 3.09Å; D109-H138 IonicContact OD1-CE1 2.75Å; D109-H138 IonicContact OD1-NE2 2.79Å; D109-H138 PolarHBondContact OD1-NE2 2.72Å; D109-H138 IonicContact OD2-CE1 3.93Å; D109-H138 PolarHBondContact OD2-CE1 3.37Å; D109-H138 IonicContact OD2-NE2 3.94Å; D109-H138 PolarHBondContact OD2-NE2 3.03Å
139	A	93.2	Very high	93.5	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	-89.7	110.3	160.4	0	0	0	0	0	109.5	Y108 C137 C400 L401	Y108-A139 HydrophobicContact CD1-CB 4.24Å; Y108-A139 HydrophobicContact CD2-CB 4.1Å; Y108-A139 HydrophobicContact CE1-CB 3.8Å; Y108-A139 HydrophobicContact CE2-CB 3.67Å; Y108-A139 HydrophobicContact CG-CB 4.34Å; Y108-A139 VanDerWaalsContact CZ-CB 3.47Å; C137-A139 WeakPolarHBondContact CB-O 3.46Å; C137-A139 PolarHBondContact O-N 3.43Å; A139-C400 HydrophobicContact CB-CB 4.25Å; A139-C400 WeakPolarHBondContact O-CB 3.37Å; A139-C400 PolarHBondContact O-SG 2.97Å; A139-L401 HydrophobicContact CB-CD2 3.73Å; A139-L401 HydrophobicContact CB-CG 3.9Å
140	S	94.7	Very high	94.1	Very high	54 Å²	54	64.2 Å²	64.2	38%	0.378	35%	0.346	S	S	.	.			trans	-111.8	-9.6	-175.5	57.1	0	0	0	0	114.6	F134 C142	F134-S140 VanDerWaalsContact O-CA 3.29Å; F134-S140 WeakPolarHBondContact O-CA 3.31Å; F134-S140 WeakPolarHBondContact O-CB 3.27Å; S140-C142 PolarHBondContact O-N 2.82Å
141	K	96.2	Very high	94.6	Very high	84 Å²	84	64.8 Å²	64.8	37%	0.365	35%	0.347	S	S	.	.			trans	-81.6	62.5	-179.6	-64.5	-167.3	-173	-176.5	0	111.7	K115 V117 K118 H404	K115-K141 HydrophobicContact CB-CD 3.84Å; K115-K141 WeakPolarHBondContact O-CD 3.34Å; K115-K141 WeakPolarHBondContact O-CE 3.44Å; K115-K141 PolarHBondContact O-NZ 2.84Å; V117-K141 WeakPolarHBondContact CA-O 3.47Å; K118-K141 PolarHBondContact N-O 3.14Å; K141-H404 PolarHBondContact O-NE2 2.93Å
142	C	97.3	Very high	95.2	Very high	13 Å²	13	66.8 Å²	66.8	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.1	173.3	-65	0	0	0	0	110	K118 F120 F134 S140 C400	K118-C142 CarbonylContact O-C 3.53Å; K118-C142 VanDerWaalsContact O-CA 3.22Å; K118-C142 WeakPolarHBondContact O-CA 3.47Å; F120-C142 HydrophobicContact CD2-CB 4.14Å; F120-C142 HydrophobicContact CE2-CB 3.92Å; F134-C142 HydrophobicContact CB-CB 4.37Å; F134-C142 HydrophobicContact CD1-CB 3.81Å; F134-C142 HydrophobicContact CD2-CB 3.73Å; F134-C142 WeakPolarHBondContact CD2-O 3.46Å; F134-C142 HydrophobicContact CE1-CB 3.88Å; F134-C142 HydrophobicContact CE2-CB 3.8Å; F134-C142 HydrophobicContact CG-CB 3.72Å; F134-C142 HydrophobicContact CZ-CB 3.89Å; S140-C142 PolarHBondContact O-N 2.82Å; C142-C400 HydrophobicContact CB-CB 3.86Å; C142-C400 WeakPolarHBondContact CB-SG 3.25Å; C142-C400 WeakPolarHBondContact SG-CA 3.39Å; C142-C400 WeakPolarHBondContact SG-CB 3.32Å; C142-C400 CovalentContact SG-SG 2.03Å; C142-C400 PolarHBondContact SG-SG 2.73Å
143	A	97.4	Very high	95.4	Very high	39 Å²	39	69.7 Å²	69.7	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	155.4	176	0	0	0	0	0	109.7	V117 K118 F120	V117-A143 HydrophobicContact CG1-CB 3.89Å; K118-A143 PolarHBondContact O-N 2.88Å; F120-A143 PolarHBondContact N-O 3.19Å
144	V	96.9	Very high	95.5	Very high	47 Å²	47	66.1 Å²	66.1	29%	0.285	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.1	175.2	-172.8	0	0	0	0	110.7	F120 M132 F134 I158	F120-V144 HydrophobicContact CB-CG2 4.07Å; F120-V144 CarbonylContact O-C 3.45Å; F120-V144 VanDerWaalsContact O-CA 3.31Å; F120-V144 WeakPolarHBondContact O-CA 3.49Å; M132-V144 HydrophobicContact CB-CB 4.32Å; M132-V144 HydrophobicContact CB-CG2 3.5Å; M132-V144 HydrophobicContact CG-CG2 4.02Å; M132-V144 HydrophobicContact SD-CG2 4.44Å; F134-V144 HydrophobicContact CE2-CG2 3.53Å; F134-V144 HydrophobicContact CZ-CG2 3.78Å; V144-I158 HydrophobicContact CG1-CD1 4.48Å
145	I	96.3	Very high	95.6	Very high	30 Å²	30	68.2 Å²	68.2	15%	0.154	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	158.4	167.2	61.1	171.5	0	0	0	110.3	T119 F120 L121 N122 R150	T119-I145 HydrophobicContact CG2-CD1 3.8Å; T119-I145 HydrophobicContact CG2-CG1 3.83Å; T119-I145 HydrophobicContact CG2-CG2 4.23Å; F120-I145 WeakPolarHBondContact O-CG1 3.39Å; F120-I145 PolarHBondContact O-N 3.49Å; L121-I145 VanDerWaalsContact CA-O 3.32Å; L121-I145 WeakPolarHBondContact CA-O 3.34Å; L121-I145 HydrophobicContact CB-CD1 4.35Å; L121-I145 HydrophobicContact CB-CG1 3.86Å; L121-I145 HydrophobicContact CD1-CD1 3.76Å; L121-I145 HydrophobicContact CD1-CG1 3.91Å; L121-I145 HydrophobicContact CG-CD1 4.43Å; L121-I145 HydrophobicContact CG-CG1 4.04Å; N122-I145 PolarHBondContact N-O 3.33Å; I145-R150 HydrophobicContact CD1-CB 3.96Å
146	T	94.4	Very high	95.7	Very high	109 Å²	109	64.2 Å²	64.2	67%	0.669	32%	0.32	S	S	*	.			trans	-122.7	-8.9	-174.9	54.6	0	0	0	0	114.1	N122 M148	N122-T146 HydrophobicContact CB-CG2 4.47Å; T146-M148 PolarHBondContact O-N 3.49Å; T146-M148 VanDerWaalsContact O-N 3.08Å
147	D	95.7	Very high	95.9	Very high	70 Å²	70	55.2 Å²	55.2	37%	0.374	28%	0.281	S	S	.	.			trans	-73.9	101.2	175.5	176.9	9	0	0	0	110.3	L121 N149 R150	L121-D147 WeakPolarHBondContact CD1-O 3.3Å; D147-N149 PolarHBondContact O-N 3.37Å; D147-N149 WeakPolarHBondContact OD1-CB 3.41Å; D147-N149 PolarHBondContact OD1-N 2.98Å; D147-N149 PolarHBondContact OD1-ND2 3.15Å; D147-R150 HydrophobicContact CB-CG 4.37Å; D147-R150 WeakPolarHBondContact O-CB 3.33Å; D147-R150 PolarHBondContact O-N 3.1Å; D147-R150 WeakPolarHBondContact OD2-CD 3.42Å
148	M	95.4	Very high	96.1	Very high	55 Å²	55	54.6 Å²	54.6	27%	0.271	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-59.1	-17.1	-178.8	-68.1	-171.9	-70	0	0	114.2	Y123 T146 R150 W151	Y123-M148 HydrophobicContact CD2-CB 4.07Å; Y123-M148 HydrophobicContact CD2-CG 3.98Å; Y123-M148 HydrophobicContact CD2-SD 4.36Å; Y123-M148 HydrophobicContact CE2-CB 3.85Å; Y123-M148 HydrophobicContact CE2-CG 4.16Å; Y123-M148 HydrophobicContact CE2-SD 4.37Å; Y123-M148 HydrophobicContact CG-CG 4.49Å; Y123-M148 HydrophobicContact CG-SD 4.46Å; T146-M148 PolarHBondContact O-N 3.49Å; T146-M148 VanDerWaalsContact O-N 3.08Å; M148-R150 PolarHBondContact O-N 3.21Å; M148-W151 VanDerWaalsContact O-CD1 3.31Å; M148-W151 PolarHBondContact O-N 3.06Å
149	N	95.9	Very high	96.3	Very high	140 Å²	140	50.6 Å²	50.6	75%	0.749	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-71.7	-23	175.7	-60.5	-58.4	0	0	0	112.5	D147 W151	D147-N149 PolarHBondContact O-N 3.37Å; D147-N149 WeakPolarHBondContact OD1-CB 3.41Å; D147-N149 PolarHBondContact OD1-N 2.98Å; D147-N149 PolarHBondContact OD1-ND2 3.15Å; N149-W151 VanDerWaalsContact C-N 3.25Å; N149-W151 PolarHBondContact O-N 2.82Å
150	R	96.6	Very high	96.4	Very high	108 Å²	108	50.8 Å²	50.8	41%	0.408	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-85.5	8.5	179.9	-67.5	171.9	66.3	-168.5	-4.5	112.9	L121 I145 D147 M148 R152 E153	L121-R150 HydrophobicContact CD1-CB 4.17Å; I145-R150 HydrophobicContact CD1-CB 3.96Å; D147-R150 HydrophobicContact CB-CG 4.37Å; D147-R150 WeakPolarHBondContact O-CB 3.33Å; D147-R150 PolarHBondContact O-N 3.1Å; D147-R150 WeakPolarHBondContact OD2-CD 3.42Å; M148-R150 PolarHBondContact O-N 3.21Å; R150-R152 PolarHBondContact O-N 3.08Å; R150-E153 HydrophobicContact CB-CG 4.26Å; R150-E153 IonicContact CZ-OE1 3.17Å; R150-E153 IonicContact NE-OE1 3.23Å; R150-E153 PolarHBondContact NE-OE1 2.88Å; R150-E153 IonicContact NE-OE2 3.89Å; R150-E153 PolarHBondContact NE-OE2 2.73Å; R150-E153 IonicContact NH2-OE1 3.97Å; R150-E153 PolarHBondContact NH2-OE1 3.45Å; R150-E153 VanDerWaalsContact O-CG 3.26Å; R150-E153 WeakPolarHBondContact O-CG 3.25Å; R150-E153 PolarHBondContact O-N 2.79Å
151	W	97.1	Very high	96.2	Very high	23 Å²	23	49.3 Å²	49.3	9%	0.087	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-26.1	-175.1	75.5	-89.7	0	0	0	114.7	L121 Y123 M148 N149 E153 L157 P165 T168 P170 Q173	L121-W151 HydrophobicContact CD1-CB 4.28Å; L121-W151 HydrophobicContact CD2-CB 4.36Å; Y123-W151 HydrophobicContact CD2-CB 4.14Å; Y123-W151 HydrophobicContact CE2-CB 4.12Å; Y123-W151 HydrophobicContact CE2-CG 4.43Å; M148-W151 VanDerWaalsContact O-CD1 3.31Å; M148-W151 PolarHBondContact O-N 3.06Å; N149-W151 VanDerWaalsContact C-N 3.25Å; N149-W151 PolarHBondContact O-N 2.82Å; W151-E153 VanDerWaalsContact C-N 3.35Å; W151-L157 HydrophobicContact CB-CD2 4.11Å; W151-L157 HydrophobicContact CE3-CD1 4.4Å; W151-P165 HydrophobicContact CB-CB 4.49Å; W151-P165 HydrophobicContact CD2-CB 3.32Å; W151-P165 HydrophobicContact CD2-CG 3.62Å; W151-P165 HydrophobicContact CE3-CB 3.71Å; W151-P165 HydrophobicContact CE3-CG 3.46Å; W151-P165 VanDerWaalsContact CE3-CG 3.46Å; W151-P165 HydrophobicContact CG-CB 3.68Å; W151-P165 HydrophobicContact CG-CG 4.12Å; W151-P165 HydrophobicContact CH2-CB 4.04Å; W151-P165 HydrophobicContact CH2-CG 4.18Å; W151-P165 HydrophobicContact CZ2-CB 3.72Å; W151-P165 HydrophobicContact CZ2-CG 4.35Å; W151-P165 HydrophobicContact CZ3-CB 4.03Å; W151-P165 HydrophobicContact CZ3-CG 3.75Å; W151-T168 WeakPolarHBondContact CH2-O 3.37Å; W151-P170 VanDerWaalsContact CZ3-CD 3.49Å; W151-P170 HydrophobicContact CZ3-CG 4.36Å; W151-Q173 PolarHBondContact O-NE2 2.98Å
152	R	97	Very high	95.8	Very high	133 Å²	133	48.9 Å²	48.9	50%	0.502	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.8	178.8	-68.8	-172	177.9	-74.4	-2.6	114.4	R150 T168 P170	R150-R152 PolarHBondContact O-N 3.08Å; R152-T168 PolarHBondContact NH1-O 3.26Å; R152-P170 HydrophobicContact CB-CG 4.42Å
153	E	96.2	Very high	95.5	Very high	101 Å²	101	52.3 Å²	52.3	47%	0.472	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-14.2	-178.2	86.8	-163.5	-155.9	0	0	112.4	R150 W151	R150-E153 HydrophobicContact CB-CG 4.26Å; R150-E153 IonicContact CZ-OE1 3.17Å; R150-E153 IonicContact NE-OE1 3.23Å; R150-E153 PolarHBondContact NE-OE1 2.88Å; R150-E153 IonicContact NE-OE2 3.89Å; R150-E153 PolarHBondContact NE-OE2 2.73Å; R150-E153 IonicContact NH2-OE1 3.97Å; R150-E153 PolarHBondContact NH2-OE1 3.45Å; R150-E153 VanDerWaalsContact O-CG 3.26Å; R150-E153 WeakPolarHBondContact O-CG 3.25Å; R150-E153 PolarHBondContact O-N 2.79Å; W151-E153 VanDerWaalsContact C-N 3.35Å
154	A	97.6	Very high	95.2	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	26%	0.258	C	S	.	.			trans	-74	135.6	-179.5	0	0	0	0	0	111	T119 L121 A156 L157 Q173	T119-A154 CarbonylContact O-C 3.41Å; L121-A154 HydrophobicContact CB-CB 3.65Å; A154-A156 VanDerWaalsContact C-N 3.26Å; A154-L157 HydrophobicContact CB-CD2 4.01Å; A154-Q173 PolarHBondContact O-NE2 3.29Å
155	D	96.8	Very high	95.1	Very high	50 Å²	50	50.3 Å²	50.3	27%	0.267	25%	0.246	S	C	.	.	S	Bend	trans	-66.9	-31.4	170.4	-63	-94.2	0	0	0	111.4	K118 T119 Q173 L174	K118-D155 WeakPolarHBondContact CA-OD2 3.42Å; K118-D155 HydrophobicContact CB-CB 4.48Å; K118-D155 HydrophobicContact CD-CB 3.88Å; K118-D155 VanDerWaalsContact CD-CG 3.48Å; K118-D155 VanDerWaalsContact CD-OD1 3.3Å; K118-D155 WeakPolarHBondContact CD-OD1 3.22Å; K118-D155 IonicContact NZ-OD1 2.89Å; K118-D155 PolarHBondContact NZ-OD1 2.89Å; K118-D155 VanDerWaalsContact NZ-OD1 3.09Å; T119-D155 PolarHBondContact N-OD2 3.3Å; T119-D155 PolarHBondContact O-N 2.9Å; D155-Q173 CarbonylContact O-C 3.56Å; D155-Q173 VanDerWaalsContact O-CA 3.31Å; D155-Q173 WeakPolarHBondContact O-CA 3.46Å; D155-L174 PolarHBondContact O-N 3.35Å
156	A	97.3	Very high	94.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	141.4	-179	0	0	0	0	0	112.8	T119 F120 L121 A154 L174 F176	T119-A156 PolarHBondContact O-N 3.01Å; T119-A156 VanDerWaalsContact O-N 3.13Å; F120-A156 CarbonylContact C-O 3.57Å; F120-A156 VanDerWaalsContact CA-O 3.25Å; F120-A156 WeakPolarHBondContact CA-O 3.25Å; F120-A156 HydrophobicContact CD1-CB 3.5Å; F120-A156 VanDerWaalsContact CD1-CB 3.5Å; F120-A156 HydrophobicContact CE1-CB 3.52Å; F120-A156 HydrophobicContact CG-CB 4.17Å; F120-A156 HydrophobicContact CZ-CB 4.2Å; L121-A156 PolarHBondContact N-O 3.41Å; A154-A156 VanDerWaalsContact C-N 3.26Å; A156-L174 CarbonylContact C-O 3.55Å; A156-L174 WeakPolarHBondContact CA-O 3.42Å; A156-L174 HydrophobicContact CB-CB 4.05Å; A156-F176 HydrophobicContact CB-CD2 4.07Å; A156-F176 HydrophobicContact CB-CE2 3.88Å
157	L	97.4	Very high	94.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.3	170	-54.6	-168.2	0	0	0	110.2	L121 W151 A154 L159 P165 Q173 L174 W175 F176	L121-L157 HydrophobicContact CB-CD2 3.93Å; L121-L157 HydrophobicContact CD2-CD2 4Å; L121-L157 HydrophobicContact CG-CD2 4.49Å; L121-L157 CarbonylContact O-C 3.54Å; L121-L157 WeakPolarHBondContact O-CA 3.01Å; W151-L157 HydrophobicContact CB-CD2 4.11Å; W151-L157 HydrophobicContact CE3-CD1 4.4Å; A154-L157 HydrophobicContact CB-CD2 4.01Å; L157-L159 HydrophobicContact CB-CD2 4Å; L157-L159 HydrophobicContact CD1-CD2 4.4Å; L157-P165 HydrophobicContact CD1-CG 3.76Å; L157-Q173 HydrophobicContact CG-CG 4.44Å; L157-L174 PolarHBondContact N-O 3.4Å; L157-W175 HydrophobicContact CB-CG 4.43Å; L157-W175 HydrophobicContact CD1-CZ2 4.24Å; L157-F176 PolarHBondContact O-N 2.94Å
158	I	97.1	Very high	94.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	101	169.6	-52	162.9	0	0	0	106.7	F120 L121 Y123 I128 M132 V144 T160 F176 L178 M399	F120-I158 HydrophobicContact CB-CD1 3.95Å; F120-I158 HydrophobicContact CB-CG1 4.36Å; F120-I158 HydrophobicContact CD1-CD1 4.11Å; F120-I158 HydrophobicContact CD1-CG1 3.91Å; F120-I158 HydrophobicContact CG-CD1 4.38Å; L121-I158 PolarHBondContact O-N 3.02Å; Y123-I158 PolarHBondContact N-O 3.26Å; I128-I158 HydrophobicContact CD1-CG2 3.8Å; M132-I158 HydrophobicContact CE-CD1 4.04Å; M132-I158 HydrophobicContact SD-CD1 4.25Å; V144-I158 HydrophobicContact CG1-CD1 4.48Å; I158-T160 HydrophobicContact CG2-CG2 4.25Å; I158-F176 CarbonylContact C-O 3.56Å; I158-L178 HydrophobicContact CG2-CB 3.72Å; I158-L178 HydrophobicContact CG2-CD1 3.99Å; I158-M399 HydrophobicContact CD1-CE 3.55Å; I158-M399 HydrophobicContact CG1-CE 3.66Å
159	L	96.1	Very high	94.5	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.3	177.6	-50.2	-174.3	0	0	0	108.7	Y123 L157 V164 W175 F176 L178 L192 I196	Y123-L159 HydrophobicContact CD1-CD2 4.14Å; Y123-L159 HydrophobicContact CG-CD2 4.28Å; L157-L159 HydrophobicContact CB-CD2 4Å; L157-L159 HydrophobicContact CD1-CD2 4.4Å; L159-V164 HydrophobicContact CD1-CG1 4.01Å; L159-W175 HydrophobicContact CD1-CB 4.47Å; L159-W175 HydrophobicContact CD1-CD2 4.2Å; L159-W175 HydrophobicContact CD1-CE3 3.71Å; L159-W175 HydrophobicContact CD1-CZ3 4.3Å; L159-F176 PolarHBondContact N-O 2.61Å; L159-L178 PolarHBondContact O-N 3.26Å; L159-L192 HydrophobicContact CD1-CD2 4.16Å; L159-I196 HydrophobicContact CD1-CD1 3.61Å
160	T	94.4	Very high	94.5	Very high	4 Å²	4	52.1 Å²	52.1	3%	0.025	26%	0.26	C	S	.	.	S	Bend	trans	-99.8	-2.6	-178.6	57.4	0	0	0	0	114	N122 I128 I158 L178	N122-T160 WeakPolarHBondContact OD1-CG2 3.16Å; I128-T160 HydrophobicContact CD1-CG2 3.67Å; I128-T160 HydrophobicContact CG1-CG2 3.57Å; I158-T160 HydrophobicContact CG2-CG2 4.25Å; T160-L178 WeakPolarHBondContact CA-O 3.35Å
161	E	92.2	Very high	94.2	Very high	23 Å²	23	52.8 Å²	52.8	11%	0.107	28%	0.279	C	S	.	.	S	Bend	trans	-156.8	-173.8	-179.3	55.8	-177	149	0	0	108.6	G124 H125 R126 K163	G124-E161 WeakPolarHBondContact CA-OE1 3.27Å; H125-E161 IonicContact CE1-OE1 3.87Å; H125-E161 IonicContact CG-OE1 2.84Å; H125-E161 PolarHBondContact N-OE1 3.4Å; H125-E161 IonicContact ND1-OE1 2.76Å; H125-E161 PolarHBondContact ND1-OE1 2.67Å; R126-E161 HydrophobicContact CG-CB 4.39Å; E161-K163 HydrophobicContact CG-CB 4.02Å; E161-K163 HydrophobicContact CG-CD 4.25Å; E161-K163 HydrophobicContact CG-CG 3.93Å; E161-K163 PolarHBondContact O-N 3.36Å; E161-K163 VanDerWaalsContact O-N 3.12Å; E161-K163 WeakPolarHBondContact OE1-CD 3.36Å; E161-K163 IonicContact OE1-NZ 3.13Å; E161-K163 PolarHBondContact OE1-NZ 2.89Å; E161-K163 WeakPolarHBondContact OE2-CE 3.11Å; E161-K163 IonicContact OE2-NZ 3.41Å; E161-K163 PolarHBondContact OE2-NZ 2.99Å
162	D	87.8	Confident	93.9	Very high	76 Å²	76	58.5 Å²	58.5	41%	0.406	31%	0.306	S	S	.	.	S	Bend	trans	-79	18.2	-179.9	67.6	-21.7	0	0	0	114.1	A189 F191	D162-A189 HydrophobicContact CB-CB 4.09Å; D162-F191 WeakPolarHBondContact O-CZ 3.44Å
163	K	89.1	Confident	93.8	Very high	84 Å²	84	52.4 Å²	52.4	37%	0.365	28%	0.283	S	S	.	.			trans	-90.6	134.4	178.4	-67	-172.5	-175.9	125.6	0	110.9	Y123 H125 E161	Y123-K163 WeakPolarHBondContact CD1-O 3.01Å; Y123-K163 HydrophobicContact CE1-CB 4.25Å; H125-K163 PolarHBondContact ND1-NZ 2.88Å; E161-K163 HydrophobicContact CG-CB 4.02Å; E161-K163 HydrophobicContact CG-CD 4.25Å; E161-K163 HydrophobicContact CG-CG 3.93Å; E161-K163 PolarHBondContact O-N 3.36Å; E161-K163 VanDerWaalsContact O-N 3.12Å; E161-K163 WeakPolarHBondContact OE1-CD 3.36Å; E161-K163 IonicContact OE1-NZ 3.13Å; E161-K163 PolarHBondContact OE1-NZ 2.89Å; E161-K163 WeakPolarHBondContact OE2-CE 3.11Å; E161-K163 IonicContact OE2-NZ 3.41Å; E161-K163 PolarHBondContact OE2-NZ 2.99Å
164	V	92.9	Very high	93.8	Very high	37 Å²	37	48.3 Å²	48.3	22%	0.224	27%	0.265	C	S	.	.			trans	-132.7	152.9	175.6	-63.8	0	0	0	0	111.1	L159 W175 F191 L192	L159-V164 HydrophobicContact CD1-CG1 4.01Å; V164-W175 HydrophobicContact CB-CH2 3.76Å; V164-W175 HydrophobicContact CB-CZ3 3.97Å; V164-W175 HydrophobicContact CG1-CE3 4.3Å; V164-W175 HydrophobicContact CG1-CH2 3.82Å; V164-W175 HydrophobicContact CG1-CZ3 3.48Å; V164-W175 VanDerWaalsContact CG1-CZ3 3.48Å; V164-F191 HydrophobicContact CB-CE2 4.34Å; V164-F191 HydrophobicContact CG1-CE2 3.91Å; V164-F191 HydrophobicContact CG2-CD2 4.28Å; V164-F191 HydrophobicContact CG2-CE2 3.46Å; V164-F191 VanDerWaalsContact CG2-CE2 3.46Å; V164-F191 HydrophobicContact CG2-CZ 4.05Å; V164-L192 HydrophobicContact CG1-CD2 3.4Å; V164-L192 VanDerWaalsContact CG1-CD2 3.4Å
165	P	93.8	Very high	93.7	Very high	8 Å²	8	48.9 Å²	48.9	5%	0.052	27%	0.266	C	S	.	.			trans	-63.8	146.3	174.3	23	-30.4	0	0	0	112.4	Y123 W151 L157 W175	Y123-P165 HydrophobicContact CE2-CB 3.95Å; Y123-P165 HydrophobicContact CE2-CG 4.29Å; Y123-P165 VanDerWaalsContact OH-CA 3.26Å; Y123-P165 WeakPolarHBondContact OH-CA 3.35Å; W151-P165 HydrophobicContact CB-CB 4.49Å; W151-P165 HydrophobicContact CD2-CB 3.32Å; W151-P165 HydrophobicContact CD2-CG 3.62Å; W151-P165 HydrophobicContact CE3-CB 3.71Å; W151-P165 HydrophobicContact CE3-CG 3.46Å; W151-P165 VanDerWaalsContact CE3-CG 3.46Å; W151-P165 HydrophobicContact CG-CB 3.68Å; W151-P165 HydrophobicContact CG-CG 4.12Å; W151-P165 HydrophobicContact CH2-CB 4.04Å; W151-P165 HydrophobicContact CH2-CG 4.18Å; W151-P165 HydrophobicContact CZ2-CB 3.72Å; W151-P165 HydrophobicContact CZ2-CG 4.35Å; W151-P165 HydrophobicContact CZ3-CB 4.03Å; W151-P165 HydrophobicContact CZ3-CG 3.75Å; L157-P165 HydrophobicContact CD1-CG 3.76Å; P165-W175 HydrophobicContact CG-CZ2 3.97Å
166	K	92.1	Very high	93.6	Very high	199 Å²	199	46.5 Å²	46.5	87%	0.865	25%	0.253	S	S	*	.	S	Bend	trans	-82	122.1	174	-66.7	-176.5	-179.7	179.6	0	110.2
167	G	91.4	Very high	93.5	Very high	56 Å²	56	46.8 Å²	46.8	58%	0.577	26%	0.255	S	S	*	.	S	Bend	trans	122.3	-176.8	172.4	0	0	0	0	0	112.8	R169	G167-R169 PolarHBondContact O-N 3.48Å
168	T	92.8	Very high	93.4	Very high	118 Å²	118	47.3 Å²	47.3	72%	0.724	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-70.3	125.9	-177.4	-47	0	0	0	0	111	W151 R152	W151-T168 WeakPolarHBondContact CH2-O 3.37Å; R152-T168 PolarHBondContact NH1-O 3.26Å
169	R	93.4	Very high	93.3	Very high	40 Å²	40	47.6 Å²	47.6	15%	0.151	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-59.4	127.8	171.2	-177.8	-173.5	-177.4	143	-4.3	110.7	G167 Q173 W175 E195 N197 W413	G167-R169 PolarHBondContact O-N 3.48Å; R169-Q173 HydrophobicContact CG-CB 4.36Å; R169-Q173 PolarHBondContact NE-O 2.9Å; R169-Q173 PolarHBondContact NH2-O 2.91Å; R169-W175 HydrophobicContact CG-CZ2 4.43Å; R169-W175 VanDerWaalsContact CZ-CG 3.47Å; R169-W175 VanDerWaalsContact NH1-CD2 3.3Å; R169-W175 VanDerWaalsContact NH1-CG 3.28Å; R169-W175 VanDerWaalsContact NH2-N 3.15Å; R169-E195 PolarHBondContact NH1-O 3.22Å; R169-E195 IonicContact NH1-OE2 3.79Å; R169-N197 PolarHBondContact NH2-OD1 3.13Å; R169-W413 VanDerWaalsContact NH1-CZ3 3.3Å
170	P	95.2	Very high	93.1	Very high	29 Å²	29	48.4 Å²	48.4	19%	0.188	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-54.4	146.9	172.9	-25	32.7	0	0	0	112	W151 R152 Q173	W151-P170 VanDerWaalsContact CZ3-CD 3.49Å; W151-P170 HydrophobicContact CZ3-CG 4.36Å; R152-P170 HydrophobicContact CB-CG 4.42Å; P170-Q173 HydrophobicContact CB-CB 4.2Å; P170-Q173 PolarHBondContact O-N 2.9Å
171	P	91.2	Very high	93.1	Very high	122 Å²	122	51.2 Å²	51.2	79%	0.792	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	142.6	170.8	-23.6	33.8	0	0	0	110.8	Q173	P171-Q173 PolarHBondContact O-N 2.96Å
172	E	90.1	Very high	93.3	Very high	142 Å²	142	50.1 Å²	50.1	66%	0.664	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-10.2	176.1	-51.8	178.4	174.5	0	0	117	L174 Q407	E172-L174 PolarHBondContact O-N 3.49Å; E172-Q407 PolarHBondContact OE2-NE2 3Å
173	Q	95.3	Very high	93.6	Very high	6 Å²	6	47 Å²	47	3%	0.028	26%	0.255	C	S	.	.			trans	-57.8	132.4	173.1	176.7	174.2	91.8	0	0	109.4	W151 A154 D155 L157 R169 P170 P171 W175	W151-Q173 PolarHBondContact O-NE2 2.98Å; A154-Q173 PolarHBondContact O-NE2 3.29Å; D155-Q173 CarbonylContact O-C 3.56Å; D155-Q173 VanDerWaalsContact O-CA 3.31Å; D155-Q173 WeakPolarHBondContact O-CA 3.46Å; L157-Q173 HydrophobicContact CG-CG 4.44Å; R169-Q173 HydrophobicContact CG-CB 4.36Å; R169-Q173 PolarHBondContact NE-O 2.9Å; R169-Q173 PolarHBondContact NH2-O 2.91Å; P170-Q173 HydrophobicContact CB-CB 4.2Å; P170-Q173 PolarHBondContact O-N 2.9Å; P171-Q173 PolarHBondContact O-N 2.96Å; Q173-W175 VanDerWaalsContact OE1-NE1 3.07Å
174	L	95.6	Very high	93.9	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.8	-179.4	-59.7	170.7	0	0	0	111.5	D155 A156 L157 E172 F176 N197 F198 A403 S406	D155-L174 PolarHBondContact O-N 3.35Å; A156-L174 CarbonylContact C-O 3.55Å; A156-L174 WeakPolarHBondContact CA-O 3.42Å; A156-L174 HydrophobicContact CB-CB 4.05Å; L157-L174 PolarHBondContact N-O 3.4Å; E172-L174 PolarHBondContact O-N 3.49Å; L174-F176 HydrophobicContact CB-CD2 4.31Å; L174-F176 HydrophobicContact CB-CE2 3.79Å; L174-F176 HydrophobicContact CD1-CE2 4.12Å; L174-F176 HydrophobicContact CD1-CZ 4.47Å; L174-N197 WeakPolarHBondContact CA-OD1 3.35Å; L174-N197 HydrophobicContact CD2-CB 4.38Å; L174-F198 HydrophobicContact CD1-CE2 4.29Å; L174-F198 HydrophobicContact CD2-CE2 4.24Å; L174-A403 HydrophobicContact CD1-CB 4.32Å; L174-S406 WeakPolarHBondContact CD1-OG 3.31Å
175	W	96	Very high	93.9	Very high	15 Å²	15	47.5 Å²	47.5	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.9	176.3	-74	17.2	0	0	0	108.6	L157 L159 V164 P165 R169 Q173 L192 E195 I196 N197 F198	L157-W175 HydrophobicContact CB-CG 4.43Å; L157-W175 HydrophobicContact CD1-CZ2 4.24Å; L159-W175 HydrophobicContact CD1-CB 4.47Å; L159-W175 HydrophobicContact CD1-CD2 4.2Å; L159-W175 HydrophobicContact CD1-CE3 3.71Å; L159-W175 HydrophobicContact CD1-CZ3 4.3Å; V164-W175 HydrophobicContact CB-CH2 3.76Å; V164-W175 HydrophobicContact CB-CZ3 3.97Å; V164-W175 HydrophobicContact CG1-CE3 4.3Å; V164-W175 HydrophobicContact CG1-CH2 3.82Å; V164-W175 HydrophobicContact CG1-CZ3 3.48Å; V164-W175 VanDerWaalsContact CG1-CZ3 3.48Å; P165-W175 HydrophobicContact CG-CZ2 3.97Å; R169-W175 HydrophobicContact CG-CZ2 4.43Å; R169-W175 VanDerWaalsContact CZ-CG 3.47Å; R169-W175 VanDerWaalsContact NH1-CD2 3.3Å; R169-W175 VanDerWaalsContact NH1-CG 3.28Å; R169-W175 VanDerWaalsContact NH2-N 3.15Å; Q173-W175 VanDerWaalsContact OE1-NE1 3.07Å; W175-L192 HydrophobicContact CZ3-CD2 4.21Å; W175-E195 HydrophobicContact CE3-CB 4.13Å; W175-E195 HydrophobicContact CZ3-CB 4.14Å; W175-I196 HydrophobicContact CB-CD1 4.46Å; W175-N197 PolarHBondContact N-OD1 3.08Å; W175-N197 PolarHBondContact O-N 2.9Å; W175-F198 PolarHBondContact O-N 2.87Å
176	F	95.1	Very high	94	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.4	173.5	-68.6	-104.3	0	0	0	108.5	F120 A156 L157 I158 L159 L174 F198 I200 I208 M399 L402	F120-F176 HydrophobicContact CE1-CD2 4Å; F120-F176 AromaticContact CE1-CE2 3.74Å; F120-F176 HydrophobicContact CE1-CE2 3.74Å; F120-F176 HydrophobicContact CE1-CZ 4.17Å; F120-F176 HydrophobicContact CZ-CE2 4.42Å; A156-F176 HydrophobicContact CB-CD2 4.07Å; A156-F176 HydrophobicContact CB-CE2 3.88Å; L157-F176 PolarHBondContact O-N 2.94Å; I158-F176 CarbonylContact C-O 3.56Å; L159-F176 PolarHBondContact N-O 2.61Å; L174-F176 HydrophobicContact CB-CD2 4.31Å; L174-F176 HydrophobicContact CB-CE2 3.79Å; L174-F176 HydrophobicContact CD1-CE2 4.12Å; L174-F176 HydrophobicContact CD1-CZ 4.47Å; F176-F198 CarbonylContact C-O 3.54Å; F176-F198 VanDerWaalsContact CA-O 3.29Å; F176-F198 WeakPolarHBondContact CA-O 3.43Å; F176-F198 HydrophobicContact CD1-CB 3.54Å; F176-F198 HydrophobicContact CD1-CD2 4.02Å; F176-F198 HydrophobicContact CD1-CG 4.2Å; F176-F198 HydrophobicContact CD2-CD2 4.46Å; F176-F198 HydrophobicContact CE1-CB 3.66Å; F176-F198 AromaticContact CE1-CD2 3.43Å; F176-F198 HydrophobicContact CE1-CD2 3.43Å; F176-F198 VanDerWaalsContact CE1-CD2 3.43Å; F176-F198 HydrophobicContact CE1-CE2 4.34Å; F176-F198 AromaticContact CE1-CG 3.82Å; F176-F198 HydrophobicContact CE1-CG 3.82Å; F176-F198 AromaticContact CE2-CD2 3.92Å; F176-F198 HydrophobicContact CE2-CD2 3.92Å; F176-F198 HydrophobicContact CG-CB 4.27Å; F176-F198 HydrophobicContact CZ-CB 4.45Å; F176-F198 AromaticContact CZ-CD2 3.37Å; F176-F198 HydrophobicContact CZ-CD2 3.37Å; F176-F198 AromaticContact CZ-CE2 3.95Å; F176-F198 HydrophobicContact CZ-CE2 3.95Å; F176-F198 HydrophobicContact CZ-CG 4.24Å; F176-I200 HydrophobicContact CB-CD1 4.3Å; F176-I200 HydrophobicContact CD1-CD1 4Å; F176-I200 HydrophobicContact CD1-CG1 4.42Å; F176-I208 HydrophobicContact CE1-CD1 4.34Å; F176-M399 HydrophobicContact CD1-CG 3.98Å; F176-M399 HydrophobicContact CE1-CB 4.22Å; F176-M399 HydrophobicContact CE1-CG 4.01Å; F176-L402 HydrophobicContact CE1-CB 4.25Å; F176-L402 HydrophobicContact CE1-CD1 4.02Å; F176-L402 HydrophobicContact CZ-CB 4.03Å
177	S	95.3	Very high	94.1	Very high	6 Å²	6	40.7 Å²	40.7	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	112.9	169	176.7	0	0	0	0	109	I179 M188 F198 I200	S177-I179 WeakPolarHBondContact OG-CD1 3.43Å; S177-M188 WeakPolarHBondContact OG-CE 3.24Å; S177-F198 PolarHBondContact N-O 3.2Å; S177-I200 PolarHBondContact O-N 3.25Å
178	L	95.3	Very high	94.2	Very high	12 Å²	12	38.3 Å²	38.3	6%	0.063	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	96.4	176.4	-166.6	168.5	0	0	0	109.3	I128 M132 I158 L159 T160 Q180 I200	I128-L178 HydrophobicContact CD1-CD1 4.37Å; I128-L178 HydrophobicContact CG2-CD1 4.05Å; I128-L178 HydrophobicContact CG2-CD2 4.37Å; M132-L178 HydrophobicContact CE-CD1 3.66Å; I158-L178 HydrophobicContact CG2-CB 3.72Å; I158-L178 HydrophobicContact CG2-CD1 3.99Å; L159-L178 PolarHBondContact O-N 3.26Å; T160-L178 WeakPolarHBondContact CA-O 3.35Å; L178-Q180 HydrophobicContact CD2-CG 4.14Å; L178-I200 WeakPolarHBondContact CA-O 3.37Å; L178-I200 HydrophobicContact CB-CB 4.23Å; L178-I200 HydrophobicContact CB-CD1 4.33Å; L178-I200 HydrophobicContact CD1-CD1 4.25Å; L178-I200 HydrophobicContact CG-CB 4.09Å; L178-I200 HydrophobicContact CG-CD1 4.35Å; L178-I200 HydrophobicContact CG-CG2 4.11Å
179	I	94.2	Very high	94.2	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	19%	0.187	C	C	.	.			trans	-126.3	117.4	-177.8	-55.3	173.6	0	0	0	108.7	S177 I186 M188 I200 S201 W421	S177-I179 WeakPolarHBondContact OG-CD1 3.43Å; I179-I186 HydrophobicContact CD1-CG2 4.12Å; I179-I186 HydrophobicContact CG1-CG2 4.41Å; I179-I186 HydrophobicContact CG2-CB 3.86Å; I179-I186 HydrophobicContact CG2-CD1 4.17Å; I179-I186 HydrophobicContact CG2-CG2 3.81Å; I179-M188 HydrophobicContact CD1-CE 4.37Å; I179-M188 HydrophobicContact CD1-CG 3.66Å; I179-M188 HydrophobicContact CD1-SD 4.07Å; I179-I200 PolarHBondContact N-O 3.42Å; I179-I200 VanDerWaalsContact N-O 3.08Å; I179-S201 WeakPolarHBondContact O-CB 3.27Å; I179-W421 HydrophobicContact CB-CH2 4.17Å; I179-W421 HydrophobicContact CB-CZ2 3.96Å; I179-W421 HydrophobicContact CG2-CH2 3.86Å; I179-W421 HydrophobicContact CG2-CZ2 3.31Å
180	Q	92.2	Very high	94	Very high	19 Å²	19	34.6 Å²	34.6	9%	0.089	21%	0.209	C	C	.	.			trans	-102.7	-20.9	-179.7	-74.8	-67.1	-11.9	0	0	113.1	L178 F202 S210 Y212	L178-Q180 HydrophobicContact CD2-CG 4.14Å; Q180-F202 WeakPolarHBondContact O-CD1 3.26Å; Q180-S210 PolarHBondContact NE2-O 3.25Å; Q180-S210 PolarHBondContact NE2-OG 3.13Å; Q180-S210 VanDerWaalsContact NE2-OG 3.1Å; Q180-S210 PolarHBondContact OE1-O 2.84Å; Q180-Y212 VanDerWaalsContact C-OH 3.3Å; Q180-Y212 VanDerWaalsContact O-CE2 3.3Å; Q180-Y212 WeakPolarHBondContact O-CE2 3.31Å; Q180-Y212 PolarHBondContact O-OH 3.4Å
181	E	94.3	Very high	93.8	Very high	63 Å²	63	38.9 Å²	38.9	29%	0.294	23%	0.225	S	C	.	.	S	Bend	trans	-78.5	165	175.7	-86.1	-64.8	171	0	0	112.1	H185 I186 Y315 W421	E181-H185 HydrophobicContact CB-CB 4.16Å; E181-H185 IonicContact OE2-CD2 3.08Å; E181-I186 HydrophobicContact CB-CD1 3.74Å; E181-I186 HydrophobicContact CB-CG1 3.85Å; E181-I186 HydrophobicContact CG-CD1 4.26Å; E181-Y315 PolarHBondContact OE2-OH 2.92Å; E181-W421 VanDerWaalsContact O-CH2 3.27Å; E181-W421 WeakPolarHBondContact O-CH2 3.49Å; E181-W421 WeakPolarHBondContact O-CZ2 3.38Å
182	S	96	Very high	93.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.			trans	-66.8	157	178.1	82	0	0	0	0	112.3	V184 H185 I186 S310	S182-V184 PolarHBondContact O-N 3.47Å; S182-V184 VanDerWaalsContact O-N 3.08Å; S182-V184 PolarHBondContact OG-N 2.94Å; S182-H185 PolarHBondContact O-N 3.27Å; S182-H185 PolarHBondContact OG-CD2 3.48Å; S182-H185 PolarHBondContact OG-N 2.95Å; S182-I186 PolarHBondContact O-N 3.49Å; S182-S310 WeakPolarHBondContact CB-OG 3.43Å; S182-S310 VanDerWaalsContact OG-CB 3.32Å; S182-S310 WeakPolarHBondContact OG-CB 3.36Å; S182-S310 PolarHBondContact OG-OG 3.4Å
183	P	95.4	Very high	93.6	Very high	10 Å²	10	29 Å²	29	7%	0.065	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.2	174.5	-25.4	31.6	0	0	0	114.9	H185 I186 A187 W421	P183-H185 VanDerWaalsContact C-N 3.33Å; P183-I186 WeakPolarHBondContact CA-O 3.3Å; P183-I186 CarbonylContact O-C 3.29Å; P183-A187 PolarHBondContact O-N 3.25Å; P183-W421 VanDerWaalsContact CB-O 3.26Å; P183-W421 WeakPolarHBondContact CB-O 3.35Å; P183-W421 HydrophobicContact CG-CD2 4.09Å; P183-W421 HydrophobicContact CG-CG 4.49Å; P183-W421 HydrophobicContact CG-CH2 4.48Å; P183-W421 HydrophobicContact CG-CZ2 4.02Å; P183-W421 WeakPolarHBondContact CG-O 3.47Å
184	V	94.2	Very high	93.1	Very high	70 Å²	70	32.7 Å²	32.7	42%	0.424	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-26.2	177	-162.6	0	0	0	0	111.7	S182 K253 C425	S182-V184 PolarHBondContact O-N 3.47Å; S182-V184 VanDerWaalsContact O-N 3.08Å; S182-V184 PolarHBondContact OG-N 2.94Å; V184-K253 HydrophobicContact CG1-CB 3.76Å; V184-K253 HydrophobicContact CG1-CD 4.16Å; V184-K253 HydrophobicContact CG1-CG 3.55Å; V184-C425 HydrophobicContact CG2-CB 4.15Å; V184-C425 VanDerWaalsContact CG2-SG 3.59Å
185	H	94	Very high	92.8	Very high	63 Å²	63	35.5 Å²	35.5	29%	0.292	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-32.1	178.8	-75.9	-54.9	0	0	0	113.1	E181 S182 P183	E181-H185 HydrophobicContact CB-CB 4.16Å; E181-H185 IonicContact OE2-CD2 3.08Å; S182-H185 PolarHBondContact O-N 3.27Å; S182-H185 PolarHBondContact OG-CD2 3.48Å; S182-H185 PolarHBondContact OG-N 2.95Å; P183-H185 VanDerWaalsContact C-N 3.33Å
186	I	94.4	Very high	92.7	Very high	13 Å²	13	34.8 Å²	34.8	7%	0.067	20%	0.199	C	C	.	.	S	Bend	trans	-136.4	103.2	174.2	-57.1	-175.4	0	0	0	107.1	R126 I179 E181 S182 P183 W421	R126-I186 HydrophobicContact CG-CD1 4.31Å; I179-I186 HydrophobicContact CD1-CG2 4.12Å; I179-I186 HydrophobicContact CG1-CG2 4.41Å; I179-I186 HydrophobicContact CG2-CB 3.86Å; I179-I186 HydrophobicContact CG2-CD1 4.17Å; I179-I186 HydrophobicContact CG2-CG2 3.81Å; E181-I186 HydrophobicContact CB-CD1 3.74Å; E181-I186 HydrophobicContact CB-CG1 3.85Å; E181-I186 HydrophobicContact CG-CD1 4.26Å; S182-I186 PolarHBondContact O-N 3.49Å; P183-I186 WeakPolarHBondContact CA-O 3.3Å; P183-I186 CarbonylContact O-C 3.29Å; I186-W421 PolarHBondContact O-NE1 3.25Å
187	A	94.5	Very high	92.6	Very high	51 Å²	51	35 Å²	35	42%	0.421	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-86	156.1	172.3	0	0	0	0	0	110.4	P183 N422	P183-A187 PolarHBondContact O-N 3.25Å; A187-N422 WeakPolarHBondContact CA-OD1 3.3Å; A187-N422 WeakPolarHBondContact CB-OD1 3.47Å
188	M	93.5	Very high	92.4	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.025	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-97	129.4	169.8	-74	-174.9	97.6	0	0	109.8	S177 I179 L192 I196 V417 A418 W421 N422	S177-M188 WeakPolarHBondContact OG-CE 3.24Å; I179-M188 HydrophobicContact CD1-CE 4.37Å; I179-M188 HydrophobicContact CD1-CG 3.66Å; I179-M188 HydrophobicContact CD1-SD 4.07Å; M188-L192 HydrophobicContact CB-CD1 4.4Å; M188-L192 HydrophobicContact CE-CD1 4.06Å; M188-I196 HydrophobicContact CE-CD1 4.24Å; M188-I196 HydrophobicContact CE-CG1 3.86Å; M188-V417 HydrophobicContact CE-CG1 4.39Å; M188-V417 HydrophobicContact CE-CG2 3.85Å; M188-V417 HydrophobicContact SD-CG2 3.87Å; M188-A418 HydrophobicContact CB-CB 4.17Å; M188-W421 HydrophobicContact CB-CB 4.44Å; M188-W421 HydrophobicContact CB-CG 4.47Å; M188-W421 HydrophobicContact CG-CB 4.16Å; M188-W421 HydrophobicContact CG-CG 3.9Å; M188-W421 HydrophobicContact SD-CB 3.74Å; M188-W421 HydrophobicContact SD-CG 3.86Å; M188-N422 PolarHBondContact N-OD1 3.38Å; M188-N422 PolarHBondContact O-ND2 3.24Å
189	A	92.7	Very high	92.3	Very high	20 Å²	20	34.4 Å²	34.4	17%	0.165	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-71	145.3	179.3	0	0	0	0	0	111.9	D162 F191 L192	D162-A189 HydrophobicContact CB-CB 4.09Å; A189-F191 HydrophobicContact CB-CD1 3.56Å; A189-F191 HydrophobicContact CB-CE1 3.2Å; A189-F191 HydrophobicContact CB-CE2 4.39Å; A189-F191 HydrophobicContact CB-CG 4.31Å; A189-F191 HydrophobicContact CB-CZ 3.66Å; A189-F191 PolarHBondContact O-N 2.93Å; A189-F191 VanDerWaalsContact O-N 3.12Å; A189-L192 WeakPolarHBondContact O-CB 3.36Å; A189-L192 PolarHBondContact O-N 2.99Å
190	G	90.6	Very high	92.3	Very high	60 Å²	60	34.2 Å²	34.2	62%	0.619	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-63.5	-18.2	-178	0	0	0	0	0	115	L192 E193	G190-L192 VanDerWaalsContact C-N 3.26Å; G190-L192 PolarHBondContact O-N 3.45Å; G190-E193 WeakPolarHBondContact O-CB 3.39Å; G190-E193 PolarHBondContact O-N 3.12Å
191	F	90.3	Very high	92.3	Very high	119 Å²	119	33.4 Å²	33.4	52%	0.522	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-75.8	-12.8	174.8	66.6	-105.8	0	0	0	113.3	D162 V164 A189 E193	D162-F191 WeakPolarHBondContact O-CZ 3.44Å; V164-F191 HydrophobicContact CB-CE2 4.34Å; V164-F191 HydrophobicContact CG1-CE2 3.91Å; V164-F191 HydrophobicContact CG2-CD2 4.28Å; V164-F191 HydrophobicContact CG2-CE2 3.46Å; V164-F191 VanDerWaalsContact CG2-CE2 3.46Å; V164-F191 HydrophobicContact CG2-CZ 4.05Å; A189-F191 HydrophobicContact CB-CD1 3.56Å; A189-F191 HydrophobicContact CB-CE1 3.2Å; A189-F191 HydrophobicContact CB-CE2 4.39Å; A189-F191 HydrophobicContact CB-CG 4.31Å; A189-F191 HydrophobicContact CB-CZ 3.66Å; A189-F191 PolarHBondContact O-N 2.93Å; A189-F191 VanDerWaalsContact O-N 3.12Å; F191-E193 PolarHBondContact O-N 3.24Å
192	L	90.7	Very high	92.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-76.7	-3	173.3	-68.7	173.5	0	0	0	112.7	L159 V164 W175 M188 A189 G190 N194 E195 I196 V417	L159-L192 HydrophobicContact CD1-CD2 4.16Å; V164-L192 HydrophobicContact CG1-CD2 3.4Å; V164-L192 VanDerWaalsContact CG1-CD2 3.4Å; W175-L192 HydrophobicContact CZ3-CD2 4.21Å; M188-L192 HydrophobicContact CB-CD1 4.4Å; M188-L192 HydrophobicContact CE-CD1 4.06Å; A189-L192 WeakPolarHBondContact O-CB 3.36Å; A189-L192 PolarHBondContact O-N 2.99Å; G190-L192 VanDerWaalsContact C-N 3.26Å; G190-L192 PolarHBondContact O-N 3.45Å; L192-N194 PolarHBondContact O-N 3.06Å; L192-E195 WeakPolarHBondContact O-CB 3.5Å; L192-E195 PolarHBondContact O-N 3.3Å; L192-I196 HydrophobicContact CB-CG1 4.34Å; L192-I196 HydrophobicContact CD2-CD1 4.12Å; L192-V417 HydrophobicContact CB-CG1 4.43Å; L192-V417 WeakPolarHBondContact O-CG1 3.38Å
193	E	86.5	Confident	91.9	Very high	57 Å²	57	31.7 Å²	31.7	27%	0.266	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	120.2	-179.7	-176.6	55.1	-154.1	0	0	111.6	G190 F191 E195 K416 V417	G190-E193 WeakPolarHBondContact O-CB 3.39Å; G190-E193 PolarHBondContact O-N 3.12Å; F191-E193 PolarHBondContact O-N 3.24Å; E193-E195 PolarHBondContact O-N 2.7Å; E193-K416 VanDerWaalsContact CD-N 3.3Å; E193-K416 WeakPolarHBondContact OE1-CA 3.3Å; E193-K416 PolarHBondContact OE1-N 2.89Å; E193-K416 WeakPolarHBondContact OE2-CA 3.48Å; E193-K416 PolarHBondContact OE2-N 3.36Å; E193-V417 PolarHBondContact OE2-N 3.25Å; E193-V417 VanDerWaalsContact OE2-N 3.15Å
194	N	83.7	Confident	91.5	Very high	83 Å²	83	33 Å²	33	44%	0.444	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	14.7	-172.4	-46.7	-66.6	0	0	0	115.4	L192	L192-N194 PolarHBondContact O-N 3.06Å
195	E	90.4	Very high	91.1	Very high	74 Å²	74	30.8 Å²	30.8	35%	0.346	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-24.2	175.4	-65.4	-64.5	155	0	0	112.6	R169 W175 L192 E193 W413	R169-E195 PolarHBondContact NH1-O 3.22Å; R169-E195 IonicContact NH1-OE2 3.79Å; W175-E195 HydrophobicContact CE3-CB 4.13Å; W175-E195 HydrophobicContact CZ3-CB 4.14Å; L192-E195 WeakPolarHBondContact O-CB 3.5Å; L192-E195 PolarHBondContact O-N 3.3Å; E193-E195 PolarHBondContact O-N 2.7Å; E195-W413 WeakPolarHBondContact O-CZ3 3.48Å
196	I	92.9	Very high	90.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.			trans	-82.9	127.2	179.2	-57.8	-59	0	0	0	109.6	L159 W175 M188 L192 F198 T199 W413 V414 V417	L159-I196 HydrophobicContact CD1-CD1 3.61Å; W175-I196 HydrophobicContact CB-CD1 4.46Å; M188-I196 HydrophobicContact CE-CD1 4.24Å; M188-I196 HydrophobicContact CE-CG1 3.86Å; L192-I196 HydrophobicContact CB-CG1 4.34Å; L192-I196 HydrophobicContact CD2-CD1 4.12Å; I196-F198 WeakPolarHBondContact CG2-O 3.27Å; I196-T199 HydrophobicContact CG2-CG2 4.05Å; I196-W413 CarbonylContact O-C 3.53Å; I196-W413 VanDerWaalsContact O-CA 3.32Å; I196-W413 WeakPolarHBondContact O-CA 3.29Å; I196-V414 HydrophobicContact CG2-CG2 4.47Å; I196-V414 PolarHBondContact O-N 3.4Å; I196-V417 HydrophobicContact CB-CG1 4.32Å; I196-V417 HydrophobicContact CB-CG2 4.3Å; I196-V417 HydrophobicContact CG1-CG1 3.96Å; I196-V417 HydrophobicContact CG1-CG2 4.31Å; I196-V417 HydrophobicContact CG2-CG2 4.47Å
197	N	92.8	Very high	90.5	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	16%	0.158	C	C	.	.	S	Bend	trans	-82	-47.3	172.1	-52	90.3	0	0	0	110.8	R169 L174 W175 Y412 W413 V414	R169-N197 PolarHBondContact NH2-OD1 3.13Å; L174-N197 WeakPolarHBondContact CA-OD1 3.35Å; L174-N197 HydrophobicContact CD2-CB 4.38Å; W175-N197 PolarHBondContact N-OD1 3.08Å; W175-N197 PolarHBondContact O-N 2.9Å; N197-Y412 VanDerWaalsContact CA-O 3.27Å; N197-Y412 WeakPolarHBondContact CA-O 3.49Å; N197-Y412 VanDerWaalsContact CB-O 3.32Å; N197-Y412 WeakPolarHBondContact CB-O 3.47Å; N197-Y412 PolarHBondContact ND2-O 2.96Å; N197-Y412 WeakPolarHBondContact O-CD1 3.35Å; N197-Y412 WeakPolarHBondContact O-CE1 3.35Å; N197-W413 VanDerWaalsContact ND2-CE3 3.32Å; N197-W413 WeakPolarHBondContact ND2-CZ3 3.44Å; N197-V414 WeakPolarHBondContact O-CG2 3.38Å
198	F	92.4	Very high	90.3	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.1	-172	-56.1	-67	0	0	0	111.2	Y82 L174 W175 F176 S177 I196 T207 L402 F409 Y412	Y82-F198 HydrophobicContact CD1-CE1 4.41Å; L174-F198 HydrophobicContact CD1-CE2 4.29Å; L174-F198 HydrophobicContact CD2-CE2 4.24Å; W175-F198 PolarHBondContact O-N 2.87Å; F176-F198 CarbonylContact C-O 3.54Å; F176-F198 VanDerWaalsContact CA-O 3.29Å; F176-F198 WeakPolarHBondContact CA-O 3.43Å; F176-F198 HydrophobicContact CD1-CB 3.54Å; F176-F198 HydrophobicContact CD1-CD2 4.02Å; F176-F198 HydrophobicContact CD1-CG 4.2Å; F176-F198 HydrophobicContact CD2-CD2 4.46Å; F176-F198 HydrophobicContact CE1-CB 3.66Å; F176-F198 AromaticContact CE1-CD2 3.43Å; F176-F198 HydrophobicContact CE1-CD2 3.43Å; F176-F198 VanDerWaalsContact CE1-CD2 3.43Å; F176-F198 HydrophobicContact CE1-CE2 4.34Å; F176-F198 AromaticContact CE1-CG 3.82Å; F176-F198 HydrophobicContact CE1-CG 3.82Å; F176-F198 AromaticContact CE2-CD2 3.92Å; F176-F198 HydrophobicContact CE2-CD2 3.92Å; F176-F198 HydrophobicContact CG-CB 4.27Å; F176-F198 HydrophobicContact CZ-CB 4.45Å; F176-F198 AromaticContact CZ-CD2 3.37Å; F176-F198 HydrophobicContact CZ-CD2 3.37Å; F176-F198 AromaticContact CZ-CE2 3.95Å; F176-F198 HydrophobicContact CZ-CE2 3.95Å; F176-F198 HydrophobicContact CZ-CG 4.24Å; S177-F198 PolarHBondContact N-O 3.2Å; I196-F198 WeakPolarHBondContact CG2-O 3.27Å; F198-T207 HydrophobicContact CB-CG2 4.08Å; F198-T207 HydrophobicContact CD1-CG2 3.44Å; F198-T207 VanDerWaalsContact CD1-CG2 3.44Å; F198-T207 HydrophobicContact CE1-CG2 4.28Å; F198-T207 HydrophobicContact CG-CG2 4.17Å; F198-L402 HydrophobicContact CB-CD1 4.49Å; F198-L402 HydrophobicContact CD1-CD1 3.89Å; F198-L402 HydrophobicContact CD1-CD2 4.44Å; F198-L402 HydrophobicContact CD2-CB 4.47Å; F198-L402 HydrophobicContact CD2-CD1 4.24Å; F198-L402 HydrophobicContact CE1-CD1 4.06Å; F198-L402 HydrophobicContact CE1-CD2 3.79Å; F198-L402 HydrophobicContact CE1-CG 4.42Å; F198-L402 HydrophobicContact CE2-CB 4.09Å; F198-L402 HydrophobicContact CE2-CD1 4.43Å; F198-L402 HydrophobicContact CG-CD1 3.95Å; F198-L402 HydrophobicContact CZ-CB 4.21Å; F198-L402 HydrophobicContact CZ-CD1 4.34Å; F198-L402 HydrophobicContact CZ-CD2 3.87Å; F198-L402 HydrophobicContact CZ-CG 4.37Å; F198-F409 HydrophobicContact CZ-CZ 4.27Å; F198-Y412 AromaticContact CD1-CD1 3.6Å; F198-Y412 HydrophobicContact CD1-CD1 3.6Å; F198-Y412 AromaticContact CD1-CE1 3.88Å; F198-Y412 HydrophobicContact CD1-CE1 3.88Å; F198-Y412 AromaticContact CE1-CD1 3.46Å; F198-Y412 HydrophobicContact CE1-CD1 3.46Å; F198-Y412 VanDerWaalsContact CE1-CD1 3.46Å; F198-Y412 HydrophobicContact CE1-CE1 4.13Å; F198-Y412 HydrophobicContact CE1-CG 4.42Å; F198-Y412 HydrophobicContact CZ-CD1 4.34Å
199	T	92.8	Very high	90.1	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.025	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139	177	50.9	0	0	0	0	111	I196 S206 T207 I208 V414 V417 W420	I196-T199 HydrophobicContact CG2-CG2 4.05Å; T199-S206 WeakPolarHBondContact OG1-CA 3.38Å; T199-T207 PolarHBondContact N-OG1 3.08Å; T199-T207 WeakPolarHBondContact O-CB 2.99Å; T199-T207 PolarHBondContact O-N 3.08Å; T199-T207 VanDerWaalsContact O-N 3.12Å; T199-T207 PolarHBondContact OG1-N 2.82Å; T199-T207 PolarHBondContact OG1-OG1 3.11Å; T199-I208 PolarHBondContact O-N 2.86Å; T199-V414 HydrophobicContact CG2-CG1 4.4Å; T199-V414 HydrophobicContact CG2-CG2 4.03Å; T199-V417 HydrophobicContact CG2-CG2 3.74Å; T199-W420 HydrophobicContact CG2-CE3 4.35Å; T199-W420 HydrophobicContact CG2-CH2 4.05Å; T199-W420 HydrophobicContact CG2-CZ3 3.61Å
200	I	93.5	Very high	90	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	110.5	177.8	-43.7	-179.6	0	0	0	107.4	F176 S177 L178 I179 I208 P395 M399	F176-I200 HydrophobicContact CB-CD1 4.3Å; F176-I200 HydrophobicContact CD1-CD1 4Å; F176-I200 HydrophobicContact CD1-CG1 4.42Å; S177-I200 PolarHBondContact O-N 3.25Å; L178-I200 WeakPolarHBondContact CA-O 3.37Å; L178-I200 HydrophobicContact CB-CB 4.23Å; L178-I200 HydrophobicContact CB-CD1 4.33Å; L178-I200 HydrophobicContact CD1-CD1 4.25Å; L178-I200 HydrophobicContact CG-CB 4.09Å; L178-I200 HydrophobicContact CG-CD1 4.35Å; L178-I200 HydrophobicContact CG-CG2 4.11Å; I179-I200 PolarHBondContact N-O 3.42Å; I179-I200 VanDerWaalsContact N-O 3.08Å; I200-I208 WeakPolarHBondContact CA-O 3.26Å; I200-I208 HydrophobicContact CB-CB 4.44Å; I200-I208 HydrophobicContact CD1-CD1 3.97Å; I200-I208 HydrophobicContact CG1-CB 4.09Å; I200-I208 HydrophobicContact CG1-CD1 3.94Å; I200-I208 HydrophobicContact CG1-CG1 4.44Å; I200-I208 HydrophobicContact CG2-CB 4.19Å; I200-I208 HydrophobicContact CG2-CG2 4.21Å; I200-P395 HydrophobicContact CG2-CB 3.63Å; I200-P395 HydrophobicContact CG2-CG 4.34Å; I200-M399 HydrophobicContact CD1-CE 4.47Å; I200-M399 HydrophobicContact CD1-CG 3.5Å; I200-M399 HydrophobicContact CD1-SD 3.44Å; I200-M399 WeakPolarHBondContact CD1-SD 3.34Å
201	S	93.2	Very high	90.1	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	179	178.2	84	0	0	0	0	111.8	I179 R203 S206 I208 S210	I179-S201 WeakPolarHBondContact O-CB 3.27Å; S201-R203 PolarHBondContact O-N 3.28Å; S201-R203 WeakPolarHBondContact OG-CB 3.13Å; S201-R203 PolarHBondContact OG-N 3.39Å; S201-S206 PolarHBondContact OG-OG 2.75Å; S201-I208 PolarHBondContact N-O 3.13Å; S201-S210 CarbonylContact C-O 3.6Å; S201-S210 PolarHBondContact O-N 3.09Å
202	F	91.6	Very high	90.2	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.018	10%	0.099	C	C	.	.	S	Bend	trans	-70.6	-8.5	171.4	62.1	-98.7	0	0	0	113.8	Q180 Y209 S210 Y212 E314 Y315 W421	Q180-F202 WeakPolarHBondContact O-CD1 3.26Å; F202-Y209 WeakPolarHBondContact O-CE2 3.48Å; F202-S210 PolarHBondContact N-O 3.43Å; F202-Y212 HydrophobicContact CB-CD2 4.5Å; F202-Y212 HydrophobicContact CD1-CE2 4.39Å; F202-E314 HydrophobicContact CD2-CB 4.47Å; F202-E314 WeakPolarHBondContact CD2-O 3.43Å; F202-Y315 AromaticContact CD1-CD2 3.76Å; F202-Y315 HydrophobicContact CD1-CD2 3.76Å; F202-Y315 HydrophobicContact CD1-CE2 4.22Å; F202-Y315 HydrophobicContact CD2-CD2 4.22Å; F202-Y315 AromaticContact CE1-CD2 3.38Å; F202-Y315 HydrophobicContact CE1-CD2 3.38Å; F202-Y315 AromaticContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CG 4.43Å; F202-Y315 AromaticContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CG 4.3Å; F202-Y315 HydrophobicContact CG-CD2 4.17Å; F202-Y315 AromaticContact CZ-CD2 3.47Å; F202-Y315 HydrophobicContact CZ-CD2 3.47Å; F202-Y315 VanDerWaalsContact CZ-CD2 3.47Å; F202-Y315 HydrophobicContact CZ-CE2 4.36Å; F202-Y315 HydrophobicContact CZ-CG 4.11Å; F202-W421 AromaticContact CE1-CH2 3.62Å; F202-W421 HydrophobicContact CE1-CH2 3.62Å; F202-W421 HydrophobicContact CE1-CZ3 4.2Å; F202-W421 AromaticContact CZ-CH2 3.86Å; F202-W421 HydrophobicContact CZ-CH2 3.86Å; F202-W421 HydrophobicContact CZ-CZ3 4.15Å
203	R	90.5	Very high	90.3	Very high	24 Å²	24	20.8 Å²	20.8	9%	0.091	10%	0.1	C	C	.	.	S	Bend	trans	-74.2	134.7	177.1	-64.7	179.7	56.3	103.1	3.5	110.4	S201 D205 S206 E314 W420 W421	S201-R203 PolarHBondContact O-N 3.28Å; S201-R203 WeakPolarHBondContact OG-CB 3.13Å; S201-R203 PolarHBondContact OG-N 3.39Å; R203-D205 VanDerWaalsContact CB-OD1 3.31Å; R203-D205 WeakPolarHBondContact CB-OD1 3.37Å; R203-D205 IonicContact CZ-OD1 3.24Å; R203-D205 IonicContact CZ-OD2 2.78Å; R203-D205 IonicContact NE-OD1 3.79Å; R203-D205 PolarHBondContact NE-OD1 2.6Å; R203-D205 IonicContact NE-OD2 3.63Å; R203-D205 IonicContact NH2-OD1 2.96Å; R203-D205 PolarHBondContact NH2-OD1 2.81Å; R203-D205 IonicContact NH2-OD2 3.67Å; R203-D205 PolarHBondContact NH2-OD2 2.99Å; R203-D205 PolarHBondContact O-N 2.97Å; R203-S206 WeakPolarHBondContact O-CB 3.25Å; R203-S206 PolarHBondContact O-N 3.36Å; R203-S206 VanDerWaalsContact O-N 3.1Å; R203-S206 PolarHBondContact O-OG 3.48Å; R203-E314 WeakPolarHBondContact CA-OE2 3.34Å; R203-W420 HydrophobicContact CB-CZ2 4.02Å; R203-W420 HydrophobicContact CG-CZ2 4.37Å; R203-W420 VanDerWaalsContact NE-CE2 3.31Å; R203-W420 VanDerWaalsContact NE-NE1 3.15Å; R203-W421 HydrophobicContact CG-CZ3 4.3Å
204	L	85.7	Confident	90.6	Very high	37 Å²	37	20.3 Å²	20.3	19%	0.194	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.8	179	-68.6	177.1	0	0	0	111.4	P94 S206 Y209 E314	P94-L204 WeakPolarHBondContact CA-O 3.27Å; P94-L204 HydrophobicContact CB-CB 3.76Å; P94-L204 WeakPolarHBondContact CB-O 3.32Å; P94-L204 HydrophobicContact CG-CB 4.33Å; L204-S206 VanDerWaalsContact C-N 3.31Å; L204-S206 PolarHBondContact O-N 2.82Å; L204-Y209 HydrophobicContact CD2-CD1 4.29Å; L204-Y209 HydrophobicContact CD2-CD2 4.03Å; L204-Y209 HydrophobicContact CD2-CE1 3.88Å; L204-Y209 HydrophobicContact CD2-CE2 3.58Å; L204-Y209 HydrophobicContact CD2-CG 4.35Å; L204-Y209 VanDerWaalsContact CD2-CZ 3.48Å; L204-Y209 HydrophobicContact CG-CE2 4.33Å; L204-E314 WeakPolarHBondContact CD1-OE1 3.44Å; L204-E314 PolarHBondContact N-OE2 3.01Å
205	D	85.6	Confident	91	Very high	24 Å²	24	17.6 Å²	17.6	13%	0.128	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	15.1	179.2	68.3	-8	0	0	0	114.6	R203 W420	R203-D205 VanDerWaalsContact CB-OD1 3.31Å; R203-D205 WeakPolarHBondContact CB-OD1 3.37Å; R203-D205 IonicContact CZ-OD1 3.24Å; R203-D205 IonicContact CZ-OD2 2.78Å; R203-D205 IonicContact NE-OD1 3.79Å; R203-D205 PolarHBondContact NE-OD1 2.6Å; R203-D205 IonicContact NE-OD2 3.63Å; R203-D205 IonicContact NH2-OD1 2.96Å; R203-D205 PolarHBondContact NH2-OD1 2.81Å; R203-D205 IonicContact NH2-OD2 3.67Å; R203-D205 PolarHBondContact NH2-OD2 2.99Å; R203-D205 PolarHBondContact O-N 2.97Å; D205-W420 VanDerWaalsContact OD1-CZ2 3.32Å; D205-W420 WeakPolarHBondContact OD1-CZ2 3.48Å; D205-W420 PolarHBondContact OD1-NE1 3.35Å; D205-W420 PolarHBondContact OD2-NE1 2.86Å
206	S	89.2	Confident	91	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-72.4	157.1	166.8	-51.3	0	0	0	0	111.1	T199 S201 R203 L204 I208	T199-S206 WeakPolarHBondContact OG1-CA 3.38Å; S201-S206 PolarHBondContact OG-OG 2.75Å; R203-S206 WeakPolarHBondContact O-CB 3.25Å; R203-S206 PolarHBondContact O-N 3.36Å; R203-S206 VanDerWaalsContact O-N 3.1Å; R203-S206 PolarHBondContact O-OG 3.48Å; L204-S206 VanDerWaalsContact C-N 3.31Å; L204-S206 PolarHBondContact O-N 2.82Å; S206-I208 VanDerWaalsContact C-N 3.3Å; S206-I208 WeakPolarHBondContact CB-O 3.34Å; S206-I208 PolarHBondContact O-N 2.99Å
207	T	88.4	Confident	90.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	-57.4	-46.5	170.7	-48.1	0	0	0	0	111.4	Y82 F198 T199 L402	Y82-T207 HydrophobicContact CD1-CG2 4.45Å; Y82-T207 HydrophobicContact CE1-CG2 3.74Å; F198-T207 HydrophobicContact CB-CG2 4.08Å; F198-T207 HydrophobicContact CD1-CG2 3.44Å; F198-T207 VanDerWaalsContact CD1-CG2 3.44Å; F198-T207 HydrophobicContact CE1-CG2 4.28Å; F198-T207 HydrophobicContact CG-CG2 4.17Å; T199-T207 PolarHBondContact N-OG1 3.08Å; T199-T207 WeakPolarHBondContact O-CB 2.99Å; T199-T207 PolarHBondContact O-N 3.08Å; T199-T207 VanDerWaalsContact O-N 3.12Å; T199-T207 PolarHBondContact OG1-N 2.82Å; T199-T207 PolarHBondContact OG1-OG1 3.11Å; T207-L402 HydrophobicContact CG2-CD1 4.22Å
208	I	90	Very high	90.8	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.015	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111	174.5	-57.5	168.7	0	0	0	107.4	F97 F176 T199 I200 S201 S206 S210 P395 A398 M399 L402	F97-I208 HydrophobicContact CE2-CG1 4.3Å; F176-I208 HydrophobicContact CE1-CD1 4.34Å; T199-I208 PolarHBondContact O-N 2.86Å; I200-I208 WeakPolarHBondContact CA-O 3.26Å; I200-I208 HydrophobicContact CB-CB 4.44Å; I200-I208 HydrophobicContact CD1-CD1 3.97Å; I200-I208 HydrophobicContact CG1-CB 4.09Å; I200-I208 HydrophobicContact CG1-CD1 3.94Å; I200-I208 HydrophobicContact CG1-CG1 4.44Å; I200-I208 HydrophobicContact CG2-CB 4.19Å; I200-I208 HydrophobicContact CG2-CG2 4.21Å; S201-I208 PolarHBondContact N-O 3.13Å; S206-I208 VanDerWaalsContact C-N 3.3Å; S206-I208 WeakPolarHBondContact CB-O 3.34Å; S206-I208 PolarHBondContact O-N 2.99Å; I208-S210 PolarHBondContact O-N 2.84Å; I208-P395 HydrophobicContact CG2-CB 3.85Å; I208-A398 HydrophobicContact CB-CB 4.5Å; I208-A398 HydrophobicContact CD1-CB 3.57Å; I208-A398 HydrophobicContact CG1-CB 3.79Å; I208-A398 HydrophobicContact CG2-CB 3.88Å; I208-M399 HydrophobicContact CD1-CG 3.82Å; I208-L402 HydrophobicContact CD1-CD1 3.9Å; I208-L402 HydrophobicContact CG1-CD1 4.18Å
209	Y	88.5	Confident	90.4	Very high	74 Å²	74	34.1 Å²	34.1	29%	0.29	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.7	173	176.4	-126.8	0	0	0	110	F202 L204 P211	F202-Y209 WeakPolarHBondContact O-CE2 3.48Å; L204-Y209 HydrophobicContact CD2-CD1 4.29Å; L204-Y209 HydrophobicContact CD2-CD2 4.03Å; L204-Y209 HydrophobicContact CD2-CE1 3.88Å; L204-Y209 HydrophobicContact CD2-CE2 3.58Å; L204-Y209 HydrophobicContact CD2-CG 4.35Å; L204-Y209 VanDerWaalsContact CD2-CZ 3.48Å; L204-Y209 HydrophobicContact CG-CE2 4.33Å; Y209-P211 HydrophobicContact CD1-CG 4.22Å; Y209-P211 HydrophobicContact CE1-CB 4.14Å; Y209-P211 HydrophobicContact CE1-CG 3.58Å; Y209-P211 HydrophobicContact CE2-CB 3.78Å; Y209-P211 HydrophobicContact CE2-CG 4.06Å; Y209-P211 WeakPolarHBondContact OH-CB 3.28Å
210	S	91.1	Very high	89.6	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.021	20%	0.2	C	C	.	.			trans	-134.1	80.3	-178.6	-175.8	0	0	0	0	109.2	Q180 S201 F202 I208	Q180-S210 PolarHBondContact NE2-O 3.25Å; Q180-S210 PolarHBondContact NE2-OG 3.13Å; Q180-S210 VanDerWaalsContact NE2-OG 3.1Å; Q180-S210 PolarHBondContact OE1-O 2.84Å; S201-S210 CarbonylContact C-O 3.6Å; S201-S210 PolarHBondContact O-N 3.09Å; F202-S210 PolarHBondContact N-O 3.43Å; I208-S210 PolarHBondContact O-N 2.84Å
211	P	92.2	Very high	88.5	Confident	15 Å²	15	45.4 Å²	45.4	10%	0.097	21%	0.214	C	C	.	.			trans	-77.5	164.9	-179.5	33.4	-36.9	0	0	0	112.6	Y209 G213	Y209-P211 HydrophobicContact CD1-CG 4.22Å; Y209-P211 HydrophobicContact CE1-CB 4.14Å; Y209-P211 HydrophobicContact CE1-CG 3.58Å; Y209-P211 HydrophobicContact CE2-CB 3.78Å; Y209-P211 HydrophobicContact CE2-CG 4.06Å; Y209-P211 WeakPolarHBondContact OH-CB 3.28Å; P211-G213 WeakPolarHBondContact CB-O 3.47Å; P211-G213 PolarHBondContact O-N 2.98Å
212	Y	93.4	Very high	87.3	Confident	23 Å²	23	52.7 Å²	52.7	9%	0.09	25%	0.247	C	C	.	.	S	Bend	trans	-70.9	-16.6	171.1	-76.3	-96.1	0	0	0	113.7	Q180 F202 Y315 T317 Y391	Q180-Y212 VanDerWaalsContact C-OH 3.3Å; Q180-Y212 VanDerWaalsContact O-CE2 3.3Å; Q180-Y212 WeakPolarHBondContact O-CE2 3.31Å; Q180-Y212 PolarHBondContact O-OH 3.4Å; F202-Y212 HydrophobicContact CB-CD2 4.5Å; F202-Y212 HydrophobicContact CD1-CE2 4.39Å; Y212-Y315 HydrophobicContact CE2-CE2 4.18Å; Y212-T317 HydrophobicContact CD2-CG2 4.03Å; Y212-T317 HydrophobicContact CE2-CG2 4.02Å; Y212-T317 HydrophobicContact CG-CG2 4.36Å; Y212-Y391 HydrophobicContact CD1-CD2 4.12Å; Y212-Y391 HydrophobicContact CD1-CE2 4.04Å; Y212-Y391 HydrophobicContact CE1-CE2 4.24Å; Y212-Y391 PolarHBondContact O-N 3.15Å
213	G	92.9	Very high	86.4	Confident	3 Å²	3	53 Å²	53	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	171.8	177.3	0	0	0	0	0	111.5	P211 H389	P211-G213 WeakPolarHBondContact CB-O 3.47Å; P211-G213 PolarHBondContact O-N 2.98Å; G213-H389 CarbonylContact C-O 3.5Å; G213-H389 WeakPolarHBondContact CA-O 3.22Å
214	S	92.4	Very high	85.5	Confident	48 Å²	48	54.7 Å²	54.7	34%	0.336	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	163.9	179.6	61.5	0	0	0	0	110.9	I388 H389	S214-I388 WeakPolarHBondContact O-CA 3.49Å; S214-H389 PolarHBondContact N-O 3.32Å; S214-H389 PolarHBondContact O-N 3.32Å
215	Y	92	Very high	85	Confident	26 Å²	26	58.2 Å²	58.2	10%	0.102	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.6	169.4	172.8	-121.4	0	0	0	109.7	P217 P346 W382 H385 I387 I388	Y215-P217 HydrophobicContact CE1-CB 3.74Å; Y215-P217 HydrophobicContact CE1-CG 4.32Å; Y215-P346 HydrophobicContact CD1-CB 3.86Å; Y215-P346 HydrophobicContact CD1-CG 4.07Å; Y215-P346 HydrophobicContact CD2-CB 4.11Å; Y215-P346 HydrophobicContact CD2-CG 3.67Å; Y215-P346 HydrophobicContact CE1-CB 3.89Å; Y215-P346 HydrophobicContact CE1-CG 4.46Å; Y215-P346 HydrophobicContact CE2-CB 4.13Å; Y215-P346 HydrophobicContact CE2-CG 4.09Å; Y215-P346 HydrophobicContact CG-CB 3.96Å; Y215-P346 HydrophobicContact CG-CG 3.64Å; Y215-W382 HydrophobicContact CE2-CE3 4.02Å; Y215-H385 PolarHBondContact OH-O 3.14Å; Y215-I387 WeakPolarHBondContact CD2-O 3.35Å; Y215-I388 HydrophobicContact CD2-CD1 3.83Å; Y215-I388 HydrophobicContact CG-CD1 4.28Å
216	E	90.3	Very high	84.8	Confident	110 Å²	110	58.3 Å²	58.3	51%	0.514	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.2	172.9	-173.9	-176.1	164.6	0	0	109.5	G386 I387 H389	E216-G386 CarbonylContact O-C 3.6Å; E216-G386 WeakPolarHBondContact O-CA 3.21Å; E216-I387 HydrophobicContact CB-CG2 3.89Å; E216-I387 PolarHBondContact N-O 2.91Å; E216-I387 PolarHBondContact O-N 3.16Å; E216-H389 IonicContact OE2-CE1 3.8Å; E216-H389 IonicContact OE2-NE2 2.67Å; E216-H389 PolarHBondContact OE2-NE2 2.94Å; E216-H389 VanDerWaalsContact OE2-NE2 3.13Å
217	P	91	Very high	84.5	Confident	33 Å²	33	65.6 Å²	65.6	21%	0.214	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	136.9	176.7	32.4	-35	0	0	0	111.1	Y215 I219	Y215-P217 HydrophobicContact CE1-CB 3.74Å; Y215-P217 HydrophobicContact CE1-CG 4.32Å; P217-I219 WeakPolarHBondContact CB-O 3.43Å; P217-I219 PolarHBondContact O-N 2.72Å
218	Y	89.9	Confident	84.6	Confident	148 Å²	148	67.4 Å²	67.4	58%	0.58	32%	0.318	S	S	*	.	S	Bend	trans	-66.3	-27.9	176.4	-57.1	-37.7	0	0	0	112.7	H385 I387	Y218-H385 VanDerWaalsContact CD2-C 3.43Å; Y218-H385 PolarHBondContact N-O 3.01Å; Y218-I387 HydrophobicContact CE1-CB 4.34Å; Y218-I387 HydrophobicContact CE1-CG2 4.32Å
219	I	84.3	Confident	84.6	Confident	134 Å²	134	71.6 Å²	71.6	69%	0.687	35%	0.345	S	S	*	.	S	Bend	trans	-126	124.7	171	-58.4	174.8	0	0	0	106.8	P217 H221	P217-I219 WeakPolarHBondContact CB-O 3.43Å; P217-I219 PolarHBondContact O-N 2.72Å; I219-H221 PolarHBondContact O-N 3.46Å; I219-H221 VanDerWaalsContact O-N 3.14Å
220	K	75.9	Confident	84.8	Confident	180 Å²	180	72.3 Å²	72.3	78%	0.783	35%	0.353	S	S	*	.			trans	-51.9	122	177.1	-170.6	-177.5	178.4	-167.9	0	109.6
221	H	71.3	Confident	84.8	Confident	62 Å²	62	73.4 Å²	73.4	29%	0.287	36%	0.36	S	S	.	.			trans	-80.1	157.3	175.7	61.1	-91.5	0	0	0	110.5	I219 G223 T226	I219-H221 PolarHBondContact O-N 3.46Å; I219-H221 VanDerWaalsContact O-N 3.14Å; H221-G223 PolarHBondContact CD2-O 3.14Å; H221-T226 HydrophobicContact CB-CG2 3.93Å
222	H	67.7	Low	84.8	Confident	155 Å²	155	79.3 Å²	79.3	72%	0.718	40%	0.402	S	S	*	.	S	Bend	trans	-83.5	-20.1	-176.4	-63.2	-73	0	0	0	113.2	T226	H222-T226 PolarHBondContact N-OG1 3.43Å
223	G	72.6	Confident	84.8	Confident	11 Å²	11	84 Å²	84	11%	0.113	42%	0.42	C	S	.	.	S	Bend	trans	169.4	177.1	179.8	0	0	0	0	0	113	H221 E225 T226	H221-G223 PolarHBondContact CD2-O 3.14Å; G223-E225 WeakPolarHBondContact CA-OE1 3.45Å; G223-E225 PolarHBondContact O-N 3.33Å; G223-E225 VanDerWaalsContact O-N 3.14Å; G223-T226 PolarHBondContact N-OG1 2.87Å; G223-T226 VanDerWaalsContact O-CB 3.26Å; G223-T226 WeakPolarHBondContact O-CB 3.15Å; G223-T226 PolarHBondContact O-N 3.32Å; G223-T226 PolarHBondContact O-OG1 3.32Å
224	P	71.2	Confident	85	Confident	60 Å²	60	86.5 Å²	86.5	39%	0.39	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.8	179.3	26	-35.2	0	0	0	113	T226 E342 P347 Y348	P224-T226 VanDerWaalsContact C-N 3.25Å; P224-T226 PolarHBondContact O-N 2.83Å; P224-E342 HydrophobicContact CB-CB 4.36Å; P224-P347 WeakPolarHBondContact O-CB 3.11Å; P224-Y348 WeakPolarHBondContact O-CE2 3.47Å
225	E	76	Confident	85.2	Confident	110 Å²	110	84.3 Å²	84.3	51%	0.514	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.2	174.7	70.2	-69.8	159.4	0	0	114.7	G223 R227	G223-E225 WeakPolarHBondContact CA-OE1 3.45Å; G223-E225 PolarHBondContact O-N 3.33Å; G223-E225 VanDerWaalsContact O-N 3.14Å; E225-R227 PolarHBondContact O-N 2.89Å
226	T	81.3	Confident	85.4	Confident	27 Å²	27	83.2 Å²	83.2	17%	0.166	41%	0.413	C	S	.	.			trans	-58.6	125	179.3	-58.5	0	0	0	0	110.8	H221 H222 G223 P224 Y228	H221-T226 HydrophobicContact CB-CG2 3.93Å; H222-T226 PolarHBondContact N-OG1 3.43Å; G223-T226 PolarHBondContact N-OG1 2.87Å; G223-T226 VanDerWaalsContact O-CB 3.26Å; G223-T226 WeakPolarHBondContact O-CB 3.15Å; G223-T226 PolarHBondContact O-N 3.32Å; G223-T226 PolarHBondContact O-OG1 3.32Å; P224-T226 VanDerWaalsContact C-N 3.25Å; P224-T226 PolarHBondContact O-N 2.83Å; T226-Y228 HydrophobicContact CG2-CE1 4.37Å; T226-Y228 HydrophobicContact CG2-CE2 4.39Å
227	R	83.1	Confident	85.8	Confident	153 Å²	153	82.2 Å²	82.2	58%	0.577	42%	0.419	S	S	*	.			trans	-110.6	116.5	176.2	-64.3	-65.3	-172.7	158.7	1.2	109.6	E225 Y348	E225-R227 PolarHBondContact O-N 2.89Å; R227-Y348 VanDerWaalsContact CD-CE2 3.43Å; R227-Y348 HydrophobicContact CG-CE2 4.23Å; R227-Y348 VanDerWaalsContact CZ-CD1 3.41Å; R227-Y348 PolarHBondContact NH2-OH 3.38Å
228	Y	88.8	Confident	86	Confident	37 Å²	37	83.8 Å²	83.8	15%	0.145	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-81.5	159.6	170.7	-63.2	-73.9	0	0	0	110.8	T226 P347 A381 W382 H385	T226-Y228 HydrophobicContact CG2-CE1 4.37Å; T226-Y228 HydrophobicContact CG2-CE2 4.39Å; Y228-P347 HydrophobicContact CD2-CG 4.16Å; Y228-P347 HydrophobicContact CE2-CG 3.53Å; Y228-A381 WeakPolarHBondContact CB-O 3.38Å; Y228-A381 WeakPolarHBondContact O-CB 3.28Å; Y228-W382 HydrophobicContact CD2-CB 3.99Å; Y228-W382 HydrophobicContact CE2-CB 4.12Å; Y228-H385 HydrophobicContact CD1-CB 3.69Å; Y228-H385 AromaticContact CD1-CD2 3.75Å; Y228-H385 AromaticContact CD1-CG 3.38Å; Y228-H385 AromaticContact CD1-ND1 3.6Å; Y228-H385 HydrophobicContact CD2-CB 4.49Å; Y228-H385 HydrophobicContact CE1-CB 3.56Å; Y228-H385 AromaticContact CE1-CG 3.74Å; Y228-H385 AromaticContact CE1-ND1 3.98Å; Y228-H385 HydrophobicContact CE2-CB 4.35Å; Y228-H385 HydrophobicContact CG-CB 4.17Å; Y228-H385 AromaticContact CG-CD2 3.85Å; Y228-H385 AromaticContact CG-CG 3.89Å
229	P	90.7	Very high	86.4	Confident	91 Å²	91	77.4 Å²	77.4	59%	0.591	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-57.9	153.9	167.1	-21.6	33.9	0	0	0	111.6	A381	P229-A381 WeakPolarHBondContact O-CB 3.3Å
230	L	91.9	Very high	87	Confident	89 Å²	89	75.6 Å²	75.6	47%	0.466	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60.6	145.2	173.8	-71.7	177.4	0	0	0	111.1	T374 N377 E378	L230-T374 HydrophobicContact CD1-CG2 4.15Å; L230-N377 HydrophobicContact CD2-CB 4.44Å; L230-E378 HydrophobicContact CD2-CB 4.3Å; L230-E378 HydrophobicContact CD2-CG 3.76Å
231	P	91.7	Very high	88.1	Confident	26 Å²	26	70.6 Å²	70.6	17%	0.169	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-63.3	146.7	176.1	28.4	-34.5	0	0	0	110.5	R233 I235 N377 F380	P231-R233 PolarHBondContact O-N 3.39Å; P231-I235 HydrophobicContact CB-CD1 4.49Å; P231-I235 HydrophobicContact CG-CD1 4.21Å; P231-N377 HydrophobicContact CG-CB 4.23Å; P231-F380 HydrophobicContact CG-CB 4.45Å
232	S	91.5	Very high	89.3	Confident	140 Å²	140	70.6 Å²	70.6	98%	0.979	39%	0.393	S	S	*	.	S	Bend	trans	-65.8	-26.8	178	57.1	0	0	0	0	113.2
233	R	94.8	Very high	90.8	Very high	120 Å²	120	63.2 Å²	63.2	45%	0.453	36%	0.359	S	S	.	.	S	Bend	trans	-98.8	133.7	175.8	-179	177	63.4	115.3	-3.2	110.1	P231 I235 E328	P231-R233 PolarHBondContact O-N 3.39Å; R233-I235 PolarHBondContact O-N 3.26Å; R233-I235 VanDerWaalsContact O-N 3.14Å; R233-E328 IonicContact CZ-OE1 3.73Å; R233-E328 IonicContact CZ-OE2 2.81Å; R233-E328 IonicContact NH1-OE2 3.39Å; R233-E328 PolarHBondContact NH1-OE2 3.24Å; R233-E328 VanDerWaalsContact NH1-OE2 3.07Å; R233-E328 IonicContact NH2-OE1 3.45Å; R233-E328 PolarHBondContact NH2-OE1 2.95Å; R233-E328 IonicContact NH2-OE2 2.64Å; R233-E328 PolarHBondContact NH2-OE2 3.2Å
234	N	96.5	Very high	92	Very high	57 Å²	57	62.7 Å²	62.7	31%	0.305	35%	0.354	S	S	.	.			trans	-70.2	104	165.8	179.3	2.3	0	0	0	110.1	A236 S237 D373 N377	N234-A236 VanDerWaalsContact C-N 3.25Å; N234-A236 PolarHBondContact O-N 3.4Å; N234-A236 WeakPolarHBondContact OD1-CA 3.38Å; N234-A236 VanDerWaalsContact OD1-CB 3.24Å; N234-A236 WeakPolarHBondContact OD1-CB 3.28Å; N234-A236 PolarHBondContact OD1-N 3.23Å; N234-S237 WeakPolarHBondContact O-CB 3.32Å; N234-S237 PolarHBondContact O-N 3.07Å; N234-S237 PolarHBondContact OD1-N 3.42Å; N234-D373 PolarHBondContact ND2-OD2 2.94Å; N234-N377 PolarHBondContact OD1-ND2 2.84Å
235	I	96.5	Very high	93.2	Very high	1 Å²	1	60 Å²	60	1%	0.005	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.8	179.7	-69.3	164.3	0	0	0	111.7	P231 R233 S237 K239 E328 Y376 N377 F380 H383	P231-I235 HydrophobicContact CB-CD1 4.49Å; P231-I235 HydrophobicContact CG-CD1 4.21Å; R233-I235 PolarHBondContact O-N 3.26Å; R233-I235 VanDerWaalsContact O-N 3.14Å; I235-S237 PolarHBondContact O-N 3.25Å; I235-K239 VanDerWaalsContact O-CD 3.29Å; I235-K239 WeakPolarHBondContact O-CD 3.38Å; I235-K239 WeakPolarHBondContact O-CE 3.47Å; I235-E328 HydrophobicContact CG2-CB 3.98Å; I235-Y376 HydrophobicContact CB-CE1 4.41Å; I235-Y376 HydrophobicContact CG2-CE1 4.14Å; I235-N377 PolarHBondContact N-OD1 3.26Å; I235-F380 HydrophobicContact CD1-CB 3.31Å; I235-F380 HydrophobicContact CD1-CD1 3.75Å; I235-F380 HydrophobicContact CD1-CD2 4.36Å; I235-F380 HydrophobicContact CD1-CG 3.56Å; I235-F380 HydrophobicContact CG2-CD1 4.28Å; I235-F380 HydrophobicContact CG2-CD2 4.34Å; I235-F380 HydrophobicContact CG2-CE1 4.2Å; I235-F380 HydrophobicContact CG2-CE2 4.29Å; I235-F380 HydrophobicContact CG2-CG 4.33Å; I235-F380 HydrophobicContact CG2-CZ 4.18Å; I235-H383 HydrophobicContact CD1-CB 4.41Å
236	A	97.3	Very high	94.1	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.025	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.6	174.5	0	0	0	0	0	112.9	N234 G238 K239 D373 Y376	N234-A236 VanDerWaalsContact C-N 3.25Å; N234-A236 PolarHBondContact O-N 3.4Å; N234-A236 WeakPolarHBondContact OD1-CA 3.38Å; N234-A236 VanDerWaalsContact OD1-CB 3.24Å; N234-A236 WeakPolarHBondContact OD1-CB 3.28Å; N234-A236 PolarHBondContact OD1-N 3.23Å; A236-G238 PolarHBondContact O-N 3.4Å; A236-K239 WeakPolarHBondContact O-CB 3.5Å; A236-K239 PolarHBondContact O-N 2.72Å; A236-D373 HydrophobicContact CB-CB 4.38Å; A236-Y376 HydrophobicContact CB-CD1 3.62Å; A236-Y376 HydrophobicContact CB-CE1 3.91Å; A236-Y376 HydrophobicContact CB-CG 4.31Å
237	S	96.9	Very high	94.7	Very high	89 Å²	89	55.3 Å²	55.3	62%	0.622	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	130.4	-173.3	-171.1	0	0	0	0	112.2	N234 I235 K239	N234-S237 WeakPolarHBondContact O-CB 3.32Å; N234-S237 PolarHBondContact O-N 3.07Å; N234-S237 PolarHBondContact OD1-N 3.42Å; I235-S237 PolarHBondContact O-N 3.25Å; S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.34Å
238	G	96.2	Very high	95	Very high	67 Å²	67	51.2 Å²	51.2	69%	0.691	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-18.7	-179.9	0	0	0	0	0	115.5	A236 S240	A236-G238 PolarHBondContact O-N 3.4Å; G238-S240 PolarHBondContact O-N 3.19Å
239	K	98.2	Very high	95.1	Very high	13 Å²	13	52 Å²	52	6%	0.057	31%	0.313	C	S	.	.			trans	-78.6	112.2	179.5	-63.4	163.4	179.3	-78.4	0	110.3	I235 A236 S237 R298 N300 Y301 K302 E328	I235-K239 VanDerWaalsContact O-CD 3.29Å; I235-K239 WeakPolarHBondContact O-CD 3.38Å; I235-K239 WeakPolarHBondContact O-CE 3.47Å; A236-K239 WeakPolarHBondContact O-CB 3.5Å; A236-K239 PolarHBondContact O-N 2.72Å; S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.34Å; K239-R298 WeakPolarHBondContact CE-O 3.35Å; K239-R298 PolarHBondContact NZ-O 2.89Å; K239-N300 CarbonylContact C-O 3.57Å; K239-Y301 VanDerWaalsContact CD-O 3.26Å; K239-Y301 WeakPolarHBondContact CD-O 3.07Å; K239-Y301 PolarHBondContact NZ-O 3.18Å; K239-K302 HydrophobicContact CB-CG 3.83Å; K239-K302 HydrophobicContact CD-CG 4.07Å; K239-E328 WeakPolarHBondContact CE-O 3.35Å; K239-E328 PolarHBondContact NZ-O 3.48Å
240	S	96.8	Very high	95.3	Very high	96 Å²	96	50.1 Å²	50.1	67%	0.671	30%	0.302	S	S	*	.			trans	-98.5	-16.1	-179.7	64.3	0	0	0	0	114.1	G238 N300	G238-S240 PolarHBondContact O-N 3.19Å; S240-N300 PolarHBondContact N-O 2.96Å
241	K	98.2	Very high	95.3	Very high	76 Å²	76	53 Å²	53	33%	0.33	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	152.4	-179.3	-58.5	-171.5	169.7	-160	0	111.7	D270 N300 Y301 K302	K241-D270 IonicContact NZ-OD2 2.96Å; K241-D270 PolarHBondContact NZ-OD2 2.86Å; K241-N300 WeakPolarHBondContact CA-O 3.17Å; K241-N300 VanDerWaalsContact CB-O 3.29Å; K241-N300 WeakPolarHBondContact CB-O 3.44Å; K241-N300 HydrophobicContact CD-CB 4.36Å; K241-N300 HydrophobicContact CG-CB 4.48Å; K241-N300 PolarHBondContact N-O 3.49Å; K241-Y301 HydrophobicContact CB-CD1 3.43Å; K241-Y301 VanDerWaalsContact CB-CD1 3.43Å; K241-Y301 HydrophobicContact CB-CD2 4.31Å; K241-Y301 HydrophobicContact CB-CE1 3.52Å; K241-Y301 HydrophobicContact CB-CE2 4.43Å; K241-Y301 HydrophobicContact CB-CG 3.87Å; K241-Y301 HydrophobicContact CD-CD1 4.22Å; K241-Y301 HydrophobicContact CD-CD2 4.28Å; K241-Y301 HydrophobicContact CD-CE1 3.53Å; K241-Y301 HydrophobicContact CD-CE2 3.66Å; K241-Y301 VanDerWaalsContact CD-OH 3.29Å; K241-Y301 WeakPolarHBondContact CD-OH 3.24Å; K241-Y301 HydrophobicContact CG-CE1 4.2Å; K241-Y301 PolarHBondContact NZ-OH 3.38Å; K241-Y301 WeakPolarHBondContact O-CA 3.44Å; K241-K302 PolarHBondContact O-N 3.03Å; K241-K302 VanDerWaalsContact O-N 3.1Å
242	K	98.4	Very high	95.3	Very high	61 Å²	61	52.7 Å²	52.7	27%	0.265	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-84.4	-173.9	-64	171.9	-177	161.9	0	110.9	I267 K302 F303 D370	K242-I267 HydrophobicContact CB-CD1 4.16Å; K242-I267 HydrophobicContact CB-CG1 4.17Å; K242-I267 HydrophobicContact CD-CD1 3.91Å; K242-I267 HydrophobicContact CD-CG1 3.61Å; K242-I267 HydrophobicContact CG-CD1 4.47Å; K242-I267 HydrophobicContact CG-CG1 4.48Å; K242-K302 PolarHBondContact O-N 3.32Å; K242-F303 HydrophobicContact CB-CD2 4.42Å; K242-F303 WeakPolarHBondContact O-CD2 3.29Å; K242-F303 PolarHBondContact O-N 3.46Å; K242-D370 WeakPolarHBondContact CE-OD2 3.45Å
243	V	98.8	Very high	95.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.1	-169.6	-172.2	0	0	0	0	110.9	I267 S268 V269 D270 F303 L305 I332 L366	V243-I267 HydrophobicContact CG2-CD1 4.17Å; V243-I267 HydrophobicContact CG2-CG1 4.46Å; V243-I267 HydrophobicContact CG2-CG2 4.32Å; V243-S268 PolarHBondContact N-O 3.09Å; V243-V269 HydrophobicContact CB-CB 4.44Å; V243-V269 HydrophobicContact CB-CG1 4.42Å; V243-V269 HydrophobicContact CB-CG2 4.06Å; V243-V269 HydrophobicContact CG1-CG1 4.09Å; V243-V269 HydrophobicContact CG1-CG2 4.18Å; V243-V269 HydrophobicContact CG2-CG2 4.46Å; V243-D270 PolarHBondContact O-N 2.96Å; V243-F303 WeakPolarHBondContact CA-O 3.29Å; V243-F303 HydrophobicContact CG2-CB 4.13Å; V243-F303 HydrophobicContact CG2-CD2 4.09Å; V243-L305 HydrophobicContact CG1-CD1 4.21Å; V243-L305 HydrophobicContact CG1-CD2 3.61Å; V243-L305 HydrophobicContact CG1-CG 3.54Å; V243-I332 HydrophobicContact CG1-CD1 4.48Å; V243-L366 HydrophobicContact CG2-CD1 4.15Å
244	A	97.5	Very high	95.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.7	167	0	0	0	0	0	110.9	M297 Y301 F303 Y304 L305	A244-M297 HydrophobicContact CB-CG 4.32Å; A244-M297 HydrophobicContact CB-SD 4.02Å; A244-Y301 HydrophobicContact CB-CD1 3.62Å; A244-Y301 HydrophobicContact CB-CD2 4.14Å; A244-Y301 HydrophobicContact CB-CE1 3.84Å; A244-Y301 HydrophobicContact CB-CE2 4.3Å; A244-Y301 HydrophobicContact CB-CG 3.76Å; A244-F303 PolarHBondContact N-O 3.08Å; A244-Y304 HydrophobicContact CB-CD2 4.28Å; A244-Y304 WeakPolarHBondContact O-CA 3.14Å; A244-L305 PolarHBondContact O-N 3.26Å
245	W	97	Very high	95.1	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	124.1	171.8	-172	29.5	0	0	0	111.8	V247 R256 M257 A260 V269 D270 I271 Y272 L305 F307	W245-V247 HydrophobicContact CD2-CB 4.18Å; W245-V247 HydrophobicContact CD2-CG1 3.77Å; W245-V247 HydrophobicContact CE3-CG1 3.86Å; W245-V247 HydrophobicContact CG-CG1 4.34Å; W245-V247 HydrophobicContact CH2-CG1 4.21Å; W245-V247 HydrophobicContact CH2-CG2 4.37Å; W245-V247 HydrophobicContact CZ2-CB 4.03Å; W245-V247 HydrophobicContact CZ2-CG1 4.12Å; W245-V247 HydrophobicContact CZ2-CG2 3.94Å; W245-V247 HydrophobicContact CZ3-CG1 4.05Å; W245-R256 HydrophobicContact CH2-CG 4.48Å; W245-R256 HydrophobicContact CZ2-CB 4.31Å; W245-R256 HydrophobicContact CZ2-CG 4.16Å; W245-M257 HydrophobicContact CH2-CE 4.3Å; W245-M257 HydrophobicContact CH2-SD 3.47Å; W245-M257 WeakPolarHBondContact CH2-SD 3.44Å; W245-M257 HydrophobicContact CZ2-SD 4.3Å; W245-M257 HydrophobicContact CZ3-CE 4.38Å; W245-M257 HydrophobicContact CZ3-SD 4.13Å; W245-A260 HydrophobicContact CD2-CB 4.37Å; W245-A260 HydrophobicContact CE3-CB 3.56Å; W245-A260 HydrophobicContact CH2-CB 3.53Å; W245-A260 HydrophobicContact CZ2-CB 4.34Å; W245-A260 HydrophobicContact CZ3-CB 3.09Å; W245-V269 HydrophobicContact CB-CG1 4.35Å; W245-D270 PolarHBondContact N-O 3.46Å; W245-I271 HydrophobicContact CE3-CD1 4.1Å; W245-I271 HydrophobicContact CE3-CG1 4.15Å; W245-I271 HydrophobicContact CE3-CG2 3.91Å; W245-I271 HydrophobicContact CZ3-CD1 4.39Å; W245-I271 CarbonylContact O-C 3.5Å; W245-I271 WeakPolarHBondContact O-CA 3.09Å; W245-Y272 PolarHBondContact O-N 3.42Å; W245-L305 HydrophobicContact CB-CB 3.91Å; W245-L305 HydrophobicContact CB-CD1 3.9Å; W245-L305 HydrophobicContact CB-CG 4.07Å; W245-L305 VanDerWaalsContact CD1-CB 3.48Å; W245-L305 VanDerWaalsContact CD1-O 3.25Å; W245-L305 HydrophobicContact CD2-CB 4.38Å; W245-L305 HydrophobicContact CD2-CD1 3.98Å; W245-L305 HydrophobicContact CE3-CD1 4.26Å; W245-L305 HydrophobicContact CG-CB 3.67Å; W245-L305 HydrophobicContact CG-CD1 3.86Å; W245-L305 HydrophobicContact CG-CG 4.19Å; W245-F307 HydrophobicContact CZ2-CB 4.46Å; W245-F307 HydrophobicContact CZ2-CD2 4.22Å
246	F	94.1	Very high	95.1	Very high	31 Å²	31	46.8 Å²	46.8	14%	0.136	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118	176.8	-77.8	-121.3	0	0	0	109	Y272 C280 C293 M296 M297 Y304	F246-Y272 AromaticContact CD2-CD2 3.95Å; F246-Y272 HydrophobicContact CD2-CD2 3.95Å; F246-Y272 HydrophobicContact CD2-CG 4.13Å; F246-Y272 HydrophobicContact CE1-CD1 4.4Å; F246-Y272 HydrophobicContact CE1-CG 4.1Å; F246-Y272 HydrophobicContact CE2-CD1 4.32Å; F246-Y272 AromaticContact CE2-CD2 3.38Å; F246-Y272 HydrophobicContact CE2-CD2 3.38Å; F246-Y272 AromaticContact CE2-CE2 3.98Å; F246-Y272 HydrophobicContact CE2-CE2 3.98Å; F246-Y272 AromaticContact CE2-CG 3.58Å; F246-Y272 HydrophobicContact CE2-CG 3.58Å; F246-Y272 AromaticContact CZ-CD1 3.91Å; F246-Y272 HydrophobicContact CZ-CD1 3.91Å; F246-Y272 AromaticContact CZ-CD2 3.83Å; F246-Y272 HydrophobicContact CZ-CD2 3.83Å; F246-Y272 HydrophobicContact CZ-CE1 4.44Å; F246-Y272 HydrophobicContact CZ-CE2 4.37Å; F246-Y272 AromaticContact CZ-CG 3.58Å; F246-Y272 HydrophobicContact CZ-CG 3.58Å; F246-C280 HydrophobicContact CE1-CB 4.21Å; F246-C293 HydrophobicContact CE1-CB 3.91Å; F246-C293 HydrophobicContact CZ-CB 4.03Å; F246-M296 HydrophobicContact CZ-CE 4.28Å; F246-M297 HydrophobicContact CD2-CE 4.35Å; F246-M297 HydrophobicContact CD2-SD 3.58Å; F246-M297 VanDerWaalsContact CD2-SD 3.58Å; F246-M297 HydrophobicContact CE2-CE 4.09Å; F246-M297 HydrophobicContact CE2-CG 3.83Å; F246-M297 HydrophobicContact CE2-SD 3.19Å; F246-M297 WeakPolarHBondContact CE2-SD 3.2Å; F246-M297 HydrophobicContact CZ-CE 4.38Å; F246-M297 HydrophobicContact CZ-CG 4.22Å; F246-M297 HydrophobicContact CZ-SD 3.92Å; F246-Y304 HydrophobicContact CB-CE2 4.43Å; F246-Y304 AromaticContact CD2-CE2 3.98Å; F246-Y304 HydrophobicContact CD2-CE2 3.98Å
247	V	93.4	Very high	95.1	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.042	29%	0.285	C	S	.	.			trans	-149.1	129	-172.5	56.1	0	0	0	0	111.4	W245 M257 I271 Y272 G273 E274 C275	W245-V247 HydrophobicContact CD2-CB 4.18Å; W245-V247 HydrophobicContact CD2-CG1 3.77Å; W245-V247 HydrophobicContact CE3-CG1 3.86Å; W245-V247 HydrophobicContact CG-CG1 4.34Å; W245-V247 HydrophobicContact CH2-CG1 4.21Å; W245-V247 HydrophobicContact CH2-CG2 4.37Å; W245-V247 HydrophobicContact CZ2-CB 4.03Å; W245-V247 HydrophobicContact CZ2-CG1 4.12Å; W245-V247 HydrophobicContact CZ2-CG2 3.94Å; W245-V247 HydrophobicContact CZ3-CG1 4.05Å; V247-M257 HydrophobicContact CG2-SD 4.32Å; V247-I271 HydrophobicContact CG1-CG2 3.68Å; V247-Y272 PolarHBondContact N-O 3.41Å; V247-G273 CarbonylContact O-C 3.47Å; V247-E274 PolarHBondContact O-N 2.92Å; V247-C275 HydrophobicContact CG1-CB 3.87Å; V247-C275 HydrophobicContact CG2-CB 4.39Å; V247-C275 PolarHBondContact O-N 3.17Å
248	S	90.6	Very high	95.1	Very high	67 Å²	67	49.7 Å²	49.7	47%	0.469	28%	0.279	S	S	.	.			trans	-114.1	-35.4	175.9	52.2	0	0	0	0	113	C250 C275	S248-C250 PolarHBondContact O-N 2.77Å; S248-C250 VanDerWaalsContact O-N 3.12Å; S248-C250 PolarHBondContact O-SG 2.78Å; S248-C275 VanDerWaalsContact C-SG 3.52Å; S248-C275 PolarHBondContact O-SG 3.41Å
249	N	91.1	Very high	95.1	Very high	52 Å²	52	46.5 Å²	46.5	28%	0.278	25%	0.246	S	C	.	.			trans	-79.6	96.9	175.3	173.1	9.6	0	0	0	111.3	I251 R256	N249-I251 VanDerWaalsContact OD1-C 3.3Å; N249-I251 PolarHBondContact OD1-N 3.24Å; N249-I251 PolarHBondContact OD1-O 2.76Å; N249-R256 PolarHBondContact O-NH2 2.95Å
250	C	93.5	Very high	95.1	Very high	52 Å²	52	45.9 Å²	45.9	35%	0.351	24%	0.243	S	C	.	.	S	Bend	trans	-83.5	-9.2	-174.5	-45.2	0	0	0	0	114.6	S248 P252 C275	S248-C250 PolarHBondContact O-N 2.77Å; S248-C250 VanDerWaalsContact O-N 3.12Å; S248-C250 PolarHBondContact O-SG 2.78Å; C250-P252 VanDerWaalsContact O-CD 3.3Å; C250-P252 WeakPolarHBondContact O-CD 3.38Å; C250-C275 WeakPolarHBondContact CA-SG 3.32Å; C250-C275 HydrophobicContact CB-CB 3.84Å; C250-C275 WeakPolarHBondContact CB-SG 3.09Å; C250-C275 PolarHBondContact N-SG 2.92Å; C250-C275 WeakPolarHBondContact SG-CA 3.27Å; C250-C275 WeakPolarHBondContact SG-CB 3.1Å; C250-C275 PolarHBondContact SG-N 2.86Å; C250-C275 CovalentContact SG-SG 2.04Å; C250-C275 PolarHBondContact SG-SG 3.47Å
251	I	92.6	Very high	95.2	Very high	150 Å²	150	48 Å²	48	77%	0.769	24%	0.24	S	C	*	.	S	Bend	trans	-122.5	61.2	177.1	-46.3	176.7	0	0	0	108.5	N249	N249-I251 VanDerWaalsContact OD1-C 3.3Å; N249-I251 PolarHBondContact OD1-N 3.24Å; N249-I251 PolarHBondContact OD1-O 2.76Å
252	P	91.5	Very high	95.2	Very high	20 Å²	20	46.6 Å²	46.6	13%	0.13	24%	0.235	C	C	.	.			trans	-69.7	163.7	179.2	32.9	-36.2	0	0	0	110.9	C250 S254 R256 M257	C250-P252 VanDerWaalsContact O-CD 3.3Å; C250-P252 WeakPolarHBondContact O-CD 3.38Å; P252-S254 VanDerWaalsContact C-N 3.33Å; P252-S254 WeakPolarHBondContact CG-O 3.05Å; P252-R256 HydrophobicContact CB-CG 4Å; P252-R256 VanDerWaalsContact CB-NE 3.3Å; P252-R256 HydrophobicContact CG-CG 3.51Å; P252-M257 HydrophobicContact CG-CG 3.74Å
253	K	91.4	Very high	95.2	Very high	150 Å²	150	43.7 Å²	43.7	65%	0.652	22%	0.222	S	C	*	.	S	Bend	trans	-88.6	-8.3	173.9	-62	-72.2	-173.8	-177	0	112.1	V184 N309	V184-K253 HydrophobicContact CG1-CB 3.76Å; V184-K253 HydrophobicContact CG1-CD 4.16Å; V184-K253 HydrophobicContact CG1-CG 3.55Å; K253-N309 PolarHBondContact N-O 3.06Å
254	S	93	Very high	95.2	Very high	5 Å²	5	46 Å²	46	4%	0.035	24%	0.239	C	C	.	.	S	Bend	trans	-90.9	159.2	166.9	68.7	0	0	0	0	112.1	P252 R256 E308 N309	P252-S254 VanDerWaalsContact C-N 3.33Å; P252-S254 WeakPolarHBondContact CG-O 3.05Å; S254-R256 PolarHBondContact O-N 3.14Å; S254-R256 WeakPolarHBondContact OG-CG 3.2Å; S254-E308 PolarHBondContact OG-O 2.77Å; S254-N309 PolarHBondContact N-O 2.87Å; S254-N309 PolarHBondContact OG-O 2.77Å
255	P	94.7	Very high	95.2	Very high	30 Å²	30	54.1 Å²	54.1	20%	0.195	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	20.6	177.7	35	-38	0	0	0	113.7	M257 Q258 Y259 L311 L430	P255-M257 VanDerWaalsContact C-N 3.26Å; P255-M257 PolarHBondContact O-N 2.89Å; P255-Q258 PolarHBondContact O-N 2.97Å; P255-Q258 VanDerWaalsContact O-N 3.13Å; P255-Q258 PolarHBondContact O-OE1 3.41Å; P255-Q258 VanDerWaalsContact O-OE1 3.08Å; P255-Y259 PolarHBondContact O-N 3.05Å; P255-L311 HydrophobicContact CG-CD1 4.37Å; P255-L430 HydrophobicContact CG-CD1 3.43Å; P255-L430 VanDerWaalsContact CG-CD1 3.43Å; P255-L430 HydrophobicContact CG-CG 4.3Å
256	R	96.1	Very high	95.3	Very high	9 Å²	9	57 Å²	57	3%	0.034	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-32.2	-171.8	66.6	179.5	-170.4	165	-1.4	113.6	W245 N249 P252 S254 A260 F307 E308 M334	W245-R256 HydrophobicContact CH2-CG 4.48Å; W245-R256 HydrophobicContact CZ2-CB 4.31Å; W245-R256 HydrophobicContact CZ2-CG 4.16Å; N249-R256 PolarHBondContact O-NH2 2.95Å; P252-R256 HydrophobicContact CB-CG 4Å; P252-R256 VanDerWaalsContact CB-NE 3.3Å; P252-R256 HydrophobicContact CG-CG 3.51Å; S254-R256 PolarHBondContact O-N 3.14Å; S254-R256 WeakPolarHBondContact OG-CG 3.2Å; R256-A260 VanDerWaalsContact O-CB 3.24Å; R256-A260 WeakPolarHBondContact O-CB 3.41Å; R256-A260 PolarHBondContact O-N 3.11Å; R256-F307 HydrophobicContact CB-CB 3.85Å; R256-F307 HydrophobicContact CB-CD2 3.9Å; R256-F307 HydrophobicContact CB-CG 4.28Å; R256-F307 PolarHBondContact NH1-O 2.67Å; R256-E308 WeakPolarHBondContact CD-O 3.36Å; R256-M334 HydrophobicContact CB-SD 3.97Å
257	M	96.6	Very high	95.5	Very high	46 Å²	46	55.9 Å²	55.9	23%	0.227	28%	0.278	C	S	.	.	H	α-helix	trans	-69.1	-43.7	177	-63.9	-55	-60.7	0	0	111.1	W245 V247 P252 P255 K261 C275	W245-M257 HydrophobicContact CH2-CE 4.3Å; W245-M257 HydrophobicContact CH2-SD 3.47Å; W245-M257 WeakPolarHBondContact CH2-SD 3.44Å; W245-M257 HydrophobicContact CZ2-SD 4.3Å; W245-M257 HydrophobicContact CZ3-CE 4.38Å; W245-M257 HydrophobicContact CZ3-SD 4.13Å; V247-M257 HydrophobicContact CG2-SD 4.32Å; P252-M257 HydrophobicContact CG-CG 3.74Å; P255-M257 VanDerWaalsContact C-N 3.26Å; P255-M257 PolarHBondContact O-N 2.89Å; M257-K261 VanDerWaalsContact O-CB 3.25Å; M257-K261 WeakPolarHBondContact O-CB 3.26Å; M257-K261 PolarHBondContact O-N 3.14Å; M257-C275 HydrophobicContact CE-CB 3.82Å; M257-C275 HydrophobicContact SD-CB 4.48Å
258	Q	96.6	Very high	95.8	Very high	106 Å²	106	59.1 Å²	59.1	50%	0.495	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-45.6	176.9	-63.1	84.9	-8.9	0	0	110.6	P255 K261 E262 W432	P255-Q258 PolarHBondContact O-N 2.97Å; P255-Q258 VanDerWaalsContact O-N 3.13Å; P255-Q258 PolarHBondContact O-OE1 3.41Å; P255-Q258 VanDerWaalsContact O-OE1 3.08Å; Q258-K261 PolarHBondContact O-N 3.39Å; Q258-E262 PolarHBondContact O-N 3.42Å; Q258-W432 HydrophobicContact CB-CH2 3.97Å; Q258-W432 HydrophobicContact CB-CZ3 4.31Å
259	Y	98.2	Very high	96.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-47.7	-179.3	-162.2	-70.1	0	0	0	111.7	P255 K261 E262 L263 F307 M334 V353 P359 L362 W432	P255-Y259 PolarHBondContact O-N 3.05Å; Y259-K261 VanDerWaalsContact C-N 3.32Å; Y259-K261 PolarHBondContact O-N 3.27Å; Y259-E262 PolarHBondContact O-N 2.91Å; Y259-L263 HydrophobicContact CD1-CB 4.5Å; Y259-L263 VanDerWaalsContact O-CB 3.31Å; Y259-L263 WeakPolarHBondContact O-CB 3.28Å; Y259-L263 PolarHBondContact O-N 3.14Å; Y259-F307 AromaticContact CD1-CE2 3.92Å; Y259-F307 HydrophobicContact CD1-CE2 3.92Å; Y259-F307 AromaticContact CD1-CZ 3.79Å; Y259-F307 HydrophobicContact CD1-CZ 3.79Å; Y259-F307 HydrophobicContact CE1-CZ 4.18Å; Y259-F307 HydrophobicContact CG-CE2 4.41Å; Y259-M334 VanDerWaalsContact CB-CE 3.43Å; Y259-M334 HydrophobicContact CD1-CE 3.93Å; Y259-M334 HydrophobicContact CD2-CE 3.26Å; Y259-M334 HydrophobicContact CE2-CE 3.99Å; Y259-M334 HydrophobicContact CG-CE 3.26Å; Y259-V353 HydrophobicContact CD1-CG1 4.47Å; Y259-V353 HydrophobicContact CE1-CB 4.41Å; Y259-V353 HydrophobicContact CE1-CG1 3.82Å; Y259-V353 HydrophobicContact CE2-CB 3.93Å; Y259-V353 HydrophobicContact CE2-CG1 4.16Å; Y259-P359 HydrophobicContact CD1-CB 4.27Å; Y259-P359 HydrophobicContact CD1-CG 4Å; Y259-P359 HydrophobicContact CD2-CG 4.08Å; Y259-P359 HydrophobicContact CE1-CB 3.85Å; Y259-P359 HydrophobicContact CE1-CG 3.79Å; Y259-P359 HydrophobicContact CE2-CG 3.87Å; Y259-P359 HydrophobicContact CG-CG 4.12Å; Y259-L362 HydrophobicContact CE1-CD2 3.88Å; Y259-W432 HydrophobicContact CD2-CB 4.42Å; Y259-W432 AromaticContact CD2-CD2 3.76Å; Y259-W432 HydrophobicContact CD2-CD2 3.76Å; Y259-W432 AromaticContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CG 4.31Å; Y259-W432 HydrophobicContact CD2-CH2 4.44Å; Y259-W432 AromaticContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CE2-CB 3.93Å; Y259-W432 HydrophobicContact CE2-CD2 4.02Å; Y259-W432 AromaticContact CE2-CE3 3.93Å; Y259-W432 HydrophobicContact CE2-CE3 3.93Å; Y259-W432 HydrophobicContact CE2-CG 4.08Å; Y259-W432 HydrophobicContact CG-CE3 4.1Å; Y259-W432 HydrophobicContact CG-CZ3 4.01Å
260	A	98.1	Very high	96.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-38	178.8	0	0	0	0	0	112.2	W245 R256 L263 S264 L305 F307	W245-A260 HydrophobicContact CD2-CB 4.37Å; W245-A260 HydrophobicContact CE3-CB 3.56Å; W245-A260 HydrophobicContact CH2-CB 3.53Å; W245-A260 HydrophobicContact CZ2-CB 4.34Å; W245-A260 HydrophobicContact CZ3-CB 3.09Å; R256-A260 VanDerWaalsContact O-CB 3.24Å; R256-A260 WeakPolarHBondContact O-CB 3.41Å; R256-A260 PolarHBondContact O-N 3.11Å; A260-L263 PolarHBondContact O-N 3.39Å; A260-S264 WeakPolarHBondContact O-CB 3.28Å; A260-S264 PolarHBondContact O-N 3.14Å; A260-L305 HydrophobicContact CB-CD1 4.08Å; A260-F307 HydrophobicContact CB-CE2 4.2Å
261	K	97.4	Very high	96.6	Very high	140 Å²	140	55.8 Å²	55.8	61%	0.609	28%	0.275	S	S	*	.	H	α-helix	trans	-61.1	-46.9	173.3	-178.5	178.7	-180	178.9	0	111.3	M257 Q258 Y259 S264	M257-K261 VanDerWaalsContact O-CB 3.25Å; M257-K261 WeakPolarHBondContact O-CB 3.26Å; M257-K261 PolarHBondContact O-N 3.14Å; Q258-K261 PolarHBondContact O-N 3.39Å; Y259-K261 VanDerWaalsContact C-N 3.32Å; Y259-K261 PolarHBondContact O-N 3.27Å; K261-S264 PolarHBondContact O-N 3.14Å; K261-S264 PolarHBondContact O-OG 2.82Å
262	E	98.3	Very high	96.6	Very high	47 Å²	47	49.2 Å²	49.2	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-44.1	177.7	-176.2	54.3	-143.6	0	0	111.3	Q258 Y259 S264 R265 H266 P359 W432	Q258-E262 PolarHBondContact O-N 3.42Å; Y259-E262 PolarHBondContact O-N 2.91Å; E262-S264 VanDerWaalsContact C-N 3.27Å; E262-S264 PolarHBondContact O-N 3.27Å; E262-R265 WeakPolarHBondContact O-CB 3.49Å; E262-R265 PolarHBondContact O-N 3.21Å; E262-R265 VanDerWaalsContact O-N 3.13Å; E262-R265 WeakPolarHBondContact OE2-CD 3.41Å; E262-R265 IonicContact OE2-CZ 2.74Å; E262-R265 IonicContact OE2-NE 3.85Å; E262-R265 IonicContact OE2-NH1 2.77Å; E262-R265 PolarHBondContact OE2-NH1 3.33Å; E262-H266 PolarHBondContact O-CD2 2.91Å; E262-H266 IonicContact OE1-CD2 3.39Å; E262-H266 IonicContact OE1-CE1 3.82Å; E262-H266 IonicContact OE1-NE2 3.73Å; E262-H266 PolarHBondContact OE1-NE2 3.24Å; E262-P359 HydrophobicContact CB-CB 4.22Å; E262-P359 HydrophobicContact CB-CG 3.97Å; E262-P359 HydrophobicContact CG-CB 3.93Å; E262-P359 HydrophobicContact CG-CG 3.74Å; E262-W432 HydrophobicContact CB-CZ2 4.23Å; E262-W432 HydrophobicContact CG-CZ2 4.34Å
263	L	98.7	Very high	96.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.1	-41.4	175.4	-175.7	63	0	0	0	112.1	Y259 A260 R265 H266 I267 V269 L305 P359 L362 A363	Y259-L263 HydrophobicContact CD1-CB 4.5Å; Y259-L263 VanDerWaalsContact O-CB 3.31Å; Y259-L263 WeakPolarHBondContact O-CB 3.28Å; Y259-L263 PolarHBondContact O-N 3.14Å; A260-L263 PolarHBondContact O-N 3.39Å; L263-R265 PolarHBondContact O-N 3.03Å; L263-R265 VanDerWaalsContact O-N 3.1Å; L263-H266 PolarHBondContact O-N 2.68Å; L263-I267 HydrophobicContact CD1-CG2 3.77Å; L263-I267 HydrophobicContact CG-CG2 3.85Å; L263-I267 PolarHBondContact O-N 2.92Å; L263-I267 VanDerWaalsContact O-N 3.15Å; L263-V269 HydrophobicContact CD2-CG2 4.29Å; L263-V269 HydrophobicContact CG-CG2 4.2Å; L263-L305 HydrophobicContact CD2-CD1 4.32Å; L263-L305 HydrophobicContact CD2-CD2 3.9Å; L263-P359 HydrophobicContact CB-CB 4.07Å; L263-P359 HydrophobicContact CD1-CB 4.3Å; L263-P359 VanDerWaalsContact CD1-O 3.27Å; L263-P359 WeakPolarHBondContact CD1-O 3.19Å; L263-L362 HydrophobicContact CD1-CD2 4.14Å; L263-L362 HydrophobicContact CD1-CG 4.28Å; L263-L362 HydrophobicContact CD2-CD2 4.33Å; L263-A363 HydrophobicContact CD1-CB 3.96Å
264	S	98.3	Very high	96.5	Very high	51 Å²	51	50.1 Å²	50.1	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-62.4	-17.3	-178.9	75.2	0	0	0	0	114.5	A260 K261 E262 H266 I267	A260-S264 WeakPolarHBondContact O-CB 3.28Å; A260-S264 PolarHBondContact O-N 3.14Å; K261-S264 PolarHBondContact O-N 3.14Å; K261-S264 PolarHBondContact O-OG 2.82Å; E262-S264 VanDerWaalsContact C-N 3.27Å; E262-S264 PolarHBondContact O-N 3.27Å; S264-H266 VanDerWaalsContact C-N 3.3Å; S264-I267 WeakPolarHBondContact CA-O 3.41Å
265	R	98.5	Very high	96.6	Very high	169 Å²	169	51.2 Å²	51.2	64%	0.638	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-23.7	173.6	-63.5	176	163.7	171.1	-12.5	112.6	E262 L263	E262-R265 WeakPolarHBondContact O-CB 3.49Å; E262-R265 PolarHBondContact O-N 3.21Å; E262-R265 VanDerWaalsContact O-N 3.13Å; E262-R265 WeakPolarHBondContact OE2-CD 3.41Å; E262-R265 IonicContact OE2-CZ 2.74Å; E262-R265 IonicContact OE2-NE 3.85Å; E262-R265 IonicContact OE2-NH1 2.77Å; E262-R265 PolarHBondContact OE2-NH1 3.33Å; L263-R265 PolarHBondContact O-N 3.03Å; L263-R265 VanDerWaalsContact O-N 3.1Å
266	H	98.7	Very high	96.4	Very high	65 Å²	65	51 Å²	51	30%	0.301	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-22.6	-169.9	-56.7	-68.9	0	0	0	112.9	E262 L263 S264 A363 K367	E262-H266 PolarHBondContact O-CD2 2.91Å; E262-H266 IonicContact OE1-CD2 3.39Å; E262-H266 IonicContact OE1-CE1 3.82Å; E262-H266 IonicContact OE1-NE2 3.73Å; E262-H266 PolarHBondContact OE1-NE2 3.24Å; L263-H266 PolarHBondContact O-N 2.68Å; S264-H266 VanDerWaalsContact C-N 3.3Å; H266-A363 HydrophobicContact CB-CB 3.38Å; H266-K367 WeakPolarHBondContact O-CE 3.44Å; H266-K367 PolarHBondContact O-NZ 3.18Å
267	I	98.8	Very high	96.2	Very high	8 Å²	8	57.1 Å²	57.1	4%	0.041	30%	0.303	C	S	.	.	S	Bend	trans	-148.9	147.8	177.8	-169.1	167.9	0	0	0	110.1	K242 V243 L263 S264 V269 A363 L366 K367	K242-I267 HydrophobicContact CB-CD1 4.16Å; K242-I267 HydrophobicContact CB-CG1 4.17Å; K242-I267 HydrophobicContact CD-CD1 3.91Å; K242-I267 HydrophobicContact CD-CG1 3.61Å; K242-I267 HydrophobicContact CG-CD1 4.47Å; K242-I267 HydrophobicContact CG-CG1 4.48Å; V243-I267 HydrophobicContact CG2-CD1 4.17Å; V243-I267 HydrophobicContact CG2-CG1 4.46Å; V243-I267 HydrophobicContact CG2-CG2 4.32Å; L263-I267 HydrophobicContact CD1-CG2 3.77Å; L263-I267 HydrophobicContact CG-CG2 3.85Å; L263-I267 PolarHBondContact O-N 2.92Å; L263-I267 VanDerWaalsContact O-N 3.15Å; S264-I267 WeakPolarHBondContact CA-O 3.41Å; I267-V269 HydrophobicContact CG2-CG2 4.28Å; I267-V269 PolarHBondContact O-N 3.36Å; I267-A363 HydrophobicContact CB-CB 4Å; I267-A363 HydrophobicContact CG2-CB 3.91Å; I267-L366 HydrophobicContact CD1-CB 3.54Å; I267-L366 HydrophobicContact CD1-CD1 4.13Å; I267-K367 HydrophobicContact CD1-CG 4.38Å
268	S	98.4	Very high	96.1	Very high	75 Å²	75	57.6 Å²	57.6	52%	0.524	31%	0.306	S	S	.	.			trans	-63	118.9	177.4	-50.6	0	0	0	0	111.1	V243	V243-S268 PolarHBondContact N-O 3.09Å
269	V	98.6	Very high	95.6	Very high	20 Å²	20	57.3 Å²	57.3	12%	0.121	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	112.4	175	-176.3	0	0	0	0	108.5	V243 W245 L263 I267 I271 L305	V243-V269 HydrophobicContact CB-CB 4.44Å; V243-V269 HydrophobicContact CB-CG1 4.42Å; V243-V269 HydrophobicContact CB-CG2 4.06Å; V243-V269 HydrophobicContact CG1-CG1 4.09Å; V243-V269 HydrophobicContact CG1-CG2 4.18Å; V243-V269 HydrophobicContact CG2-CG2 4.46Å; W245-V269 HydrophobicContact CB-CG1 4.35Å; L263-V269 HydrophobicContact CD2-CG2 4.29Å; L263-V269 HydrophobicContact CG-CG2 4.2Å; I267-V269 HydrophobicContact CG2-CG2 4.28Å; I267-V269 PolarHBondContact O-N 3.36Å; V269-I271 HydrophobicContact CG1-CG1 3.95Å; V269-L305 HydrophobicContact CG1-CD1 4Å
270	D	97.5	Very high	94.7	Very high	44 Å²	44	58.9 Å²	58.9	24%	0.235	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.6	175.4	-77.1	-2.8	0	0	0	109	K241 V243 W245 Y272 L278 Y301	K241-D270 IonicContact NZ-OD2 2.96Å; K241-D270 PolarHBondContact NZ-OD2 2.86Å; V243-D270 PolarHBondContact O-N 2.96Å; W245-D270 PolarHBondContact N-O 3.46Å; D270-Y272 HydrophobicContact CB-CE2 3.88Å; D270-L278 HydrophobicContact CB-CD1 3.55Å; D270-Y301 HydrophobicContact CB-CE1 3.72Å; D270-Y301 VanDerWaalsContact CB-OH 3.25Å; D270-Y301 WeakPolarHBondContact CB-OH 3.38Å; D270-Y301 VanDerWaalsContact CG-OH 3.29Å; D270-Y301 WeakPolarHBondContact OD2-CE1 3.36Å; D270-Y301 PolarHBondContact OD2-OH 3.39Å
271	I	96.1	Very high	93.3	Very high	36 Å²	36	62.4 Å²	62.4	19%	0.185	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119	-174.6	-48.7	178.8	0	0	0	109.8	W245 V247 V269 G276 T277 L278	W245-I271 HydrophobicContact CE3-CD1 4.1Å; W245-I271 HydrophobicContact CE3-CG1 4.15Å; W245-I271 HydrophobicContact CE3-CG2 3.91Å; W245-I271 HydrophobicContact CZ3-CD1 4.39Å; W245-I271 CarbonylContact O-C 3.5Å; W245-I271 WeakPolarHBondContact O-CA 3.09Å; V247-I271 HydrophobicContact CG1-CG2 3.68Å; V269-I271 HydrophobicContact CG1-CG1 3.95Å; I271-G276 WeakPolarHBondContact O-CA 3.5Å; I271-T277 PolarHBondContact O-N 2.69Å; I271-L278 WeakPolarHBondContact O-CB 3.2Å; I271-L278 PolarHBondContact O-N 3.45Å; I271-L278 VanDerWaalsContact O-N 3.14Å
272	Y	93.5	Very high	91.4	Very high	13 Å²	13	65.2 Å²	65.2	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.5	179.2	-65.8	-99.3	0	0	0	111.7	W245 F246 V247 D270 L278 M296 Y301	W245-Y272 PolarHBondContact O-N 3.42Å; F246-Y272 AromaticContact CD2-CD2 3.95Å; F246-Y272 HydrophobicContact CD2-CD2 3.95Å; F246-Y272 HydrophobicContact CD2-CG 4.13Å; F246-Y272 HydrophobicContact CE1-CD1 4.4Å; F246-Y272 HydrophobicContact CE1-CG 4.1Å; F246-Y272 HydrophobicContact CE2-CD1 4.32Å; F246-Y272 AromaticContact CE2-CD2 3.38Å; F246-Y272 HydrophobicContact CE2-CD2 3.38Å; F246-Y272 AromaticContact CE2-CE2 3.98Å; F246-Y272 HydrophobicContact CE2-CE2 3.98Å; F246-Y272 AromaticContact CE2-CG 3.58Å; F246-Y272 HydrophobicContact CE2-CG 3.58Å; F246-Y272 AromaticContact CZ-CD1 3.91Å; F246-Y272 HydrophobicContact CZ-CD1 3.91Å; F246-Y272 AromaticContact CZ-CD2 3.83Å; F246-Y272 HydrophobicContact CZ-CD2 3.83Å; F246-Y272 HydrophobicContact CZ-CE1 4.44Å; F246-Y272 HydrophobicContact CZ-CE2 4.37Å; F246-Y272 AromaticContact CZ-CG 3.58Å; F246-Y272 HydrophobicContact CZ-CG 3.58Å; V247-Y272 PolarHBondContact N-O 3.41Å; D270-Y272 HydrophobicContact CB-CE2 3.88Å; Y272-L278 VanDerWaalsContact CA-O 3.3Å; Y272-L278 WeakPolarHBondContact CA-O 3.38Å; Y272-L278 HydrophobicContact CD1-CB 3.53Å; Y272-L278 HydrophobicContact CD2-CB 4.35Å; Y272-L278 HydrophobicContact CD2-CD1 4.26Å; Y272-L278 HydrophobicContact CE1-CB 3.64Å; Y272-L278 HydrophobicContact CE1-CD1 4.09Å; Y272-L278 HydrophobicContact CE1-CG 4.49Å; Y272-L278 HydrophobicContact CE2-CB 4.44Å; Y272-L278 HydrophobicContact CE2-CD1 3.78Å; Y272-L278 HydrophobicContact CG-CB 3.91Å; Y272-M296 HydrophobicContact CE1-CE 4.15Å; Y272-M296 HydrophobicContact CE1-SD 4.48Å; Y272-M296 HydrophobicContact CE2-CE 4.41Å; Y272-Y301 WeakPolarHBondContact CE2-OH 3.06Å; Y272-Y301 PolarHBondContact OH-OH 3.2Å
273	G	90.3	Very high	89.1	Confident	34 Å²	34	72.8 Å²	72.8	35%	0.351	39%	0.39	S	S	.	.	S	Bend	trans	98.5	-165.3	176.4	0	0	0	0	0	112.7	V247 C275 G276 L278	V247-G273 CarbonylContact O-C 3.47Å; G273-C275 PolarHBondContact O-N 2.86Å; G273-C275 VanDerWaalsContact O-N 3.15Å; G273-G276 PolarHBondContact O-N 3.44Å; G273-G276 VanDerWaalsContact O-N 3.11Å; G273-L278 PolarHBondContact N-O 2.03Å; G273-L278 VanDerWaalsContact N-O 3.1Å
274	E	91.1	Very high	86.6	Confident	154 Å²	154	78.2 Å²	78.2	72%	0.72	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22	-170	-57.2	-177.7	172.4	0	0	113.8	V247	V247-E274 PolarHBondContact O-N 2.92Å
275	C	93.6	Very high	83.8	Confident	29 Å²	29	82 Å²	82	20%	0.196	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	2.3	-179.6	-37.1	0	0	0	0	113.6	V247 S248 C250 M257 G273	V247-C275 HydrophobicContact CG1-CB 3.87Å; V247-C275 HydrophobicContact CG2-CB 4.39Å; V247-C275 PolarHBondContact O-N 3.17Å; S248-C275 VanDerWaalsContact C-SG 3.52Å; S248-C275 PolarHBondContact O-SG 3.41Å; C250-C275 WeakPolarHBondContact CA-SG 3.32Å; C250-C275 HydrophobicContact CB-CB 3.84Å; C250-C275 WeakPolarHBondContact CB-SG 3.09Å; C250-C275 PolarHBondContact N-SG 2.92Å; C250-C275 WeakPolarHBondContact SG-CA 3.27Å; C250-C275 WeakPolarHBondContact SG-CB 3.1Å; C250-C275 PolarHBondContact SG-N 2.86Å; C250-C275 CovalentContact SG-SG 2.04Å; C250-C275 PolarHBondContact SG-SG 3.47Å; M257-C275 HydrophobicContact CE-CB 3.82Å; M257-C275 HydrophobicContact SD-CB 4.48Å; G273-C275 PolarHBondContact O-N 2.86Å; G273-C275 VanDerWaalsContact O-N 3.15Å
276	G	91.1	Very high	81	Confident	25 Å²	25	77.7 Å²	77.7	26%	0.258	43%	0.434	S	S	.	.	S	Bend	trans	-118.9	177.7	-179	0	0	0	0	0	112.4	I271 G273	I271-G276 WeakPolarHBondContact O-CA 3.5Å; G273-G276 PolarHBondContact O-N 3.44Å; G273-G276 VanDerWaalsContact O-N 3.11Å
277	T	92.5	Very high	78.4	Confident	137 Å²	137	85.2 Å²	85.2	84%	0.84	47%	0.466	S	S	*	.	S	Bend	trans	-96.8	-13.6	175.4	56.1	0	0	0	0	112.4	I271	I271-T277 PolarHBondContact O-N 2.69Å
278	L	93.3	Very high	76.2	Confident	56 Å²	56	87.5 Å²	87.5	29%	0.293	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-95.4	144.4	179.9	-55.4	175.3	0	0	0	110.1	D270 I271 Y272 G273	D270-L278 HydrophobicContact CB-CD1 3.55Å; I271-L278 WeakPolarHBondContact O-CB 3.2Å; I271-L278 PolarHBondContact O-N 3.45Å; I271-L278 VanDerWaalsContact O-N 3.14Å; Y272-L278 VanDerWaalsContact CA-O 3.3Å; Y272-L278 WeakPolarHBondContact CA-O 3.38Å; Y272-L278 HydrophobicContact CD1-CB 3.53Å; Y272-L278 HydrophobicContact CD2-CB 4.35Å; Y272-L278 HydrophobicContact CD2-CD1 4.26Å; Y272-L278 HydrophobicContact CE1-CB 3.64Å; Y272-L278 HydrophobicContact CE1-CD1 4.09Å; Y272-L278 HydrophobicContact CE1-CG 4.49Å; Y272-L278 HydrophobicContact CE2-CB 4.44Å; Y272-L278 HydrophobicContact CE2-CD1 3.78Å; Y272-L278 HydrophobicContact CG-CB 3.91Å; G273-L278 PolarHBondContact N-O 2.03Å; G273-L278 VanDerWaalsContact N-O 3.1Å
279	S	87.2	Confident	74.5	Confident	100 Å²	100	84.6 Å²	84.6	70%	0.699	46%	0.46	S	S	*	.			trans	-115.8	138.7	174.8	-71.8	0	0	0	0	109.7
280	C	79.4	Confident	73.3	Confident	33 Å²	33	84.1 Å²	84.1	22%	0.223	46%	0.457	C	S	.	.			trans	-65.1	128.9	165.8	176.7	0	0	0	0	108.2	F246 K282 S290 C293	F246-C280 HydrophobicContact CE1-CB 4.21Å; C280-K282 PolarHBondContact O-N 2.8Å; C280-S290 PolarHBondContact SG-OG 3.45Å; C280-C293 WeakPolarHBondContact CA-SG 3.19Å; C280-C293 HydrophobicContact CB-CB 4.17Å; C280-C293 WeakPolarHBondContact CB-SG 3.34Å; C280-C293 WeakPolarHBondContact SG-CB 3.34Å; C280-C293 CovalentContact SG-SG 2.01Å; C280-C293 PolarHBondContact SG-SG 3.2Å
281	P	68.4	Low	72.5	Confident	74 Å²	74	88 Å²	88	48%	0.481	48%	0.482	S	S	.	.			trans	-55.1	114.5	172.5	-25.2	34.5	0	0	0	109.2	Y283 C293	P281-Y283 VanDerWaalsContact C-N 3.31Å; P281-Y283 HydrophobicContact CB-CD2 4.24Å; P281-Y283 HydrophobicContact CB-CE2 4.34Å; P281-Y283 PolarHBondContact O-N 3.35Å; P281-C293 VanDerWaalsContact CD-SG 3.58Å
282	K	56.8	Low	72	Confident	199 Å²	199	88.3 Å²	88.3	87%	0.865	50%	0.495	S	S	*	.			trans	-66.6	90.3	178.6	-69.5	-178.2	-178.4	177.5	0	108.5	C280	C280-K282 PolarHBondContact O-N 2.8Å
283	Y	49.8	Very low	71.8	Confident	207 Å²	207	87.7 Å²	87.7	81%	0.812	49%	0.492	S	S	*	.	S	Bend	trans	-91.7	-28.8	162.1	-85.7	-81.2	0	0	0	111.4	P281	P281-Y283 VanDerWaalsContact C-N 3.31Å; P281-Y283 HydrophobicContact CB-CD2 4.24Å; P281-Y283 HydrophobicContact CB-CE2 4.34Å; P281-Y283 PolarHBondContact O-N 3.35Å
284	I	47.4	Very low	71.7	Confident	114 Å²	114	86.9 Å²	86.9	59%	0.585	48%	0.48	S	S	*	.	S	Bend	trans	-149.3	131.8	174.4	-53.2	-179.8	0	0	0	109	T286	I284-T286 HydrophobicContact CG2-CG2 4.3Å; I284-T286 PolarHBondContact O-N 3.32Å
285	P	39.2	Very low	71.8	Confident	130 Å²	130	85.1 Å²	85.1	84%	0.844	47%	0.47	S	S	*	.			trans	-76.6	90.6	175.5	30.6	-30.7	0	0	0	110
286	T	40	Very low	71.7	Confident	79 Å²	79	85.8 Å²	85.8	49%	0.485	47%	0.471	S	S	.	.			trans	-121.7	146.9	159.5	58.3	0	0	0	0	109.1	I284 T288	I284-T286 HydrophobicContact CG2-CG2 4.3Å; I284-T286 PolarHBondContact O-N 3.32Å; T286-T288 PolarHBondContact O-N 3.44Å; T286-T288 VanDerWaalsContact O-O 3.11Å; T286-T288 PolarHBondContact OG1-OG1 2.89Å
287	F	43.9	Very low	71.9	Confident	223 Å²	223	84.6 Å²	84.6	98%	0.978	46%	0.458	S	S	*	.	S	Bend	trans	-64.8	-4.7	178.5	-83.5	-90.4	0	0	0	113.8
288	T	53.2	Low	72	Confident	55 Å²	55	82.6 Å²	82.6	34%	0.337	44%	0.435	S	S	.	.	S	Bend	trans	-98.4	152	174.7	58.4	0	0	0	0	109.9	T286 S290	T286-T288 PolarHBondContact O-N 3.44Å; T286-T288 VanDerWaalsContact O-O 3.11Å; T286-T288 PolarHBondContact OG1-OG1 2.89Å; T288-S290 PolarHBondContact O-N 2.58Å
289	S	62.1	Low	72.1	Confident	14 Å²	14	84.9 Å²	84.9	10%	0.098	44%	0.444	C	S	.	.			trans	-40.3	112.3	164.6	-46.5	0	0	0	0	109.3	N323	S289-N323 PolarHBondContact OG-OD1 2.87Å
290	S	72.1	Confident	72.6	Confident	10 Å²	10	82.5 Å²	82.5	7%	0.07	42%	0.424	C	S	.	.			trans	-58.9	154.8	-176.1	75	0	0	0	0	109.6	C280 T288 G292 C293 L294	C280-S290 PolarHBondContact SG-OG 3.45Å; T288-S290 PolarHBondContact O-N 2.58Å; S290-G292 PolarHBondContact O-N 3.34Å; S290-G292 VanDerWaalsContact O-N 3.08Å; S290-C293 WeakPolarHBondContact O-CA 3.42Å; S290-C293 PolarHBondContact O-N 2.61Å; S290-C293 PolarHBondContact OG-N 2.78Å; S290-L294 PolarHBondContact O-N 3.49Å
291	V	81.7	Confident	73.5	Confident	125 Å²	125	81 Å²	81	76%	0.758	41%	0.414	S	S	*	.	H	α-helix	trans	-50.7	-38.8	178.6	176.5	0	0	0	0	111.4	K295	V291-K295 WeakPolarHBondContact O-CB 3.31Å; V291-K295 PolarHBondContact O-N 2.85Å
292	G	85.1	Confident	74.9	Confident	43 Å²	43	78 Å²	78	44%	0.443	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-38.3	175.2	0	0	0	0	0	113.9	S290 M296	S290-G292 PolarHBondContact O-N 3.34Å; S290-G292 VanDerWaalsContact O-N 3.08Å; G292-M296 WeakPolarHBondContact O-CB 3.35Å; G292-M296 PolarHBondContact O-N 3.36Å
293	C	88.7	Confident	76.9	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.007	35%	0.352	C	S	.	.	H	α-helix	trans	-74.6	-38	177.3	-76.2	0	0	0	0	113	F246 C280 P281 S290 K295 M296 M297	F246-C293 HydrophobicContact CE1-CB 3.91Å; F246-C293 HydrophobicContact CZ-CB 4.03Å; C280-C293 WeakPolarHBondContact CA-SG 3.19Å; C280-C293 HydrophobicContact CB-CB 4.17Å; C280-C293 WeakPolarHBondContact CB-SG 3.34Å; C280-C293 WeakPolarHBondContact SG-CB 3.34Å; C280-C293 CovalentContact SG-SG 2.01Å; C280-C293 PolarHBondContact SG-SG 3.2Å; P281-C293 VanDerWaalsContact CD-SG 3.58Å; S290-C293 WeakPolarHBondContact O-CA 3.42Å; S290-C293 PolarHBondContact O-N 2.61Å; S290-C293 PolarHBondContact OG-N 2.78Å; C293-K295 VanDerWaalsContact C-N 3.31Å; C293-K295 PolarHBondContact O-N 3.39Å; C293-M296 PolarHBondContact O-N 3.1Å; C293-M297 WeakPolarHBondContact O-CB 3.45Å; C293-M297 WeakPolarHBondContact O-CG 3.41Å; C293-M297 PolarHBondContact O-N 2.88Å
294	L	90.2	Very high	79.2	Confident	16 Å²	16	58.8 Å²	58.8	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-59.6	-44.3	171	-69.5	178.2	0	0	0	110.9	S290 M297 R298	S290-L294 PolarHBondContact O-N 3.49Å; L294-M297 HydrophobicContact CD2-CE 3.49Å; L294-M297 VanDerWaalsContact CD2-CE 3.49Å; L294-M297 PolarHBondContact O-N 3.03Å; L294-R298 WeakPolarHBondContact O-CB 3.3Å; L294-R298 PolarHBondContact O-N 3.36Å
295	K	91.8	Very high	81.7	Confident	118 Å²	118	53.4 Å²	53.4	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-50.5	174	-177.3	-175.7	171.1	-170.2	0	112	V291 C293 M297 R298 E299	V291-K295 WeakPolarHBondContact O-CB 3.31Å; V291-K295 PolarHBondContact O-N 2.85Å; C293-K295 VanDerWaalsContact C-N 3.31Å; C293-K295 PolarHBondContact O-N 3.39Å; K295-M297 VanDerWaalsContact C-N 3.26Å; K295-M297 PolarHBondContact O-N 3.17Å; K295-R298 WeakPolarHBondContact O-CB 3.2Å; K295-R298 PolarHBondContact O-N 3.05Å; K295-R298 VanDerWaalsContact O-N 3.15Å; K295-E299 WeakPolarHBondContact CE-OE1 3.17Å; K295-E299 HydrophobicContact CG-CG 4.5Å; K295-E299 IonicContact NZ-OE1 2.87Å; K295-E299 WeakPolarHBondContact O-CG 3.44Å; K295-E299 PolarHBondContact O-N 2.9Å
296	M	92.7	Very high	84.5	Confident	43 Å²	43	47.2 Å²	47.2	21%	0.212	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-41.3	176.6	176.2	-144.9	63.3	0	0	111.4	F246 Y272 G292 C293 E299 N300 Y301	F246-M296 HydrophobicContact CZ-CE 4.28Å; Y272-M296 HydrophobicContact CE1-CE 4.15Å; Y272-M296 HydrophobicContact CE1-SD 4.48Å; Y272-M296 HydrophobicContact CE2-CE 4.41Å; G292-M296 WeakPolarHBondContact O-CB 3.35Å; G292-M296 PolarHBondContact O-N 3.36Å; C293-M296 PolarHBondContact O-N 3.1Å; M296-E299 PolarHBondContact O-N 3.14Å; M296-N300 WeakPolarHBondContact O-CB 3.39Å; M296-N300 PolarHBondContact O-N 3.02Å; M296-N300 PolarHBondContact O-ND2 3.42Å; M296-Y301 HydrophobicContact CE-CE2 4.11Å
297	M	93.9	Very high	87.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-50.1	175.4	-77.5	-165	-61.1	0	0	111.7	A244 F246 C293 L294 K295 E299 N300 Y301 Y304 L329	A244-M297 HydrophobicContact CB-CG 4.32Å; A244-M297 HydrophobicContact CB-SD 4.02Å; F246-M297 HydrophobicContact CD2-CE 4.35Å; F246-M297 HydrophobicContact CD2-SD 3.58Å; F246-M297 VanDerWaalsContact CD2-SD 3.58Å; F246-M297 HydrophobicContact CE2-CE 4.09Å; F246-M297 HydrophobicContact CE2-CG 3.83Å; F246-M297 HydrophobicContact CE2-SD 3.19Å; F246-M297 WeakPolarHBondContact CE2-SD 3.2Å; F246-M297 HydrophobicContact CZ-CE 4.38Å; F246-M297 HydrophobicContact CZ-CG 4.22Å; F246-M297 HydrophobicContact CZ-SD 3.92Å; C293-M297 WeakPolarHBondContact O-CB 3.45Å; C293-M297 WeakPolarHBondContact O-CG 3.41Å; C293-M297 PolarHBondContact O-N 2.88Å; L294-M297 HydrophobicContact CD2-CE 3.49Å; L294-M297 VanDerWaalsContact CD2-CE 3.49Å; L294-M297 PolarHBondContact O-N 3.03Å; K295-M297 VanDerWaalsContact C-N 3.26Å; K295-M297 PolarHBondContact O-N 3.17Å; M297-E299 PolarHBondContact O-N 2.04Å; M297-N300 PolarHBondContact O-N 3.15Å; M297-Y301 HydrophobicContact CG-CD2 4.43Å; M297-Y301 PolarHBondContact O-N 3.12Å; M297-Y304 HydrophobicContact CE-CD2 4.42Å; M297-Y304 HydrophobicContact CE-CE2 4.14Å; M297-Y304 HydrophobicContact SD-CD2 3.65Å; M297-Y304 HydrophobicContact SD-CE2 3.64Å; M297-L329 HydrophobicContact CB-CD1 3.97Å; M297-L329 HydrophobicContact CB-CD2 4Å
298	R	95.4	Very high	89.8	Confident	94 Å²	94	32.8 Å²	32.8	36%	0.355	18%	0.176	S	C	.	.	H	α-helix	trans	-54.7	-40.3	176.4	-177.2	-176.5	-54.3	-153.3	2.8	112.2	K239 L294 K295 N326 N327 E328	K239-R298 WeakPolarHBondContact CE-O 3.35Å; K239-R298 PolarHBondContact NZ-O 2.89Å; L294-R298 WeakPolarHBondContact O-CB 3.3Å; L294-R298 PolarHBondContact O-N 3.36Å; K295-R298 WeakPolarHBondContact O-CB 3.2Å; K295-R298 PolarHBondContact O-N 3.05Å; K295-R298 VanDerWaalsContact O-N 3.15Å; R298-N326 PolarHBondContact NH2-O 3.33Å; R298-N327 WeakPolarHBondContact CA-O 3.2Å; R298-N327 HydrophobicContact CB-CB 4.43Å; R298-N327 VanDerWaalsContact CB-O 3.26Å; R298-N327 WeakPolarHBondContact CB-O 3.36Å; R298-N327 VanDerWaalsContact CG-O 3.27Å; R298-N327 WeakPolarHBondContact CG-O 3.49Å; R298-N327 PolarHBondContact NE-OD1 3.26Å; R298-N327 PolarHBondContact NH2-OD1 3.39Å; R298-E328 HydrophobicContact CG-CB 4.27Å; R298-E328 HydrophobicContact CG-CG 4.42Å
299	E	95.5	Very high	91.9	Very high	104 Å²	104	30.9 Å²	30.9	49%	0.486	16%	0.164	S	C	.	.	H	α-helix	trans	-81	-27.8	-176.2	-69.7	173.5	165.5	0	0	113.4	K295 M296 M297	K295-E299 WeakPolarHBondContact CE-OE1 3.17Å; K295-E299 HydrophobicContact CG-CG 4.5Å; K295-E299 IonicContact NZ-OE1 2.87Å; K295-E299 WeakPolarHBondContact O-CG 3.44Å; K295-E299 PolarHBondContact O-N 2.9Å; M296-E299 PolarHBondContact O-N 3.14Å; M297-E299 PolarHBondContact O-N 2.04Å
300	N	96.8	Very high	93.5	Very high	51 Å²	51	30.2 Å²	30.2	27%	0.273	16%	0.159	S	C	.	.	H	α-helix	trans	-114.7	-28.4	-168	-64.3	-77.7	0	0	0	115.1	K239 S240 K241 M296 M297	K239-N300 CarbonylContact C-O 3.57Å; S240-N300 PolarHBondContact N-O 2.96Å; K241-N300 WeakPolarHBondContact CA-O 3.17Å; K241-N300 VanDerWaalsContact CB-O 3.29Å; K241-N300 WeakPolarHBondContact CB-O 3.44Å; K241-N300 HydrophobicContact CD-CB 4.36Å; K241-N300 HydrophobicContact CG-CB 4.48Å; K241-N300 PolarHBondContact N-O 3.49Å; M296-N300 WeakPolarHBondContact O-CB 3.39Å; M296-N300 PolarHBondContact O-N 3.02Å; M296-N300 PolarHBondContact O-ND2 3.42Å; M297-N300 PolarHBondContact O-N 3.15Å
301	Y	98.4	Very high	94.7	Very high	1 Å²	1	31 Å²	31	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.5	-170	-66.6	-97.5	0	0	0	112.9	K239 K241 A244 D270 Y272 M296 M297	K239-Y301 VanDerWaalsContact CD-O 3.26Å; K239-Y301 WeakPolarHBondContact CD-O 3.07Å; K239-Y301 PolarHBondContact NZ-O 3.18Å; K241-Y301 HydrophobicContact CB-CD1 3.43Å; K241-Y301 VanDerWaalsContact CB-CD1 3.43Å; K241-Y301 HydrophobicContact CB-CD2 4.31Å; K241-Y301 HydrophobicContact CB-CE1 3.52Å; K241-Y301 HydrophobicContact CB-CE2 4.43Å; K241-Y301 HydrophobicContact CB-CG 3.87Å; K241-Y301 HydrophobicContact CD-CD1 4.22Å; K241-Y301 HydrophobicContact CD-CD2 4.28Å; K241-Y301 HydrophobicContact CD-CE1 3.53Å; K241-Y301 HydrophobicContact CD-CE2 3.66Å; K241-Y301 VanDerWaalsContact CD-OH 3.29Å; K241-Y301 WeakPolarHBondContact CD-OH 3.24Å; K241-Y301 HydrophobicContact CG-CE1 4.2Å; K241-Y301 PolarHBondContact NZ-OH 3.38Å; K241-Y301 WeakPolarHBondContact O-CA 3.44Å; A244-Y301 HydrophobicContact CB-CD1 3.62Å; A244-Y301 HydrophobicContact CB-CD2 4.14Å; A244-Y301 HydrophobicContact CB-CE1 3.84Å; A244-Y301 HydrophobicContact CB-CE2 4.3Å; A244-Y301 HydrophobicContact CB-CG 3.76Å; D270-Y301 HydrophobicContact CB-CE1 3.72Å; D270-Y301 VanDerWaalsContact CB-OH 3.25Å; D270-Y301 WeakPolarHBondContact CB-OH 3.38Å; D270-Y301 VanDerWaalsContact CG-OH 3.29Å; D270-Y301 WeakPolarHBondContact OD2-CE1 3.36Å; D270-Y301 PolarHBondContact OD2-OH 3.39Å; Y272-Y301 WeakPolarHBondContact CE2-OH 3.06Å; Y272-Y301 PolarHBondContact OH-OH 3.2Å; M296-Y301 HydrophobicContact CE-CE2 4.11Å; M297-Y301 HydrophobicContact CG-CD2 4.43Å; M297-Y301 PolarHBondContact O-N 3.12Å
302	K	98.7	Very high	95.4	Very high	12 Å²	12	25.1 Å²	25.1	5%	0.052	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-42	173.7	-68.6	-173.6	-177.7	177.5	0	112.7	K239 K241 K242 L330 D370 Y376	K239-K302 HydrophobicContact CB-CG 3.83Å; K239-K302 HydrophobicContact CD-CG 4.07Å; K241-K302 PolarHBondContact O-N 3.03Å; K241-K302 VanDerWaalsContact O-N 3.1Å; K242-K302 PolarHBondContact O-N 3.32Å; K302-L330 PolarHBondContact O-N 3.24Å; K302-D370 WeakPolarHBondContact CD-OD1 3.44Å; K302-D370 WeakPolarHBondContact CE-OD1 3.3Å; K302-D370 PolarHBondContact NZ-O 2.82Å; K302-D370 IonicContact NZ-OD1 3.99Å; K302-D370 PolarHBondContact NZ-OD1 3.13Å; K302-Y376 HydrophobicContact CB-CE2 3.72Å; K302-Y376 HydrophobicContact CD-CE2 4.48Å; K302-Y376 HydrophobicContact CG-CE2 4.25Å; K302-Y376 PolarHBondContact O-OH 3.19Å
303	F	98.9	Very high	95.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.4	-172.2	-44.3	-73.9	0	0	0	111.7	K242 V243 A244 L330 I332 L366 L369 D370 Y376	K242-F303 HydrophobicContact CB-CD2 4.42Å; K242-F303 WeakPolarHBondContact O-CD2 3.29Å; K242-F303 PolarHBondContact O-N 3.46Å; V243-F303 WeakPolarHBondContact CA-O 3.29Å; V243-F303 HydrophobicContact CG2-CB 4.13Å; V243-F303 HydrophobicContact CG2-CD2 4.09Å; A244-F303 PolarHBondContact N-O 3.08Å; F303-L330 WeakPolarHBondContact CA-O 3.34Å; F303-L330 HydrophobicContact CD1-CB 4.01Å; F303-L330 HydrophobicContact CD1-CD2 4.17Å; F303-L330 HydrophobicContact CD1-CG 4.27Å; F303-L330 HydrophobicContact CE1-CD2 4.07Å; F303-I332 HydrophobicContact CB-CD1 3.74Å; F303-I332 HydrophobicContact CB-CG1 4.36Å; F303-I332 HydrophobicContact CG-CD1 4.35Å; F303-L366 HydrophobicContact CD1-CD2 3.74Å; F303-L366 HydrophobicContact CD2-CB 4.47Å; F303-L366 HydrophobicContact CD2-CD2 4.33Å; F303-L366 HydrophobicContact CE1-CD2 3.79Å; F303-L366 HydrophobicContact CE2-CB 4.1Å; F303-L366 HydrophobicContact CE2-CD2 4.38Å; F303-L366 HydrophobicContact CG-CD2 4.03Å; F303-L366 HydrophobicContact CZ-CB 4.26Å; F303-L366 HydrophobicContact CZ-CD2 4.13Å; F303-L366 WeakPolarHBondContact CZ-O 3.26Å; F303-L369 HydrophobicContact CE1-CB 4.09Å; F303-L369 HydrophobicContact CE1-CD1 4.09Å; F303-L369 HydrophobicContact CZ-CB 3.88Å; F303-D370 HydrophobicContact CE2-CB 4.41Å; F303-Y376 HydrophobicContact CD1-CE2 4.29Å; F303-Y376 AromaticContact CE1-CD2 3.92Å; F303-Y376 HydrophobicContact CE1-CD2 3.92Å; F303-Y376 AromaticContact CE1-CE2 3.85Å; F303-Y376 HydrophobicContact CE1-CE2 3.85Å; F303-Y376 HydrophobicContact CZ-CD2 4.31Å; F303-Y376 HydrophobicContact CZ-CE2 4.4Å
304	Y	98.6	Very high	96	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.008	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.5	174.8	-177	-96.4	0	0	0	110.5	A244 F246 M297 S306 K319 N323 A324 L330 I332	A244-Y304 HydrophobicContact CB-CD2 4.28Å; A244-Y304 WeakPolarHBondContact O-CA 3.14Å; F246-Y304 HydrophobicContact CB-CE2 4.43Å; F246-Y304 AromaticContact CD2-CE2 3.98Å; F246-Y304 HydrophobicContact CD2-CE2 3.98Å; M297-Y304 HydrophobicContact CE-CD2 4.42Å; M297-Y304 HydrophobicContact CE-CE2 4.14Å; M297-Y304 HydrophobicContact SD-CD2 3.65Å; M297-Y304 HydrophobicContact SD-CE2 3.64Å; Y304-S306 WeakPolarHBondContact CD1-OG 3.44Å; Y304-S306 PolarHBondContact O-N 2.81Å; Y304-S306 VanDerWaalsContact O-N 3.15Å; Y304-K319 HydrophobicContact CE1-CB 4.48Å; Y304-N323 HydrophobicContact CD1-CB 4.3Å; Y304-N323 HydrophobicContact CE1-CB 3.61Å; Y304-N323 HydrophobicContact CE2-CB 4.22Å; Y304-N323 PolarHBondContact OH-ND2 3.19Å; Y304-A324 HydrophobicContact CD1-CB 3.88Å; Y304-A324 HydrophobicContact CG-CB 4.22Å; Y304-L330 PolarHBondContact N-O 3.25Å; Y304-L330 VanDerWaalsContact N-O 3.08Å; Y304-I332 PolarHBondContact O-N 3.47Å
305	L	98.7	Very high	96.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	98.4	172.9	-61.1	-170.3	0	0	0	110.2	V243 A244 W245 A260 L263 V269 F307 I332	V243-L305 HydrophobicContact CG1-CD1 4.21Å; V243-L305 HydrophobicContact CG1-CD2 3.61Å; V243-L305 HydrophobicContact CG1-CG 3.54Å; A244-L305 PolarHBondContact O-N 3.26Å; W245-L305 HydrophobicContact CB-CB 3.91Å; W245-L305 HydrophobicContact CB-CD1 3.9Å; W245-L305 HydrophobicContact CB-CG 4.07Å; W245-L305 VanDerWaalsContact CD1-CB 3.48Å; W245-L305 VanDerWaalsContact CD1-O 3.25Å; W245-L305 HydrophobicContact CD2-CB 4.38Å; W245-L305 HydrophobicContact CD2-CD1 3.98Å; W245-L305 HydrophobicContact CE3-CD1 4.26Å; W245-L305 HydrophobicContact CG-CB 3.67Å; W245-L305 HydrophobicContact CG-CD1 3.86Å; W245-L305 HydrophobicContact CG-CG 4.19Å; A260-L305 HydrophobicContact CB-CD1 4.08Å; L263-L305 HydrophobicContact CD2-CD1 4.32Å; L263-L305 HydrophobicContact CD2-CD2 3.9Å; V269-L305 HydrophobicContact CG1-CD1 4Å; L305-F307 HydrophobicContact CB-CD1 4.21Å; L305-F307 HydrophobicContact CB-CD2 4.34Å; L305-F307 HydrophobicContact CB-CE1 4.34Å; L305-F307 HydrophobicContact CB-CE2 4.48Å; L305-F307 HydrophobicContact CB-CG 4.23Å; L305-F307 HydrophobicContact CB-CZ 4.48Å; L305-F307 HydrophobicContact CD1-CD2 4.24Å; L305-F307 HydrophobicContact CD1-CE2 3.84Å; L305-F307 HydrophobicContact CD1-CZ 4.17Å; L305-F307 HydrophobicContact CD2-CE1 3.97Å; L305-F307 HydrophobicContact CD2-CE2 4.31Å; L305-F307 HydrophobicContact CD2-CZ 3.78Å; L305-F307 HydrophobicContact CG-CE2 4.44Å; L305-F307 HydrophobicContact CG-CZ 4.36Å; L305-F307 PolarHBondContact O-N 3Å; L305-F307 VanDerWaalsContact O-N 3.08Å; L305-I332 HydrophobicContact CD2-CB 3.89Å; L305-I332 HydrophobicContact CD2-CD1 3.73Å; L305-I332 HydrophobicContact CD2-CG1 4.41Å; L305-I332 HydrophobicContact CD2-CG2 4.09Å
306	S	98.4	Very high	96.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	52.8	173.1	-58.5	0	0	0	0	110.9	Y304 K319 P331 I332	Y304-S306 WeakPolarHBondContact CD1-OG 3.44Å; Y304-S306 PolarHBondContact O-N 2.81Å; Y304-S306 VanDerWaalsContact O-N 3.15Å; S306-K319 WeakPolarHBondContact CB-O 3.32Å; S306-K319 PolarHBondContact OG-O 3.22Å; S306-P331 WeakPolarHBondContact OG-CB 3.31Å; S306-I332 PolarHBondContact N-O 2.94Å
307	F	98.3	Very high	96.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	118.3	-175.6	-69.3	-1.9	0	0	0	112.4	W245 R256 Y259 A260 L305 K319 I332 M334 V353	W245-F307 HydrophobicContact CZ2-CB 4.46Å; W245-F307 HydrophobicContact CZ2-CD2 4.22Å; R256-F307 HydrophobicContact CB-CB 3.85Å; R256-F307 HydrophobicContact CB-CD2 3.9Å; R256-F307 HydrophobicContact CB-CG 4.28Å; R256-F307 PolarHBondContact NH1-O 2.67Å; Y259-F307 AromaticContact CD1-CE2 3.92Å; Y259-F307 HydrophobicContact CD1-CE2 3.92Å; Y259-F307 AromaticContact CD1-CZ 3.79Å; Y259-F307 HydrophobicContact CD1-CZ 3.79Å; Y259-F307 HydrophobicContact CE1-CZ 4.18Å; Y259-F307 HydrophobicContact CG-CE2 4.41Å; A260-F307 HydrophobicContact CB-CE2 4.2Å; L305-F307 HydrophobicContact CB-CD1 4.21Å; L305-F307 HydrophobicContact CB-CD2 4.34Å; L305-F307 HydrophobicContact CB-CE1 4.34Å; L305-F307 HydrophobicContact CB-CE2 4.48Å; L305-F307 HydrophobicContact CB-CG 4.23Å; L305-F307 HydrophobicContact CB-CZ 4.48Å; L305-F307 HydrophobicContact CD1-CD2 4.24Å; L305-F307 HydrophobicContact CD1-CE2 3.84Å; L305-F307 HydrophobicContact CD1-CZ 4.17Å; L305-F307 HydrophobicContact CD2-CE1 3.97Å; L305-F307 HydrophobicContact CD2-CE2 4.31Å; L305-F307 HydrophobicContact CD2-CZ 3.78Å; L305-F307 HydrophobicContact CG-CE2 4.44Å; L305-F307 HydrophobicContact CG-CZ 4.36Å; L305-F307 PolarHBondContact O-N 3Å; L305-F307 VanDerWaalsContact O-N 3.08Å; F307-K319 WeakPolarHBondContact O-CD 3.42Å; F307-I332 WeakPolarHBondContact CD1-O 2.93Å; F307-I332 HydrophobicContact CE1-CG2 3.95Å; F307-I332 WeakPolarHBondContact CE1-O 3.49Å; F307-I332 HydrophobicContact CZ-CG2 4.47Å; F307-M334 HydrophobicContact CB-CB 4.32Å; F307-M334 HydrophobicContact CD1-CB 3.44Å; F307-M334 VanDerWaalsContact CD1-CB 3.44Å; F307-M334 HydrophobicContact CD2-CE 4.38Å; F307-M334 HydrophobicContact CD2-SD 4.46Å; F307-M334 HydrophobicContact CE1-CB 3.82Å; F307-M334 HydrophobicContact CE1-CE 4.43Å; F307-M334 HydrophobicContact CE2-CE 4.1Å; F307-M334 HydrophobicContact CG-CB 3.92Å; F307-M334 HydrophobicContact CG-SD 4.45Å; F307-M334 HydrophobicContact CZ-CE 4.12Å; F307-V353 HydrophobicContact CE1-CG1 3.73Å; F307-V353 HydrophobicContact CZ-CG1 3.94Å
308	E	97.6	Very high	96.8	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.			trans	-73.8	147.9	179.6	-62	-60.4	172.7	0	0	113	S254 R256 S310 Y315 T317 K319 M334	S254-E308 PolarHBondContact OG-O 2.77Å; R256-E308 WeakPolarHBondContact CD-O 3.36Å; E308-S310 PolarHBondContact O-N 3.5Å; E308-Y315 HydrophobicContact CB-CD1 4.09Å; E308-Y315 HydrophobicContact CB-CE1 4.22Å; E308-Y315 HydrophobicContact CG-CD1 4.25Å; E308-T317 VanDerWaalsContact OE1-CB 3.28Å; E308-T317 WeakPolarHBondContact OE1-CB 3.05Å; E308-T317 WeakPolarHBondContact OE1-CG2 3.34Å; E308-T317 PolarHBondContact OE1-N 3.18Å; E308-T317 PolarHBondContact OE1-OG1 3.45Å; E308-T317 VanDerWaalsContact OE2-CG2 3.22Å; E308-T317 WeakPolarHBondContact OE2-CG2 3.41Å; E308-T317 PolarHBondContact OE2-OG1 3.06Å; E308-K319 WeakPolarHBondContact OE2-CE 3.47Å; E308-K319 IonicContact OE2-NZ 3.56Å; E308-K319 PolarHBondContact OE2-NZ 2.8Å; E308-K319 VanDerWaalsContact OE2-NZ 3.08Å; E308-M334 WeakPolarHBondContact CB-O 3.05Å; E308-M334 PolarHBondContact N-O 3.05Å
309	N	96.2	Very high	96.8	Very high	14 Å²	14	17.7 Å²	17.7	8%	0.075	9%	0.089	C	C	.	.	S	Bend	trans	-69.5	-14	-179.5	66.2	21	0	0	0	113	K253 S254 Y315	K253-N309 PolarHBondContact N-O 3.06Å; S254-N309 PolarHBondContact N-O 2.87Å; S254-N309 PolarHBondContact OG-O 2.77Å; N309-Y315 PolarHBondContact ND2-OH 2.99Å; N309-Y315 VanDerWaalsContact OD1-CE1 3.31Å; N309-Y315 WeakPolarHBondContact OD1-CE1 3.44Å
310	S	96.7	Very high	97	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	-146.1	142.1	-175	-52.3	0	0	0	0	109.7	S182 E308 C312	S182-S310 WeakPolarHBondContact CB-OG 3.43Å; S182-S310 VanDerWaalsContact OG-CB 3.32Å; S182-S310 WeakPolarHBondContact OG-CB 3.36Å; S182-S310 PolarHBondContact OG-OG 3.4Å; E308-S310 PolarHBondContact O-N 3.5Å; S310-C312 VanDerWaalsContact CB-SG 3.52Å; S310-C312 PolarHBondContact O-N 2.93Å
311	L	96.5	Very high	97	Very high	28 Å²	28	10.5 Å²	10.5	15%	0.147	5%	0.054	C	C	.	.			trans	-92.1	87.5	174.1	-59.9	-174.9	0	0	0	108.7	P255 M334 R428 L430	P255-L311 HydrophobicContact CG-CD1 4.37Å; L311-M334 HydrophobicContact CD2-CG 3.96Å; L311-R428 HydrophobicContact CB-CB 4.32Å; L311-R428 HydrophobicContact CB-CG 3.69Å; L311-L430 HydrophobicContact CD1-CD1 4.47Å; L311-L430 HydrophobicContact CD1-CD2 4.1Å; L311-L430 HydrophobicContact CD1-CG 3.86Å; L311-L430 HydrophobicContact CD2-CD2 4.06Å
312	C	96.7	Very high	96.8	Very high	1 Å²	1	13 Å²	13	1%	0.007	7%	0.065	C	C	.	.			trans	-129.3	150	-175.7	-52.9	0	0	0	0	111.3	S310 E314 Y315 A336 C425	S310-C312 VanDerWaalsContact CB-SG 3.52Å; S310-C312 PolarHBondContact O-N 2.93Å; C312-E314 PolarHBondContact O-N 2.96Å; C312-Y315 PolarHBondContact O-N 3.08Å; C312-A336 WeakPolarHBondContact O-CA 3.04Å; C312-C425 HydrophobicContact CB-CB 3.91Å; C312-C425 WeakPolarHBondContact CB-SG 3.45Å; C312-C425 WeakPolarHBondContact SG-CB 3.32Å; C312-C425 CovalentContact SG-SG 2.03Å; C312-C425 PolarHBondContact SG-SG 3.08Å
313	S	93.5	Very high	96.6	Very high	38 Å²	38	12.8 Å²	12.8	27%	0.266	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	133.1	174.5	-176.5	0	0	0	0	109.7	Y315 E340 G424	S313-Y315 PolarHBondContact O-N 2.7Å; S313-E340 WeakPolarHBondContact CA-OE1 3.45Å; S313-E340 WeakPolarHBondContact CB-OE1 3.28Å; S313-E340 PolarHBondContact OG-OE1 3.42Å; S313-G424 WeakPolarHBondContact CB-O 2.99Å; S313-G424 PolarHBondContact N-O 3.29Å
314	E	93.3	Very high	96.5	Very high	34 Å²	34	12.8 Å²	12.8	16%	0.159	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	3	176.1	-52.6	-178.5	150.9	0	0	116.2	F202 R203 L204 C312 V316 E340 R343	F202-E314 HydrophobicContact CD2-CB 4.47Å; F202-E314 WeakPolarHBondContact CD2-O 3.43Å; R203-E314 WeakPolarHBondContact CA-OE2 3.34Å; L204-E314 WeakPolarHBondContact CD1-OE1 3.44Å; L204-E314 PolarHBondContact N-OE2 3.01Å; C312-E314 PolarHBondContact O-N 2.96Å; E314-V316 PolarHBondContact O-N 2.86Å; E314-E340 WeakPolarHBondContact CG-OE1 3.44Å; E314-E340 PolarHBondContact N-OE1 3.38Å; E314-R343 IonicContact OE1-NH2 3.62Å; E314-R343 PolarHBondContact OE1-NH2 2.87Å
315	Y	97.3	Very high	96.5	Very high	3 Å²	3	12.9 Å²	12.9	1%	0.012	7%	0.065	C	C	.	.			trans	-77.6	90.5	178	-172.4	-116.9	0	0	0	110.4	E181 F202 Y212 E308 N309 C312 S313 T317	E181-Y315 PolarHBondContact OE2-OH 2.92Å; F202-Y315 AromaticContact CD1-CD2 3.76Å; F202-Y315 HydrophobicContact CD1-CD2 3.76Å; F202-Y315 HydrophobicContact CD1-CE2 4.22Å; F202-Y315 HydrophobicContact CD2-CD2 4.22Å; F202-Y315 AromaticContact CE1-CD2 3.38Å; F202-Y315 HydrophobicContact CE1-CD2 3.38Å; F202-Y315 AromaticContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CG 4.43Å; F202-Y315 AromaticContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CG 4.3Å; F202-Y315 HydrophobicContact CG-CD2 4.17Å; F202-Y315 AromaticContact CZ-CD2 3.47Å; F202-Y315 HydrophobicContact CZ-CD2 3.47Å; F202-Y315 VanDerWaalsContact CZ-CD2 3.47Å; F202-Y315 HydrophobicContact CZ-CE2 4.36Å; F202-Y315 HydrophobicContact CZ-CG 4.11Å; Y212-Y315 HydrophobicContact CE2-CE2 4.18Å; E308-Y315 HydrophobicContact CB-CD1 4.09Å; E308-Y315 HydrophobicContact CB-CE1 4.22Å; E308-Y315 HydrophobicContact CG-CD1 4.25Å; N309-Y315 PolarHBondContact ND2-OH 2.99Å; N309-Y315 VanDerWaalsContact OD1-CE1 3.31Å; N309-Y315 WeakPolarHBondContact OD1-CE1 3.44Å; C312-Y315 PolarHBondContact O-N 3.08Å; S313-Y315 PolarHBondContact O-N 2.7Å; Y315-T317 HydrophobicContact CD1-CG2 4.27Å; Y315-T317 HydrophobicContact CD2-CG2 4.11Å; Y315-T317 HydrophobicContact CE1-CG2 3.81Å; Y315-T317 HydrophobicContact CE2-CG2 3.67Å; Y315-T317 HydrophobicContact CG-CG2 4.42Å; Y315-T317 VanDerWaalsContact CZ-CG2 3.5Å
316	V	96.6	Very high	96.3	Very high	7 Å²	7	15 Å²	15	4%	0.042	8%	0.077	C	C	.	.			trans	-126.1	118	179.1	-178.7	0	0	0	0	108.5	E314 L320 Y321 A336 Y341 V344	E314-V316 PolarHBondContact O-N 2.86Å; V316-L320 HydrophobicContact CG1-CB 3.92Å; V316-L320 HydrophobicContact CG1-CD2 3.39Å; V316-L320 HydrophobicContact CG1-CG 4.29Å; V316-Y321 HydrophobicContact CG1-CE2 3.78Å; V316-A336 HydrophobicContact CG2-CB 4.24Å; V316-Y341 HydrophobicContact CB-CE1 4.32Å; V316-Y341 HydrophobicContact CG1-CD1 4.07Å; V316-Y341 HydrophobicContact CG1-CE1 3.69Å; V316-Y341 HydrophobicContact CG2-CD1 3.99Å; V316-Y341 HydrophobicContact CG2-CE1 3.76Å; V316-Y341 HydrophobicContact CG2-CE2 4.44Å; V316-Y341 HydrophobicContact CG2-CG 4.43Å; V316-V344 HydrophobicContact CB-CG2 4.48Å; V316-V344 HydrophobicContact CG1-CG2 4.38Å; V316-V344 HydrophobicContact CG2-CG2 4.29Å
317	T	96.1	Very high	96.2	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.			trans	-112.2	-169.9	-163.7	71.5	0	0	0	0	114	Y212 E308 Y315 K319 L320 Y321	Y212-T317 HydrophobicContact CD2-CG2 4.03Å; Y212-T317 HydrophobicContact CE2-CG2 4.02Å; Y212-T317 HydrophobicContact CG-CG2 4.36Å; E308-T317 VanDerWaalsContact OE1-CB 3.28Å; E308-T317 WeakPolarHBondContact OE1-CB 3.05Å; E308-T317 WeakPolarHBondContact OE1-CG2 3.34Å; E308-T317 PolarHBondContact OE1-N 3.18Å; E308-T317 PolarHBondContact OE1-OG1 3.45Å; E308-T317 VanDerWaalsContact OE2-CG2 3.22Å; E308-T317 WeakPolarHBondContact OE2-CG2 3.41Å; E308-T317 PolarHBondContact OE2-OG1 3.06Å; Y315-T317 HydrophobicContact CD1-CG2 4.27Å; Y315-T317 HydrophobicContact CD2-CG2 4.11Å; Y315-T317 HydrophobicContact CE1-CG2 3.81Å; Y315-T317 HydrophobicContact CE2-CG2 3.67Å; Y315-T317 HydrophobicContact CG-CG2 4.42Å; Y315-T317 VanDerWaalsContact CZ-CG2 3.5Å; T317-K319 PolarHBondContact O-N 2.99Å; T317-K319 PolarHBondContact OG1-N 2.83Å; T317-K319 PolarHBondContact OG1-NZ 2.85Å; T317-L320 PolarHBondContact O-N 2.77Å; T317-L320 VanDerWaalsContact O-N 3.09Å; T317-Y321 VanDerWaalsContact O-CD2 3.29Å; T317-Y321 WeakPolarHBondContact O-CD2 3.26Å
318	E	94.7	Very high	96.1	Very high	53 Å²	53	16.9 Å²	16.9	25%	0.248	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-18.7	173.7	79.7	-65.5	152.2	0	0	113.3	L320 K322 N323	E318-L320 VanDerWaalsContact C-N 3.31Å; E318-L320 PolarHBondContact O-N 2.64Å; E318-K322 HydrophobicContact CB-CB 4.04Å; E318-K322 WeakPolarHBondContact O-CA 3.44Å; E318-K322 WeakPolarHBondContact O-CB 3.13Å; E318-K322 PolarHBondContact O-N 2.99Å; E318-N323 PolarHBondContact O-N 2.83Å
319	K	96.3	Very high	96.1	Very high	23 Å²	23	16.9 Å²	16.9	10%	0.1	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-35.9	177	-66.6	171.7	-154.7	62.3	0	112.7	Y304 S306 F307 E308 T317	Y304-K319 HydrophobicContact CE1-CB 4.48Å; S306-K319 WeakPolarHBondContact CB-O 3.32Å; S306-K319 PolarHBondContact OG-O 3.22Å; F307-K319 WeakPolarHBondContact O-CD 3.42Å; E308-K319 WeakPolarHBondContact OE2-CE 3.47Å; E308-K319 IonicContact OE2-NZ 3.56Å; E308-K319 PolarHBondContact OE2-NZ 2.8Å; E308-K319 VanDerWaalsContact OE2-NZ 3.08Å; T317-K319 PolarHBondContact O-N 2.99Å; T317-K319 PolarHBondContact OG1-N 2.83Å; T317-K319 PolarHBondContact OG1-NZ 2.85Å
320	L	98.1	Very high	96.2	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-56.2	174.1	176.9	66.3	0	0	0	110	V316 T317 E318 A324 L325 P331 V333 Y341 A345 F350	V316-L320 HydrophobicContact CG1-CB 3.92Å; V316-L320 HydrophobicContact CG1-CD2 3.39Å; V316-L320 HydrophobicContact CG1-CG 4.29Å; T317-L320 PolarHBondContact O-N 2.77Å; T317-L320 VanDerWaalsContact O-N 3.09Å; E318-L320 VanDerWaalsContact C-N 3.31Å; E318-L320 PolarHBondContact O-N 2.64Å; L320-A324 WeakPolarHBondContact O-CB 3.25Å; L320-L325 HydrophobicContact CD1-CD1 3.98Å; L320-L325 HydrophobicContact CD1-CG 4.25Å; L320-L325 HydrophobicContact CG-CD1 3.92Å; L320-L325 HydrophobicContact CG-CG 4.49Å; L320-L325 WeakPolarHBondContact O-CG 3.4Å; L320-L325 PolarHBondContact O-N 2.82Å; L320-P331 HydrophobicContact CD1-CB 3.74Å; L320-P331 HydrophobicContact CD1-CG 3.58Å; L320-V333 HydrophobicContact CD1-CG1 3.91Å; L320-Y341 HydrophobicContact CD2-CD1 4.03Å; L320-Y341 HydrophobicContact CD2-CE1 4.24Å; L320-A345 HydrophobicContact CD2-CB 4.07Å; L320-F350 HydrophobicContact CD1-CB 4.5Å
321	Y	96.7	Very high	96.4	Very high	3 Å²	3	16.2 Å²	16.2	1%	0.012	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-71.4	-168.9	-55.3	-75.2	0	0	0	112	V316 T317 L325 N326 V344 I388	V316-Y321 HydrophobicContact CG1-CE2 3.78Å; T317-Y321 VanDerWaalsContact O-CD2 3.29Å; T317-Y321 WeakPolarHBondContact O-CD2 3.26Å; Y321-L325 HydrophobicContact CD1-CD1 4.44Å; Y321-L325 PolarHBondContact O-N 2.74Å; Y321-N326 WeakPolarHBondContact O-CB 3.44Å; Y321-N326 PolarHBondContact O-N 3.12Å; Y321-V344 WeakPolarHBondContact OH-CB 3.43Å; Y321-V344 VanDerWaalsContact OH-CG2 3.29Å; Y321-V344 WeakPolarHBondContact OH-CG2 3.46Å; Y321-V344 PolarHBondContact OH-O 3.08Å; Y321-I388 HydrophobicContact CD1-CG2 3.96Å; Y321-I388 HydrophobicContact CG-CG2 4.43Å
322	K	95	Very high	96.5	Very high	53 Å²	53	14.9 Å²	14.9	23%	0.23	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-52.3	-174.8	-178.4	174.1	-178.5	168.6	0	112.8	E318 N327 D390	E318-K322 HydrophobicContact CB-CB 4.04Å; E318-K322 WeakPolarHBondContact O-CA 3.44Å; E318-K322 WeakPolarHBondContact O-CB 3.13Å; E318-K322 PolarHBondContact O-N 2.99Å; K322-N327 PolarHBondContact O-ND2 3.4Å; K322-D390 HydrophobicContact CB-CB 4Å; K322-D390 WeakPolarHBondContact CD-OD2 3.42Å; K322-D390 WeakPolarHBondContact CG-OD2 3.38Å
323	N	95	Very high	96.6	Very high	9 Å²	9	14.9 Å²	14.9	5%	0.048	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-32.1	-170.5	-68.5	-33.6	0	0	0	113.1	S289 Y304 E318	S289-N323 PolarHBondContact OG-OD1 2.87Å; Y304-N323 HydrophobicContact CD1-CB 4.3Å; Y304-N323 HydrophobicContact CE1-CB 3.61Å; Y304-N323 HydrophobicContact CE2-CB 4.22Å; Y304-N323 PolarHBondContact OH-ND2 3.19Å; E318-N323 PolarHBondContact O-N 2.83Å
324	A	97.3	Very high	96.8	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-71.3	-175.2	0	0	0	0	0	113.2	Y304 L320 N326 N327 E328 L329 P331	Y304-A324 HydrophobicContact CD1-CB 3.88Å; Y304-A324 HydrophobicContact CG-CB 4.22Å; L320-A324 WeakPolarHBondContact O-CB 3.25Å; A324-N326 PolarHBondContact O-N 2.61Å; A324-N327 CarbonylContact O-C 3.48Å; A324-N327 VanDerWaalsContact O-C 3.29Å; A324-N327 WeakPolarHBondContact O-CA 3.39Å; A324-N327 PolarHBondContact O-N 2.85Å; A324-E328 PolarHBondContact O-N 2.77Å; A324-E328 VanDerWaalsContact O-N 3.08Å; A324-L329 CarbonylContact C-O 3.54Å; A324-L329 PolarHBondContact O-N 2.85Å; A324-L329 VanDerWaalsContact O-N 3.1Å; A324-P331 HydrophobicContact CB-CB 3.69Å; A324-P331 HydrophobicContact CB-CG 4.26Å
325	L	97.5	Very high	97	Very high	3 Å²	3	11.4 Å²	11.4	2%	0.016	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-60.7	-48.3	-171.3	-65.3	175.7	0	0	0	112.4	L320 Y321 N327 E328 P331 P346 W382 I388	L320-L325 HydrophobicContact CD1-CD1 3.98Å; L320-L325 HydrophobicContact CD1-CG 4.25Å; L320-L325 HydrophobicContact CG-CD1 3.92Å; L320-L325 HydrophobicContact CG-CG 4.49Å; L320-L325 WeakPolarHBondContact O-CG 3.4Å; L320-L325 PolarHBondContact O-N 2.82Å; Y321-L325 HydrophobicContact CD1-CD1 4.44Å; Y321-L325 PolarHBondContact O-N 2.74Å; L325-N327 PolarHBondContact O-N 2.65Å; L325-N327 VanDerWaalsContact O-N 3.07Å; L325-E328 PolarHBondContact O-N 3.1Å; L325-P331 HydrophobicContact CD2-CG 3.82Å; L325-P331 HydrophobicContact CG-CG 4.23Å; L325-P346 HydrophobicContact CD1-CG 4.25Å; L325-W382 HydrophobicContact CB-CH2 4.24Å; L325-W382 HydrophobicContact CB-CZ2 4.21Å; L325-W382 HydrophobicContact CD2-CZ2 3.72Å; L325-W382 HydrophobicContact CG-CZ2 4.48Å; L325-I388 HydrophobicContact CB-CD1 4.34Å; L325-I388 HydrophobicContact CB-CG1 4.15Å; L325-I388 HydrophobicContact CD1-CD1 3.84Å
326	N	95.6	Very high	97	Very high	46 Å²	46	11.3 Å²	11.3	25%	0.246	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-63.3	-14.3	176.2	-90.1	-14.5	0	0	0	113.8	R298 Y321 A324 I388 D390	R298-N326 PolarHBondContact NH2-O 3.33Å; Y321-N326 WeakPolarHBondContact O-CB 3.44Å; Y321-N326 PolarHBondContact O-N 3.12Å; A324-N326 PolarHBondContact O-N 2.61Å; N326-I388 WeakPolarHBondContact OD1-CB 3.44Å; N326-I388 WeakPolarHBondContact OD1-CG2 3.47Å; N326-D390 PolarHBondContact ND2-OD1 3.48Å
327	N	95.1	Very high	96.9	Very high	13 Å²	13	12.2 Å²	12.2	7%	0.07	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-117.1	18.8	-179.3	-75.7	-71.3	0	0	0	113.5	R298 K322 A324 L325 L329	R298-N327 WeakPolarHBondContact CA-O 3.2Å; R298-N327 HydrophobicContact CB-CB 4.43Å; R298-N327 VanDerWaalsContact CB-O 3.26Å; R298-N327 WeakPolarHBondContact CB-O 3.36Å; R298-N327 VanDerWaalsContact CG-O 3.27Å; R298-N327 WeakPolarHBondContact CG-O 3.49Å; R298-N327 PolarHBondContact NE-OD1 3.26Å; R298-N327 PolarHBondContact NH2-OD1 3.39Å; K322-N327 PolarHBondContact O-ND2 3.4Å; A324-N327 CarbonylContact O-C 3.48Å; A324-N327 VanDerWaalsContact O-C 3.29Å; A324-N327 WeakPolarHBondContact O-CA 3.39Å; A324-N327 PolarHBondContact O-N 2.85Å; L325-N327 PolarHBondContact O-N 2.65Å; L325-N327 VanDerWaalsContact O-N 3.07Å; N327-L329 HydrophobicContact CB-CD1 3.59Å; N327-L329 WeakPolarHBondContact O-CD1 3.49Å; N327-L329 PolarHBondContact O-N 2.83Å
328	E	96.3	Very high	97	Very high	26 Å²	26	14 Å²	14	12%	0.121	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	37	172.8	-47.5	177.3	174.4	0	0	113.2	R233 I235 K239 R298 A324 L325	R233-E328 IonicContact CZ-OE1 3.73Å; R233-E328 IonicContact CZ-OE2 2.81Å; R233-E328 IonicContact NH1-OE2 3.39Å; R233-E328 PolarHBondContact NH1-OE2 3.24Å; R233-E328 VanDerWaalsContact NH1-OE2 3.07Å; R233-E328 IonicContact NH2-OE1 3.45Å; R233-E328 PolarHBondContact NH2-OE1 2.95Å; R233-E328 IonicContact NH2-OE2 2.64Å; R233-E328 PolarHBondContact NH2-OE2 3.2Å; I235-E328 HydrophobicContact CG2-CB 3.98Å; K239-E328 WeakPolarHBondContact CE-O 3.35Å; K239-E328 PolarHBondContact NZ-O 3.48Å; R298-E328 HydrophobicContact CG-CB 4.27Å; R298-E328 HydrophobicContact CG-CG 4.42Å; A324-E328 PolarHBondContact O-N 2.77Å; A324-E328 VanDerWaalsContact O-N 3.08Å; L325-E328 PolarHBondContact O-N 3.1Å
329	L	98.2	Very high	97	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.082	C	C	.	.			trans	-109.3	143.9	167.9	-59.5	102.8	0	0	0	108.8	M297 A324 N327 P331	M297-L329 HydrophobicContact CB-CD1 3.97Å; M297-L329 HydrophobicContact CB-CD2 4Å; A324-L329 CarbonylContact C-O 3.54Å; A324-L329 PolarHBondContact O-N 2.85Å; A324-L329 VanDerWaalsContact O-N 3.1Å; N327-L329 HydrophobicContact CB-CD1 3.59Å; N327-L329 WeakPolarHBondContact O-CD1 3.49Å; N327-L329 PolarHBondContact O-N 2.83Å; L329-P331 WeakPolarHBondContact O-CD 3.44Å
330	L	98.7	Very high	96.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	110.5	175.8	177	48.2	0	0	0	108.6	K302 F303 Y304 I332 S349 I351 L369 Y376 Y379 F380	K302-L330 PolarHBondContact O-N 3.24Å; F303-L330 WeakPolarHBondContact CA-O 3.34Å; F303-L330 HydrophobicContact CD1-CB 4.01Å; F303-L330 HydrophobicContact CD1-CD2 4.17Å; F303-L330 HydrophobicContact CD1-CG 4.27Å; F303-L330 HydrophobicContact CE1-CD2 4.07Å; Y304-L330 PolarHBondContact N-O 3.25Å; Y304-L330 VanDerWaalsContact N-O 3.08Å; L330-I332 PolarHBondContact O-N 2.79Å; L330-S349 WeakPolarHBondContact CD1-O 3.45Å; L330-I351 HydrophobicContact CD1-CG1 4.36Å; L330-I351 HydrophobicContact CD2-CD1 3.65Å; L330-I351 HydrophobicContact CD2-CG1 4.12Å; L330-I351 HydrophobicContact CG-CD1 4.06Å; L330-I351 HydrophobicContact CG-CG1 4.24Å; L330-L369 HydrophobicContact CD2-CD1 4Å; L330-Y376 HydrophobicContact CB-CE2 3.99Å; L330-Y376 HydrophobicContact CD2-CD2 4.32Å; L330-Y376 HydrophobicContact CD2-CE2 4.27Å; L330-Y379 HydrophobicContact CD1-CD1 3.68Å; L330-Y379 HydrophobicContact CD1-CE1 4.45Å; L330-Y379 HydrophobicContact CD1-CG 3.76Å; L330-Y379 HydrophobicContact CD2-CD1 4.17Å; L330-Y379 HydrophobicContact CD2-CD2 3.66Å; L330-Y379 HydrophobicContact CD2-CE2 4.21Å; L330-Y379 HydrophobicContact CD2-CG 3.63Å; L330-Y379 HydrophobicContact CG-CG 4.38Å; L330-F380 HydrophobicContact CB-CE2 4.02Å; L330-F380 HydrophobicContact CB-CZ 3.99Å
331	P	98.8	Very high	96.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.2	179.5	26.1	-35.2	0	0	0	111.6	S306 L320 A324 L325 L329 V333 S349 F350 I351	S306-P331 WeakPolarHBondContact OG-CB 3.31Å; L320-P331 HydrophobicContact CD1-CB 3.74Å; L320-P331 HydrophobicContact CD1-CG 3.58Å; A324-P331 HydrophobicContact CB-CB 3.69Å; A324-P331 HydrophobicContact CB-CG 4.26Å; L325-P331 HydrophobicContact CD2-CG 3.82Å; L325-P331 HydrophobicContact CG-CG 4.23Å; L329-P331 WeakPolarHBondContact O-CD 3.44Å; P331-V333 HydrophobicContact CB-CG1 4.11Å; P331-S349 VanDerWaalsContact CD-O 3.3Å; P331-S349 WeakPolarHBondContact CD-O 3.22Å; P331-S349 WeakPolarHBondContact CG-O 3.33Å; P331-F350 HydrophobicContact CB-CB 4.46Å; P331-F350 HydrophobicContact CG-CB 3.74Å; P331-F350 WeakPolarHBondContact O-CA 3.32Å; P331-I351 PolarHBondContact O-N 2.68Å
332	I	98.9	Very high	96.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.9	165.3	-56.4	163.9	0	0	0	106.7	V243 F303 Y304 L305 S306 F307 L330 I351 V353 L362 L366	V243-I332 HydrophobicContact CG1-CD1 4.48Å; F303-I332 HydrophobicContact CB-CD1 3.74Å; F303-I332 HydrophobicContact CB-CG1 4.36Å; F303-I332 HydrophobicContact CG-CD1 4.35Å; Y304-I332 PolarHBondContact O-N 3.47Å; L305-I332 HydrophobicContact CD2-CB 3.89Å; L305-I332 HydrophobicContact CD2-CD1 3.73Å; L305-I332 HydrophobicContact CD2-CG1 4.41Å; L305-I332 HydrophobicContact CD2-CG2 4.09Å; S306-I332 PolarHBondContact N-O 2.94Å; F307-I332 WeakPolarHBondContact CD1-O 2.93Å; F307-I332 HydrophobicContact CE1-CG2 3.95Å; F307-I332 WeakPolarHBondContact CE1-O 3.49Å; F307-I332 HydrophobicContact CZ-CG2 4.47Å; L330-I332 PolarHBondContact O-N 2.79Å; I332-I351 CarbonylContact C-O 3.59Å; I332-I351 VanDerWaalsContact CA-O 3.25Å; I332-I351 WeakPolarHBondContact CA-O 3.45Å; I332-I351 HydrophobicContact CG1-CB 4.49Å; I332-V353 HydrophobicContact CG2-CG1 4.18Å; I332-L362 HydrophobicContact CG2-CD1 4.48Å; I332-L362 HydrophobicContact CG2-CD2 3.86Å; I332-L366 HydrophobicContact CD1-CD1 3.5Å; I332-L366 VanDerWaalsContact CD1-CD1 3.5Å; I332-L366 HydrophobicContact CD1-CD2 3.75Å; I332-L366 HydrophobicContact CD1-CG 4.26Å; I332-L366 HydrophobicContact CG1-CD2 4.2Å
333	V	98.8	Very high	96.4	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	143.2	-169	-61.9	0	0	0	0	112.5	L320 P331 Y341 F350 I351 H352 V353	L320-V333 HydrophobicContact CD1-CG1 3.91Å; P331-V333 HydrophobicContact CB-CG1 4.11Å; V333-Y341 HydrophobicContact CB-CD1 4.16Å; V333-Y341 HydrophobicContact CB-CE1 3.61Å; V333-Y341 HydrophobicContact CB-CE2 4.05Å; V333-Y341 HydrophobicContact CG1-CD1 4Å; V333-Y341 HydrophobicContact CG1-CE1 3.53Å; V333-Y341 HydrophobicContact CG2-CD1 4.08Å; V333-Y341 HydrophobicContact CG2-CD2 4.07Å; V333-Y341 HydrophobicContact CG2-CE1 4.01Å; V333-Y341 HydrophobicContact CG2-CE2 4.02Å; V333-Y341 HydrophobicContact CG2-CG 4.12Å; V333-F350 HydrophobicContact CG1-CB 4.24Å; V333-F350 HydrophobicContact CG2-CB 4.46Å; V333-F350 HydrophobicContact CG2-CD2 3.53Å; V333-F350 HydrophobicContact CG2-CE2 4.13Å; V333-F350 HydrophobicContact CG2-CG 4.26Å; V333-I351 WeakPolarHBondContact CG2-O 3.43Å; V333-I351 PolarHBondContact N-O 3.14Å; V333-H352 HydrophobicContact CG2-CB 3.81Å; V333-H352 VanDerWaalsContact CG2-CD2 3.47Å; V333-H352 WeakPolarHBondContact CG2-CD2 3.41Å; V333-V353 WeakPolarHBondContact O-CG1 3.26Å; V333-V353 PolarHBondContact O-N 3.49Å; V333-V353 VanDerWaalsContact O-N 3.11Å
334	M	98.3	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	115	170.4	174.9	-169.5	-69.4	0	0	107.7	R256 Y259 F307 E308 L311 V353 L430	R256-M334 HydrophobicContact CB-SD 3.97Å; Y259-M334 VanDerWaalsContact CB-CE 3.43Å; Y259-M334 HydrophobicContact CD1-CE 3.93Å; Y259-M334 HydrophobicContact CD2-CE 3.26Å; Y259-M334 HydrophobicContact CE2-CE 3.99Å; Y259-M334 HydrophobicContact CG-CE 3.26Å; F307-M334 HydrophobicContact CB-CB 4.32Å; F307-M334 HydrophobicContact CD1-CB 3.44Å; F307-M334 VanDerWaalsContact CD1-CB 3.44Å; F307-M334 HydrophobicContact CD2-CE 4.38Å; F307-M334 HydrophobicContact CD2-SD 4.46Å; F307-M334 HydrophobicContact CE1-CB 3.82Å; F307-M334 HydrophobicContact CE1-CE 4.43Å; F307-M334 HydrophobicContact CE2-CE 4.1Å; F307-M334 HydrophobicContact CG-CB 3.92Å; F307-M334 HydrophobicContact CG-SD 4.45Å; F307-M334 HydrophobicContact CZ-CE 4.12Å; E308-M334 WeakPolarHBondContact CB-O 3.05Å; E308-M334 PolarHBondContact N-O 3.05Å; L311-M334 HydrophobicContact CD2-CG 3.96Å; M334-V353 HydrophobicContact CB-CG1 4.2Å; M334-V353 HydrophobicContact CB-CG2 3.85Å; M334-V353 HydrophobicContact CE-CB 4.47Å; M334-V353 HydrophobicContact CE-CG1 4.12Å; M334-V353 HydrophobicContact CE-CG2 4.07Å; M334-V353 HydrophobicContact CG-CG2 4Å; M334-L430 HydrophobicContact CE-CD1 3.66Å; M334-L430 HydrophobicContact CG-CD1 4.1Å; M334-L430 HydrophobicContact CG-CD2 3.93Å; M334-L430 HydrophobicContact SD-CD1 3.79Å
335	G	97.4	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	176.9	-111.2	-177.9	0	0	0	0	0	110.9	R428	G335-R428 PolarHBondContact O-NE 3.27Å; G335-R428 PolarHBondContact O-NH2 2.67Å
336	A	96.8	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-55.7	175.5	168	0	0	0	0	0	113	C312 V316 E340 Y341 H352 R428	C312-A336 WeakPolarHBondContact O-CA 3.04Å; V316-A336 HydrophobicContact CG2-CB 4.24Å; A336-E340 HydrophobicContact CB-CB 3.76Å; A336-E340 HydrophobicContact CB-CG 4.45Å; A336-E340 WeakPolarHBondContact CB-OE2 3.42Å; A336-Y341 HydrophobicContact CB-CD2 4.19Å; A336-Y341 HydrophobicContact CB-CE2 3.94Å; A336-H352 PolarHBondContact O-NE2 3.27Å; A336-R428 PolarHBondContact O-NE 2.83Å; A336-R428 PolarHBondContact O-NH2 2.81Å
337	S	96.4	Very high	95.7	Very high	27 Å²	27	23.5 Å²	23.5	19%	0.189	11%	0.112	C	C	.	.			trans	-72.7	165.5	175.9	92.8	0	0	0	0	112.3	E339 E340 Y341	S337-E339 VanDerWaalsContact C-N 3.29Å; S337-E339 VanDerWaalsContact CB-OE2 3.3Å; S337-E339 WeakPolarHBondContact CB-OE2 3.47Å; S337-E339 PolarHBondContact O-N 3.42Å; S337-E339 PolarHBondContact OG-N 2.97Å; S337-E339 PolarHBondContact OG-OE2 3.24Å; S337-E340 PolarHBondContact N-OE2 3.04Å; S337-E340 WeakPolarHBondContact O-CB 3.38Å; S337-E340 PolarHBondContact O-N 3.43Å; S337-E340 VanDerWaalsContact O-N 3.14Å; S337-E340 WeakPolarHBondContact OG-CG 3.49Å; S337-E340 PolarHBondContact OG-N 3.25Å; S337-Y341 WeakPolarHBondContact O-CD2 3.15Å; S337-Y341 PolarHBondContact O-N 2.94Å; S337-Y341 VanDerWaalsContact O-N 3.11Å
338	I	96.6	Very high	95.6	Very high	36 Å²	36	27 Å²	27	19%	0.185	13%	0.125	C	C	.	.	H	α-helix	trans	-55.7	-48.3	177.3	-63.7	172.5	0	0	0	110.1	E340 Y341 E342 H352 D354 Q355	I338-E340 PolarHBondContact O-N 2.03Å; I338-Y341 PolarHBondContact O-N 3.46Å; I338-Y341 VanDerWaalsContact O-N 3.14Å; I338-E342 HydrophobicContact CG2-CG 4.28Å; I338-E342 WeakPolarHBondContact O-CG 3.46Å; I338-E342 PolarHBondContact O-N 2.95Å; I338-H352 HydrophobicContact CD1-CB 4.5Å; I338-H352 HydrophobicContact CG1-CB 3.85Å; I338-D354 HydrophobicContact CD1-CB 4.31Å; I338-Q355 HydrophobicContact CD1-CG 3.91Å
339	E	94.3	Very high	95.6	Very high	109 Å²	109	25.8 Å²	25.8	51%	0.509	12%	0.119	S	C	.	.	H	α-helix	trans	-64.5	-28.7	-178.3	-54.1	75.1	-164.1	0	0	111.9	S337 R343	S337-E339 VanDerWaalsContact C-N 3.29Å; S337-E339 VanDerWaalsContact CB-OE2 3.3Å; S337-E339 WeakPolarHBondContact CB-OE2 3.47Å; S337-E339 PolarHBondContact O-N 3.42Å; S337-E339 PolarHBondContact OG-N 2.97Å; S337-E339 PolarHBondContact OG-OE2 3.24Å; E339-R343 WeakPolarHBondContact O-CG 2.9Å; E339-R343 PolarHBondContact O-N 3.14Å; E339-R343 PolarHBondContact O-NH1 2.82Å; E339-R343 VanDerWaalsContact O-NH1 3.12Å
340	E	94.2	Very high	95.6	Very high	20 Å²	20	26.4 Å²	26.4	9%	0.093	12%	0.122	C	C	.	.	H	α-helix	trans	-72.8	-41.5	174.9	-61.9	-178.5	104	0	0	111.6	S313 E314 A336 S337 I338 R343	S313-E340 WeakPolarHBondContact CA-OE1 3.45Å; S313-E340 WeakPolarHBondContact CB-OE1 3.28Å; S313-E340 PolarHBondContact OG-OE1 3.42Å; E314-E340 WeakPolarHBondContact CG-OE1 3.44Å; E314-E340 PolarHBondContact N-OE1 3.38Å; A336-E340 HydrophobicContact CB-CB 3.76Å; A336-E340 HydrophobicContact CB-CG 4.45Å; A336-E340 WeakPolarHBondContact CB-OE2 3.42Å; S337-E340 PolarHBondContact N-OE2 3.04Å; S337-E340 WeakPolarHBondContact O-CB 3.38Å; S337-E340 PolarHBondContact O-N 3.43Å; S337-E340 VanDerWaalsContact O-N 3.14Å; S337-E340 WeakPolarHBondContact OG-CG 3.49Å; S337-E340 PolarHBondContact OG-N 3.25Å; I338-E340 PolarHBondContact O-N 2.03Å; E340-R343 PolarHBondContact O-N 3.29Å
341	Y	95.9	Very high	95.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-41.7	172.2	-82.3	-83.9	0	0	0	112	V316 L320 V333 A336 S337 I338 R343 V344 A345 F350 H352	V316-Y341 HydrophobicContact CB-CE1 4.32Å; V316-Y341 HydrophobicContact CG1-CD1 4.07Å; V316-Y341 HydrophobicContact CG1-CE1 3.69Å; V316-Y341 HydrophobicContact CG2-CD1 3.99Å; V316-Y341 HydrophobicContact CG2-CE1 3.76Å; V316-Y341 HydrophobicContact CG2-CE2 4.44Å; V316-Y341 HydrophobicContact CG2-CG 4.43Å; L320-Y341 HydrophobicContact CD2-CD1 4.03Å; L320-Y341 HydrophobicContact CD2-CE1 4.24Å; V333-Y341 HydrophobicContact CB-CD1 4.16Å; V333-Y341 HydrophobicContact CB-CE1 3.61Å; V333-Y341 HydrophobicContact CB-CE2 4.05Å; V333-Y341 HydrophobicContact CG1-CD1 4Å; V333-Y341 HydrophobicContact CG1-CE1 3.53Å; V333-Y341 HydrophobicContact CG2-CD1 4.08Å; V333-Y341 HydrophobicContact CG2-CD2 4.07Å; V333-Y341 HydrophobicContact CG2-CE1 4.01Å; V333-Y341 HydrophobicContact CG2-CE2 4.02Å; V333-Y341 HydrophobicContact CG2-CG 4.12Å; A336-Y341 HydrophobicContact CB-CD2 4.19Å; A336-Y341 HydrophobicContact CB-CE2 3.94Å; S337-Y341 WeakPolarHBondContact O-CD2 3.15Å; S337-Y341 PolarHBondContact O-N 2.94Å; S337-Y341 VanDerWaalsContact O-N 3.11Å; I338-Y341 PolarHBondContact O-N 3.46Å; I338-Y341 VanDerWaalsContact O-N 3.14Å; Y341-R343 PolarHBondContact O-N 3.31Å; Y341-V344 PolarHBondContact O-N 2.88Å; Y341-V344 VanDerWaalsContact O-N 3.14Å; Y341-A345 VanDerWaalsContact O-CB 3.26Å; Y341-A345 WeakPolarHBondContact O-CB 3.47Å; Y341-A345 PolarHBondContact O-N 3.28Å; Y341-F350 HydrophobicContact CG-CE2 4.39Å; Y341-F350 HydrophobicContact CG-CZ 4.42Å; Y341-H352 AromaticContact CD2-CD2 3.65Å; Y341-H352 AromaticContact CE2-CD2 3.92Å; Y341-H352 AromaticContact CE2-NE2 3.99Å
342	E	93.6	Very high	95.6	Very high	85 Å²	85	26.4 Å²	26.4	40%	0.397	12%	0.122	S	C	.	.	H	α-helix	trans	-61	-27.6	178.5	-72.4	177.2	161.8	0	0	113.4	P224 I338 F350	P224-E342 HydrophobicContact CB-CB 4.36Å; I338-E342 HydrophobicContact CG2-CG 4.28Å; I338-E342 WeakPolarHBondContact O-CG 3.46Å; I338-E342 PolarHBondContact O-N 2.95Å; E342-F350 HydrophobicContact CG-CE1 4.3Å; E342-F350 HydrophobicContact CG-CZ 3.82Å
343	R	89.8	Confident	95.6	Very high	131 Å²	131	26.4 Å²	26.4	49%	0.494	12%	0.122	S	C	.	.	H	α-helix	trans	-72.8	-24.8	177	-74.6	-169	-49.2	-92.1	17.8	114	E314 E339 E340 Y341	E314-R343 IonicContact OE1-NH2 3.62Å; E314-R343 PolarHBondContact OE1-NH2 2.87Å; E339-R343 WeakPolarHBondContact O-CG 2.9Å; E339-R343 PolarHBondContact O-N 3.14Å; E339-R343 PolarHBondContact O-NH1 2.82Å; E339-R343 VanDerWaalsContact O-NH1 3.12Å; E340-R343 PolarHBondContact O-N 3.29Å; Y341-R343 PolarHBondContact O-N 3.31Å
344	V	90.5	Very high	95.6	Very high	28 Å²	28	27.5 Å²	27.5	17%	0.17	13%	0.128	C	C	.	.	H	α-helix	trans	-123.4	-16.9	-166.8	-57.7	0	0	0	0	114.2	V316 Y321 Y341	V316-V344 HydrophobicContact CB-CG2 4.48Å; V316-V344 HydrophobicContact CG1-CG2 4.38Å; V316-V344 HydrophobicContact CG2-CG2 4.29Å; Y321-V344 WeakPolarHBondContact OH-CB 3.43Å; Y321-V344 VanDerWaalsContact OH-CG2 3.29Å; Y321-V344 WeakPolarHBondContact OH-CG2 3.46Å; Y321-V344 PolarHBondContact OH-O 3.08Å; Y341-V344 PolarHBondContact O-N 2.88Å; Y341-V344 VanDerWaalsContact O-N 3.14Å
345	A	94.1	Very high	95.6	Very high	6 Å²	6	31.3 Å²	31.3	5%	0.05	15%	0.146	C	C	.	.	S	Bend	trans	-92.9	160.5	175.2	0	0	0	0	0	110.8	L320 Y341 F350	L320-A345 HydrophobicContact CD2-CB 4.07Å; Y341-A345 VanDerWaalsContact O-CB 3.26Å; Y341-A345 WeakPolarHBondContact O-CB 3.47Å; Y341-A345 PolarHBondContact O-N 3.28Å; A345-F350 HydrophobicContact CB-CD1 3.77Å; A345-F350 HydrophobicContact CB-CE1 3.9Å
346	P	94.2	Very high	95.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-57	149.7	165.4	-13.6	22.6	0	0	0	111.2	Y215 L325 Y348 S349 W382 I388	Y215-P346 HydrophobicContact CD1-CB 3.86Å; Y215-P346 HydrophobicContact CD1-CG 4.07Å; Y215-P346 HydrophobicContact CD2-CB 4.11Å; Y215-P346 HydrophobicContact CD2-CG 3.67Å; Y215-P346 HydrophobicContact CE1-CB 3.89Å; Y215-P346 HydrophobicContact CE1-CG 4.46Å; Y215-P346 HydrophobicContact CE2-CB 4.13Å; Y215-P346 HydrophobicContact CE2-CG 4.09Å; Y215-P346 HydrophobicContact CG-CB 3.96Å; Y215-P346 HydrophobicContact CG-CG 3.64Å; L325-P346 HydrophobicContact CD1-CG 4.25Å; P346-Y348 PolarHBondContact O-N 2.84Å; P346-S349 WeakPolarHBondContact CD-OG 3.35Å; P346-S349 VanDerWaalsContact O-CB 3.27Å; P346-S349 WeakPolarHBondContact O-CB 3.34Å; P346-S349 PolarHBondContact O-N 2.77Å; P346-S349 PolarHBondContact O-OG 3.3Å; P346-W382 HydrophobicContact CB-CB 3.71Å; P346-W382 HydrophobicContact CB-CD2 3.64Å; P346-W382 HydrophobicContact CB-CE3 3.99Å; P346-W382 HydrophobicContact CB-CG 3.5Å; P346-W382 VanDerWaalsContact CB-CG 3.5Å; P346-W382 HydrophobicContact CG-CD2 3.73Å; P346-W382 HydrophobicContact CG-CE3 3.8Å; P346-W382 HydrophobicContact CG-CG 4.13Å; P346-W382 HydrophobicContact CG-CZ3 4.23Å; P346-I388 HydrophobicContact CG-CD1 3.6Å
347	P	92.1	Very high	95.7	Very high	11 Å²	11	38.7 Å²	38.7	7%	0.071	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	138.5	179.9	27.6	-35.4	0	0	0	110.4	P224 Y228 S349	P224-P347 WeakPolarHBondContact O-CB 3.11Å; Y228-P347 HydrophobicContact CD2-CG 4.16Å; Y228-P347 HydrophobicContact CE2-CG 3.53Å; P347-S349 VanDerWaalsContact C-N 3.29Å; P347-S349 PolarHBondContact O-N 3.12Å
348	Y	93.4	Very high	95.7	Very high	86 Å²	86	39 Å²	39	34%	0.337	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	40.3	-179.5	-60.6	-76.4	0	0	0	114.8	P224 R227 P346 Y379	P224-Y348 WeakPolarHBondContact O-CE2 3.47Å; R227-Y348 VanDerWaalsContact CD-CE2 3.43Å; R227-Y348 HydrophobicContact CG-CE2 4.23Å; R227-Y348 VanDerWaalsContact CZ-CD1 3.41Å; R227-Y348 PolarHBondContact NH2-OH 3.38Å; P346-Y348 PolarHBondContact O-N 2.84Å; Y348-Y379 CarbonylContact O-C 3.48Å; Y348-Y379 WeakPolarHBondContact O-CA 3.44Å; Y348-Y379 VanDerWaalsContact O-CD1 3.25Å; Y348-Y379 WeakPolarHBondContact O-CD1 3.27Å
349	S	97	Very high	95.8	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.007	17%	0.174	C	C	.	.			trans	-107.8	-0.7	-174.9	64.6	0	0	0	0	115.6	L330 P331 P346 P347	L330-S349 WeakPolarHBondContact CD1-O 3.45Å; P331-S349 VanDerWaalsContact CD-O 3.3Å; P331-S349 WeakPolarHBondContact CD-O 3.22Å; P331-S349 WeakPolarHBondContact CG-O 3.33Å; P346-S349 WeakPolarHBondContact CD-OG 3.35Å; P346-S349 VanDerWaalsContact O-CB 3.27Å; P346-S349 WeakPolarHBondContact O-CB 3.34Å; P346-S349 PolarHBondContact O-N 2.77Å; P346-S349 PolarHBondContact O-OG 3.3Å; P347-S349 VanDerWaalsContact C-N 3.29Å; P347-S349 PolarHBondContact O-N 3.12Å
350	F	98.4	Very high	96	Very high	13 Å²	13	33.4 Å²	33.4	6%	0.057	16%	0.16	C	C	.	.			trans	-143.1	160.7	-176.3	66.3	-91.6	0	0	0	112.4	L320 P331 V333 Y341 E342 A345 H352 Y379	L320-F350 HydrophobicContact CD1-CB 4.5Å; P331-F350 HydrophobicContact CB-CB 4.46Å; P331-F350 HydrophobicContact CG-CB 3.74Å; P331-F350 WeakPolarHBondContact O-CA 3.32Å; V333-F350 HydrophobicContact CG1-CB 4.24Å; V333-F350 HydrophobicContact CG2-CB 4.46Å; V333-F350 HydrophobicContact CG2-CD2 3.53Å; V333-F350 HydrophobicContact CG2-CE2 4.13Å; V333-F350 HydrophobicContact CG2-CG 4.26Å; Y341-F350 HydrophobicContact CG-CE2 4.39Å; Y341-F350 HydrophobicContact CG-CZ 4.42Å; E342-F350 HydrophobicContact CG-CE1 4.3Å; E342-F350 HydrophobicContact CG-CZ 3.82Å; A345-F350 HydrophobicContact CB-CD1 3.77Å; A345-F350 HydrophobicContact CB-CE1 3.9Å; F350-H352 HydrophobicContact CD2-CB 4.13Å; F350-H352 HydrophobicContact CE2-CB 3.92Å; F350-Y379 WeakPolarHBondContact O-CE1 3.46Å
351	I	98.8	Very high	96.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.2	169.3	-61.9	173.5	0	0	0	107.7	L330 P331 I332 V333 F356 L362 Y365 L366 L369 Y379	L330-I351 HydrophobicContact CD1-CG1 4.36Å; L330-I351 HydrophobicContact CD2-CD1 3.65Å; L330-I351 HydrophobicContact CD2-CG1 4.12Å; L330-I351 HydrophobicContact CG-CD1 4.06Å; L330-I351 HydrophobicContact CG-CG1 4.24Å; P331-I351 PolarHBondContact O-N 2.68Å; I332-I351 CarbonylContact C-O 3.59Å; I332-I351 VanDerWaalsContact CA-O 3.25Å; I332-I351 WeakPolarHBondContact CA-O 3.45Å; I332-I351 HydrophobicContact CG1-CB 4.49Å; V333-I351 WeakPolarHBondContact CG2-O 3.43Å; V333-I351 PolarHBondContact N-O 3.14Å; I351-F356 HydrophobicContact CG2-CE2 3.5Å; I351-F356 HydrophobicContact CG2-CZ 4.07Å; I351-L362 HydrophobicContact CG2-CD1 3.74Å; I351-Y365 HydrophobicContact CD1-CD1 4.15Å; I351-Y365 HydrophobicContact CD1-CE1 3.92Å; I351-Y365 HydrophobicContact CG1-CE1 4.4Å; I351-L366 HydrophobicContact CD1-CD2 3.76Å; I351-L369 HydrophobicContact CD1-CD1 3.6Å; I351-Y379 HydrophobicContact CG1-CE1 3.91Å
352	H	98.8	Very high	96.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	134.3	179.1	-169.4	-70.6	0	0	0	110.8	V333 A336 I338 Y341 F350 D354 Q355 R428	V333-H352 HydrophobicContact CG2-CB 3.81Å; V333-H352 VanDerWaalsContact CG2-CD2 3.47Å; V333-H352 WeakPolarHBondContact CG2-CD2 3.41Å; A336-H352 PolarHBondContact O-NE2 3.27Å; I338-H352 HydrophobicContact CD1-CB 4.5Å; I338-H352 HydrophobicContact CG1-CB 3.85Å; Y341-H352 AromaticContact CD2-CD2 3.65Å; Y341-H352 AromaticContact CE2-CD2 3.92Å; Y341-H352 AromaticContact CE2-NE2 3.99Å; F350-H352 HydrophobicContact CD2-CB 4.13Å; F350-H352 HydrophobicContact CE2-CB 3.92Å; H352-D354 IonicContact CE1-OD2 3.03Å; H352-D354 PolarHBondContact CE1-OD2 2.96Å; H352-D354 VanDerWaalsContact CE1-OD2 3.24Å; H352-D354 WeakPolarHBondContact ND1-CB 3.42Å; H352-D354 PolarHBondContact ND1-N 3.03Å; H352-D354 IonicContact ND1-OD2 2.61Å; H352-D354 PolarHBondContact O-N 2.8Å; H352-D354 VanDerWaalsContact O-N 3.14Å; H352-Q355 HydrophobicContact CB-CG 4.24Å; H352-Q355 VanDerWaalsContact O-CB 3.27Å; H352-Q355 WeakPolarHBondContact O-CB 3.32Å; H352-Q355 WeakPolarHBondContact O-CG 3.14Å; H352-Q355 PolarHBondContact O-N 2.99Å; H352-Q355 PolarHBondContact O-OE1 3.22Å; H352-R428 PolarHBondContact CE1-NH2 2.71Å; H352-R428 VanDerWaalsContact CE1-NH2 3.26Å; H352-R428 PolarHBondContact NE2-NH2 3.38Å
353	V	98.7	Very high	96.6	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-56	-34.4	-176.8	-68.3	0	0	0	0	113.9	Y259 F307 I332 V333 M334 Q355 F356 L362 L430	Y259-V353 HydrophobicContact CD1-CG1 4.47Å; Y259-V353 HydrophobicContact CE1-CB 4.41Å; Y259-V353 HydrophobicContact CE1-CG1 3.82Å; Y259-V353 HydrophobicContact CE2-CB 3.93Å; Y259-V353 HydrophobicContact CE2-CG1 4.16Å; F307-V353 HydrophobicContact CE1-CG1 3.73Å; F307-V353 HydrophobicContact CZ-CG1 3.94Å; I332-V353 HydrophobicContact CG2-CG1 4.18Å; V333-V353 WeakPolarHBondContact O-CG1 3.26Å; V333-V353 PolarHBondContact O-N 3.49Å; V333-V353 VanDerWaalsContact O-N 3.11Å; M334-V353 HydrophobicContact CB-CG1 4.2Å; M334-V353 HydrophobicContact CB-CG2 3.85Å; M334-V353 HydrophobicContact CE-CB 4.47Å; M334-V353 HydrophobicContact CE-CG1 4.12Å; M334-V353 HydrophobicContact CE-CG2 4.07Å; M334-V353 HydrophobicContact CG-CG2 4Å; V353-Q355 PolarHBondContact O-N 3.02Å; V353-F356 PolarHBondContact O-N 3Å; V353-F356 VanDerWaalsContact O-N 3.13Å; V353-L362 HydrophobicContact CG1-CD2 4.3Å; V353-L430 HydrophobicContact CG2-CD2 4.12Å
354	D	98.2	Very high	97.1	Very high	22 Å²	22	31.5 Å²	31.5	12%	0.118	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-70.3	-9.6	179	-66.5	-24	0	0	0	114.5	I338 H352 F356 R428 L430 R431	I338-D354 HydrophobicContact CD1-CB 4.31Å; H352-D354 IonicContact CE1-OD2 3.03Å; H352-D354 PolarHBondContact CE1-OD2 2.96Å; H352-D354 VanDerWaalsContact CE1-OD2 3.24Å; H352-D354 WeakPolarHBondContact ND1-CB 3.42Å; H352-D354 PolarHBondContact ND1-N 3.03Å; H352-D354 IonicContact ND1-OD2 2.61Å; H352-D354 PolarHBondContact O-N 2.8Å; H352-D354 VanDerWaalsContact O-N 3.14Å; D354-F356 PolarHBondContact O-N 3.47Å; D354-R428 IonicContact OD2-CZ 3.2Å; D354-R428 VanDerWaalsContact OD2-CZ 3.23Å; D354-R428 IonicContact OD2-NH1 3.79Å; D354-R428 PolarHBondContact OD2-NH1 3.47Å; D354-R428 IonicContact OD2-NH2 3.73Å; D354-R428 PolarHBondContact OD2-NH2 2.78Å; D354-L430 WeakPolarHBondContact OD1-CA 3.25Å; D354-R431 HydrophobicContact CB-CB 4.05Å; D354-R431 WeakPolarHBondContact O-CD 3.45Å; D354-R431 PolarHBondContact O-NH1 2.65Å; D354-R431 PolarHBondContact OD1-N 3.03Å
355	Q	98.3	Very high	97.5	Very high	81 Å²	81	33.4 Å²	33.4	38%	0.379	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-67.4	-16.1	169.4	-65.4	172.1	-45.6	0	0	111.7	I338 H352 V353	I338-Q355 HydrophobicContact CD1-CG 3.91Å; H352-Q355 HydrophobicContact CB-CG 4.24Å; H352-Q355 VanDerWaalsContact O-CB 3.27Å; H352-Q355 WeakPolarHBondContact O-CB 3.32Å; H352-Q355 WeakPolarHBondContact O-CG 3.14Å; H352-Q355 PolarHBondContact O-N 2.99Å; H352-Q355 PolarHBondContact O-OE1 3.22Å; V353-Q355 PolarHBondContact O-N 3.02Å
356	F	98.5	Very high	97.7	Very high	30 Å²	30	33.1 Å²	33.1	13%	0.132	16%	0.16	C	C	.	.	S	Bend	trans	-119.3	148.4	-175.6	-54.3	-87.8	0	0	0	111.5	I351 V353 D354 S358 K361 L362 Y365	I351-F356 HydrophobicContact CG2-CE2 3.5Å; I351-F356 HydrophobicContact CG2-CZ 4.07Å; V353-F356 PolarHBondContact O-N 3Å; V353-F356 VanDerWaalsContact O-N 3.13Å; D354-F356 PolarHBondContact O-N 3.47Å; F356-S358 VanDerWaalsContact C-N 3.32Å; F356-K361 HydrophobicContact CB-CB 4.25Å; F356-K361 HydrophobicContact CD1-CB 4.35Å; F356-L362 HydrophobicContact CB-CB 4.17Å; F356-L362 HydrophobicContact CD1-CB 4.38Å; F356-L362 HydrophobicContact CD2-CB 4Å; F356-L362 HydrophobicContact CD2-CD1 3.69Å; F356-L362 HydrophobicContact CD2-CG 4.37Å; F356-L362 HydrophobicContact CE2-CD1 3.52Å; F356-L362 HydrophobicContact CG-CB 3.89Å; F356-L362 HydrophobicContact CG-CD1 4.34Å; F356-L362 HydrophobicContact CZ-CD1 4.02Å; F356-Y365 VanDerWaalsContact CE1-CB 3.47Å; F356-Y365 AromaticContact CE1-CD1 3.92Å; F356-Y365 HydrophobicContact CE1-CD1 3.92Å; F356-Y365 HydrophobicContact CE1-CD2 4.47Å; F356-Y365 AromaticContact CE1-CG 3.71Å; F356-Y365 HydrophobicContact CE1-CG 3.71Å; F356-Y365 AromaticContact CZ-CD1 3.44Å; F356-Y365 HydrophobicContact CZ-CD1 3.44Å; F356-Y365 VanDerWaalsContact CZ-CD1 3.44Å; F356-Y365 HydrophobicContact CZ-CE1 4.14Å; F356-Y365 AromaticContact CZ-CG 3.75Å; F356-Y365 HydrophobicContact CZ-CG 3.75Å
357	E	97.3	Very high	97.9	Very high	125 Å²	125	36.1 Å²	36.1	58%	0.584	17%	0.173	S	C	*	.	S	Bend	trans	-70.5	-29.3	177.1	-67.8	173.7	176.5	0	0	112.9	R431	E357-R431 VanDerWaalsContact CG-NH2 3.27Å; E357-R431 IonicContact OE1-NH2 3.43Å
358	S	97.9	Very high	98.2	Very high	34 Å²	34	41 Å²	41	24%	0.238	19%	0.19	C	C	.	.	S	Bend	trans	-155.1	161.3	-176.7	70.7	0	0	0	0	112.1	F356 A360 K361 L362	F356-S358 VanDerWaalsContact C-N 3.32Å; S358-A360 PolarHBondContact O-N 3.22Å; S358-A360 PolarHBondContact OG-N 3.15Å; S358-K361 PolarHBondContact O-N 3.23Å; S358-K361 VanDerWaalsContact O-N 3.1Å; S358-K361 PolarHBondContact OG-N 2.9Å; S358-L362 PolarHBondContact O-N 2.87Å; S358-L362 VanDerWaalsContact O-N 3.08Å
359	P	98.6	Very high	98.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-57.1	-29.3	172.3	-24.1	32.2	0	0	0	113.4	Y259 E262 L263 L362 A363 W432	Y259-P359 HydrophobicContact CD1-CB 4.27Å; Y259-P359 HydrophobicContact CD1-CG 4Å; Y259-P359 HydrophobicContact CD2-CG 4.08Å; Y259-P359 HydrophobicContact CE1-CB 3.85Å; Y259-P359 HydrophobicContact CE1-CG 3.79Å; Y259-P359 HydrophobicContact CE2-CG 3.87Å; Y259-P359 HydrophobicContact CG-CG 4.12Å; E262-P359 HydrophobicContact CB-CB 4.22Å; E262-P359 HydrophobicContact CB-CG 3.97Å; E262-P359 HydrophobicContact CG-CB 3.93Å; E262-P359 HydrophobicContact CG-CG 3.74Å; L263-P359 HydrophobicContact CB-CB 4.07Å; L263-P359 HydrophobicContact CD1-CB 4.3Å; L263-P359 VanDerWaalsContact CD1-O 3.27Å; L263-P359 WeakPolarHBondContact CD1-O 3.19Å; P359-L362 PolarHBondContact O-N 3.44Å; P359-A363 WeakPolarHBondContact O-CB 3.4Å; P359-A363 PolarHBondContact O-N 3.4Å; P359-W432 HydrophobicContact CG-CD2 4.22Å; P359-W432 HydrophobicContact CG-CG 4.49Å; P359-W432 HydrophobicContact CG-CZ2 4.08Å
360	A	98.6	Very high	98.6	Very high	26 Å²	26	38.4 Å²	38.4	22%	0.215	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-44	175	0	0	0	0	0	111.9	S358 A363 D364	S358-A360 PolarHBondContact O-N 3.22Å; S358-A360 PolarHBondContact OG-N 3.15Å; A360-A363 WeakPolarHBondContact O-CB 3.29Å; A360-A363 PolarHBondContact O-N 3.03Å; A360-D364 PolarHBondContact O-N 3.19Å
361	K	98.7	Very high	98.5	Very high	114 Å²	114	46.3 Å²	46.3	50%	0.496	22%	0.217	S	C	.	.	H	α-helix	trans	-66.1	-38.3	176	-69.5	-61	-173.5	-176.4	0	112.2	F356 S358 D364 Y365	F356-K361 HydrophobicContact CB-CB 4.25Å; F356-K361 HydrophobicContact CD1-CB 4.35Å; S358-K361 PolarHBondContact O-N 3.23Å; S358-K361 VanDerWaalsContact O-N 3.1Å; S358-K361 PolarHBondContact OG-N 2.9Å; K361-D364 PolarHBondContact O-N 3.47Å; K361-Y365 PolarHBondContact O-N 3.12Å
362	L	98.8	Very high	98.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-48.2	169.9	173.3	62.7	0	0	0	110.6	Y259 L263 I332 I351 V353 F356 S358 P359 D364 Y365 L366	Y259-L362 HydrophobicContact CE1-CD2 3.88Å; L263-L362 HydrophobicContact CD1-CD2 4.14Å; L263-L362 HydrophobicContact CD1-CG 4.28Å; L263-L362 HydrophobicContact CD2-CD2 4.33Å; I332-L362 HydrophobicContact CG2-CD1 4.48Å; I332-L362 HydrophobicContact CG2-CD2 3.86Å; I351-L362 HydrophobicContact CG2-CD1 3.74Å; V353-L362 HydrophobicContact CG1-CD2 4.3Å; F356-L362 HydrophobicContact CB-CB 4.17Å; F356-L362 HydrophobicContact CD1-CB 4.38Å; F356-L362 HydrophobicContact CD2-CB 4Å; F356-L362 HydrophobicContact CD2-CD1 3.69Å; F356-L362 HydrophobicContact CD2-CG 4.37Å; F356-L362 HydrophobicContact CE2-CD1 3.52Å; F356-L362 HydrophobicContact CG-CB 3.89Å; F356-L362 HydrophobicContact CG-CD1 4.34Å; F356-L362 HydrophobicContact CZ-CD1 4.02Å; S358-L362 PolarHBondContact O-N 2.87Å; S358-L362 VanDerWaalsContact O-N 3.08Å; P359-L362 PolarHBondContact O-N 3.44Å; L362-D364 VanDerWaalsContact C-N 3.29Å; L362-D364 PolarHBondContact O-N 3.45Å; L362-Y365 WeakPolarHBondContact O-CB 3.36Å; L362-Y365 PolarHBondContact O-N 2.83Å; L362-Y365 VanDerWaalsContact O-N 3.09Å; L362-L366 HydrophobicContact CD1-CD1 4.22Å; L362-L366 HydrophobicContact CD1-CD2 4.22Å; L362-L366 HydrophobicContact CD1-CG 4.02Å; L362-L366 HydrophobicContact CG-CD1 4.03Å; L362-L366 HydrophobicContact CG-CG 4.26Å; L362-L366 WeakPolarHBondContact O-CG 3.14Å; L362-L366 PolarHBondContact O-N 3.12Å
363	A	98.9	Very high	98.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.4	-38.9	178.8	0	0	0	0	0	113.1	L263 H266 I267 P359 A360 Y365 L366 K367	L263-A363 HydrophobicContact CD1-CB 3.96Å; H266-A363 HydrophobicContact CB-CB 3.38Å; I267-A363 HydrophobicContact CB-CB 4Å; I267-A363 HydrophobicContact CG2-CB 3.91Å; P359-A363 WeakPolarHBondContact O-CB 3.4Å; P359-A363 PolarHBondContact O-N 3.4Å; A360-A363 WeakPolarHBondContact O-CB 3.29Å; A360-A363 PolarHBondContact O-N 3.03Å; A363-Y365 VanDerWaalsContact C-N 3.35Å; A363-L366 PolarHBondContact O-N 2.81Å; A363-K367 VanDerWaalsContact O-CG 3.25Å; A363-K367 WeakPolarHBondContact O-CG 3.34Å; A363-K367 PolarHBondContact O-N 2.99Å
364	D	98.9	Very high	98.4	Very high	82 Å²	82	55.5 Å²	55.5	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175.5	-69.5	-20.5	0	0	0	111.8	A360 K361 L362 K367 Y368	A360-D364 PolarHBondContact O-N 3.19Å; K361-D364 PolarHBondContact O-N 3.47Å; L362-D364 VanDerWaalsContact C-N 3.29Å; L362-D364 PolarHBondContact O-N 3.45Å; D364-K367 PolarHBondContact O-N 3.29Å; D364-K367 IonicContact OD1-NZ 3.07Å; D364-K367 PolarHBondContact OD1-NZ 3.3Å; D364-Y368 PolarHBondContact O-N 2.94Å
365	Y	98.9	Very high	98.4	Very high	67 Å²	67	54.6 Å²	54.6	26%	0.263	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.1	-172.9	-112.9	0	0	0	112.6	I351 F356 K361 L362 A363 K367 Y368 L369 Y379	I351-Y365 HydrophobicContact CD1-CD1 4.15Å; I351-Y365 HydrophobicContact CD1-CE1 3.92Å; I351-Y365 HydrophobicContact CG1-CE1 4.4Å; F356-Y365 VanDerWaalsContact CE1-CB 3.47Å; F356-Y365 AromaticContact CE1-CD1 3.92Å; F356-Y365 HydrophobicContact CE1-CD1 3.92Å; F356-Y365 HydrophobicContact CE1-CD2 4.47Å; F356-Y365 AromaticContact CE1-CG 3.71Å; F356-Y365 HydrophobicContact CE1-CG 3.71Å; F356-Y365 AromaticContact CZ-CD1 3.44Å; F356-Y365 HydrophobicContact CZ-CD1 3.44Å; F356-Y365 VanDerWaalsContact CZ-CD1 3.44Å; F356-Y365 HydrophobicContact CZ-CE1 4.14Å; F356-Y365 AromaticContact CZ-CG 3.75Å; F356-Y365 HydrophobicContact CZ-CG 3.75Å; K361-Y365 PolarHBondContact O-N 3.12Å; L362-Y365 WeakPolarHBondContact O-CB 3.36Å; L362-Y365 PolarHBondContact O-N 2.83Å; L362-Y365 VanDerWaalsContact O-N 3.09Å; A363-Y365 VanDerWaalsContact C-N 3.35Å; Y365-K367 VanDerWaalsContact C-N 3.32Å; Y365-K367 PolarHBondContact O-N 2.91Å; Y365-Y368 HydrophobicContact CD2-CD1 4.01Å; Y365-Y368 AromaticContact CE2-CD1 3.84Å; Y365-Y368 HydrophobicContact CE2-CD1 3.84Å; Y365-Y368 HydrophobicContact CE2-CE1 4.12Å; Y365-Y368 WeakPolarHBondContact O-CB 3.15Å; Y365-Y368 PolarHBondContact O-N 2.99Å; Y365-Y368 VanDerWaalsContact O-N 3.12Å; Y365-L369 HydrophobicContact CD1-CD1 4.01Å; Y365-L369 HydrophobicContact CD1-CG 4.4Å; Y365-L369 HydrophobicContact CE1-CD1 3.54Å; Y365-L369 HydrophobicContact CE1-CD2 4.46Å; Y365-L369 HydrophobicContact CE1-CG 4.04Å; Y365-L369 PolarHBondContact O-N 2.94Å; Y365-Y379 HydrophobicContact CE1-CE2 4.42Å; Y365-Y379 PolarHBondContact OH-OH 2.87Å
366	L	98.9	Very high	98.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-37.2	175.3	-62.7	177.1	0	0	0	112	V243 I267 F303 I332 I351 L362 A363 Y368 L369 D370	V243-L366 HydrophobicContact CG2-CD1 4.15Å; I267-L366 HydrophobicContact CD1-CB 3.54Å; I267-L366 HydrophobicContact CD1-CD1 4.13Å; F303-L366 HydrophobicContact CD1-CD2 3.74Å; F303-L366 HydrophobicContact CD2-CB 4.47Å; F303-L366 HydrophobicContact CD2-CD2 4.33Å; F303-L366 HydrophobicContact CE1-CD2 3.79Å; F303-L366 HydrophobicContact CE2-CB 4.1Å; F303-L366 HydrophobicContact CE2-CD2 4.38Å; F303-L366 HydrophobicContact CG-CD2 4.03Å; F303-L366 HydrophobicContact CZ-CB 4.26Å; F303-L366 HydrophobicContact CZ-CD2 4.13Å; F303-L366 WeakPolarHBondContact CZ-O 3.26Å; I332-L366 HydrophobicContact CD1-CD1 3.5Å; I332-L366 VanDerWaalsContact CD1-CD1 3.5Å; I332-L366 HydrophobicContact CD1-CD2 3.75Å; I332-L366 HydrophobicContact CD1-CG 4.26Å; I332-L366 HydrophobicContact CG1-CD2 4.2Å; I351-L366 HydrophobicContact CD1-CD2 3.76Å; L362-L366 HydrophobicContact CD1-CD1 4.22Å; L362-L366 HydrophobicContact CD1-CD2 4.22Å; L362-L366 HydrophobicContact CD1-CG 4.02Å; L362-L366 HydrophobicContact CG-CD1 4.03Å; L362-L366 HydrophobicContact CG-CG 4.26Å; L362-L366 WeakPolarHBondContact O-CG 3.14Å; L362-L366 PolarHBondContact O-N 3.12Å; A363-L366 PolarHBondContact O-N 2.81Å; L366-Y368 VanDerWaalsContact C-N 3.32Å; L366-L369 PolarHBondContact O-N 2.88Å; L366-D370 VanDerWaalsContact O-CB 3.25Å; L366-D370 WeakPolarHBondContact O-CB 3.35Å; L366-D370 PolarHBondContact O-N 3.39Å
367	K	98.8	Very high	98.4	Very high	65 Å²	65	49.9 Å²	49.9	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-66.7	-33.1	173	-70.4	165	-164.9	160.2	0	112.4	H266 I267 A363 D364 Y365 K371	H266-K367 WeakPolarHBondContact O-CE 3.44Å; H266-K367 PolarHBondContact O-NZ 3.18Å; I267-K367 HydrophobicContact CD1-CG 4.38Å; A363-K367 VanDerWaalsContact O-CG 3.25Å; A363-K367 WeakPolarHBondContact O-CG 3.34Å; A363-K367 PolarHBondContact O-N 2.99Å; D364-K367 PolarHBondContact O-N 3.29Å; D364-K367 IonicContact OD1-NZ 3.07Å; D364-K367 PolarHBondContact OD1-NZ 3.3Å; Y365-K367 VanDerWaalsContact C-N 3.32Å; Y365-K367 PolarHBondContact O-N 2.91Å; K367-K371 WeakPolarHBondContact O-CG 3.22Å; K367-K371 PolarHBondContact O-N 3.45Å
368	Y	98.8	Very high	98.3	Very high	112 Å²	112	48.3 Å²	48.3	44%	0.439	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-51.9	172.7	158.4	-102.9	0	0	0	110.6	D364 Y365 L366 D370 K371 N372 A375	D364-Y368 PolarHBondContact O-N 2.94Å; Y365-Y368 HydrophobicContact CD2-CD1 4.01Å; Y365-Y368 AromaticContact CE2-CD1 3.84Å; Y365-Y368 HydrophobicContact CE2-CD1 3.84Å; Y365-Y368 HydrophobicContact CE2-CE1 4.12Å; Y365-Y368 WeakPolarHBondContact O-CB 3.15Å; Y365-Y368 PolarHBondContact O-N 2.99Å; Y365-Y368 VanDerWaalsContact O-N 3.12Å; L366-Y368 VanDerWaalsContact C-N 3.32Å; Y368-D370 VanDerWaalsContact C-N 3.28Å; Y368-D370 PolarHBondContact O-N 2.76Å; Y368-K371 PolarHBondContact O-N 2.9Å; Y368-N372 HydrophobicContact CE2-CB 4.09Å; Y368-N372 WeakPolarHBondContact O-CB 3.29Å; Y368-N372 PolarHBondContact O-N 3.05Å; Y368-N372 PolarHBondContact OH-ND2 3.41Å; Y368-N372 VanDerWaalsContact OH-ND2 3.12Å; Y368-A375 HydrophobicContact CE1-CB 3.81Å; Y368-A375 WeakPolarHBondContact OH-CB 3.47Å
369	L	98.7	Very high	98.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-37.2	177.4	-66.7	-178.9	0	0	0	112.2	F303 L330 I351 Y365 L366 K371 N372 A375 Y379	F303-L369 HydrophobicContact CE1-CB 4.09Å; F303-L369 HydrophobicContact CE1-CD1 4.09Å; F303-L369 HydrophobicContact CZ-CB 3.88Å; L330-L369 HydrophobicContact CD2-CD1 4Å; I351-L369 HydrophobicContact CD1-CD1 3.6Å; Y365-L369 HydrophobicContact CD1-CD1 4.01Å; Y365-L369 HydrophobicContact CD1-CG 4.4Å; Y365-L369 HydrophobicContact CE1-CD1 3.54Å; Y365-L369 HydrophobicContact CE1-CD2 4.46Å; Y365-L369 HydrophobicContact CE1-CG 4.04Å; Y365-L369 PolarHBondContact O-N 2.94Å; L366-L369 PolarHBondContact O-N 2.88Å; L369-K371 PolarHBondContact O-N 3.28Å; L369-N372 CarbonylContact O-C 3.55Å; L369-N372 PolarHBondContact O-N 3.04Å; L369-A375 HydrophobicContact CD2-CB 3.84Å; L369-Y379 HydrophobicContact CD1-CD2 4.32Å; L369-Y379 HydrophobicContact CD1-CE2 3.87Å; L369-Y379 HydrophobicContact CD2-CE2 4.14Å
370	D	98.5	Very high	98.2	Very high	33 Å²	33	48.1 Å²	48.1	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-27.9	175.3	-177.9	46.3	0	0	0	113.1	K242 K302 F303 L366 Y368	K242-D370 WeakPolarHBondContact CE-OD2 3.45Å; K302-D370 WeakPolarHBondContact CD-OD1 3.44Å; K302-D370 WeakPolarHBondContact CE-OD1 3.3Å; K302-D370 PolarHBondContact NZ-O 2.82Å; K302-D370 IonicContact NZ-OD1 3.99Å; K302-D370 PolarHBondContact NZ-OD1 3.13Å; F303-D370 HydrophobicContact CE2-CB 4.41Å; L366-D370 VanDerWaalsContact O-CB 3.25Å; L366-D370 WeakPolarHBondContact O-CB 3.35Å; L366-D370 PolarHBondContact O-N 3.39Å; Y368-D370 VanDerWaalsContact C-N 3.28Å; Y368-D370 PolarHBondContact O-N 2.76Å
371	K	98.2	Very high	98.1	Very high	180 Å²	180	47.4 Å²	47.4	78%	0.783	23%	0.225	S	C	*	.	H	α-helix	trans	-99.3	-8.9	179.9	-67.3	175.7	-178.3	-178.4	0	113.8	K367 Y368 L369	K367-K371 WeakPolarHBondContact O-CG 3.22Å; K367-K371 PolarHBondContact O-N 3.45Å; Y368-K371 PolarHBondContact O-N 2.9Å; L369-K371 PolarHBondContact O-N 3.28Å
372	N	98.4	Very high	97.8	Very high	51 Å²	51	42.5 Å²	42.5	27%	0.273	20%	0.203	S	C	.	.			trans	-127.4	89.3	-176.3	-174.6	-13.2	0	0	0	109.8	Y368 L369 T374 A375 Y376	Y368-N372 HydrophobicContact CE2-CB 4.09Å; Y368-N372 WeakPolarHBondContact O-CB 3.29Å; Y368-N372 PolarHBondContact O-N 3.05Å; Y368-N372 PolarHBondContact OH-ND2 3.41Å; Y368-N372 VanDerWaalsContact OH-ND2 3.12Å; L369-N372 CarbonylContact O-C 3.55Å; L369-N372 PolarHBondContact O-N 3.04Å; N372-T374 PolarHBondContact O-N 2.85Å; N372-T374 WeakPolarHBondContact OD1-CB 3.34Å; N372-T374 PolarHBondContact OD1-N 2.79Å; N372-A375 HydrophobicContact CB-CB 4.1Å; N372-A375 PolarHBondContact O-N 2.87Å; N372-A375 PolarHBondContact OD1-N 3.09Å; N372-A375 VanDerWaalsContact OD1-N 3.13Å; N372-Y376 PolarHBondContact O-N 2.89Å
373	D	97.7	Very high	97.5	Very high	58 Å²	58	45.8 Å²	45.8	31%	0.31	22%	0.218	S	C	.	.	H	α-helix	trans	-59	-35.4	-179.4	-75.1	6.3	0	0	0	112	N234 A236 Y376 N377	N234-D373 PolarHBondContact ND2-OD2 2.94Å; A236-D373 HydrophobicContact CB-CB 4.38Å; D373-Y376 PolarHBondContact O-N 3.14Å; D373-N377 WeakPolarHBondContact O-CB 3.4Å; D373-N377 PolarHBondContact O-N 3.03Å; D373-N377 PolarHBondContact O-ND2 3.02Å
374	T	97.7	Very high	97	Very high	84 Å²	84	48.1 Å²	48.1	52%	0.515	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-52.4	176.7	-56.5	0	0	0	0	110.7	L230 N372 Y376 N377 E378	L230-T374 HydrophobicContact CD1-CG2 4.15Å; N372-T374 PolarHBondContact O-N 2.85Å; N372-T374 WeakPolarHBondContact OD1-CB 3.34Å; N372-T374 PolarHBondContact OD1-N 2.79Å; T374-Y376 VanDerWaalsContact C-N 3.3Å; T374-Y376 PolarHBondContact O-N 3.05Å; T374-N377 PolarHBondContact O-N 3.29Å; T374-E378 PolarHBondContact O-N 2.78Å; T374-E378 VanDerWaalsContact O-N 3.12Å
375	A	98	Very high	96.7	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-34.3	178.9	0	0	0	0	0	112.6	Y368 L369 N372	Y368-A375 HydrophobicContact CE1-CB 3.81Å; Y368-A375 WeakPolarHBondContact OH-CB 3.47Å; L369-A375 HydrophobicContact CD2-CB 3.84Å; N372-A375 HydrophobicContact CB-CB 4.1Å; N372-A375 PolarHBondContact O-N 2.87Å; N372-A375 PolarHBondContact OD1-N 3.09Å; N372-A375 VanDerWaalsContact OD1-N 3.13Å
376	Y	98.5	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-44.5	173.2	177.2	-89.9	0	0	0	111.9	I235 A236 K302 F303 L330 N372 D373 T374 E378 Y379 F380	I235-Y376 HydrophobicContact CB-CE1 4.41Å; I235-Y376 HydrophobicContact CG2-CE1 4.14Å; A236-Y376 HydrophobicContact CB-CD1 3.62Å; A236-Y376 HydrophobicContact CB-CE1 3.91Å; A236-Y376 HydrophobicContact CB-CG 4.31Å; K302-Y376 HydrophobicContact CB-CE2 3.72Å; K302-Y376 HydrophobicContact CD-CE2 4.48Å; K302-Y376 HydrophobicContact CG-CE2 4.25Å; K302-Y376 PolarHBondContact O-OH 3.19Å; F303-Y376 HydrophobicContact CD1-CE2 4.29Å; F303-Y376 AromaticContact CE1-CD2 3.92Å; F303-Y376 HydrophobicContact CE1-CD2 3.92Å; F303-Y376 AromaticContact CE1-CE2 3.85Å; F303-Y376 HydrophobicContact CE1-CE2 3.85Å; F303-Y376 HydrophobicContact CZ-CD2 4.31Å; F303-Y376 HydrophobicContact CZ-CE2 4.4Å; L330-Y376 HydrophobicContact CB-CE2 3.99Å; L330-Y376 HydrophobicContact CD2-CD2 4.32Å; L330-Y376 HydrophobicContact CD2-CE2 4.27Å; N372-Y376 PolarHBondContact O-N 2.89Å; D373-Y376 PolarHBondContact O-N 3.14Å; T374-Y376 VanDerWaalsContact C-N 3.3Å; T374-Y376 PolarHBondContact O-N 3.05Å; Y376-E378 VanDerWaalsContact C-N 3.27Å; Y376-E378 PolarHBondContact O-N 3.13Å; Y376-Y379 WeakPolarHBondContact O-CB 3.47Å; Y376-Y379 PolarHBondContact O-N 3.21Å; Y376-F380 HydrophobicContact CD1-CD2 4.32Å; Y376-F380 HydrophobicContact CD1-CE2 4.11Å; Y376-F380 AromaticContact CE1-CD2 3.92Å; Y376-F380 HydrophobicContact CE1-CD2 3.92Å; Y376-F380 AromaticContact CE1-CE2 3.4Å; Y376-F380 HydrophobicContact CE1-CE2 3.4Å; Y376-F380 VanDerWaalsContact CE1-CE2 3.4Å; Y376-F380 HydrophobicContact CE1-CZ 4.24Å; Y376-F380 HydrophobicContact CE2-CE2 4.06Å; Y376-F380 AromaticContact CZ-CE2 3.38Å; Y376-F380 AromaticContact CZ-CZ 3.96Å; Y376-F380 WeakPolarHBondContact OH-CE2 3.19Å; Y376-F380 WeakPolarHBondContact OH-CZ 3.39Å
377	N	97.5	Very high	96.1	Very high	11 Å²	11	48 Å²	48	6%	0.059	25%	0.245	C	C	.	.	H	α-helix	trans	-71	-19.2	-178.8	-78	-81.4	0	0	0	113.4	L230 P231 N234 I235 D373 T374 Y379 F380 A381	L230-N377 HydrophobicContact CD2-CB 4.44Å; P231-N377 HydrophobicContact CG-CB 4.23Å; N234-N377 PolarHBondContact OD1-ND2 2.84Å; I235-N377 PolarHBondContact N-OD1 3.26Å; D373-N377 WeakPolarHBondContact O-CB 3.4Å; D373-N377 PolarHBondContact O-N 3.03Å; D373-N377 PolarHBondContact O-ND2 3.02Å; T374-N377 PolarHBondContact O-N 3.29Å; N377-Y379 PolarHBondContact O-N 3.49Å; N377-F380 CarbonylContact O-C 3.53Å; N377-F380 WeakPolarHBondContact O-CA 3.29Å; N377-F380 PolarHBondContact O-N 2.67Å; N377-A381 PolarHBondContact O-N 3.45Å
378	E	96.6	Very high	95.9	Very high	92 Å²	92	45.4 Å²	45.4	43%	0.43	23%	0.234	S	C	.	.	H	α-helix	trans	-56.5	-34.2	169.8	-72.6	174.5	-174.1	0	0	112.1	L230 T374 Y376 F380 A381	L230-E378 HydrophobicContact CD2-CB 4.3Å; L230-E378 HydrophobicContact CD2-CG 3.76Å; T374-E378 PolarHBondContact O-N 2.78Å; T374-E378 VanDerWaalsContact O-N 3.12Å; Y376-E378 VanDerWaalsContact C-N 3.27Å; Y376-E378 PolarHBondContact O-N 3.13Å; E378-F380 PolarHBondContact O-N 2.8Å; E378-A381 WeakPolarHBondContact O-CB 3.28Å; E378-A381 PolarHBondContact O-N 2.83Å
379	Y	97.5	Very high	95.6	Very high	31 Å²	31	41.8 Å²	41.8	12%	0.122	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.4	175.9	-77.3	-83.1	0	0	0	114.5	L330 Y348 F350 I351 Y365 L369 Y376 N377 W382	L330-Y379 HydrophobicContact CD1-CD1 3.68Å; L330-Y379 HydrophobicContact CD1-CE1 4.45Å; L330-Y379 HydrophobicContact CD1-CG 3.76Å; L330-Y379 HydrophobicContact CD2-CD1 4.17Å; L330-Y379 HydrophobicContact CD2-CD2 3.66Å; L330-Y379 HydrophobicContact CD2-CE2 4.21Å; L330-Y379 HydrophobicContact CD2-CG 3.63Å; L330-Y379 HydrophobicContact CG-CG 4.38Å; Y348-Y379 CarbonylContact O-C 3.48Å; Y348-Y379 WeakPolarHBondContact O-CA 3.44Å; Y348-Y379 VanDerWaalsContact O-CD1 3.25Å; Y348-Y379 WeakPolarHBondContact O-CD1 3.27Å; F350-Y379 WeakPolarHBondContact O-CE1 3.46Å; I351-Y379 HydrophobicContact CG1-CE1 3.91Å; Y365-Y379 HydrophobicContact CE1-CE2 4.42Å; Y365-Y379 PolarHBondContact OH-OH 2.87Å; L369-Y379 HydrophobicContact CD1-CD2 4.32Å; L369-Y379 HydrophobicContact CD1-CE2 3.87Å; L369-Y379 HydrophobicContact CD2-CE2 4.14Å; Y376-Y379 WeakPolarHBondContact O-CB 3.47Å; Y376-Y379 PolarHBondContact O-N 3.21Å; N377-Y379 PolarHBondContact O-N 3.49Å; Y379-W382 PolarHBondContact O-NE1 3.33Å
380	F	96.7	Very high	95.2	Very high	1 Å²	1	44.4 Å²	44.4	0%	0.004	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	14.5	178.2	-64.7	-89.6	0	0	0	112.1	P231 I235 L330 Y376 N377 E378 W382 H383	P231-F380 HydrophobicContact CG-CB 4.45Å; I235-F380 HydrophobicContact CD1-CB 3.31Å; I235-F380 HydrophobicContact CD1-CD1 3.75Å; I235-F380 HydrophobicContact CD1-CD2 4.36Å; I235-F380 HydrophobicContact CD1-CG 3.56Å; I235-F380 HydrophobicContact CG2-CD1 4.28Å; I235-F380 HydrophobicContact CG2-CD2 4.34Å; I235-F380 HydrophobicContact CG2-CE1 4.2Å; I235-F380 HydrophobicContact CG2-CE2 4.29Å; I235-F380 HydrophobicContact CG2-CG 4.33Å; I235-F380 HydrophobicContact CG2-CZ 4.18Å; L330-F380 HydrophobicContact CB-CE2 4.02Å; L330-F380 HydrophobicContact CB-CZ 3.99Å; Y376-F380 HydrophobicContact CD1-CD2 4.32Å; Y376-F380 HydrophobicContact CD1-CE2 4.11Å; Y376-F380 AromaticContact CE1-CD2 3.92Å; Y376-F380 HydrophobicContact CE1-CD2 3.92Å; Y376-F380 AromaticContact CE1-CE2 3.4Å; Y376-F380 HydrophobicContact CE1-CE2 3.4Å; Y376-F380 VanDerWaalsContact CE1-CE2 3.4Å; Y376-F380 HydrophobicContact CE1-CZ 4.24Å; Y376-F380 HydrophobicContact CE2-CE2 4.06Å; Y376-F380 AromaticContact CZ-CE2 3.38Å; Y376-F380 AromaticContact CZ-CZ 3.96Å; Y376-F380 WeakPolarHBondContact OH-CE2 3.19Å; Y376-F380 WeakPolarHBondContact OH-CZ 3.39Å; N377-F380 CarbonylContact O-C 3.53Å; N377-F380 WeakPolarHBondContact O-CA 3.29Å; N377-F380 PolarHBondContact O-N 2.67Å; E378-F380 PolarHBondContact O-N 2.8Å; F380-W382 PolarHBondContact O-N 2.81Å; F380-H383 HydrophobicContact CB-CB 4.41Å; F380-H383 WeakPolarHBondContact O-CB 3.05Å; F380-H383 PolarHBondContact O-N 2.79Å
381	A	94.8	Very high	94.5	Very high	11 Å²	11	46 Å²	46	9%	0.091	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.3	173.9	0	0	0	0	0	112.2	Y228 P229 N377 E378 H383 H385	Y228-A381 WeakPolarHBondContact CB-O 3.38Å; Y228-A381 WeakPolarHBondContact O-CB 3.28Å; P229-A381 WeakPolarHBondContact O-CB 3.3Å; N377-A381 PolarHBondContact O-N 3.45Å; E378-A381 WeakPolarHBondContact O-CB 3.28Å; E378-A381 PolarHBondContact O-N 2.83Å; A381-H383 PolarHBondContact O-N 3.38Å; A381-H385 PolarHBondContact O-CD2 3.2Å; A381-H385 VanDerWaalsContact O-CD2 3.24Å
382	W	93.1	Very high	93.8	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.038	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.8	173.6	68.5	-92.6	0	0	0	113.6	Y215 Y228 L325 P346 Y379 F380 G384 H385 I388	Y215-W382 HydrophobicContact CE2-CE3 4.02Å; Y228-W382 HydrophobicContact CD2-CB 3.99Å; Y228-W382 HydrophobicContact CE2-CB 4.12Å; L325-W382 HydrophobicContact CB-CH2 4.24Å; L325-W382 HydrophobicContact CB-CZ2 4.21Å; L325-W382 HydrophobicContact CD2-CZ2 3.72Å; L325-W382 HydrophobicContact CG-CZ2 4.48Å; P346-W382 HydrophobicContact CB-CB 3.71Å; P346-W382 HydrophobicContact CB-CD2 3.64Å; P346-W382 HydrophobicContact CB-CE3 3.99Å; P346-W382 HydrophobicContact CB-CG 3.5Å; P346-W382 VanDerWaalsContact CB-CG 3.5Å; P346-W382 HydrophobicContact CG-CD2 3.73Å; P346-W382 HydrophobicContact CG-CE3 3.8Å; P346-W382 HydrophobicContact CG-CG 4.13Å; P346-W382 HydrophobicContact CG-CZ3 4.23Å; Y379-W382 PolarHBondContact O-NE1 3.33Å; F380-W382 PolarHBondContact O-N 2.81Å; W382-G384 PolarHBondContact O-N 2.86Å; W382-H385 WeakPolarHBondContact O-CB 3.49Å; W382-H385 PolarHBondContact O-N 2.89Å; W382-I388 HydrophobicContact CH2-CD1 4.32Å; W382-I388 HydrophobicContact CH2-CG1 3.78Å; W382-I388 HydrophobicContact CZ3-CD1 4.2Å; W382-I388 HydrophobicContact CZ3-CG1 3.75Å
383	H	92.4	Very high	93.2	Very high	69 Å²	69	40.1 Å²	40.1	32%	0.319	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	122	-175.5	-174.9	-79.4	0	0	0	110.6	I235 F380 A381	I235-H383 HydrophobicContact CD1-CB 4.41Å; F380-H383 HydrophobicContact CB-CB 4.41Å; F380-H383 WeakPolarHBondContact O-CB 3.05Å; F380-H383 PolarHBondContact O-N 2.79Å; A381-H383 PolarHBondContact O-N 3.38Å
384	G	89.8	Confident	92.8	Very high	50 Å²	50	42.2 Å²	42.2	52%	0.515	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	-3.6	-174.8	0	0	0	0	0	114.7	W382	W382-G384 PolarHBondContact O-N 2.86Å
385	H	92	Very high	92.6	Very high	64 Å²	64	38.4 Å²	38.4	30%	0.296	20%	0.204	S	C	.	.	S	Bend	trans	-104.1	1.9	174.6	-67.5	-82	0	0	0	113.8	Y215 Y218 Y228 A381 W382	Y215-H385 PolarHBondContact OH-O 3.14Å; Y218-H385 VanDerWaalsContact CD2-C 3.43Å; Y218-H385 PolarHBondContact N-O 3.01Å; Y228-H385 HydrophobicContact CD1-CB 3.69Å; Y228-H385 AromaticContact CD1-CD2 3.75Å; Y228-H385 AromaticContact CD1-CG 3.38Å; Y228-H385 AromaticContact CD1-ND1 3.6Å; Y228-H385 HydrophobicContact CD2-CB 4.49Å; Y228-H385 HydrophobicContact CE1-CB 3.56Å; Y228-H385 AromaticContact CE1-CG 3.74Å; Y228-H385 AromaticContact CE1-ND1 3.98Å; Y228-H385 HydrophobicContact CE2-CB 4.35Å; Y228-H385 HydrophobicContact CG-CB 4.17Å; Y228-H385 AromaticContact CG-CD2 3.85Å; Y228-H385 AromaticContact CG-CG 3.89Å; A381-H385 PolarHBondContact O-CD2 3.2Å; A381-H385 VanDerWaalsContact O-CD2 3.24Å; W382-H385 WeakPolarHBondContact O-CB 3.49Å; W382-H385 PolarHBondContact O-N 2.89Å
386	G	91.7	Very high	92.4	Very high	7 Å²	7	38.4 Å²	38.4	7%	0.072	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-174	173.7	0	0	0	0	0	111.1	E216	E216-G386 CarbonylContact O-C 3.6Å; E216-G386 WeakPolarHBondContact O-CA 3.21Å
387	I	93.9	Very high	92.1	Very high	74 Å²	74	39.4 Å²	39.4	38%	0.379	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.3	-180	-173.3	165.5	0	0	0	110.1	Y215 E216 Y218 H389	Y215-I387 WeakPolarHBondContact CD2-O 3.35Å; E216-I387 HydrophobicContact CB-CG2 3.89Å; E216-I387 PolarHBondContact N-O 2.91Å; E216-I387 PolarHBondContact O-N 3.16Å; Y218-I387 HydrophobicContact CE1-CB 4.34Å; Y218-I387 HydrophobicContact CE1-CG2 4.32Å; I387-H389 WeakPolarHBondContact CG2-NE2 3.06Å
388	I	94.6	Very high	91.9	Very high	11 Å²	11	39 Å²	39	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.6	171.6	-63.1	-69.3	0	0	0	107.9	S214 Y215 Y321 L325 N326 P346 W382	S214-I388 WeakPolarHBondContact O-CA 3.49Å; Y215-I388 HydrophobicContact CD2-CD1 3.83Å; Y215-I388 HydrophobicContact CG-CD1 4.28Å; Y321-I388 HydrophobicContact CD1-CG2 3.96Å; Y321-I388 HydrophobicContact CG-CG2 4.43Å; L325-I388 HydrophobicContact CB-CD1 4.34Å; L325-I388 HydrophobicContact CB-CG1 4.15Å; L325-I388 HydrophobicContact CD1-CD1 3.84Å; N326-I388 WeakPolarHBondContact OD1-CB 3.44Å; N326-I388 WeakPolarHBondContact OD1-CG2 3.47Å; P346-I388 HydrophobicContact CG-CD1 3.6Å; W382-I388 HydrophobicContact CH2-CD1 4.32Å; W382-I388 HydrophobicContact CH2-CG1 3.78Å; W382-I388 HydrophobicContact CZ3-CD1 4.2Å; W382-I388 HydrophobicContact CZ3-CG1 3.75Å
389	H	92	Very high	91.7	Very high	37 Å²	37	34.6 Å²	34.6	17%	0.171	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.7	170	-64.7	-78	0	0	0	109.2	G213 S214 E216 I387 D392	G213-H389 CarbonylContact C-O 3.5Å; G213-H389 WeakPolarHBondContact CA-O 3.22Å; S214-H389 PolarHBondContact N-O 3.32Å; S214-H389 PolarHBondContact O-N 3.32Å; E216-H389 IonicContact OE2-CE1 3.8Å; E216-H389 IonicContact OE2-NE2 2.67Å; E216-H389 PolarHBondContact OE2-NE2 2.94Å; E216-H389 VanDerWaalsContact OE2-NE2 3.13Å; I387-H389 WeakPolarHBondContact CG2-NE2 3.06Å; H389-D392 HydrophobicContact CB-CB 4.09Å; H389-D392 WeakPolarHBondContact CB-OD2 3.03Å; H389-D392 IonicContact CE1-OD2 3.84Å; H389-D392 IonicContact CG-OD2 2.98Å; H389-D392 IonicContact ND1-OD2 2.83Å; H389-D392 PolarHBondContact ND1-OD2 3.03Å
390	D	89.2	Confident	91.6	Very high	54 Å²	54	33.1 Å²	33.1	29%	0.289	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	110.5	172.1	68.3	-51.8	0	0	0	111.1	K322 N326 D392	K322-D390 HydrophobicContact CB-CB 4Å; K322-D390 WeakPolarHBondContact CD-OD2 3.42Å; K322-D390 WeakPolarHBondContact CG-OD2 3.38Å; N326-D390 PolarHBondContact ND2-OD1 3.48Å; D390-D392 VanDerWaalsContact C-N 3.27Å; D390-D392 PolarHBondContact O-N 2.91Å
391	Y	83.8	Confident	91.4	Very high	66 Å²	66	33.1 Å²	33.1	26%	0.259	18%	0.182	S	C	.	.	S	Bend	trans	62.6	26.9	179.4	-141.8	-98.4	0	0	0	115	F129 Y212 A393	F129-Y391 HydrophobicContact CB-CE1 3.63Å; Y212-Y391 HydrophobicContact CD1-CD2 4.12Å; Y212-Y391 HydrophobicContact CD1-CE2 4.04Å; Y212-Y391 HydrophobicContact CE1-CE2 4.24Å; Y212-Y391 PolarHBondContact O-N 3.15Å; Y391-A393 VanDerWaalsContact C-N 3.32Å; Y391-A393 PolarHBondContact O-N 3.15Å
392	D	83.8	Confident	91.3	Very high	83 Å²	83	32.6 Å²	32.6	44%	0.444	18%	0.178	S	C	.	.			trans	-81.5	-7.5	-179.6	-71.5	-20.9	0	0	0	114.2	H389 D390 Q394	H389-D392 HydrophobicContact CB-CB 4.09Å; H389-D392 WeakPolarHBondContact CB-OD2 3.03Å; H389-D392 IonicContact CE1-OD2 3.84Å; H389-D392 IonicContact CG-OD2 2.98Å; H389-D392 IonicContact ND1-OD2 2.83Å; H389-D392 PolarHBondContact ND1-OD2 3.03Å; D390-D392 VanDerWaalsContact C-N 3.27Å; D390-D392 PolarHBondContact O-N 2.91Å; D392-Q394 WeakPolarHBondContact O-CG 2.99Å; D392-Q394 PolarHBondContact O-N 3.47Å; D392-Q394 PolarHBondContact O-NE2 3.12Å
393	A	86.4	Confident	91.4	Very high	26 Å²	26	32.3 Å²	32.3	22%	0.215	18%	0.177	C	C	.	.			trans	-56.7	131.1	179.7	0	0	0	0	0	110.9	Y391 P395	Y391-A393 VanDerWaalsContact C-N 3.32Å; Y391-A393 PolarHBondContact O-N 3.15Å; A393-P395 WeakPolarHBondContact O-CD 3.45Å
394	Q	89.5	Confident	91.4	Very high	101 Å²	101	30.1 Å²	30.1	47%	0.472	17%	0.167	S	C	.	.			trans	-111.9	63.7	-178.7	-55.2	-60.8	-30.3	0	0	111.1	D392 Q396 C397	D392-Q394 WeakPolarHBondContact O-CG 2.99Å; D392-Q394 PolarHBondContact O-N 3.47Å; D392-Q394 PolarHBondContact O-NE2 3.12Å; Q394-Q396 PolarHBondContact O-N 2.99Å; Q394-C397 PolarHBondContact O-N 3.15Å; Q394-C397 VanDerWaalsContact O-N 3.15Å
395	P	91.9	Very high	91.5	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-57.9	-24.6	-177.9	26.4	-36.8	0	0	0	112.9	T130 I200 I208 A393 C397 A398 M399	T130-P395 HydrophobicContact CG2-CG 4.39Å; I200-P395 HydrophobicContact CG2-CB 3.63Å; I200-P395 HydrophobicContact CG2-CG 4.34Å; I208-P395 HydrophobicContact CG2-CB 3.85Å; A393-P395 WeakPolarHBondContact O-CD 3.45Å; P395-C397 VanDerWaalsContact C-N 3.28Å; P395-C397 PolarHBondContact O-N 3Å; P395-A398 WeakPolarHBondContact O-CB 3.31Å; P395-A398 PolarHBondContact O-N 3.5Å; P395-M399 HydrophobicContact CB-SD 4.48Å; P395-M399 WeakPolarHBondContact O-CG 3.21Å; P395-M399 PolarHBondContact O-N 2.72Å
396	Q	94	Very high	91.4	Very high	5 Å²	5	25 Å²	25	2%	0.023	13%	0.131	C	C	.	.	H	α-helix	trans	-64.1	-30	-179.7	79.8	-75.6	1.9	0	0	113.2	M132 D133 F134 Q394 M399 C400	M132-Q396 HydrophobicContact SD-CB 3.86Å; D133-Q396 WeakPolarHBondContact O-CG 3.33Å; D133-Q396 PolarHBondContact O-NE2 3.24Å; F134-Q396 HydrophobicContact CD1-CB 3.98Å; F134-Q396 HydrophobicContact CD1-CG 4Å; F134-Q396 WeakPolarHBondContact CD1-O 3.44Å; F134-Q396 HydrophobicContact CE1-CB 3.59Å; F134-Q396 HydrophobicContact CE1-CG 4.13Å; F134-Q396 WeakPolarHBondContact CE1-O 3.47Å; F134-Q396 HydrophobicContact CZ-CB 4.26Å; Q394-Q396 PolarHBondContact O-N 2.99Å; Q396-M399 HydrophobicContact CB-SD 4.42Å; Q396-M399 PolarHBondContact O-N 2.8Å; Q396-C400 PolarHBondContact O-N 3.27Å
397	C	93.3	Very high	91.2	Very high	21 Å²	21	29.1 Å²	29.1	14%	0.142	15%	0.149	C	C	.	.	H	α-helix	trans	-67.1	-45.6	175.5	-63.6	0	0	0	0	111.3	C137 Q394 P395 M399 C400 L401	C137-C397 VanDerWaalsContact CA-SG 3.55Å; C137-C397 HydrophobicContact CB-CB 3.6Å; C137-C397 WeakPolarHBondContact CB-SG 3.4Å; C137-C397 WeakPolarHBondContact SG-CA 3.47Å; C137-C397 WeakPolarHBondContact SG-CB 3.34Å; C137-C397 CovalentContact SG-SG 2.04Å; C137-C397 PolarHBondContact SG-SG 3.45Å; Q394-C397 PolarHBondContact O-N 3.15Å; Q394-C397 VanDerWaalsContact O-N 3.15Å; P395-C397 VanDerWaalsContact C-N 3.28Å; P395-C397 PolarHBondContact O-N 3Å; C397-M399 PolarHBondContact O-N 2.83Å; C397-C400 PolarHBondContact O-N 2.9Å; C397-L401 PolarHBondContact O-N 2.82Å
398	A	92.2	Very high	90.9	Very high	2 Å²	2	27.5 Å²	27.5	2%	0.017	15%	0.146	C	C	.	.	H	α-helix	trans	-60.2	-43.8	172.9	0	0	0	0	0	112.4	F97 I208 P395 C400 L401 L402	F97-A398 HydrophobicContact CD1-CB 4.48Å; F97-A398 HydrophobicContact CE1-CB 3.5Å; F97-A398 VanDerWaalsContact CE1-CB 3.5Å; F97-A398 HydrophobicContact CE2-CB 3.66Å; F97-A398 HydrophobicContact CZ-CB 3.04Å; I208-A398 HydrophobicContact CB-CB 4.5Å; I208-A398 HydrophobicContact CD1-CB 3.57Å; I208-A398 HydrophobicContact CG1-CB 3.79Å; I208-A398 HydrophobicContact CG2-CB 3.88Å; P395-A398 WeakPolarHBondContact O-CB 3.31Å; P395-A398 PolarHBondContact O-N 3.5Å; A398-C400 VanDerWaalsContact C-N 3.35Å; A398-C400 PolarHBondContact O-N 2.65Å; A398-L401 PolarHBondContact O-N 3.13Å; A398-L402 WeakPolarHBondContact O-CB 3.27Å; A398-L402 WeakPolarHBondContact O-CG 3.32Å; A398-L402 PolarHBondContact O-N 3.13Å
399	M	94	Very high	90.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.7	-48.1	176.3	-70.1	162.2	59.2	0	0	111.1	F120 M132 I158 F176 I200 I208 P395 Q396 C397 L402 A403	F120-M399 HydrophobicContact CD1-CE 3.74Å; F120-M399 HydrophobicContact CE1-CB 3.93Å; F120-M399 HydrophobicContact CE1-CE 3.73Å; F120-M399 HydrophobicContact CG-CE 4.5Å; F120-M399 HydrophobicContact CZ-CB 3.84Å; F120-M399 HydrophobicContact CZ-CE 4.48Å; F120-M399 WeakPolarHBondContact CZ-O 3.42Å; M132-M399 HydrophobicContact CE-CE 4.2Å; M132-M399 HydrophobicContact CE-SD 4.34Å; M132-M399 HydrophobicContact SD-CE 4.1Å; M132-M399 HydrophobicContact SD-SD 4.41Å; I158-M399 HydrophobicContact CD1-CE 3.55Å; I158-M399 HydrophobicContact CG1-CE 3.66Å; F176-M399 HydrophobicContact CD1-CG 3.98Å; F176-M399 HydrophobicContact CE1-CB 4.22Å; F176-M399 HydrophobicContact CE1-CG 4.01Å; I200-M399 HydrophobicContact CD1-CE 4.47Å; I200-M399 HydrophobicContact CD1-CG 3.5Å; I200-M399 HydrophobicContact CD1-SD 3.44Å; I200-M399 WeakPolarHBondContact CD1-SD 3.34Å; I208-M399 HydrophobicContact CD1-CG 3.82Å; P395-M399 HydrophobicContact CB-SD 4.48Å; P395-M399 WeakPolarHBondContact O-CG 3.21Å; P395-M399 PolarHBondContact O-N 2.72Å; Q396-M399 HydrophobicContact CB-SD 4.42Å; Q396-M399 PolarHBondContact O-N 2.8Å; C397-M399 PolarHBondContact O-N 2.83Å; M399-L402 PolarHBondContact O-N 3.33Å; M399-A403 WeakPolarHBondContact O-CB 3.49Å; M399-A403 PolarHBondContact O-N 2.89Å
400	C	95	Very high	89.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-43.3	-178.9	-168.2	0	0	0	0	111.6	F134 A139 C142 Q396 C397 A398 L402 A403 H404	F134-C400 HydrophobicContact CD1-CB 3.72Å; F134-C400 HydrophobicContact CE1-CB 4Å; A139-C400 HydrophobicContact CB-CB 4.25Å; A139-C400 WeakPolarHBondContact O-CB 3.37Å; A139-C400 PolarHBondContact O-SG 2.97Å; C142-C400 HydrophobicContact CB-CB 3.86Å; C142-C400 WeakPolarHBondContact CB-SG 3.25Å; C142-C400 WeakPolarHBondContact SG-CA 3.39Å; C142-C400 WeakPolarHBondContact SG-CB 3.32Å; C142-C400 CovalentContact SG-SG 2.03Å; C142-C400 PolarHBondContact SG-SG 2.73Å; Q396-C400 PolarHBondContact O-N 3.27Å; C397-C400 PolarHBondContact O-N 2.9Å; A398-C400 VanDerWaalsContact C-N 3.35Å; A398-C400 PolarHBondContact O-N 2.65Å; C400-L402 VanDerWaalsContact C-N 3.34Å; C400-L402 PolarHBondContact O-N 2.75Å; C400-A403 PolarHBondContact O-N 2.59Å; C400-H404 PolarHBondContact O-CD2 3.35Å; C400-H404 VanDerWaalsContact O-CD2 3.25Å; C400-H404 PolarHBondContact O-N 2.7Å; C400-H404 VanDerWaalsContact O-N 3.14Å
401	L	92.4	Very high	88.7	Confident	1 Å²	1	29 Å²	29	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-55.3	-49	172.9	-79.8	167.6	0	0	0	111.5	E101 L104 E105 Y108 A139 C397 A398 A403 H404 T405	E101-L401 HydrophobicContact CG-CD1 4.27Å; L104-L401 HydrophobicContact CB-CB 4.47Å; E105-L401 HydrophobicContact CG-CD1 3.9Å; E105-L401 HydrophobicContact CG-CD2 4.14Å; Y108-L401 HydrophobicContact CD1-CD2 4.29Å; Y108-L401 HydrophobicContact CG-CD2 3.99Å; A139-L401 HydrophobicContact CB-CD2 3.73Å; A139-L401 HydrophobicContact CB-CG 3.9Å; C397-L401 PolarHBondContact O-N 2.82Å; A398-L401 PolarHBondContact O-N 3.13Å; L401-A403 PolarHBondContact O-N 3.12Å; L401-H404 PolarHBondContact O-N 3.04Å; L401-T405 WeakPolarHBondContact O-CB 2.89Å; L401-T405 WeakPolarHBondContact O-CG2 2.82Å; L401-T405 PolarHBondContact O-N 3.17Å; L401-T405 PolarHBondContact O-OG1 3.08Å
402	L	92.5	Very high	88.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-41	179.2	-73.1	171	0	0	0	112.5	L104 F176 F198 T207 I208 A398 M399 C400 H404 T405 S406 F409	L104-L402 HydrophobicContact CD1-CD2 3.81Å; L104-L402 HydrophobicContact CD1-CG 4.25Å; L104-L402 HydrophobicContact CD2-CD2 4Å; F176-L402 HydrophobicContact CE1-CB 4.25Å; F176-L402 HydrophobicContact CE1-CD1 4.02Å; F176-L402 HydrophobicContact CZ-CB 4.03Å; F198-L402 HydrophobicContact CB-CD1 4.49Å; F198-L402 HydrophobicContact CD1-CD1 3.89Å; F198-L402 HydrophobicContact CD1-CD2 4.44Å; F198-L402 HydrophobicContact CD2-CB 4.47Å; F198-L402 HydrophobicContact CD2-CD1 4.24Å; F198-L402 HydrophobicContact CE1-CD1 4.06Å; F198-L402 HydrophobicContact CE1-CD2 3.79Å; F198-L402 HydrophobicContact CE1-CG 4.42Å; F198-L402 HydrophobicContact CE2-CB 4.09Å; F198-L402 HydrophobicContact CE2-CD1 4.43Å; F198-L402 HydrophobicContact CG-CD1 3.95Å; F198-L402 HydrophobicContact CZ-CB 4.21Å; F198-L402 HydrophobicContact CZ-CD1 4.34Å; F198-L402 HydrophobicContact CZ-CD2 3.87Å; F198-L402 HydrophobicContact CZ-CG 4.37Å; T207-L402 HydrophobicContact CG2-CD1 4.22Å; I208-L402 HydrophobicContact CD1-CD1 3.9Å; I208-L402 HydrophobicContact CG1-CD1 4.18Å; A398-L402 WeakPolarHBondContact O-CB 3.27Å; A398-L402 WeakPolarHBondContact O-CG 3.32Å; A398-L402 PolarHBondContact O-N 3.13Å; M399-L402 PolarHBondContact O-N 3.33Å; C400-L402 VanDerWaalsContact C-N 3.34Å; C400-L402 PolarHBondContact O-N 2.75Å; L402-H404 PolarHBondContact O-N 3.4Å; L402-T405 PolarHBondContact O-N 3.01Å; L402-S406 VanDerWaalsContact O-CB 3.22Å; L402-S406 WeakPolarHBondContact O-CB 2.85Å; L402-S406 PolarHBondContact O-N 2.9Å; L402-S406 PolarHBondContact O-OG 2.76Å; L402-F409 HydrophobicContact CD2-CZ 4.05Å
403	A	94.1	Very high	88.4	Confident	3 Å²	3	26.5 Å²	26.5	3%	0.025	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-26.8	178	0	0	0	0	0	113.7	K118 F120 L174 M399 C400 L401	K118-A403 HydrophobicContact CB-CB 4.24Å; K118-A403 WeakPolarHBondContact CE-O 3.3Å; K118-A403 HydrophobicContact CG-CB 4.27Å; F120-A403 HydrophobicContact CE1-CB 4.49Å; F120-A403 HydrophobicContact CE2-CB 3.94Å; F120-A403 HydrophobicContact CZ-CB 3.55Å; L174-A403 HydrophobicContact CD1-CB 4.32Å; M399-A403 WeakPolarHBondContact O-CB 3.49Å; M399-A403 PolarHBondContact O-N 2.89Å; C400-A403 PolarHBondContact O-N 2.59Å; L401-A403 PolarHBondContact O-N 3.12Å
404	H	93.5	Very high	88.4	Confident	23 Å²	23	25.6 Å²	25.6	11%	0.106	14%	0.141	C	C	.	.	H	α-helix	trans	-87.2	-25	175.1	-81.9	-82.6	0	0	0	113.7	Y108 L111 T116 K141 C400 L401 L402	Y108-H404 HydrophobicContact CD2-CB 3.62Å; Y108-H404 HydrophobicContact CE2-CB 3.64Å; Y108-H404 AromaticContact CE2-CG 3.6Å; Y108-H404 AromaticContact CE2-ND1 3.95Å; L111-H404 WeakPolarHBondContact CD1-O 2.69Å; T116-H404 PolarHBondContact O-CE1 2.85Å; K141-H404 PolarHBondContact O-NE2 2.93Å; C400-H404 PolarHBondContact O-CD2 3.35Å; C400-H404 VanDerWaalsContact O-CD2 3.25Å; C400-H404 PolarHBondContact O-N 2.7Å; C400-H404 VanDerWaalsContact O-N 3.14Å; L401-H404 PolarHBondContact O-N 3.04Å; L402-H404 PolarHBondContact O-N 3.4Å
405	T	91.2	Very high	88.1	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-110.5	-21.6	-169.5	55.5	0	0	0	0	114.5	L107 L111 L401 L402 Q407 A408 F409	L107-T405 HydrophobicContact CB-CG2 4.41Å; L107-T405 HydrophobicContact CD2-CG2 4.18Å; L107-T405 HydrophobicContact CG-CG2 4.1Å; L111-T405 HydrophobicContact CD1-CG2 4.05Å; L401-T405 WeakPolarHBondContact O-CB 2.89Å; L401-T405 WeakPolarHBondContact O-CG2 2.82Å; L401-T405 PolarHBondContact O-N 3.17Å; L401-T405 PolarHBondContact O-OG1 3.08Å; L402-T405 PolarHBondContact O-N 3.01Å; T405-Q407 PolarHBondContact O-N 3.46Å; T405-Q407 VanDerWaalsContact O-N 3.12Å; T405-A408 WeakPolarHBondContact O-CB 3.29Å; T405-A408 PolarHBondContact O-N 3.47Å; T405-F409 VanDerWaalsContact O-CD1 3.31Å; T405-F409 WeakPolarHBondContact O-CD1 3.31Å
406	S	90.1	Very high	87.9	Confident	8 Å²	8	26.6 Å²	26.6	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-31.8	-172.4	67.3	0	0	0	0	114.1	L174 L402 A408 F409 G410	L174-S406 WeakPolarHBondContact CD1-OG 3.31Å; L402-S406 VanDerWaalsContact O-CB 3.22Å; L402-S406 WeakPolarHBondContact O-CB 2.85Å; L402-S406 PolarHBondContact O-N 2.9Å; L402-S406 PolarHBondContact O-OG 2.76Å; S406-A408 PolarHBondContact O-N 3.43Å; S406-F409 VanDerWaalsContact CA-CE1 3.46Å; S406-F409 PolarHBondContact O-N 2.89Å; S406-G410 PolarHBondContact O-N 3.12Å
407	Q	88.1	Confident	87.8	Confident	93 Å²	93	26.3 Å²	26.3	44%	0.435	15%	0.146	S	C	.	.	H	α-helix	trans	-64.2	-31.1	177.4	-64.9	-174.8	-12	0	0	112.2	E172 T405	E172-Q407 PolarHBondContact OE2-NE2 3Å; T405-Q407 PolarHBondContact O-N 3.46Å; T405-Q407 VanDerWaalsContact O-N 3.12Å
408	A	88	Confident	87.7	Confident	39 Å²	39	25.7 Å²	25.7	32%	0.322	14%	0.142	S	C	.	.	H	α-helix	trans	-74.8	-28.8	-178.2	0	0	0	0	0	113	L107 L111 T405 S406	L107-A408 HydrophobicContact CD1-CB 4.36Å; L107-A408 HydrophobicContact CD2-CB 4.26Å; L111-A408 HydrophobicContact CD2-CB 4Å; T405-A408 WeakPolarHBondContact O-CB 3.29Å; T405-A408 PolarHBondContact O-N 3.47Å; S406-A408 PolarHBondContact O-N 3.43Å
409	F	83.1	Confident	87.8	Confident	7 Å²	7	33.2 Å²	33.2	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-107.9	7.2	178	63.8	-102.9	0	0	0	114.1	A75 L78 H79 Y82 L104 L107 F198 L402 T405 S406	A75-F409 WeakPolarHBondContact O-CB 3.48Å; L78-F409 HydrophobicContact CB-CB 4.07Å; L78-F409 HydrophobicContact CB-CD1 4.12Å; L78-F409 HydrophobicContact CB-CG 4.08Å; L78-F409 HydrophobicContact CD1-CD1 4.38Å; H79-F409 HydrophobicContact CB-CB 4.3Å; H79-F409 PolarHBondContact ND1-O 2.78Å; Y82-F409 HydrophobicContact CD2-CD2 4.23Å; Y82-F409 AromaticContact CD2-CE2 3.71Å; Y82-F409 HydrophobicContact CD2-CE2 3.71Å; Y82-F409 AromaticContact CD2-CZ 3.92Å; Y82-F409 HydrophobicContact CD2-CZ 3.92Å; Y82-F409 HydrophobicContact CE2-CE2 4.45Å; Y82-F409 HydrophobicContact CE2-CZ 4.2Å; Y82-F409 HydrophobicContact CG-CE2 4.02Å; Y82-F409 HydrophobicContact CG-CZ 4.5Å; L104-F409 HydrophobicContact CD2-CE1 3.94Å; L107-F409 HydrophobicContact CD2-CD1 4Å; F198-F409 HydrophobicContact CZ-CZ 4.27Å; L402-F409 HydrophobicContact CD2-CZ 4.05Å; T405-F409 VanDerWaalsContact O-CD1 3.31Å; T405-F409 WeakPolarHBondContact O-CD1 3.31Å; S406-F409 VanDerWaalsContact CA-CE1 3.46Å; S406-F409 PolarHBondContact O-N 2.89Å
410	G	75.1	Confident	87.6	Confident	19 Å²	19	34 Å²	34	20%	0.196	17%	0.173	C	C	.	.			trans	89.4	168.5	171.2	0	0	0	0	0	115.1	S406 Y412	S406-G410 PolarHBondContact O-N 3.12Å; G410-Y412 PolarHBondContact O-N 2.93Å
411	P	70.3	Confident	87.6	Confident	108 Å²	108	34 Å²	34	70%	0.701	17%	0.174	S	C	*	.			trans	-66.9	123	-178	28.2	-34	0	0	0	110.6	W413	P411-W413 HydrophobicContact CB-CZ2 4.39Å
412	Y	76.7	Confident	87.7	Confident	9 Å²	9	36.7 Å²	36.7	4%	0.035	19%	0.188	C	C	.	.			trans	-110	140.5	176.1	169.7	-121.5	0	0	0	110.5	Y82 N197 F198 G410 V414	Y82-Y412 VanDerWaalsContact C-CD2 3.47Å; Y82-Y412 HydrophobicContact CD1-CD1 4.14Å; Y82-Y412 HydrophobicContact CD1-CE1 4.01Å; Y82-Y412 WeakPolarHBondContact O-CD2 3.47Å; Y82-Y412 WeakPolarHBondContact O-CE2 3.43Å; N197-Y412 VanDerWaalsContact CA-O 3.27Å; N197-Y412 WeakPolarHBondContact CA-O 3.49Å; N197-Y412 VanDerWaalsContact CB-O 3.32Å; N197-Y412 WeakPolarHBondContact CB-O 3.47Å; N197-Y412 PolarHBondContact ND2-O 2.96Å; N197-Y412 WeakPolarHBondContact O-CD1 3.35Å; N197-Y412 WeakPolarHBondContact O-CE1 3.35Å; F198-Y412 AromaticContact CD1-CD1 3.6Å; F198-Y412 HydrophobicContact CD1-CD1 3.6Å; F198-Y412 AromaticContact CD1-CE1 3.88Å; F198-Y412 HydrophobicContact CD1-CE1 3.88Å; F198-Y412 AromaticContact CE1-CD1 3.46Å; F198-Y412 HydrophobicContact CE1-CD1 3.46Å; F198-Y412 VanDerWaalsContact CE1-CD1 3.46Å; F198-Y412 HydrophobicContact CE1-CE1 4.13Å; F198-Y412 HydrophobicContact CE1-CG 4.42Å; F198-Y412 HydrophobicContact CZ-CD1 4.34Å; G410-Y412 PolarHBondContact O-N 2.93Å; Y412-V414 HydrophobicContact CE1-CG2 4.03Å
413	W	84.4	Confident	87.8	Confident	87 Å²	87	40 Å²	40	33%	0.33	21%	0.206	S	C	.	.			trans	-136	135.9	176.8	-47.3	96.8	0	0	0	109	R169 E195 I196 N197 P411 P415	R169-W413 VanDerWaalsContact NH1-CZ3 3.3Å; E195-W413 WeakPolarHBondContact O-CZ3 3.48Å; I196-W413 CarbonylContact O-C 3.53Å; I196-W413 VanDerWaalsContact O-CA 3.32Å; I196-W413 WeakPolarHBondContact O-CA 3.29Å; N197-W413 VanDerWaalsContact ND2-CE3 3.32Å; N197-W413 WeakPolarHBondContact ND2-CZ3 3.44Å; P411-W413 HydrophobicContact CB-CZ2 4.39Å; W413-P415 VanDerWaalsContact O-CD 3.24Å; W413-P415 WeakPolarHBondContact O-CD 3.31Å
414	V	86.3	Confident	87.8	Confident	8 Å²	8	40.3 Å²	40.3	5%	0.048	21%	0.209	C	C	.	.			trans	-76.4	112.5	174.5	-176.6	0	0	0	0	108.7	I196 N197 T199 Y412 V417	I196-V414 HydrophobicContact CG2-CG2 4.47Å; I196-V414 PolarHBondContact O-N 3.4Å; N197-V414 WeakPolarHBondContact O-CG2 3.38Å; T199-V414 HydrophobicContact CG2-CG1 4.4Å; T199-V414 HydrophobicContact CG2-CG2 4.03Å; Y412-V414 HydrophobicContact CE1-CG2 4.03Å; V414-V417 HydrophobicContact CB-CB 4.07Å; V414-V417 HydrophobicContact CB-CG2 4.11Å; V414-V417 HydrophobicContact CG1-CB 3.86Å; V414-V417 HydrophobicContact CG1-CG2 3.87Å
415	P	84.1	Confident	87.9	Confident	39 Å²	39	40.3 Å²	40.3	25%	0.253	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	147.9	177	32.6	-34.9	0	0	0	109.8	P84 W413 V417	P84-P415 HydrophobicContact CB-CG 4.4Å; W413-P415 VanDerWaalsContact O-CD 3.24Å; W413-P415 WeakPolarHBondContact O-CD 3.31Å; P415-V417 PolarHBondContact O-N 3.07Å; P415-V417 VanDerWaalsContact O-N 3.13Å
416	K	88.1	Confident	88.1	Confident	86 Å²	86	45.4 Å²	45.4	37%	0.374	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	28.1	175.7	-65.2	172.7	-177.1	166.1	0	112.6	K87 E193 A418 R419 W420	K87-K416 PolarHBondContact O-NZ 3.42Å; E193-K416 VanDerWaalsContact CD-N 3.3Å; E193-K416 WeakPolarHBondContact OE1-CA 3.3Å; E193-K416 PolarHBondContact OE1-N 2.89Å; E193-K416 WeakPolarHBondContact OE2-CA 3.48Å; E193-K416 PolarHBondContact OE2-N 3.36Å; K416-A418 VanDerWaalsContact C-N 3.28Å; K416-A418 PolarHBondContact O-N 2.95Å; K416-R419 HydrophobicContact CB-CB 4.36Å; K416-R419 WeakPolarHBondContact O-CB 3.49Å; K416-R419 PolarHBondContact O-N 2.91Å; K416-W420 WeakPolarHBondContact O-CB 2.77Å; K416-W420 PolarHBondContact O-N 2.78Å
417	V	90.5	Very high	88.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-40.7	-169.9	70.2	0	0	0	0	112	M188 L192 E193 I196 T199 V414 P415 R419 W420 W421	M188-V417 HydrophobicContact CE-CG1 4.39Å; M188-V417 HydrophobicContact CE-CG2 3.85Å; M188-V417 HydrophobicContact SD-CG2 3.87Å; L192-V417 HydrophobicContact CB-CG1 4.43Å; L192-V417 WeakPolarHBondContact O-CG1 3.38Å; E193-V417 PolarHBondContact OE2-N 3.25Å; E193-V417 VanDerWaalsContact OE2-N 3.15Å; I196-V417 HydrophobicContact CB-CG1 4.32Å; I196-V417 HydrophobicContact CB-CG2 4.3Å; I196-V417 HydrophobicContact CG1-CG1 3.96Å; I196-V417 HydrophobicContact CG1-CG2 4.31Å; I196-V417 HydrophobicContact CG2-CG2 4.47Å; T199-V417 HydrophobicContact CG2-CG2 3.74Å; V414-V417 HydrophobicContact CB-CB 4.07Å; V414-V417 HydrophobicContact CB-CG2 4.11Å; V414-V417 HydrophobicContact CG1-CB 3.86Å; V414-V417 HydrophobicContact CG1-CG2 3.87Å; P415-V417 PolarHBondContact O-N 3.07Å; P415-V417 VanDerWaalsContact O-N 3.13Å; V417-R419 PolarHBondContact O-N 3.13Å; V417-W420 HydrophobicContact CG2-CE3 4.09Å; V417-W420 HydrophobicContact CG2-CZ3 4.43Å; V417-W421 WeakPolarHBondContact O-CB 3.28Å; V417-W421 PolarHBondContact O-N 3.31Å
418	A	93.1	Very high	88.5	Confident	7 Å²	7	46.2 Å²	46.2	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-41.8	177.8	0	0	0	0	0	111.7	M188 K416 N422	M188-A418 HydrophobicContact CB-CB 4.17Å; K416-A418 VanDerWaalsContact C-N 3.28Å; K416-A418 PolarHBondContact O-N 2.95Å; A418-N422 WeakPolarHBondContact O-CB 3.49Å; A418-N422 PolarHBondContact O-N 3.2Å; A418-N422 PolarHBondContact O-ND2 3.25Å; A418-N422 VanDerWaalsContact O-ND2 3.12Å
419	R	92.6	Very high	88.7	Confident	160 Å²	160	52.6 Å²	52.6	60%	0.604	28%	0.279	S	S	*	.	H	α-helix	trans	-68	-48.7	177.5	-177.7	-179.9	-117.1	155.8	2	111.5	K416 V417 W421 N422 D423	K416-R419 HydrophobicContact CB-CB 4.36Å; K416-R419 WeakPolarHBondContact O-CB 3.49Å; K416-R419 PolarHBondContact O-N 2.91Å; V417-R419 PolarHBondContact O-N 3.13Å; R419-W421 PolarHBondContact O-N 2.9Å; R419-N422 PolarHBondContact O-N 3Å; R419-D423 WeakPolarHBondContact CG-OD2 3.24Å; R419-D423 IonicContact NE-OD2 3.74Å; R419-D423 WeakPolarHBondContact O-CB 3.12Å; R419-D423 PolarHBondContact O-N 3.37Å
420	W	90.6	Very high	89.3	Confident	16 Å²	16	53.4 Å²	53.4	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-49.3	-48.9	176.2	164.3	67	0	0	0	111.5	V90 T199 R203 D205 K416 V417	V90-W420 HydrophobicContact CG1-CB 3.98Å; V90-W420 HydrophobicContact CG1-CG 3.6Å; V90-W420 HydrophobicContact CG2-CB 3.93Å; V90-W420 HydrophobicContact CG2-CG 4.45Å; T199-W420 HydrophobicContact CG2-CE3 4.35Å; T199-W420 HydrophobicContact CG2-CH2 4.05Å; T199-W420 HydrophobicContact CG2-CZ3 3.61Å; R203-W420 HydrophobicContact CB-CZ2 4.02Å; R203-W420 HydrophobicContact CG-CZ2 4.37Å; R203-W420 VanDerWaalsContact NE-CE2 3.31Å; R203-W420 VanDerWaalsContact NE-NE1 3.15Å; D205-W420 VanDerWaalsContact OD1-CZ2 3.32Å; D205-W420 WeakPolarHBondContact OD1-CZ2 3.48Å; D205-W420 PolarHBondContact OD1-NE1 3.35Å; D205-W420 PolarHBondContact OD2-NE1 2.86Å; K416-W420 WeakPolarHBondContact O-CB 2.77Å; K416-W420 PolarHBondContact O-N 2.78Å; V417-W420 HydrophobicContact CG2-CE3 4.09Å; V417-W420 HydrophobicContact CG2-CZ3 4.43Å
421	W	94.5	Very high	90.4	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-71.8	-56.4	-179.5	-178.8	-105.9	0	0	0	112.2	I179 E181 P183 I186 M188 F202 R203 V417 R419 D423 G424	I179-W421 HydrophobicContact CB-CH2 4.17Å; I179-W421 HydrophobicContact CB-CZ2 3.96Å; I179-W421 HydrophobicContact CG2-CH2 3.86Å; I179-W421 HydrophobicContact CG2-CZ2 3.31Å; E181-W421 VanDerWaalsContact O-CH2 3.27Å; E181-W421 WeakPolarHBondContact O-CH2 3.49Å; E181-W421 WeakPolarHBondContact O-CZ2 3.38Å; P183-W421 VanDerWaalsContact CB-O 3.26Å; P183-W421 WeakPolarHBondContact CB-O 3.35Å; P183-W421 HydrophobicContact CG-CD2 4.09Å; P183-W421 HydrophobicContact CG-CG 4.49Å; P183-W421 HydrophobicContact CG-CH2 4.48Å; P183-W421 HydrophobicContact CG-CZ2 4.02Å; P183-W421 WeakPolarHBondContact CG-O 3.47Å; I186-W421 PolarHBondContact O-NE1 3.25Å; M188-W421 HydrophobicContact CB-CB 4.44Å; M188-W421 HydrophobicContact CB-CG 4.47Å; M188-W421 HydrophobicContact CG-CB 4.16Å; M188-W421 HydrophobicContact CG-CG 3.9Å; M188-W421 HydrophobicContact SD-CB 3.74Å; M188-W421 HydrophobicContact SD-CG 3.86Å; F202-W421 AromaticContact CE1-CH2 3.62Å; F202-W421 HydrophobicContact CE1-CH2 3.62Å; F202-W421 HydrophobicContact CE1-CZ3 4.2Å; F202-W421 AromaticContact CZ-CH2 3.86Å; F202-W421 HydrophobicContact CZ-CH2 3.86Å; F202-W421 HydrophobicContact CZ-CZ3 4.15Å; R203-W421 HydrophobicContact CG-CZ3 4.3Å; V417-W421 WeakPolarHBondContact O-CB 3.28Å; V417-W421 PolarHBondContact O-N 3.31Å; R419-W421 PolarHBondContact O-N 2.9Å; W421-D423 VanDerWaalsContact C-N 3.29Å; W421-D423 PolarHBondContact O-N 3.4Å; W421-G424 PolarHBondContact O-N 2.9Å
422	N	95.3	Very high	91.6	Very high	56 Å²	56	55.2 Å²	55.2	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-64.9	-31.5	-172.9	-64.6	-18.9	0	0	0	113.1	A187 M188 A418 R419 G424	A187-N422 WeakPolarHBondContact CA-OD1 3.3Å; A187-N422 WeakPolarHBondContact CB-OD1 3.47Å; M188-N422 PolarHBondContact N-OD1 3.38Å; M188-N422 PolarHBondContact O-ND2 3.24Å; A418-N422 WeakPolarHBondContact O-CB 3.49Å; A418-N422 PolarHBondContact O-N 3.2Å; A418-N422 PolarHBondContact O-ND2 3.25Å; A418-N422 VanDerWaalsContact O-ND2 3.12Å; R419-N422 PolarHBondContact O-N 3Å; N422-G424 PolarHBondContact O-N 3.31Å
423	D	95.2	Very high	92	Very high	71 Å²	71	61.7 Å²	61.7	38%	0.38	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-79.5	-2.9	177.4	-68	-14	0	0	0	112.7	R419 W421 C425 N426	R419-D423 WeakPolarHBondContact CG-OD2 3.24Å; R419-D423 IonicContact NE-OD2 3.74Å; R419-D423 WeakPolarHBondContact O-CB 3.12Å; R419-D423 PolarHBondContact O-N 3.37Å; W421-D423 VanDerWaalsContact C-N 3.29Å; W421-D423 PolarHBondContact O-N 3.4Å; D423-C425 PolarHBondContact O-N 2.62Å; D423-N426 WeakPolarHBondContact CA-ND2 3.18Å; D423-N426 WeakPolarHBondContact CB-ND2 3.37Å; D423-N426 VanDerWaalsContact CG-ND2 3.26Å; D423-N426 VanDerWaalsContact O-CB 3.29Å; D423-N426 WeakPolarHBondContact O-CB 3.4Å; D423-N426 PolarHBondContact O-N 2.97Å; D423-N426 PolarHBondContact OD1-ND2 3.41Å
424	G	93.9	Very high	91.5	Very high	8 Å²	8	63.4 Å²	63.4	8%	0.082	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-61.6	-13.5	-175.6	0	0	0	0	0	115.5	S313 W421 N422	S313-G424 WeakPolarHBondContact CB-O 2.99Å; S313-G424 PolarHBondContact N-O 3.29Å; W421-G424 PolarHBondContact O-N 2.9Å; N422-G424 PolarHBondContact O-N 3.31Å
425	C	95.8	Very high	91.8	Very high	23 Å²	23	66.2 Å²	66.2	16%	0.155	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-107.3	-3.2	175.7	-45	0	0	0	0	113.3	V184 C312 D423	V184-C425 HydrophobicContact CG2-CB 4.15Å; V184-C425 VanDerWaalsContact CG2-SG 3.59Å; C312-C425 HydrophobicContact CB-CB 3.91Å; C312-C425 WeakPolarHBondContact CB-SG 3.45Å; C312-C425 WeakPolarHBondContact SG-CB 3.32Å; C312-C425 CovalentContact SG-SG 2.03Å; C312-C425 PolarHBondContact SG-SG 3.08Å; D423-C425 PolarHBondContact O-N 2.62Å
426	N	95.1	Very high	92.2	Very high	108 Å²	108	67.6 Å²	67.6	58%	0.578	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	139.1	-175.2	-69.9	-11.9	0	0	0	111	D423 R428	D423-N426 WeakPolarHBondContact CA-ND2 3.18Å; D423-N426 WeakPolarHBondContact CB-ND2 3.37Å; D423-N426 VanDerWaalsContact CG-ND2 3.26Å; D423-N426 VanDerWaalsContact O-CB 3.29Å; D423-N426 WeakPolarHBondContact O-CB 3.4Å; D423-N426 PolarHBondContact O-N 2.97Å; D423-N426 PolarHBondContact OD1-ND2 3.41Å; N426-R428 PolarHBondContact O-N 2.83Å
427	G	92.4	Very high	92.4	Very high	73 Å²	73	66.6 Å²	66.6	75%	0.753	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-15.2	174.5	0	0	0	0	0	115.5	K429	G427-K429 PolarHBondContact O-N 2.99Å
428	R	94	Very high	92.5	Very high	44 Å²	44	70.5 Å²	70.5	17%	0.166	37%	0.366	C	S	.	.			trans	-69.2	115.6	175.9	-178.8	62.5	-179.2	110.6	-6.4	110.7	L311 G335 A336 H352 D354 N426	L311-R428 HydrophobicContact CB-CB 4.32Å; L311-R428 HydrophobicContact CB-CG 3.69Å; G335-R428 PolarHBondContact O-NE 3.27Å; G335-R428 PolarHBondContact O-NH2 2.67Å; A336-R428 PolarHBondContact O-NE 2.83Å; A336-R428 PolarHBondContact O-NH2 2.81Å; H352-R428 PolarHBondContact CE1-NH2 2.71Å; H352-R428 VanDerWaalsContact CE1-NH2 3.26Å; H352-R428 PolarHBondContact NE2-NH2 3.38Å; D354-R428 IonicContact OD2-CZ 3.2Å; D354-R428 VanDerWaalsContact OD2-CZ 3.23Å; D354-R428 IonicContact OD2-NH1 3.79Å; D354-R428 PolarHBondContact OD2-NH1 3.47Å; D354-R428 IonicContact OD2-NH2 3.73Å; D354-R428 PolarHBondContact OD2-NH2 2.78Å; N426-R428 PolarHBondContact O-N 2.83Å
429	K	92.9	Very high	92.5	Very high	173 Å²	173	74.5 Å²	74.5	75%	0.752	39%	0.385	S	S	*	.			trans	-132.3	138.7	176.4	-64.6	-179	-178.8	180	0	110.1	G427	G427-K429 PolarHBondContact O-N 2.99Å
430	L	95.7	Very high	92.5	Very high	24 Å²	24	68.8 Å²	68.8	13%	0.126	37%	0.371	C	S	.	.			trans	-69.1	152.7	172.4	-59.2	-176.9	0	0	0	110.6	P255 L311 M334 V353 D354 W432	P255-L430 HydrophobicContact CG-CD1 3.43Å; P255-L430 VanDerWaalsContact CG-CD1 3.43Å; P255-L430 HydrophobicContact CG-CG 4.3Å; L311-L430 HydrophobicContact CD1-CD1 4.47Å; L311-L430 HydrophobicContact CD1-CD2 4.1Å; L311-L430 HydrophobicContact CD1-CG 3.86Å; L311-L430 HydrophobicContact CD2-CD2 4.06Å; M334-L430 HydrophobicContact CE-CD1 3.66Å; M334-L430 HydrophobicContact CG-CD1 4.1Å; M334-L430 HydrophobicContact CG-CD2 3.93Å; M334-L430 HydrophobicContact SD-CD1 3.79Å; V353-L430 HydrophobicContact CG2-CD2 4.12Å; D354-L430 WeakPolarHBondContact OD1-CA 3.25Å; L430-W432 VanDerWaalsContact C-N 3.3Å
431	R	96.2	Very high	92.6	Very high	135 Å²	135	72.6 Å²	72.6	51%	0.509	39%	0.393	S	S	.	.	S	Bend	trans	-63.8	-40.4	169.1	-179.6	178.3	179.9	179.3	-0.3	110.8	D354 E357 N433	D354-R431 HydrophobicContact CB-CB 4.05Å; D354-R431 WeakPolarHBondContact O-CD 3.45Å; D354-R431 PolarHBondContact O-NH1 2.65Å; D354-R431 PolarHBondContact OD1-N 3.03Å; E357-R431 VanDerWaalsContact CG-NH2 3.27Å; E357-R431 IonicContact OE1-NH2 3.43Å; R431-N433 PolarHBondContact O-N 3.28Å
432	W	95.3	Very high	92.5	Very high	31 Å²	31	78 Å²	78	12%	0.117	42%	0.423	C	S	.	.			trans	-73.2	121.4	173.6	177.7	64.7	0	0	0	110.2	Q258 Y259 E262 P359 L430 P434	Q258-W432 HydrophobicContact CB-CH2 3.97Å; Q258-W432 HydrophobicContact CB-CZ3 4.31Å; Y259-W432 HydrophobicContact CD2-CB 4.42Å; Y259-W432 AromaticContact CD2-CD2 3.76Å; Y259-W432 HydrophobicContact CD2-CD2 3.76Å; Y259-W432 AromaticContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CG 4.31Å; Y259-W432 HydrophobicContact CD2-CH2 4.44Å; Y259-W432 AromaticContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CE2-CB 3.93Å; Y259-W432 HydrophobicContact CE2-CD2 4.02Å; Y259-W432 AromaticContact CE2-CE3 3.93Å; Y259-W432 HydrophobicContact CE2-CE3 3.93Å; Y259-W432 HydrophobicContact CE2-CG 4.08Å; Y259-W432 HydrophobicContact CG-CE3 4.1Å; Y259-W432 HydrophobicContact CG-CZ3 4.01Å; E262-W432 HydrophobicContact CB-CZ2 4.23Å; E262-W432 HydrophobicContact CG-CZ2 4.34Å; P359-W432 HydrophobicContact CG-CD2 4.22Å; P359-W432 HydrophobicContact CG-CG 4.49Å; P359-W432 HydrophobicContact CG-CZ2 4.08Å; L430-W432 VanDerWaalsContact C-N 3.3Å; W432-P434 HydrophobicContact CE3-CB 4.48Å; W432-P434 HydrophobicContact CH2-CB 3.65Å; W432-P434 HydrophobicContact CZ2-CB 3.8Å; W432-P434 HydrophobicContact CZ3-CB 3.98Å; W432-P434 HydrophobicContact CZ3-CG 4.39Å
433	N	87	Confident	92.3	Very high	144 Å²	144	79.8 Å²	79.8	77%	0.77	43%	0.433	S	S	*	.			trans	-105.7	116.4	169.3	-170.8	39.9	0	0	0	108	R431	R431-N433 PolarHBondContact O-N 3.28Å
434	P	73.8	Confident	92	Very high	124 Å²	124	80.6 Å²	80.6	81%	0.805	44%	0.438	S	S	*	.			trans	-61.3	0	-176.2	23.2	-33	0	0	0	114.7	W432	W432-P434 HydrophobicContact CE3-CB 4.48Å; W432-P434 HydrophobicContact CH2-CB 3.65Å; W432-P434 HydrophobicContact CZ2-CB 3.8Å; W432-P434 HydrophobicContact CZ3-CB 3.98Å; W432-P434 HydrophobicContact CZ3-CG 4.39Å

Retrieved 434 of 434 residues in 392.2 ms (Link to these results)

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