A0A3Q0KNN7_SCHMA Loading...

Fucosyltransferase

AlphaFold DB , UniProt , Accession A0A3Q0KNN7, 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	27.7	Very low	29.9	Very low	239 Å²	239	147.3 Å²	147.3	100%	1.177	79%	0.788	S	S	*	*				0	117.7	0	-75.8	-179	-79.8	0	0	106.3
2	C	31.9	Very low	31.5	Very low	127 Å²	127	145.1 Å²	145.1	86%	0.858	78%	0.776	S	S	*	*			cis	-127.2	142.2	33.3	-68.2	0	0	0	0	113.3
3	E	23.9	Very low	33.1	Very low	161 Å²	161	146.2 Å²	146.2	75%	0.752	77%	0.769	S	S	*	*			trans	-55.5	144.3	149	-59.9	168.3	135.9	0	0	109.8
4	V	30.1	Very low	34.4	Very low	141 Å²	141	147.5 Å²	147.5	86%	0.855	76%	0.761	S	S	*	*				-147.3	110.2	128.2	-178.8	0	0	0	0	107.4	G6	V4-G6 PolarHBondContact O-N 2.95Å
5	F	25.2	Very low	36.3	Very low	175 Å²	175	141.1 Å²	141.1	77%	0.768	73%	0.734	S	S	*	*			trans	-57.8	121.8	161	-84	-99.1	0	0	0	109.6	I7	F5-I7 HydrophobicContact CD1-CD1 4.42Å
6	G	29.4	Very low	38.3	Very low	65 Å²	65	140.5 Å²	140.5	67%	0.67	73%	0.731	S	S	*	*			trans	-131.1	57.7	170.5	0	0	0	0	0	110.3	V4 V8	V4-G6 PolarHBondContact O-N 2.95Å; G6-V8 PolarHBondContact O-N 3.38Å
7	I	25.4	Very low	40.4	Very low	136 Å²	136	140 Å²	140	70%	0.697	72%	0.722	S	S	*	*			trans	-70.8	87.9	164.3	-59.6	174.6	0	0	0	106.4	F5 V9	F5-I7 HydrophobicContact CD1-CD1 4.42Å; I7-V9 HydrophobicContact CG2-CG2 3.86Å
8	V	31	Very low	42.5	Very low	121 Å²	121	136.9 Å²	136.9	73%	0.733	71%	0.71	S	S	*	*			trans	-91.5	98	160	-179.7	0	0	0	0	106.3	G6 R10	G6-V8 PolarHBondContact O-N 3.38Å; V8-R10 PolarHBondContact O-N 2.81Å
9	V	28.3	Very low	44.3	Very low	119 Å²	119	137 Å²	137	72%	0.721	70%	0.704	S	S	*	*			trans	-56.1	90.3	164.5	179.2	0	0	0	0	107.5	I7 N11	I7-V9 HydrophobicContact CG2-CG2 3.86Å; V9-N11 VanDerWaalsContact C-N 3.29Å; V9-N11 PolarHBondContact O-N 3.01Å
10	R	35.5	Very low	46.3	Very low	232 Å²	232	136.1 Å²	136.1	88%	0.875	70%	0.7	S	S	*	*			trans	-83.7	79.5	-178.6	-148	-179.8	-160.1	-171.9	5.6	109	V8 D12	V8-R10 PolarHBondContact O-N 2.81Å; R10-D12 PolarHBondContact O-N 3.31Å
11	N	40.8	Very low	48	Very low	104 Å²	104	135 Å²	135	56%	0.556	70%	0.695	S	S	*	*			trans	44	65.1	151.7	-131.5	-4.4	0	0	0	116.1	V9 K13 Y14	V9-N11 VanDerWaalsContact C-N 3.29Å; V9-N11 PolarHBondContact O-N 3.01Å; N11-K13 PolarHBondContact O-N 3.15Å; N11-Y14 PolarHBondContact O-N 2.99Å; N11-Y14 VanDerWaalsContact O-N 3.15Å
12	D	49	Very low	50.8	Low	121 Å²	121	127.1 Å²	127.1	65%	0.647	66%	0.661	S	S	*	*	H	α-helix	trans	-56.3	-17.4	177.2	-102.3	-32.3	0	0	0	114.5	R10 Y14 S15 L16	R10-D12 PolarHBondContact O-N 3.31Å; D12-Y14 VanDerWaalsContact C-N 3.28Å; D12-Y14 PolarHBondContact O-N 3.35Å; D12-S15 PolarHBondContact O-N 3.3Å; D12-L16 WeakPolarHBondContact O-CB 3.37Å; D12-L16 PolarHBondContact O-N 2.9Å
13	K	52.3	Low	53.3	Low	159 Å²	159	124.1 Å²	124.1	69%	0.691	64%	0.641	S	S	*	*	H	α-helix	trans	-63.9	-31.7	177.3	-125.2	177.3	-175	176	0	112.8	N11 K17	N11-K13 PolarHBondContact O-N 3.15Å; K13-K17 WeakPolarHBondContact O-CB 3.29Å; K13-K17 VanDerWaalsContact O-CG 3.29Å; K13-K17 WeakPolarHBondContact O-CG 3.44Å; K13-K17 PolarHBondContact O-N 3.32Å
14	Y	51.5	Low	56.4	Low	165 Å²	165	119.9 Å²	119.9	65%	0.647	63%	0.626	S	S	*	*	H	α-helix	trans	-78.3	-40.5	175.3	-91.3	-89	0	0	0	111.6	N11 D12 L16 K17 V18	N11-Y14 PolarHBondContact O-N 2.99Å; N11-Y14 VanDerWaalsContact O-N 3.15Å; D12-Y14 VanDerWaalsContact C-N 3.28Å; D12-Y14 PolarHBondContact O-N 3.35Å; Y14-L16 PolarHBondContact O-N 3.44Å; Y14-K17 PolarHBondContact O-N 3.39Å; Y14-V18 WeakPolarHBondContact O-CB 3.36Å; Y14-V18 WeakPolarHBondContact O-CG2 3.48Å; Y14-V18 PolarHBondContact O-N 3.48Å
15	S	62	Low	59.2	Low	51 Å²	51	116.8 Å²	116.8	36%	0.357	61%	0.61	S	S	.	*	H	α-helix	trans	-60.1	-45.4	176.3	178.5	0	0	0	0	111.9	D12 V18 K19	D12-S15 PolarHBondContact O-N 3.3Å; S15-V18 PolarHBondContact O-N 3.44Å; S15-K19 WeakPolarHBondContact O-CB 3.5Å; S15-K19 WeakPolarHBondContact O-CG 3.22Å; S15-K19 PolarHBondContact O-N 2.95Å
16	L	68.5	Low	62.3	Low	132 Å²	132	112.7 Å²	112.7	69%	0.691	60%	0.596	S	S	*	*	H	α-helix	trans	-67	-42.1	178.6	-157.3	84	0	0	0	112.1	D12 Y14 K19 L20	D12-L16 WeakPolarHBondContact O-CB 3.37Å; D12-L16 PolarHBondContact O-N 2.9Å; Y14-L16 PolarHBondContact O-N 3.44Å; L16-K19 PolarHBondContact O-N 3.37Å; L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 PolarHBondContact O-N 2.92Å
17	K	74.2	Confident	65.2	Low	132 Å²	132	114.2 Å²	114.2	57%	0.574	59%	0.587	S	S	*	*	H	α-helix	trans	-61.9	-42.7	175.3	-80.5	-178	176.7	-171.9	0	111.7	K13 Y14 L20 L21	K13-K17 WeakPolarHBondContact O-CB 3.29Å; K13-K17 VanDerWaalsContact O-CG 3.29Å; K13-K17 WeakPolarHBondContact O-CG 3.44Å; K13-K17 PolarHBondContact O-N 3.32Å; Y14-K17 PolarHBondContact O-N 3.39Å; K17-L20 PolarHBondContact O-N 3.4Å; K17-L21 WeakPolarHBondContact O-CB 3.5Å; K17-L21 WeakPolarHBondContact O-CD1 3.37Å; K17-L21 VanDerWaalsContact O-CG 3.23Å; K17-L21 WeakPolarHBondContact O-CG 3.23Å; K17-L21 PolarHBondContact O-N 3.49Å
18	V	77.5	Confident	68.3	Low	84 Å²	84	112.7 Å²	112.7	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-65	-45.8	177.4	172.2	0	0	0	0	110.5	Y14 S15 L20 L21 V22	Y14-V18 WeakPolarHBondContact O-CB 3.36Å; Y14-V18 WeakPolarHBondContact O-CG2 3.48Å; Y14-V18 PolarHBondContact O-N 3.48Å; S15-V18 PolarHBondContact O-N 3.44Å; V18-L20 PolarHBondContact O-N 2.99Å; V18-L21 PolarHBondContact O-N 2.92Å; V18-V22 HydrophobicContact CG1-CG2 4.41Å; V18-V22 VanDerWaalsContact O-CG2 3.27Å; V18-V22 WeakPolarHBondContact O-CG2 3.27Å; V18-V22 PolarHBondContact O-N 3.28Å
19	K	77.7	Confident	71.1	Confident	139 Å²	139	111.7 Å²	111.7	60%	0.604	57%	0.57	S	S	*	*	H	α-helix	trans	-59.4	-45.1	175.9	-74.3	178.7	-178.4	-178.3	0	111.9	S15 L16 V22 S23	S15-K19 WeakPolarHBondContact O-CB 3.5Å; S15-K19 WeakPolarHBondContact O-CG 3.22Å; S15-K19 PolarHBondContact O-N 2.95Å; L16-K19 PolarHBondContact O-N 3.37Å; K19-V22 PolarHBondContact O-N 3.3Å; K19-S23 PolarHBondContact O-N 3.46Å; K19-S23 PolarHBondContact O-OG 3.29Å; K19-S23 VanDerWaalsContact O-OG 3.06Å
20	L	83.3	Confident	74	Confident	118 Å²	118	110.3 Å²	110.3	62%	0.618	56%	0.558	S	S	*	*	H	α-helix	trans	-62.5	-43.8	177.5	-171.5	70.6	0	0	0	111.7	L16 K17 V18 V22 S23 V24	L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 PolarHBondContact O-N 2.92Å; K17-L20 PolarHBondContact O-N 3.4Å; V18-L20 PolarHBondContact O-N 2.99Å; L20-V22 VanDerWaalsContact C-N 3.33Å; L20-V22 PolarHBondContact O-N 3.32Å; L20-S23 PolarHBondContact O-N 2.9Å; L20-V24 WeakPolarHBondContact O-CB 3.29Å; L20-V24 VanDerWaalsContact O-CG2 3.29Å; L20-V24 WeakPolarHBondContact O-CG2 3.22Å; L20-V24 PolarHBondContact O-N 2.92Å
21	L	83.4	Confident	76.4	Confident	113 Å²	113	103.3 Å²	103.3	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-63	-38	176.5	-76.4	165	0	0	0	112.4	K17 V18 S25	K17-L21 WeakPolarHBondContact O-CB 3.5Å; K17-L21 WeakPolarHBondContact O-CD1 3.37Å; K17-L21 VanDerWaalsContact O-CG 3.23Å; K17-L21 WeakPolarHBondContact O-CG 3.23Å; K17-L21 PolarHBondContact O-N 3.49Å; V18-L21 PolarHBondContact O-N 2.92Å; L21-S25 VanDerWaalsContact O-CB 3.32Å; L21-S25 WeakPolarHBondContact O-CB 3.44Å; L21-S25 PolarHBondContact O-N 3.23Å; L21-S25 PolarHBondContact O-OG 3.48Å
22	V	85.6	Confident	78.5	Confident	75 Å²	75	104.1 Å²	104.1	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-45.8	174.9	172.2	0	0	0	0	110.4	V18 K19 L20 V24 S25 I26	V18-V22 HydrophobicContact CG1-CG2 4.41Å; V18-V22 VanDerWaalsContact O-CG2 3.27Å; V18-V22 WeakPolarHBondContact O-CG2 3.27Å; V18-V22 PolarHBondContact O-N 3.28Å; K19-V22 PolarHBondContact O-N 3.3Å; L20-V22 VanDerWaalsContact C-N 3.33Å; L20-V22 PolarHBondContact O-N 3.32Å; V22-V24 PolarHBondContact O-N 2.91Å; V22-S25 PolarHBondContact O-N 3.47Å; V22-I26 HydrophobicContact CG1-CD1 3.83Å; V22-I26 HydrophobicContact CG1-CG1 4.49Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.32Å; V22-I26 PolarHBondContact O-N 3.29Å
23	S	84.4	Confident	80.2	Confident	64 Å²	64	102.5 Å²	102.5	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-61.9	-44	177.5	-60.2	0	0	0	0	112.6	K19 L20 I26 I27	K19-S23 PolarHBondContact O-N 3.46Å; K19-S23 PolarHBondContact O-OG 3.29Å; K19-S23 VanDerWaalsContact O-OG 3.06Å; L20-S23 PolarHBondContact O-N 2.9Å; S23-I26 PolarHBondContact O-N 3.06Å; S23-I27 WeakPolarHBondContact O-CG1 3.47Å; S23-I27 PolarHBondContact O-N 2.91Å
24	V	89.1	Confident	81.6	Confident	72 Å²	72	99.4 Å²	99.4	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-43	176.2	172.1	0	0	0	0	110.7	L20 V22 I26 I27 L28	L20-V24 WeakPolarHBondContact O-CB 3.29Å; L20-V24 VanDerWaalsContact O-CG2 3.29Å; L20-V24 WeakPolarHBondContact O-CG2 3.22Å; L20-V24 PolarHBondContact O-N 2.92Å; V22-V24 PolarHBondContact O-N 2.91Å; V24-I26 VanDerWaalsContact C-N 3.34Å; V24-I26 PolarHBondContact O-N 3.37Å; V24-I27 PolarHBondContact O-N 2.88Å; V24-L28 HydrophobicContact CG1-CD1 3.92Å; V24-L28 HydrophobicContact CG1-CG 4.36Å; V24-L28 WeakPolarHBondContact O-CB 3.45Å; V24-L28 VanDerWaalsContact O-CG 3.32Å; V24-L28 WeakPolarHBondContact O-CG 3.32Å; V24-L28 PolarHBondContact O-N 2.75Å
25	S	88.9	Confident	82.9	Confident	75 Å²	75	96.4 Å²	96.4	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175.9	-61	0	0	0	0	112.5	L21 V22 L28 L29	L21-S25 VanDerWaalsContact O-CB 3.32Å; L21-S25 WeakPolarHBondContact O-CB 3.44Å; L21-S25 PolarHBondContact O-N 3.23Å; L21-S25 PolarHBondContact O-OG 3.48Å; V22-S25 PolarHBondContact O-N 3.47Å; S25-L28 PolarHBondContact O-N 2.99Å; S25-L29 WeakPolarHBondContact O-CB 3.3Å; S25-L29 PolarHBondContact O-N 2.92Å
26	I	90.9	Very high	83.6	Confident	90 Å²	90	97.4 Å²	97.4	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-44.3	176.3	-69.3	166.1	0	0	0	110.9	V22 S23 V24 L29 I30	V22-I26 HydrophobicContact CG1-CD1 3.83Å; V22-I26 HydrophobicContact CG1-CG1 4.49Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.32Å; V22-I26 PolarHBondContact O-N 3.29Å; S23-I26 PolarHBondContact O-N 3.06Å; V24-I26 VanDerWaalsContact C-N 3.34Å; V24-I26 PolarHBondContact O-N 3.37Å; I26-L29 WeakPolarHBondContact O-CB 3.3Å; I26-L29 PolarHBondContact O-N 3.44Å; I26-I30 HydrophobicContact CG2-CD1 3.87Å; I26-I30 HydrophobicContact CG2-CG1 4.48Å; I26-I30 VanDerWaalsContact O-CG1 3.3Å; I26-I30 WeakPolarHBondContact O-CG1 3.34Å; I26-I30 PolarHBondContact O-N 2.9Å
27	I	90.8	Very high	84.1	Confident	97 Å²	97	92.9 Å²	92.9	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-62.6	-44.6	177.9	-68.6	166.3	0	0	0	110.6	S23 V24 L29 I30 I31	S23-I27 WeakPolarHBondContact O-CG1 3.47Å; S23-I27 PolarHBondContact O-N 2.91Å; V24-I27 PolarHBondContact O-N 2.88Å; I27-L29 VanDerWaalsContact C-N 3.33Å; I27-L29 PolarHBondContact O-N 3.27Å; I27-I30 PolarHBondContact O-N 2.93Å; I27-I31 HydrophobicContact CG2-CD1 3.84Å; I27-I31 HydrophobicContact CG2-CG1 4.44Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.48Å; I27-I31 PolarHBondContact O-N 2.91Å
28	L	90.3	Very high	84.1	Confident	103 Å²	103	89.8 Å²	89.8	54%	0.539	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-39.2	176.5	-70.8	172.8	0	0	0	111.9	V24 S25 I31 W32	V24-L28 HydrophobicContact CG1-CD1 3.92Å; V24-L28 HydrophobicContact CG1-CG 4.36Å; V24-L28 WeakPolarHBondContact O-CB 3.45Å; V24-L28 VanDerWaalsContact O-CG 3.32Å; V24-L28 WeakPolarHBondContact O-CG 3.32Å; V24-L28 PolarHBondContact O-N 2.75Å; S25-L28 PolarHBondContact O-N 2.99Å; L28-I31 PolarHBondContact O-N 2.84Å; L28-W32 VanDerWaalsContact O-CB 3.29Å; L28-W32 WeakPolarHBondContact O-CB 3.36Å; L28-W32 PolarHBondContact O-N 2.79Å
29	L	90	Very high	83.9	Confident	100 Å²	100	88.9 Å²	88.9	52%	0.524	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-43.3	173.9	-170.4	80.9	0	0	0	111.3	S25 I26 I27 W32 L33	S25-L29 WeakPolarHBondContact O-CB 3.3Å; S25-L29 PolarHBondContact O-N 2.92Å; I26-L29 WeakPolarHBondContact O-CB 3.3Å; I26-L29 PolarHBondContact O-N 3.44Å; I27-L29 VanDerWaalsContact C-N 3.33Å; I27-L29 PolarHBondContact O-N 3.27Å; L29-W32 WeakPolarHBondContact O-CB 3.3Å; L29-W32 PolarHBondContact O-N 3.31Å; L29-L33 HydrophobicContact CD2-CD1 4.41Å; L29-L33 HydrophobicContact CG-CD1 4.17Å; L29-L33 WeakPolarHBondContact O-CB 2.8Å; L29-L33 VanDerWaalsContact O-CG 3.26Å; L29-L33 WeakPolarHBondContact O-CG 3.43Å; L29-L33 PolarHBondContact O-N 3.17Å
30	I	89.3	Confident	83.7	Confident	91 Å²	91	86.2 Å²	86.2	47%	0.467	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-46.1	176.5	-68.2	165.8	0	0	0	110.5	I26 I27 W32 L33 V34	I26-I30 HydrophobicContact CG2-CD1 3.87Å; I26-I30 HydrophobicContact CG2-CG1 4.48Å; I26-I30 VanDerWaalsContact O-CG1 3.3Å; I26-I30 WeakPolarHBondContact O-CG1 3.34Å; I26-I30 PolarHBondContact O-N 2.9Å; I27-I30 PolarHBondContact O-N 2.93Å; I30-W32 VanDerWaalsContact C-N 3.26Å; I30-W32 PolarHBondContact O-N 3.35Å; I30-L33 PolarHBondContact O-N 3.29Å; I30-V34 HydrophobicContact CG2-CG2 4.19Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 VanDerWaalsContact O-CG2 3.26Å; I30-V34 WeakPolarHBondContact O-CG2 3.37Å; I30-V34 PolarHBondContact O-N 3.36Å
31	I	84	Confident	83.1	Confident	85 Å²	85	85 Å²	85	44%	0.436	47%	0.467	S	S	.	.	H	α-helix	trans	-59.1	-41	176.2	-69.5	168.7	0	0	0	110.5	I27 L28 N35	I27-I31 HydrophobicContact CG2-CD1 3.84Å; I27-I31 HydrophobicContact CG2-CG1 4.44Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.48Å; I27-I31 PolarHBondContact O-N 2.91Å; L28-I31 PolarHBondContact O-N 2.84Å; I31-N35 WeakPolarHBondContact O-CB 3.39Å; I31-N35 PolarHBondContact O-N 2.81Å; I31-N35 PolarHBondContact O-ND2 2.73Å
32	W	85.7	Confident	82.1	Confident	120 Å²	120	84.7 Å²	84.7	46%	0.455	46%	0.462	S	S	.	.	I	π-helix	trans	-65.7	-45.1	177	-170.6	85.1	0	0	0	112.2	L28 L29 I30 V34 I36 V37 L40	L28-W32 VanDerWaalsContact O-CB 3.29Å; L28-W32 WeakPolarHBondContact O-CB 3.36Å; L28-W32 PolarHBondContact O-N 2.79Å; L29-W32 WeakPolarHBondContact O-CB 3.3Å; L29-W32 PolarHBondContact O-N 3.31Å; I30-W32 VanDerWaalsContact C-N 3.26Å; I30-W32 PolarHBondContact O-N 3.35Å; W32-V34 PolarHBondContact O-N 3.17Å; W32-I36 HydrophobicContact CG-CB 4.24Å; W32-I36 WeakPolarHBondContact O-CA 2.91Å; W32-I36 WeakPolarHBondContact O-CB 3.3Å; W32-I36 PolarHBondContact O-N 3.4Å; W32-V37 HydrophobicContact CD2-CG2 4.37Å; W32-V37 HydrophobicContact CE3-CG2 3.77Å; W32-V37 HydrophobicContact CH2-CG2 3.98Å; W32-V37 HydrophobicContact CZ3-CG2 3.55Å; W32-V37 PolarHBondContact O-N 3.24Å; W32-L40 HydrophobicContact CZ2-CD1 4.41Å
33	L	85	Confident	81.1	Confident	88 Å²	88	88.2 Å²	88.2	46%	0.461	47%	0.467	S	S	.	.	I	π-helix	trans	-64.8	-35.6	176.3	-73.2	171	0	0	0	112.9	L29 I30 V37 P38	L29-L33 HydrophobicContact CD2-CD1 4.41Å; L29-L33 HydrophobicContact CG-CD1 4.17Å; L29-L33 WeakPolarHBondContact O-CB 2.8Å; L29-L33 VanDerWaalsContact O-CG 3.26Å; L29-L33 WeakPolarHBondContact O-CG 3.43Å; L29-L33 PolarHBondContact O-N 3.17Å; I30-L33 PolarHBondContact O-N 3.29Å; L33-V37 HydrophobicContact CD2-CG2 4.03Å; L33-P38 WeakPolarHBondContact O-CD 3.49Å
34	V	81.8	Confident	79.9	Confident	94 Å²	94	92 Å²	92	57%	0.57	48%	0.476	S	S	*	.	I	π-helix	trans	-82.8	-38.4	-177.9	173.4	0	0	0	0	111.9	I30 W32 P38	I30-V34 HydrophobicContact CG2-CG2 4.19Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 VanDerWaalsContact O-CG2 3.26Å; I30-V34 WeakPolarHBondContact O-CG2 3.37Å; I30-V34 PolarHBondContact O-N 3.36Å; W32-V34 PolarHBondContact O-N 3.17Å; V34-P38 WeakPolarHBondContact O-CD 3.26Å; V34-P38 WeakPolarHBondContact O-CG 3.42Å
35	N	78	Confident	78.2	Confident	101 Å²	101	92.5 Å²	92.5	54%	0.54	48%	0.475	S	S	.	.	I	π-helix	trans	-103.9	-39.6	-172.4	-60.9	-69.3	0	0	0	113.4	I31	I31-N35 WeakPolarHBondContact O-CB 3.39Å; I31-N35 PolarHBondContact O-N 2.81Å; I31-N35 PolarHBondContact O-ND2 2.73Å
36	I	77.3	Confident	76.3	Confident	73 Å²	73	92.6 Å²	92.6	37%	0.374	47%	0.47	S	S	.	.	I	π-helix	trans	-91.2	-42.6	-172.2	-55.4	-157.2	0	0	0	111.2	W32 S39 L40	W32-I36 HydrophobicContact CG-CB 4.24Å; W32-I36 WeakPolarHBondContact O-CA 2.91Å; W32-I36 WeakPolarHBondContact O-CB 3.3Å; W32-I36 PolarHBondContact O-N 3.4Å; I36-S39 WeakPolarHBondContact O-CB 3.4Å; I36-S39 PolarHBondContact O-N 2.98Å; I36-S39 VanDerWaalsContact O-N 3.1Å; I36-S39 PolarHBondContact O-OG 3.26Å; I36-L40 HydrophobicContact CG2-CD1 3.78Å; I36-L40 HydrophobicContact CG2-CG 4.08Å; I36-L40 PolarHBondContact O-N 3.02Å
37	V	79.4	Confident	74	Confident	36 Å²	36	92.2 Å²	92.2	22%	0.218	47%	0.466	C	S	.	.	H	α-helix	trans	-59.8	-45.1	-179.2	172.6	0	0	0	0	113	W32 L33 S39 L40 I41	W32-V37 HydrophobicContact CD2-CG2 4.37Å; W32-V37 HydrophobicContact CE3-CG2 3.77Å; W32-V37 HydrophobicContact CH2-CG2 3.98Å; W32-V37 HydrophobicContact CZ3-CG2 3.55Å; W32-V37 PolarHBondContact O-N 3.24Å; L33-V37 HydrophobicContact CD2-CG2 4.03Å; V37-S39 VanDerWaalsContact C-N 3.27Å; V37-S39 PolarHBondContact O-N 2.76Å; V37-L40 PolarHBondContact O-N 2.72Å; V37-I41 HydrophobicContact CG1-CD1 3.59Å; V37-I41 HydrophobicContact CG1-CG1 4.15Å; V37-I41 WeakPolarHBondContact O-CB 3.29Å; V37-I41 VanDerWaalsContact O-CG1 3.27Å; V37-I41 WeakPolarHBondContact O-CG1 3.34Å; V37-I41 PolarHBondContact O-N 2.82Å
38	P	74.1	Confident	71.7	Confident	68 Å²	68	90.8 Å²	90.8	44%	0.442	46%	0.462	S	S	.	.	H	α-helix	trans	-61.7	-36.6	175	-25.5	37.1	0	0	0	112.4	L33 V34 I41 Q42	L33-P38 WeakPolarHBondContact O-CD 3.49Å; V34-P38 WeakPolarHBondContact O-CD 3.26Å; V34-P38 WeakPolarHBondContact O-CG 3.42Å; P38-I41 PolarHBondContact O-N 3.44Å; P38-Q42 VanDerWaalsContact O-CB 3.25Å; P38-Q42 WeakPolarHBondContact O-CB 3.35Å; P38-Q42 PolarHBondContact O-N 3.47Å
39	S	72.1	Confident	69.4	Low	64 Å²	64	91 Å²	91	45%	0.448	46%	0.464	S	S	.	.	H	α-helix	trans	-66.8	-37.7	176.4	78	0	0	0	0	112.6	I36 V37 Q42 W43	I36-S39 WeakPolarHBondContact O-CB 3.4Å; I36-S39 PolarHBondContact O-N 2.98Å; I36-S39 VanDerWaalsContact O-N 3.1Å; I36-S39 PolarHBondContact O-OG 3.26Å; V37-S39 VanDerWaalsContact C-N 3.27Å; V37-S39 PolarHBondContact O-N 2.76Å; S39-Q42 PolarHBondContact O-N 3.18Å; S39-W43 VanDerWaalsContact O-CB 3.25Å; S39-W43 WeakPolarHBondContact O-CB 3.3Å; S39-W43 PolarHBondContact O-N 3.34Å
40	L	73.3	Confident	67.1	Low	83 Å²	83	92.6 Å²	92.6	44%	0.435	47%	0.468	S	S	.	.	H	α-helix	trans	-73.1	-38	176.1	-75.3	171.5	0	0	0	112.1	W32 I36 V37 W43 K44	W32-L40 HydrophobicContact CZ2-CD1 4.41Å; I36-L40 HydrophobicContact CG2-CD1 3.78Å; I36-L40 HydrophobicContact CG2-CG 4.08Å; I36-L40 PolarHBondContact O-N 3.02Å; V37-L40 PolarHBondContact O-N 2.72Å; L40-W43 PolarHBondContact O-N 3.22Å; L40-K44 VanDerWaalsContact O-CB 3.31Å; L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 PolarHBondContact O-N 3.13Å
41	I	72	Confident	64.5	Low	94 Å²	94	93.1 Å²	93.1	48%	0.482	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-46.6	172.3	-69	169.8	0	0	0	109.2	V37 P38 W43 K44 I45	V37-I41 HydrophobicContact CG1-CD1 3.59Å; V37-I41 HydrophobicContact CG1-CG1 4.15Å; V37-I41 WeakPolarHBondContact O-CB 3.29Å; V37-I41 VanDerWaalsContact O-CG1 3.27Å; V37-I41 WeakPolarHBondContact O-CG1 3.34Å; V37-I41 PolarHBondContact O-N 2.82Å; P38-I41 PolarHBondContact O-N 3.44Å; I41-W43 VanDerWaalsContact C-N 3.34Å; I41-W43 PolarHBondContact O-N 3.28Å; I41-K44 PolarHBondContact O-N 3.36Å; I41-I45 HydrophobicContact CG2-CD1 3.66Å; I41-I45 HydrophobicContact CG2-CG1 4.29Å; I41-I45 WeakPolarHBondContact O-CB 3.49Å; I41-I45 VanDerWaalsContact O-CG1 3.23Å; I41-I45 WeakPolarHBondContact O-CG1 3.45Å; I41-I45 PolarHBondContact O-N 3.5Å
42	Q	62.7	Low	62.2	Low	106 Å²	106	98.8 Å²	98.8	50%	0.495	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-42.7	176	-169.2	65.1	34	0	0	111.5	P38 S39 I45 N46	P38-Q42 VanDerWaalsContact O-CB 3.25Å; P38-Q42 WeakPolarHBondContact O-CB 3.35Å; P38-Q42 PolarHBondContact O-N 3.47Å; S39-Q42 PolarHBondContact O-N 3.18Å; Q42-I45 PolarHBondContact O-N 2.72Å; Q42-N46 PolarHBondContact NE2-OD1 2.88Å; Q42-N46 WeakPolarHBondContact O-CB 3.32Å; Q42-N46 PolarHBondContact O-N 2.8Å; Q42-N46 PolarHBondContact O-ND2 3.29Å; Q42-N46 PolarHBondContact O-OD1 2.88Å
43	W	63.5	Low	59.8	Low	149 Å²	149	97.1 Å²	97.1	56%	0.564	49%	0.486	S	S	*	.	H	α-helix	trans	-62.1	-42	175.5	-179.8	78.5	0	0	0	112	S39 L40 I41 N46 Q47	S39-W43 VanDerWaalsContact O-CB 3.25Å; S39-W43 WeakPolarHBondContact O-CB 3.3Å; S39-W43 PolarHBondContact O-N 3.34Å; L40-W43 PolarHBondContact O-N 3.22Å; I41-W43 VanDerWaalsContact C-N 3.34Å; I41-W43 PolarHBondContact O-N 3.28Å; W43-N46 PolarHBondContact O-N 3.36Å; W43-Q47 HydrophobicContact CD2-CG 4.35Å; W43-Q47 HydrophobicContact CH2-CG 4.34Å; W43-Q47 HydrophobicContact CZ2-CG 4.13Å; W43-Q47 WeakPolarHBondContact O-CG 3.39Å; W43-Q47 PolarHBondContact O-N 3.39Å
44	K	59.1	Low	57.3	Low	143 Å²	143	96.4 Å²	96.4	62%	0.622	49%	0.486	S	S	*	.	H	α-helix	trans	-72.1	-35.9	177.9	-165.3	165.8	-176.2	178	0	112.5	L40 I41 N46 Q47 V48	L40-K44 VanDerWaalsContact O-CB 3.31Å; L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 PolarHBondContact O-N 3.13Å; I41-K44 PolarHBondContact O-N 3.36Å; K44-N46 VanDerWaalsContact C-N 3.33Å; K44-Q47 WeakPolarHBondContact O-CB 3.22Å; K44-Q47 PolarHBondContact O-N 3.25Å; K44-V48 WeakPolarHBondContact O-CG2 3.38Å; K44-V48 PolarHBondContact O-N 2.98Å
45	I	55	Low	55	Low	82 Å²	82	100 Å²	100	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-45	171	-70.5	167.1	0	0	0	109.6	I41 Q42 Q47 V48 D49	I41-I45 HydrophobicContact CG2-CD1 3.66Å; I41-I45 HydrophobicContact CG2-CG1 4.29Å; I41-I45 WeakPolarHBondContact O-CB 3.49Å; I41-I45 VanDerWaalsContact O-CG1 3.23Å; I41-I45 WeakPolarHBondContact O-CG1 3.45Å; I41-I45 PolarHBondContact O-N 3.5Å; Q42-I45 PolarHBondContact O-N 2.72Å; I45-Q47 VanDerWaalsContact C-N 3.25Å; I45-Q47 PolarHBondContact O-N 2.82Å; I45-V48 PolarHBondContact O-N 2.86Å; I45-D49 PolarHBondContact O-N 3.48Å
46	N	48.2	Very low	53	Low	77 Å²	77	100.5 Å²	100.5	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-29.9	175.5	-65.8	-11.9	0	0	0	112.5	Q42 W43 K44 H50	Q42-N46 PolarHBondContact NE2-OD1 2.88Å; Q42-N46 WeakPolarHBondContact O-CB 3.32Å; Q42-N46 PolarHBondContact O-N 2.8Å; Q42-N46 PolarHBondContact O-ND2 3.29Å; Q42-N46 PolarHBondContact O-OD1 2.88Å; W43-N46 PolarHBondContact O-N 3.36Å; K44-N46 VanDerWaalsContact C-N 3.33Å; N46-H50 PolarHBondContact O-N 3.04Å
47	Q	43.2	Very low	51.2	Low	82 Å²	82	100 Å²	100	38%	0.383	50%	0.501	S	S	.	.	H	α-helix	trans	-74.1	-41.1	172.8	-74.4	-112.1	-36.2	0	0	112.5	W43 K44 I45 D49 H50 D51	W43-Q47 HydrophobicContact CD2-CG 4.35Å; W43-Q47 HydrophobicContact CH2-CG 4.34Å; W43-Q47 HydrophobicContact CZ2-CG 4.13Å; W43-Q47 WeakPolarHBondContact O-CG 3.39Å; W43-Q47 PolarHBondContact O-N 3.39Å; K44-Q47 WeakPolarHBondContact O-CB 3.22Å; K44-Q47 PolarHBondContact O-N 3.25Å; I45-Q47 VanDerWaalsContact C-N 3.25Å; I45-Q47 PolarHBondContact O-N 2.82Å; Q47-D49 PolarHBondContact O-N 2.94Å; Q47-H50 CarbonylContact O-C 3.36Å; Q47-H50 WeakPolarHBondContact O-CA 3.48Å; Q47-H50 WeakPolarHBondContact O-CB 3.43Å; Q47-H50 PolarHBondContact O-N 3.14Å; Q47-D51 PolarHBondContact O-N 3.46Å
48	V	42	Very low	49	Very low	68 Å²	68	103.7 Å²	103.7	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-31.6	175.2	172.9	0	0	0	0	111.4	K44 I45 H50 D51 R52	K44-V48 WeakPolarHBondContact O-CG2 3.38Å; K44-V48 PolarHBondContact O-N 2.98Å; I45-V48 PolarHBondContact O-N 2.86Å; V48-H50 VanDerWaalsContact C-N 3.29Å; V48-D51 PolarHBondContact O-N 2.95Å; V48-R52 WeakPolarHBondContact O-CB 3.45Å; V48-R52 PolarHBondContact O-N 2.51Å
49	D	41.7	Very low	47.2	Very low	108 Å²	108	105 Å²	105	58%	0.578	52%	0.523	S	S	*	.	H	α-helix	trans	-69	-24.7	170.8	-87.2	-15	0	0	0	113	I45 Q47	I45-D49 PolarHBondContact O-N 3.48Å; Q47-D49 PolarHBondContact O-N 2.94Å
50	H	41.2	Very low	45.5	Very low	133 Å²	133	106.6 Å²	106.6	62%	0.616	53%	0.526	S	S	*	.	H	α-helix	trans	-79.8	-39.4	169.6	-76.9	-36.5	0	0	0	112.3	N46 Q47 V48 R52 M53	N46-H50 PolarHBondContact O-N 3.04Å; Q47-H50 CarbonylContact O-C 3.36Å; Q47-H50 WeakPolarHBondContact O-CA 3.48Å; Q47-H50 WeakPolarHBondContact O-CB 3.43Å; Q47-H50 PolarHBondContact O-N 3.14Å; V48-H50 VanDerWaalsContact C-N 3.29Å; H50-R52 VanDerWaalsContact C-N 3.28Å; H50-R52 PolarHBondContact O-N 2.94Å; H50-M53 WeakPolarHBondContact O-CG 3.21Å; H50-M53 PolarHBondContact O-N 3.24Å
51	D	36	Very low	43.8	Very low	102 Å²	102	106 Å²	106	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-73.1	-17.8	179.5	-67.2	-11.6	0	0	0	113.1	Q47 V48 M53	Q47-D51 PolarHBondContact O-N 3.46Å; V48-D51 PolarHBondContact O-N 2.95Å; D51-M53 PolarHBondContact O-N 3.49Å
52	R	34.7	Very low	42.2	Very low	203 Å²	203	106 Å²	106	77%	0.766	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	12.9	171.1	-89.2	-172.3	180	177.5	1.9	114.1	V48 H50	V48-R52 WeakPolarHBondContact O-CB 3.45Å; V48-R52 PolarHBondContact O-N 2.51Å; H50-R52 VanDerWaalsContact C-N 3.28Å; H50-R52 PolarHBondContact O-N 2.94Å
53	M	36.5	Very low	40.7	Very low	85 Å²	85	106.5 Å²	106.5	42%	0.419	54%	0.542	S	S	.	.	S	Bend	trans	-64.8	135.9	154.4	-72.6	-161.2	126.4	0	0	108.4	H50 D51 E55 I57	H50-M53 WeakPolarHBondContact O-CG 3.21Å; H50-M53 PolarHBondContact O-N 3.24Å; D51-M53 PolarHBondContact O-N 3.49Å; M53-E55 PolarHBondContact O-N 3.44Å; M53-I57 HydrophobicContact CB-CB 4.39Å; M53-I57 HydrophobicContact CE-CG2 3.84Å; M53-I57 HydrophobicContact SD-CB 4.5Å; M53-I57 HydrophobicContact SD-CG2 3.8Å
54	P	32.7	Very low	39.3	Very low	73 Å²	73	104.4 Å²	104.4	47%	0.474	54%	0.541	S	S	.	.			trans	-52	135.2	171.4	-15.9	26.1	0	0	0	107.8	T56 I57	P54-T56 PolarHBondContact O-N 3.49Å; P54-I57 HydrophobicContact CB-CG1 4.48Å; P54-I57 HydrophobicContact CG-CD1 4.08Å; P54-I57 HydrophobicContact CG-CG1 4.26Å; P54-I57 PolarHBondContact O-N 3.08Å
55	E	33.1	Very low	38	Very low	171 Å²	171	101.8 Å²	101.8	80%	0.799	54%	0.54	S	S	*	.	H	α-helix	trans	-48.5	-20.1	175.8	-71.4	172.3	147.5	0	0	112.6	M53 I57 V59	M53-E55 PolarHBondContact O-N 3.44Å; E55-I57 VanDerWaalsContact C-N 3.3Å; E55-I57 PolarHBondContact O-N 2.98Å; E55-V59 WeakPolarHBondContact O-CG2 3.25Å
56	T	36.1	Very low	37.1	Very low	111 Å²	111	105.6 Å²	105.6	68%	0.681	56%	0.56	S	S	*	*	H	α-helix	trans	-64	-24.3	171.7	-16.2	0	0	0	0	114.8	P54	P54-T56 PolarHBondContact O-N 3.49Å
57	I	39.3	Very low	36.4	Very low	61 Å²	61	106.7 Å²	106.7	31%	0.313	57%	0.57	S	S	.	*	H	α-helix	trans	-95	-36.4	-175.5	-58.3	-169.2	0	0	0	111.7	M53 P54 E55 V59 L60 C61	M53-I57 HydrophobicContact CB-CB 4.39Å; M53-I57 HydrophobicContact CE-CG2 3.84Å; M53-I57 HydrophobicContact SD-CB 4.5Å; M53-I57 HydrophobicContact SD-CG2 3.8Å; P54-I57 HydrophobicContact CB-CG1 4.48Å; P54-I57 HydrophobicContact CG-CD1 4.08Å; P54-I57 HydrophobicContact CG-CG1 4.26Å; P54-I57 PolarHBondContact O-N 3.08Å; E55-I57 VanDerWaalsContact C-N 3.3Å; E55-I57 PolarHBondContact O-N 2.98Å; I57-V59 VanDerWaalsContact C-N 3.33Å; I57-V59 PolarHBondContact O-N 2.92Å; I57-L60 WeakPolarHBondContact O-CA 3.39Å; I57-L60 VanDerWaalsContact O-CB 3.28Å; I57-L60 WeakPolarHBondContact O-CB 3.42Å; I57-L60 PolarHBondContact O-N 3.13Å; I57-C61 PolarHBondContact O-N 3.35Å
58	E	33.1	Very low	36.2	Very low	114 Å²	114	110.9 Å²	110.9	53%	0.533	60%	0.595	S	S	.	*	H	α-helix	trans	-67.5	-34.4	179.3	-137.8	-177.8	-176.8	0	0	112.2	L60 C61 S62	E58-L60 PolarHBondContact O-N 3.31Å; E58-C61 PolarHBondContact O-N 3.3Å; E58-S62 WeakPolarHBondContact O-CB 3.37Å; E58-S62 PolarHBondContact O-N 3.26Å; E58-S62 PolarHBondContact O-OG 2.97Å
59	V	36	Very low	35.9	Very low	96 Å²	96	114.9 Å²	114.9	58%	0.582	61%	0.609	S	S	*	*	H	α-helix	trans	-65.2	-27.6	170	176.5	0	0	0	0	112	E55 I57 S62 N63	E55-V59 WeakPolarHBondContact O-CG2 3.25Å; I57-V59 VanDerWaalsContact C-N 3.33Å; I57-V59 PolarHBondContact O-N 2.92Å; V59-S62 PolarHBondContact O-OG 3.09Å; V59-N63 PolarHBondContact O-ND2 2.84Å
60	L	36.1	Very low	36	Very low	98 Å²	98	113 Å²	113	51%	0.513	60%	0.604	S	S	.	*	H	α-helix	trans	-78.1	-38.5	176.1	-118.8	88.4	0	0	0	111.9	I57 E58 I64	I57-L60 WeakPolarHBondContact O-CA 3.39Å; I57-L60 VanDerWaalsContact O-CB 3.28Å; I57-L60 WeakPolarHBondContact O-CB 3.42Å; I57-L60 PolarHBondContact O-N 3.13Å; E58-L60 PolarHBondContact O-N 3.31Å; L60-I64 WeakPolarHBondContact O-CG1 3.33Å
61	C	38.4	Very low	35.8	Very low	71 Å²	71	114.3 Å²	114.3	48%	0.48	61%	0.611	S	S	.	*	H	α-helix	trans	-79.9	-34	-176.2	-72.3	0	0	0	0	113.7	I57 E58 N63 I64	I57-C61 PolarHBondContact O-N 3.35Å; E58-C61 PolarHBondContact O-N 3.3Å; C61-N63 PolarHBondContact O-N 2.7Å; C61-I64 PolarHBondContact O-N 2.96Å; C61-I64 VanDerWaalsContact O-N 3.15Å
62	S	38	Very low	35.9	Very low	93 Å²	93	113.2 Å²	113.2	65%	0.65	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-20.1	178.3	44.7	0	0	0	0	113.6	E58 V59	E58-S62 WeakPolarHBondContact O-CB 3.37Å; E58-S62 PolarHBondContact O-N 3.26Å; E58-S62 PolarHBondContact O-OG 2.97Å; V59-S62 PolarHBondContact O-OG 3.09Å
63	N	31.5	Very low	36.4	Very low	117 Å²	117	106.9 Å²	106.9	63%	0.626	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	4.7	176.7	-73.4	-48.4	0	0	0	114.4	V59 C61 S65	V59-N63 PolarHBondContact O-ND2 2.84Å; C61-N63 PolarHBondContact O-N 2.7Å; N63-S65 PolarHBondContact O-N 3.01Å
64	I	34.3	Very low	36.8	Very low	105 Å²	105	106.5 Å²	106.5	54%	0.538	59%	0.591	S	S	.	*			trans	-85.7	66.5	173.9	-50.4	176.1	0	0	0	108.6	L60 C61 I66	L60-I64 WeakPolarHBondContact O-CG1 3.33Å; C61-I64 PolarHBondContact O-N 2.96Å; C61-I64 VanDerWaalsContact O-N 3.15Å; I64-I66 HydrophobicContact CG2-CG1 4.16Å; I64-I66 PolarHBondContact O-N 3.12Å
65	S	32.3	Very low	37.1	Very low	87 Å²	87	104.8 Å²	104.8	61%	0.608	58%	0.584	S	S	*	*			trans	-72.9	115.8	153.6	62	0	0	0	0	106.6	N63 T67	N63-S65 PolarHBondContact O-N 3.01Å; S65-T67 PolarHBondContact O-N 3.35Å
66	I	34.6	Very low	37.4	Very low	162 Å²	162	99.5 Å²	99.5	83%	0.831	57%	0.565	S	S	*	*			trans	-72.4	76.5	-178.3	-55.4	170.2	0	0	0	107.8	I64	I64-I66 HydrophobicContact CG2-CG1 4.16Å; I64-I66 PolarHBondContact O-N 3.12Å
67	T	33	Very low	37.7	Very low	101 Å²	101	96.7 Å²	96.7	62%	0.62	55%	0.546	S	S	*	.	S	Bend	trans	-137.3	99	167.5	55	0	0	0	0	108.2	S65 Q69	S65-T67 PolarHBondContact O-N 3.35Å; T67-Q69 PolarHBondContact O-N 2.71Å
68	N	39.4	Very low	37.8	Very low	170 Å²	170	95.2 Å²	95.2	91%	0.909	54%	0.538	S	S	*	.			trans	55.4	37.9	160.8	-63.8	-11	0	0	0	118.2
69	Q	36.3	Very low	38.2	Very low	152 Å²	152	96.2 Å²	96.2	71%	0.71	54%	0.543	S	S	*	.			trans	-85.3	134	160.6	-76.1	-172.8	-5.9	0	0	110.5	T67	T67-Q69 PolarHBondContact O-N 2.71Å
70	S	43	Very low	38.3	Very low	68 Å²	68	100.2 Å²	100.2	48%	0.476	55%	0.552	S	S	.	*			trans	-63.4	147	-167.7	70.3	0	0	0	0	113	S72 D73	S70-S72 PolarHBondContact O-N 3.41Å; S70-D73 PolarHBondContact O-N 2.8Å
71	E	38	Very low	38.3	Very low	161 Å²	161	99.1 Å²	99.1	75%	0.752	55%	0.546	S	S	*	.	H	α-helix	trans	-47.3	-27.6	176.5	-65.2	173.4	150.4	0	0	113.7	D73 L74 A75	E71-D73 PolarHBondContact O-N 2.98Å; E71-L74 PolarHBondContact O-N 2.85Å; E71-A75 PolarHBondContact O-N 3.36Å
72	S	38.5	Very low	38.3	Very low	79 Å²	79	101.2 Å²	101.2	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-56.8	-40	174.7	153.8	0	0	0	0	114	S70 A75 S76	S70-S72 PolarHBondContact O-N 3.41Å; S72-A75 PolarHBondContact O-N 2.95Å; S72-S76 PolarHBondContact O-N 2.69Å
73	D	44.6	Very low	37.9	Very low	69 Å²	69	101.5 Å²	101.5	37%	0.369	55%	0.547	S	S	.	.	H	α-helix	trans	-74.9	-31.8	-174.1	-68.5	-35.8	0	0	0	111.6	S70 E71 S76 I77	S70-D73 PolarHBondContact O-N 2.8Å; E71-D73 PolarHBondContact O-N 2.98Å; D73-S76 PolarHBondContact O-N 3.18Å; D73-I77 WeakPolarHBondContact O-CB 3.25Å; D73-I77 WeakPolarHBondContact O-CD1 3.19Å; D73-I77 VanDerWaalsContact O-CG1 3.23Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.37Å
74	L	43.8	Very low	38	Very low	77 Å²	77	101.6 Å²	101.6	40%	0.403	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-43.1	175	-155.5	83.2	0	0	0	110.9	E71 I77 L78	E71-L74 PolarHBondContact O-N 2.85Å; L74-I77 PolarHBondContact O-N 3.24Å; L74-L78 WeakPolarHBondContact O-CG 3.48Å; L74-L78 PolarHBondContact O-N 3.02Å
75	A	39.9	Very low	38	Very low	38 Å²	38	100.6 Å²	100.6	31%	0.314	55%	0.549	S	S	.	.	H	α-helix	trans	-63.4	-40.1	176.9	0	0	0	0	0	112.4	E71 S72 L78 H79	E71-A75 PolarHBondContact O-N 3.36Å; S72-A75 PolarHBondContact O-N 2.95Å; A75-L78 PolarHBondContact O-N 3.38Å; A75-H79 PolarHBondContact O-N 3.22Å
76	S	39.4	Very low	38.1	Very low	59 Å²	59	100.3 Å²	100.3	41%	0.413	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-40.7	176.2	178.5	0	0	0	0	112.9	S72 D73 H79 K80	S72-S76 PolarHBondContact O-N 2.69Å; D73-S76 PolarHBondContact O-N 3.18Å; S76-H79 WeakPolarHBondContact O-CB 3.25Å; S76-H79 PolarHBondContact O-N 3.05Å; S76-H79 VanDerWaalsContact O-N 3.11Å; S76-K80 PolarHBondContact O-N 3.24Å
77	I	43	Very low	38.2	Very low	53 Å²	53	102.2 Å²	102.2	27%	0.272	55%	0.549	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.2	-69.8	165.5	0	0	0	110.5	D73 L74 H79 K80 I81	D73-I77 WeakPolarHBondContact O-CB 3.25Å; D73-I77 WeakPolarHBondContact O-CD1 3.19Å; D73-I77 VanDerWaalsContact O-CG1 3.23Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.37Å; L74-I77 PolarHBondContact O-N 3.24Å; I77-H79 PolarHBondContact O-N 3.3Å; I77-K80 PolarHBondContact O-N 2.96Å; I77-I81 HydrophobicContact CG2-CD1 3.85Å; I77-I81 WeakPolarHBondContact O-CD1 3.5Å; I77-I81 WeakPolarHBondContact O-CG1 3.35Å
78	L	41.4	Very low	38.3	Very low	29 Å²	29	102.1 Å²	102.1	15%	0.152	55%	0.548	C	S	.	.	H	α-helix	trans	-60.9	-32.4	173.3	-69.9	167.9	0	0	0	111.7	L74 A75 K80 F409	L74-L78 WeakPolarHBondContact O-CG 3.48Å; L74-L78 PolarHBondContact O-N 3.02Å; A75-L78 PolarHBondContact O-N 3.38Å; L78-K80 VanDerWaalsContact C-N 3.34Å; L78-K80 PolarHBondContact O-N 3.19Å; L78-F409 HydrophobicContact CD1-CB 4.19Å
79	H	39.8	Very low	38.4	Very low	136 Å²	136	96 Å²	96	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-74.7	-16.6	-179.9	-138.3	-65.2	0	0	0	115.1	A75 S76 I77 Y82	A75-H79 PolarHBondContact O-N 3.22Å; S76-H79 WeakPolarHBondContact O-CB 3.25Å; S76-H79 PolarHBondContact O-N 3.05Å; S76-H79 VanDerWaalsContact O-N 3.11Å; I77-H79 PolarHBondContact O-N 3.3Å; H79-Y82 HydrophobicContact CB-CE2 4.15Å; H79-Y82 AromaticContact CE1-CE2 3.93Å; H79-Y82 AromaticContact CG-CE2 3.75Å; H79-Y82 AromaticContact ND1-CE2 3.54Å; H79-Y82 WeakPolarHBondContact O-CD2 3.39Å; H79-Y82 WeakPolarHBondContact O-CE2 3.07Å
80	K	39.7	Very low	38.9	Very low	179 Å²	179	90.2 Å²	90.2	78%	0.778	49%	0.494	S	S	*	.	H	α-helix	trans	-99.6	-16.9	-178.4	-80.7	179	177.6	173.7	0	114.3	S76 I77 L78 Y82	S76-K80 PolarHBondContact O-N 3.24Å; I77-K80 PolarHBondContact O-N 2.96Å; L78-K80 VanDerWaalsContact C-N 3.34Å; L78-K80 PolarHBondContact O-N 3.19Å; K80-Y82 PolarHBondContact O-N 2.9Å
81	I	34.8	Very low	39.1	Very low	76 Å²	76	90 Å²	90	39%	0.39	49%	0.485	S	S	.	.			trans	-82.3	1.3	-176.7	-64.7	167.1	0	0	0	112.3	I77 S83	I77-I81 HydrophobicContact CG2-CD1 3.85Å; I77-I81 WeakPolarHBondContact O-CD1 3.5Å; I77-I81 WeakPolarHBondContact O-CG1 3.35Å; I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 3.15Å
82	Y	39.3	Very low	39.8	Very low	114 Å²	114	90.2 Å²	90.2	45%	0.447	48%	0.484	S	S	.	.			trans	-67.8	74.7	177.7	-58.9	-57.3	0	0	0	113.4	H79 K80 S98	H79-Y82 HydrophobicContact CB-CE2 4.15Å; H79-Y82 AromaticContact CE1-CE2 3.93Å; H79-Y82 AromaticContact CG-CE2 3.75Å; H79-Y82 AromaticContact ND1-CE2 3.54Å; H79-Y82 WeakPolarHBondContact O-CD2 3.39Å; H79-Y82 WeakPolarHBondContact O-CE2 3.07Å; K80-Y82 PolarHBondContact O-N 2.9Å; Y82-S98 VanDerWaalsContact CE1-OG 3.23Å; Y82-S98 WeakPolarHBondContact CE1-OG 3.39Å
83	S	29.9	Very low	40.6	Very low	100 Å²	100	91.8 Å²	91.8	70%	0.699	48%	0.478	S	S	*	.			trans	-103.9	146.9	165.1	-160	0	0	0	0	109.7	I81 I85	I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 3.15Å; S83-I85 PolarHBondContact O-N 3.3Å
84	P	33.5	Very low	41.2	Very low	118 Å²	118	89.5 Å²	89.5	77%	0.766	47%	0.467	S	S	*	.			trans	-58.2	140.2	179.6	-17.8	29.8	0	0	0	110.7	S86	P84-S86 PolarHBondContact O-N 3.28Å
85	I	34.3	Very low	42.2	Very low	84 Å²	84	86.2 Å²	86.2	43%	0.431	45%	0.45	S	S	.	.			trans	-42.6	115.7	169.2	-66.8	168.3	0	0	0	108.1	S83 K87	S83-I85 PolarHBondContact O-N 3.3Å; I85-K87 PolarHBondContact O-N 2.96Å
86	S	33.1	Very low	43.2	Very low	82 Å²	82	86 Å²	86	57%	0.573	44%	0.441	S	S	*	.			trans	-56.9	128	163.4	61	0	0	0	0	105.9	P84 T88	P84-S86 PolarHBondContact O-N 3.28Å; S86-T88 PolarHBondContact O-N 3.27Å; S86-T88 PolarHBondContact O-OG1 2.92Å; S86-T88 PolarHBondContact OG-OG1 2.89Å
87	K	38.3	Very low	43.9	Very low	202 Å²	202	88.2 Å²	88.2	88%	0.878	44%	0.444	S	S	*	.	S	Bend	trans	-64.8	38.8	-175.5	-62.9	176	175.7	179.6	0	113.5	I85	I85-K87 PolarHBondContact O-N 2.96Å
88	T	35	Very low	44.4	Very low	98 Å²	98	86.6 Å²	86.6	60%	0.601	44%	0.437	S	S	*	.			trans	-104.1	122.2	-177.3	45.9	0	0	0	0	108.5	S86	S86-T88 PolarHBondContact O-N 3.27Å; S86-T88 PolarHBondContact O-OG1 2.92Å; S86-T88 PolarHBondContact OG-OG1 2.89Å
89	S	41.4	Very low	45.3	Very low	42 Å²	42	86.4 Å²	86.4	29%	0.294	44%	0.436	S	S	.	.			trans	18.2	122.6	172	61.1	0	0	0	0	117.9	H91	S89-H91 PolarHBondContact O-N 3.04Å; S89-H91 PolarHBondContact OG-CE1 3.15Å; S89-H91 PolarHBondContact OG-ND1 2.84Å; S89-H91 PolarHBondContact OG-NE2 2.93Å
90	V	45.6	Very low	46.7	Very low	30 Å²	30	84.7 Å²	84.7	18%	0.182	43%	0.428	C	S	.	.			trans	-62	81.3	171.9	-176.2	0	0	0	0	110.1	R96 L204 Y209 V344	V90-R96 VanDerWaalsContact CG1-NH2 3.28Å; V90-L204 HydrophobicContact CB-CD2 4.32Å; V90-L204 HydrophobicContact CG1-CD2 3.75Å; V90-L204 HydrophobicContact CG2-CD1 4.08Å; V90-L204 HydrophobicContact CG2-CD2 3.55Å; V90-Y209 HydrophobicContact CG1-CD1 4.04Å; V90-Y209 HydrophobicContact CG1-CE1 3.17Å; V90-V344 HydrophobicContact CG2-CG1 4.07Å
91	H	48.7	Very low	48.6	Very low	63 Å²	63	77.7 Å²	77.7	29%	0.292	40%	0.398	S	S	.	.			trans	-74.3	159.1	176.1	-76	-16.7	0	0	0	111.8	S89 Y93 R96	S89-H91 PolarHBondContact O-N 3.04Å; S89-H91 PolarHBondContact OG-CE1 3.15Å; S89-H91 PolarHBondContact OG-ND1 2.84Å; S89-H91 PolarHBondContact OG-NE2 2.93Å; H91-Y93 HydrophobicContact CB-CD2 4.29Å; H91-Y93 HydrophobicContact CB-CE2 4.49Å; H91-Y93 PolarHBondContact O-N 3.14Å; H91-R96 PolarHBondContact O-NH2 1.99Å
92	K	52.4	Low	50.8	Low	166 Å²	166	78.1 Å²	78.1	72%	0.722	40%	0.402	S	S	*	.	S	Bend	trans	-47.9	-8.4	-172.9	-167.8	168.8	-173.6	156.5	0	118.2	P94 E216	K92-P94 WeakPolarHBondContact O-CD 3.38Å; K92-E216 IonicContact NZ-OE2 3.96Å
93	Y	55.5	Low	52.9	Low	112 Å²	112	76.1 Å²	76.1	44%	0.439	39%	0.393	S	S	.	.			trans	-77	124.8	-175.7	-57	-70.5	0	0	0	110.7	H91 L95 E101	H91-Y93 HydrophobicContact CB-CD2 4.29Å; H91-Y93 HydrophobicContact CB-CE2 4.49Å; H91-Y93 PolarHBondContact O-N 3.14Å; Y93-L95 VanDerWaalsContact C-N 3.3Å; Y93-E101 WeakPolarHBondContact CD1-OE2 3.36Å
94	P	57.2	Low	55.5	Low	21 Å²	21	71.9 Å²	71.9	14%	0.136	36%	0.363	C	S	.	.	S	Bend	trans	-65.2	-35.1	173.1	26.1	-34.6	0	0	0	111.1	K92 E101 I208 Y209 A398	K92-P94 WeakPolarHBondContact O-CD 3.38Å; P94-E101 WeakPolarHBondContact CD-OE2 3.33Å; P94-I208 HydrophobicContact CB-CG2 4.04Å; P94-I208 CarbonylContact O-C 3.44Å; P94-I208 WeakPolarHBondContact O-CA 3.49Å; P94-Y209 PolarHBondContact O-N 3.49Å; P94-A398 HydrophobicContact CB-CB 4.11Å; P94-A398 HydrophobicContact CG-CB 4.02Å
95	L	64.2	Low	58.1	Low	9 Å²	9	68.6 Å²	68.6	5%	0.047	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-80.5	135.8	-179.9	-70.1	163.3	0	0	0	112.1	Y93 L99 E101 L104 I208 A398 L401 L402	Y93-L95 VanDerWaalsContact C-N 3.3Å; L95-L99 HydrophobicContact CB-CB 4.42Å; L95-L99 WeakPolarHBondContact CB-O 3.47Å; L95-L99 HydrophobicContact CD2-CB 4.35Å; L95-L99 HydrophobicContact CD2-CD1 4.33Å; L95-E101 HydrophobicContact CD1-CB 3.87Å; L95-E101 HydrophobicContact CD1-CG 4.08Å; L95-L104 HydrophobicContact CD1-CD1 3.65Å; L95-I208 HydrophobicContact CD2-CG1 3.9Å; L95-A398 HydrophobicContact CD1-CB 4.31Å; L95-A398 HydrophobicContact CD2-CB 3.93Å; L95-A398 HydrophobicContact CG-CB 3.8Å; L95-L401 HydrophobicContact CD1-CD2 4.42Å; L95-L402 HydrophobicContact CD2-CD1 3.88Å; L95-L402 HydrophobicContact CD2-CG 4.28Å
96	R	60.9	Low	60.6	Low	34 Å²	34	72 Å²	72	13%	0.128	35%	0.348	C	S	.	.			trans	-119	166.3	175.1	-61.3	-70.9	-177.2	-154.8	-10	110.8	V90 H91 L204 S206 T207 Y209	V90-R96 VanDerWaalsContact CG1-NH2 3.28Å; H91-R96 PolarHBondContact O-NH2 1.99Å; R96-L204 WeakPolarHBondContact CG-O 3.41Å; R96-S206 WeakPolarHBondContact CB-O 3.17Å; R96-T207 PolarHBondContact N-O 3.25Å; R96-Y209 VanDerWaalsContact NH2-CD1 3.3Å
97	F	55	Low	63.1	Low	104 Å²	104	69.6 Å²	69.6	46%	0.456	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-156.8	-173.6	-50.9	-83.3	0	0	0	113.7	L99 D205	F97-L99 PolarHBondContact O-N 3.27Å; F97-D205 VanDerWaalsContact CE2-C 3.42Å; F97-D205 HydrophobicContact CE2-CB 4.48Å; F97-D205 WeakPolarHBondContact CE2-O 3.43Å; F97-D205 VanDerWaalsContact CZ-CA 3.47Å; F97-D205 HydrophobicContact CZ-CB 3.71Å; F97-D205 WeakPolarHBondContact CZ-O 3.23Å
98	S	51.8	Low	65.5	Low	19 Å²	19	60.4 Å²	60.4	13%	0.133	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.7	-178.5	53.7	0	0	0	0	114.9	Y82 E100	Y82-S98 VanDerWaalsContact CE1-OG 3.23Å; Y82-S98 WeakPolarHBondContact CE1-OG 3.39Å; S98-E100 PolarHBondContact O-N 2.91Å; S98-E100 VanDerWaalsContact O-N 3.15Å
99	L	61	Low	68.1	Low	26 Å²	26	59.8 Å²	59.8	14%	0.136	28%	0.282	C	S	.	.			trans	-82.7	79.8	172.5	-61.2	172.6	0	0	0	109.3	L95 F97 E101 L104 T207 L402	L95-L99 HydrophobicContact CB-CB 4.42Å; L95-L99 WeakPolarHBondContact CB-O 3.47Å; L95-L99 HydrophobicContact CD2-CB 4.35Å; L95-L99 HydrophobicContact CD2-CD1 4.33Å; F97-L99 PolarHBondContact O-N 3.27Å; L99-E101 PolarHBondContact O-N 3.24Å; L99-L104 HydrophobicContact CB-CD1 4.2Å; L99-L104 HydrophobicContact CD2-CD1 4.16Å; L99-L104 HydrophobicContact CD2-CD2 4.43Å; L99-T207 HydrophobicContact CD1-CG2 3.47Å; L99-T207 VanDerWaalsContact CD1-CG2 3.47Å; L99-L402 HydrophobicContact CD1-CD2 4.17Å; L99-L402 HydrophobicContact CD2-CD2 4.42Å
100	E	70.1	Confident	70.3	Confident	99 Å²	99	61.5 Å²	61.5	46%	0.463	29%	0.294	S	S	.	.			trans	-69.4	119.2	167.7	-67.1	179.7	-175.5	0	0	109.1	S98 N102 R103 L104	S98-E100 PolarHBondContact O-N 2.91Å; S98-E100 VanDerWaalsContact O-N 3.15Å; E100-N102 VanDerWaalsContact C-N 3.25Å; E100-N102 PolarHBondContact O-N 3.47Å; E100-R103 HydrophobicContact CB-CB 4.11Å; E100-R103 HydrophobicContact CB-CG 3.91Å; E100-R103 WeakPolarHBondContact O-CB 3.32Å; E100-R103 PolarHBondContact O-N 2.91Å; E100-R103 WeakPolarHBondContact OE2-CD 3.38Å; E100-R103 WeakPolarHBondContact OE2-CG 3.26Å; E100-L104 PolarHBondContact O-N 2.96Å; E100-L104 VanDerWaalsContact O-N 3.12Å
101	E	78.8	Confident	72.1	Confident	32 Å²	32	62.5 Å²	62.5	15%	0.15	30%	0.298	C	S	.	.	H	α-helix	trans	-50.5	-47	178.7	-171.9	163.7	-157.3	0	0	111.5	Y93 P94 L95 L99 R103 L104 E105 L401	Y93-E101 WeakPolarHBondContact CD1-OE2 3.36Å; P94-E101 WeakPolarHBondContact CD-OE2 3.33Å; L95-E101 HydrophobicContact CD1-CB 3.87Å; L95-E101 HydrophobicContact CD1-CG 4.08Å; L99-E101 PolarHBondContact O-N 3.24Å; E101-R103 VanDerWaalsContact C-N 3.27Å; E101-R103 PolarHBondContact O-N 3.22Å; E101-L104 PolarHBondContact O-N 3.1Å; E101-L104 VanDerWaalsContact O-N 3.1Å; E101-E105 WeakPolarHBondContact O-CG 3.07Å; E101-E105 PolarHBondContact O-N 3.36Å; E101-L401 HydrophobicContact CG-CD2 4.4Å
102	N	81.1	Confident	72.8	Confident	86 Å²	86	67.4 Å²	67.4	46%	0.46	33%	0.327	S	S	.	.	H	α-helix	trans	-57.3	-34	176.5	-66.5	-16.5	0	0	0	113.9	E100 K106	E100-N102 VanDerWaalsContact C-N 3.25Å; E100-N102 PolarHBondContact O-N 3.47Å; N102-K106 VanDerWaalsContact O-CG 3.31Å; N102-K106 WeakPolarHBondContact O-CG 2.83Å; N102-K106 PolarHBondContact O-N 2.84Å; N102-K106 VanDerWaalsContact O-N 3.16Å
103	R	82.5	Confident	73.1	Confident	72 Å²	72	66.2 Å²	66.2	27%	0.272	33%	0.325	S	S	.	.	H	α-helix	trans	-75.2	-40.1	178.2	-71.7	-180	64.1	-176.3	-0.6	111	E100 E101 E105 K106 L107	E100-R103 HydrophobicContact CB-CB 4.11Å; E100-R103 HydrophobicContact CB-CG 3.91Å; E100-R103 WeakPolarHBondContact O-CB 3.32Å; E100-R103 PolarHBondContact O-N 2.91Å; E100-R103 WeakPolarHBondContact OE2-CD 3.38Å; E100-R103 WeakPolarHBondContact OE2-CG 3.26Å; E101-R103 VanDerWaalsContact C-N 3.27Å; E101-R103 PolarHBondContact O-N 3.22Å; R103-E105 VanDerWaalsContact C-N 3.34Å; R103-K106 PolarHBondContact O-N 3.14Å; R103-L107 WeakPolarHBondContact O-CB 3.39Å; R103-L107 PolarHBondContact O-N 3.41Å
104	L	84.7	Confident	73.3	Confident	11 Å²	11	68.2 Å²	68.2	6%	0.058	34%	0.344	C	S	.	.	H	α-helix	trans	-67.6	-36.2	175.7	-69.1	177.8	0	0	0	111.6	L95 L99 E100 E101 L107 Y108 L401 L402 F409	L95-L104 HydrophobicContact CD1-CD1 3.65Å; L99-L104 HydrophobicContact CB-CD1 4.2Å; L99-L104 HydrophobicContact CD2-CD1 4.16Å; L99-L104 HydrophobicContact CD2-CD2 4.43Å; E100-L104 PolarHBondContact O-N 2.96Å; E100-L104 VanDerWaalsContact O-N 3.12Å; E101-L104 PolarHBondContact O-N 3.1Å; E101-L104 VanDerWaalsContact O-N 3.1Å; L104-L107 HydrophobicContact CD2-CD2 4.44Å; L104-L107 PolarHBondContact O-N 3.4Å; L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.24Å; L104-Y108 PolarHBondContact O-N 3.33Å; L104-L401 HydrophobicContact CB-CD1 4.44Å; L104-L401 HydrophobicContact CB-CD2 3.53Å; L104-L401 HydrophobicContact CB-CG 3.85Å; L104-L401 HydrophobicContact CD1-CD2 4.4Å; L104-L402 HydrophobicContact CD1-CD2 3.72Å; L104-L402 HydrophobicContact CD1-CG 4.46Å; L104-F409 HydrophobicContact CD2-CE1 4.24Å
105	E	88	Confident	74	Confident	48 Å²	48	69.7 Å²	69.7	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-48.2	172.6	-72.8	-179.6	162.4	0	0	111.4	E101 R103 L107 Y108 D109 H138 L401	E101-E105 WeakPolarHBondContact O-CG 3.07Å; E101-E105 PolarHBondContact O-N 3.36Å; R103-E105 VanDerWaalsContact C-N 3.34Å; E105-L107 VanDerWaalsContact C-N 3.31Å; E105-L107 PolarHBondContact O-N 3.06Å; E105-Y108 WeakPolarHBondContact O-CB 3.44Å; E105-Y108 PolarHBondContact O-N 2.94Å; E105-D109 PolarHBondContact O-N 2.86Å; E105-H138 HydrophobicContact CG-CB 4.29Å; E105-H138 IonicContact OE1-CG 3.65Å; E105-L401 HydrophobicContact CG-CD1 4.43Å; E105-L401 HydrophobicContact CG-CD2 3.94Å
106	K	87.5	Confident	75.3	Confident	155 Å²	155	73.6 Å²	73.6	67%	0.674	37%	0.372	S	S	*	.	H	α-helix	trans	-59.5	-42.2	174.4	-72.5	175.6	-175.2	-179.1	0	112.3	N102 R103 D109 S110	N102-K106 VanDerWaalsContact O-CG 3.31Å; N102-K106 WeakPolarHBondContact O-CG 2.83Å; N102-K106 PolarHBondContact O-N 2.84Å; N102-K106 VanDerWaalsContact O-N 3.16Å; R103-K106 PolarHBondContact O-N 3.14Å; K106-D109 PolarHBondContact O-N 3.45Å; K106-S110 WeakPolarHBondContact O-CB 3.18Å; K106-S110 PolarHBondContact O-N 3.39Å; K106-S110 PolarHBondContact O-OG 2.88Å
107	L	86.3	Confident	76.9	Confident	32 Å²	32	76 Å²	76	17%	0.168	39%	0.39	C	S	.	.	H	α-helix	trans	-61.2	-49.1	175.3	177	58.9	0	0	0	110.4	R103 L104 E105 D109 S110 L111 T405 A408	R103-L107 WeakPolarHBondContact O-CB 3.39Å; R103-L107 PolarHBondContact O-N 3.41Å; L104-L107 HydrophobicContact CD2-CD2 4.44Å; L104-L107 PolarHBondContact O-N 3.4Å; E105-L107 VanDerWaalsContact C-N 3.31Å; E105-L107 PolarHBondContact O-N 3.06Å; L107-D109 VanDerWaalsContact C-N 3.26Å; L107-D109 PolarHBondContact O-N 2.9Å; L107-S110 WeakPolarHBondContact CA-OG 2.99Å; L107-S110 PolarHBondContact O-N 3.18Å; L107-S110 PolarHBondContact O-OG 2.89Å; L107-L111 HydrophobicContact CD1-CD2 4.48Å; L107-L111 HydrophobicContact CD1-CG 4.28Å; L107-L111 HydrophobicContact CG-CD1 4.34Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 3.41Å; L107-T405 HydrophobicContact CB-CG2 4.38Å; L107-T405 HydrophobicContact CD2-CG2 4.13Å; L107-T405 HydrophobicContact CG-CG2 4.09Å; L107-A408 HydrophobicContact CD1-CB 4.22Å; L107-A408 HydrophobicContact CD2-CB 4.11Å
108	Y	88	Confident	78.9	Confident	9 Å²	9	72 Å²	72	4%	0.035	37%	0.373	C	S	.	.	H	α-helix	trans	-57	-37.4	176.6	174.1	-106.4	0	0	0	113.4	L104 E105 K115 H138 A139 L401 H404	L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.24Å; L104-Y108 PolarHBondContact O-N 3.33Å; E105-Y108 WeakPolarHBondContact O-CB 3.44Å; E105-Y108 PolarHBondContact O-N 2.94Å; Y108-K115 HydrophobicContact CE1-CD 4.22Å; Y108-K115 HydrophobicContact CE2-CD 3.91Å; Y108-K115 HydrophobicContact CE2-CG 4.31Å; Y108-K115 WeakPolarHBondContact O-CE 2.86Å; Y108-K115 PolarHBondContact O-NZ 2.74Å; Y108-K115 VanDerWaalsContact O-NZ 3.09Å; Y108-K115 WeakPolarHBondContact OH-CD 3.37Å; Y108-H138 AromaticContact CD1-CD2 3.71Å; Y108-A139 HydrophobicContact CD1-CB 4.21Å; Y108-A139 HydrophobicContact CD2-CB 4.11Å; Y108-A139 HydrophobicContact CE1-CB 3.83Å; Y108-A139 HydrophobicContact CE2-CB 3.76Å; Y108-A139 HydrophobicContact CG-CB 4.31Å; Y108-L401 HydrophobicContact CD1-CD1 4.44Å; Y108-L401 HydrophobicContact CD2-CD1 4.45Å; Y108-L401 HydrophobicContact CG-CD1 3.93Å; Y108-H404 HydrophobicContact CD2-CB 3.57Å; Y108-H404 HydrophobicContact CE2-CB 3.65Å; Y108-H404 AromaticContact CE2-CD2 3.97Å; Y108-H404 AromaticContact CE2-CG 3.56Å; Y108-H404 AromaticContact CE2-ND1 3.88Å
109	D	89.2	Confident	81.1	Confident	85 Å²	85	72.7 Å²	72.7	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-74.2	-33.2	175.7	-66.6	-24.7	0	0	0	112.3	E105 K106 L107 K115 H138	E105-D109 PolarHBondContact O-N 2.86Å; K106-D109 PolarHBondContact O-N 3.45Å; L107-D109 VanDerWaalsContact C-N 3.26Å; L107-D109 PolarHBondContact O-N 2.9Å; D109-K115 IonicContact OD1-NZ 2.88Å; D109-H138 VanDerWaalsContact CG-NE2 3.34Å; D109-H138 IonicContact OD1-CD2 3.73Å; D109-H138 IonicContact OD1-CE1 2.97Å; D109-H138 IonicContact OD1-NE2 2.68Å; D109-H138 PolarHBondContact OD1-NE2 3.2Å; D109-H138 VanDerWaalsContact OD1-NE2 3.08Å; D109-H138 IonicContact OD2-CE1 3.83Å; D109-H138 PolarHBondContact OD2-CE1 2.64Å; D109-H138 IonicContact OD2-NE2 3.58Å; D109-H138 PolarHBondContact OD2-NE2 2.89Å
110	S	87.3	Confident	82.8	Confident	79 Å²	79	71.5 Å²	71.5	55%	0.552	37%	0.37	S	S	*	.	H	α-helix	trans	-75.3	-25.8	177.2	76.5	0	0	0	0	113.9	K106 L107 N112	K106-S110 WeakPolarHBondContact O-CB 3.18Å; K106-S110 PolarHBondContact O-N 3.39Å; K106-S110 PolarHBondContact O-OG 2.88Å; L107-S110 WeakPolarHBondContact CA-OG 2.99Å; L107-S110 PolarHBondContact O-N 3.18Å; L107-S110 PolarHBondContact O-OG 2.89Å; S110-N112 VanDerWaalsContact C-N 3.27Å; S110-N112 PolarHBondContact O-N 3.09Å
111	L	84.5	Confident	84.1	Confident	50 Å²	50	66.8 Å²	66.8	26%	0.262	35%	0.348	S	S	.	.			trans	-67.4	90	173.2	-69.6	172.1	0	0	0	108.2	L107 M113 H404 T405 A408	L107-L111 HydrophobicContact CD1-CD2 4.48Å; L107-L111 HydrophobicContact CD1-CG 4.28Å; L107-L111 HydrophobicContact CG-CD1 4.34Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 3.41Å; L111-M113 PolarHBondContact O-N 3.41Å; L111-H404 WeakPolarHBondContact CD1-O 3.34Å; L111-T405 HydrophobicContact CD1-CG2 4.32Å; L111-A408 HydrophobicContact CD2-CB 4.49Å
112	N	63.7	Low	85	Confident	166 Å²	166	66.5 Å²	66.5	89%	0.888	35%	0.347	S	S	*	.			trans	-68.9	21	-179.2	-148.1	24.4	0	0	0	113.1	S110	S110-N112 VanDerWaalsContact C-N 3.27Å; S110-N112 PolarHBondContact O-N 3.09Å
113	M	58.6	Low	85.7	Confident	141 Å²	141	64 Å²	64	70%	0.695	33%	0.332	S	S	*	.	S	Bend	trans	-71.5	148.8	179.7	-62.1	-129.8	82.1	0	0	109.7	L111 K115	L111-M113 PolarHBondContact O-N 3.41Å; M113-K115 PolarHBondContact O-N 3.31Å
114	N	59.8	Low	86.2	Confident	154 Å²	154	61.1 Å²	61.1	82%	0.824	33%	0.325	S	S	*	.			trans	-56	93.8	156	-95.1	-18.4	0	0	0	106.4	T116	N114-T116 PolarHBondContact O-N 2.97Å
115	K	71.9	Confident	86.5	Confident	52 Å²	52	66.7 Å²	66.7	23%	0.226	35%	0.35	C	S	.	.			trans	-57	92.5	179.9	-66.5	168.6	170.2	-170.8	0	106.3	Y108 D109 M113 K141	Y108-K115 HydrophobicContact CE1-CD 4.22Å; Y108-K115 HydrophobicContact CE2-CD 3.91Å; Y108-K115 HydrophobicContact CE2-CG 4.31Å; Y108-K115 WeakPolarHBondContact O-CE 2.86Å; Y108-K115 PolarHBondContact O-NZ 2.74Å; Y108-K115 VanDerWaalsContact O-NZ 3.09Å; Y108-K115 WeakPolarHBondContact OH-CD 3.37Å; D109-K115 IonicContact OD1-NZ 2.88Å; M113-K115 PolarHBondContact O-N 3.31Å; K115-K141 HydrophobicContact CB-CD 3.7Å; K115-K141 WeakPolarHBondContact O-CD 3.46Å; K115-K141 WeakPolarHBondContact O-CE 3.08Å; K115-K141 PolarHBondContact O-NZ 3.47Å
116	T	90.7	Very high	86.6	Confident	92 Å²	92	70.1 Å²	70.1	56%	0.564	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-71.9	154.4	176.9	47.2	0	0	0	0	107.6	N114 K118 H404	N114-T116 PolarHBondContact O-N 2.97Å; T116-K118 PolarHBondContact O-N 2.96Å; T116-H404 PolarHBondContact O-CE1 3.08Å
117	V	95.2	Very high	86.5	Confident	83 Å²	83	67.6 Å²	67.6	50%	0.503	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-69.5	119.4	177.3	179.2	0	0	0	0	108.3	K141 A143	V117-K141 WeakPolarHBondContact CA-O 3.13Å; V117-A143 HydrophobicContact CG1-CB 3.84Å
118	K	95.9	Very high	86.5	Confident	22 Å²	22	67.6 Å²	67.6	10%	0.096	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	123.9	173.3	-69	-69.1	-178.2	177.9	0	109.7	T116 K141 C142 A143 D155 A403 H404	T116-K118 PolarHBondContact O-N 2.96Å; K118-K141 PolarHBondContact N-O 3.1Å; K118-C142 CarbonylContact O-C 3.59Å; K118-C142 VanDerWaalsContact O-CA 3.22Å; K118-C142 WeakPolarHBondContact O-CA 3.41Å; K118-A143 PolarHBondContact O-N 2.99Å; K118-D155 WeakPolarHBondContact CA-OD2 3.37Å; K118-D155 HydrophobicContact CB-CB 4.48Å; K118-D155 HydrophobicContact CD-CB 3.87Å; K118-D155 WeakPolarHBondContact CD-OD1 3.43Å; K118-D155 IonicContact NZ-OD1 3.17Å; K118-D155 PolarHBondContact NZ-OD1 2.88Å; K118-A403 HydrophobicContact CB-CB 4.25Å; K118-A403 WeakPolarHBondContact CE-O 2.91Å; K118-A403 HydrophobicContact CG-CB 4.3Å; K118-H404 WeakPolarHBondContact CG-NE2 3.04Å
119	T	97.8	Very high	86.3	Confident	33 Å²	33	74.1 Å²	74.1	20%	0.202	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.2	-177.2	-56.5	0	0	0	0	110	I145 A154 D155 A156	T119-I145 HydrophobicContact CG2-CD1 3.79Å; T119-I145 HydrophobicContact CG2-CG1 3.85Å; T119-I145 HydrophobicContact CG2-CG2 4.19Å; T119-A154 CarbonylContact O-C 3.53Å; T119-D155 PolarHBondContact N-OD2 3.08Å; T119-D155 PolarHBondContact O-N 2.88Å; T119-A156 PolarHBondContact O-N 3.02Å; T119-A156 VanDerWaalsContact O-N 3.12Å
120	F	98	Very high	86.1	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	144.7	166.4	-74.2	-96.4	0	0	0	110	F134 C142 A143 V144 I145 A156 I158 F176 M399 A403	F120-F134 HydrophobicContact CD2-CZ 4.2Å; F120-F134 HydrophobicContact CE2-CZ 4.49Å; F120-C142 HydrophobicContact CD2-CB 4.08Å; F120-C142 HydrophobicContact CE2-CB 3.92Å; F120-A143 PolarHBondContact N-O 3.08Å; F120-V144 HydrophobicContact CB-CG2 3.7Å; F120-V144 CarbonylContact O-C 3.58Å; F120-V144 VanDerWaalsContact O-CA 3.3Å; F120-V144 WeakPolarHBondContact O-CA 3.43Å; F120-I145 WeakPolarHBondContact O-CG1 3.39Å; F120-I145 PolarHBondContact O-N 3.11Å; F120-A156 CarbonylContact C-O 3.42Å; F120-A156 VanDerWaalsContact CA-O 3.25Å; F120-A156 WeakPolarHBondContact CA-O 3.33Å; F120-A156 HydrophobicContact CD1-CB 3.52Å; F120-A156 HydrophobicContact CE1-CB 3.55Å; F120-A156 HydrophobicContact CG-CB 4.15Å; F120-A156 HydrophobicContact CZ-CB 4.19Å; F120-I158 HydrophobicContact CB-CD1 4Å; F120-I158 HydrophobicContact CB-CG1 4.34Å; F120-I158 HydrophobicContact CD1-CD1 4.09Å; F120-I158 HydrophobicContact CD1-CG1 3.85Å; F120-I158 HydrophobicContact CG-CD1 4.4Å; F120-F176 AromaticContact CE1-CD2 3.91Å; F120-F176 HydrophobicContact CE1-CD2 3.91Å; F120-F176 AromaticContact CE1-CE2 3.67Å; F120-F176 HydrophobicContact CE1-CE2 3.67Å; F120-F176 HydrophobicContact CE1-CZ 4.09Å; F120-F176 HydrophobicContact CZ-CE2 4.28Å; F120-F176 HydrophobicContact CZ-CZ 4.4Å; F120-M399 HydrophobicContact CD1-CE 3.83Å; F120-M399 HydrophobicContact CE1-CB 4.02Å; F120-M399 HydrophobicContact CE1-CE 3.77Å; F120-M399 HydrophobicContact CZ-CB 3.9Å; F120-M399 WeakPolarHBondContact CZ-O 3.23Å; F120-A403 HydrophobicContact CE1-CB 4.5Å; F120-A403 HydrophobicContact CE2-CB 3.85Å; F120-A403 HydrophobicContact CZ-CB 3.52Å
121	L	97.5	Very high	85.9	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.8	170.8	-179.2	148	0	0	0	110	Y123 I145 D147 R150 W151 A154 A156 L157 I158	L121-Y123 HydrophobicContact CD2-CD2 3.66Å; L121-Y123 HydrophobicContact CD2-CG 4.2Å; L121-Y123 PolarHBondContact O-N 3.1Å; L121-I145 WeakPolarHBondContact CA-O 3.49Å; L121-I145 HydrophobicContact CB-CD1 4.35Å; L121-I145 HydrophobicContact CB-CG1 3.85Å; L121-I145 HydrophobicContact CD1-CD1 3.78Å; L121-I145 HydrophobicContact CD1-CG1 3.93Å; L121-I145 HydrophobicContact CG-CD1 4.44Å; L121-I145 HydrophobicContact CG-CG1 4.05Å; L121-D147 WeakPolarHBondContact CD1-O 3.25Å; L121-R150 VanDerWaalsContact CD1-C 3.45Å; L121-R150 HydrophobicContact CD1-CB 4.11Å; L121-W151 HydrophobicContact CD1-CB 4.3Å; L121-W151 HydrophobicContact CD2-CB 4.36Å; L121-A154 HydrophobicContact CB-CB 3.61Å; L121-A154 HydrophobicContact CD1-CB 4.49Å; L121-A156 PolarHBondContact N-O 3.11Å; L121-L157 HydrophobicContact CB-CD2 3.93Å; L121-L157 HydrophobicContact CD2-CD2 3.99Å; L121-L157 HydrophobicContact CG-CD2 4.48Å; L121-L157 CarbonylContact O-C 3.58Å; L121-L157 WeakPolarHBondContact O-CA 3.42Å; L121-I158 PolarHBondContact O-N 3.2Å
122	N	96.1	Very high	86.3	Confident	26 Å²	26	70.4 Å²	70.4	14%	0.139	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	110.8	169	-177.2	10.6	0	0	0	109.1	I128 I145 T146 T160	N122-I128 HydrophobicContact CB-CD1 4.36Å; N122-I145 PolarHBondContact N-O 3.42Å; N122-T146 HydrophobicContact CB-CG2 4.44Å; N122-T160 WeakPolarHBondContact OD1-CG2 3.4Å
123	Y	95.5	Very high	87.7	Confident	34 Å²	34	66.2 Å²	66.2	13%	0.133	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	92.1	-178.9	-161.7	-87.2	0	0	0	109.6	L121 M148 W151 I158 L159 T160 K163 V164 P165	L121-Y123 HydrophobicContact CD2-CD2 3.66Å; L121-Y123 HydrophobicContact CD2-CG 4.2Å; L121-Y123 PolarHBondContact O-N 3.1Å; Y123-M148 HydrophobicContact CD2-CB 4.02Å; Y123-M148 HydrophobicContact CD2-CG 3.95Å; Y123-M148 HydrophobicContact CD2-SD 4.31Å; Y123-M148 HydrophobicContact CE2-CB 3.86Å; Y123-M148 HydrophobicContact CE2-CG 4.18Å; Y123-M148 HydrophobicContact CE2-SD 4.33Å; Y123-M148 HydrophobicContact CG-SD 4.47Å; Y123-W151 HydrophobicContact CD2-CB 4.18Å; Y123-W151 HydrophobicContact CE2-CB 4.21Å; Y123-I158 PolarHBondContact N-O 3.46Å; Y123-L159 HydrophobicContact CD1-CD2 4.06Å; Y123-L159 HydrophobicContact CG-CD2 4.27Å; Y123-T160 PolarHBondContact O-N 3.5Å; Y123-K163 WeakPolarHBondContact CD1-O 3.42Å; Y123-K163 HydrophobicContact CE1-CB 4.22Å; Y123-V164 PolarHBondContact OH-O 3.49Å; Y123-P165 HydrophobicContact CD2-CG 4.01Å; Y123-P165 HydrophobicContact CE1-CG 4.2Å; Y123-P165 HydrophobicContact CE2-CB 4.15Å; Y123-P165 HydrophobicContact CE2-CG 3.61Å; Y123-P165 HydrophobicContact CG-CG 4.46Å; Y123-P165 VanDerWaalsContact OH-CA 3.23Å; Y123-P165 WeakPolarHBondContact OH-CA 3.39Å
124	G	92.9	Very high	89.4	Confident	12 Å²	12	59.9 Å²	59.9	12%	0.124	31%	0.312	C	S	.	.	S	Bend	trans	152.3	173.8	178.7	0	0	0	0	0	111.8	M148 T160 E161	G124-M148 PolarHBondContact N-SD 2.91Å; G124-T160 WeakPolarHBondContact CA-OG1 3.32Å; G124-E161 VanDerWaalsContact CA-OE1 3.25Å; G124-E161 WeakPolarHBondContact CA-OE1 3.4Å
125	H	91.6	Very high	91	Very high	127 Å²	127	56.4 Å²	56.4	59%	0.588	30%	0.3	S	S	*	.	S	Bend	trans	-100.6	-7.9	-174.7	-55.9	76.7	0	0	0	112.3	E161 K163	H125-E161 IonicContact CE1-OE1 2.94Å; H125-E161 IonicContact CG-OE1 3.37Å; H125-E161 PolarHBondContact N-OE1 2.95Å; H125-E161 IonicContact ND1-OE1 2.63Å; H125-E161 PolarHBondContact ND1-OE1 3.15Å; H125-K163 PolarHBondContact ND1-NZ 2.79Å
126	R	89.9	Confident	91.9	Very high	121 Å²	121	63 Å²	63	46%	0.457	33%	0.328	S	S	.	.	S	Bend	trans	-79.7	135.3	179.9	-66	-146.6	-179.1	-109.5	7.1	110.5	I128 I186	R126-I128 PolarHBondContact O-N 3.11Å; R126-I186 VanDerWaalsContact CD-CD1 3.43Å
127	T	85.6	Confident	92	Very high	102 Å²	102	59.1 Å²	59.1	63%	0.626	31%	0.305	S	S	*	.			trans	-69	127.3	176.6	-52.1	0	0	0	0	109.7	F129	T127-F129 HydrophobicContact CG2-CD1 4.29Å; T127-F129 HydrophobicContact CG2-CE1 4.25Å
128	I	87.6	Confident	91.7	Very high	31 Å²	31	59.3 Å²	59.3	16%	0.159	30%	0.3	C	S	.	.			trans	-86.1	114.1	166.3	-59	175.9	0	0	0	106.3	N122 R126 M132 I158 T160 L178	N122-I128 HydrophobicContact CB-CD1 4.36Å; R126-I128 PolarHBondContact O-N 3.11Å; I128-M132 HydrophobicContact CD1-CE 4.01Å; I128-M132 HydrophobicContact CG2-CE 3.54Å; I128-M132 HydrophobicContact CG2-CG 4.49Å; I128-I158 HydrophobicContact CD1-CD1 4.46Å; I128-I158 HydrophobicContact CD1-CG2 3.79Å; I128-T160 HydrophobicContact CD1-CG2 3.72Å; I128-T160 HydrophobicContact CG1-CG2 3.62Å; I128-L178 HydrophobicContact CD1-CD1 4.31Å; I128-L178 HydrophobicContact CG2-CD1 4.18Å
129	F	83.1	Confident	91.5	Very high	147 Å²	147	58.3 Å²	58.3	65%	0.645	30%	0.296	S	S	*	.			trans	-81	-24.8	-176.8	-63	-81.6	0	0	0	113.1	T127 P131 Y391	T127-F129 HydrophobicContact CG2-CD1 4.29Å; T127-F129 HydrophobicContact CG2-CE1 4.25Å; F129-P131 WeakPolarHBondContact O-CD 3.38Å; F129-Y391 HydrophobicContact CB-CE1 3.76Å; F129-Y391 WeakPolarHBondContact CB-OH 3.32Å
130	T	84.3	Confident	91.3	Very high	10 Å²	10	59.2 Å²	59.2	6%	0.061	30%	0.304	C	S	.	.	S	Bend	trans	-67.5	127.4	173	-53.1	0	0	0	0	109.6	M132 P395	T130-M132 PolarHBondContact O-N 2.92Å; T130-M132 VanDerWaalsContact O-N 3.15Å; T130-P395 HydrophobicContact CG2-CG 4.45Å
131	P	84.5	Confident	91.2	Very high	88 Å²	88	63.6 Å²	63.6	57%	0.571	32%	0.323	S	S	*	.			trans	-58.5	120	170.6	-21.3	33.1	0	0	0	109.8	F129 D133	F129-P131 WeakPolarHBondContact O-CD 3.38Å; P131-D133 PolarHBondContact O-N 2.92Å
132	M	92.2	Very high	91.2	Very high	38 Å²	38	64.2 Å²	64.2	19%	0.187	33%	0.327	C	S	.	.			trans	-77.3	51.7	173.4	-70.1	-73	173.5	0	0	111	I128 T130 F134 V144 I158 L178 Q396 M399	I128-M132 HydrophobicContact CD1-CE 4.01Å; I128-M132 HydrophobicContact CG2-CE 3.54Å; I128-M132 HydrophobicContact CG2-CG 4.49Å; T130-M132 PolarHBondContact O-N 2.92Å; T130-M132 VanDerWaalsContact O-N 3.15Å; M132-F134 HydrophobicContact CB-CE2 4.36Å; M132-F134 HydrophobicContact CB-CZ 4.47Å; M132-F134 WeakPolarHBondContact O-CD2 3.49Å; M132-F134 VanDerWaalsContact O-CE2 3.3Å; M132-F134 WeakPolarHBondContact O-CE2 3.26Å; M132-F134 HydrophobicContact SD-CZ 4.39Å; M132-V144 HydrophobicContact CB-CB 4.33Å; M132-V144 HydrophobicContact CB-CG2 3.76Å; M132-V144 HydrophobicContact CG-CG2 4.06Å; M132-V144 HydrophobicContact SD-CG2 4.45Å; M132-I158 HydrophobicContact CE-CD1 4.09Å; M132-I158 HydrophobicContact SD-CD1 4.31Å; M132-L178 HydrophobicContact CE-CD1 3.59Å; M132-Q396 HydrophobicContact SD-CB 3.79Å; M132-M399 HydrophobicContact CE-CE 3.96Å; M132-M399 HydrophobicContact CE-SD 4Å; M132-M399 HydrophobicContact SD-CE 4.02Å; M132-M399 HydrophobicContact SD-SD 4.24Å
133	D	92.8	Very high	91.2	Very high	78 Å²	78	64.9 Å²	64.9	42%	0.417	34%	0.337	S	S	.	.			trans	-94.6	113.5	177	178.4	11.8	0	0	0	109.7	P131 S135 Q396	P131-D133 PolarHBondContact O-N 2.92Å; D133-S135 VanDerWaalsContact CG-OG 3.3Å; D133-S135 WeakPolarHBondContact OD1-CB 3.44Å; D133-S135 PolarHBondContact OD1-N 3.28Å; D133-S135 PolarHBondContact OD1-OG 3.2Å; D133-S135 PolarHBondContact OD2-OG 3.16Å; D133-Q396 WeakPolarHBondContact O-CG 3.19Å; D133-Q396 PolarHBondContact O-NE2 3.37Å
134	F	94.9	Very high	91.3	Very high	8 Å²	8	65.7 Å²	65.7	4%	0.035	35%	0.345	C	S	.	.			trans	-95.1	-4.3	-178.8	-53.5	-84.1	0	0	0	113.1	F120 M132 K136 C137 S140 C142 V144 Q396 C400	F120-F134 HydrophobicContact CD2-CZ 4.2Å; F120-F134 HydrophobicContact CE2-CZ 4.49Å; M132-F134 HydrophobicContact CB-CE2 4.36Å; M132-F134 HydrophobicContact CB-CZ 4.47Å; M132-F134 WeakPolarHBondContact O-CD2 3.49Å; M132-F134 VanDerWaalsContact O-CE2 3.3Å; M132-F134 WeakPolarHBondContact O-CE2 3.26Å; M132-F134 HydrophobicContact SD-CZ 4.39Å; F134-K136 PolarHBondContact O-N 2.92Å; F134-K136 VanDerWaalsContact O-N 3.09Å; F134-C137 WeakPolarHBondContact O-CB 3.1Å; F134-C137 PolarHBondContact O-N 3.42Å; F134-S140 VanDerWaalsContact O-CA 3.28Å; F134-S140 WeakPolarHBondContact O-CA 3.48Å; F134-S140 WeakPolarHBondContact O-CB 3.31Å; F134-C142 HydrophobicContact CB-CB 4.41Å; F134-C142 HydrophobicContact CD1-CB 3.83Å; F134-C142 HydrophobicContact CD2-CB 3.84Å; F134-C142 VanDerWaalsContact CD2-O 3.25Å; F134-C142 WeakPolarHBondContact CD2-O 3.13Å; F134-C142 HydrophobicContact CE1-CB 3.93Å; F134-C142 HydrophobicContact CE2-CB 3.99Å; F134-C142 HydrophobicContact CG-CB 3.76Å; F134-C142 HydrophobicContact CZ-CB 4.02Å; F134-V144 HydrophobicContact CE2-CG2 3.84Å; F134-V144 HydrophobicContact CZ-CG2 3.95Å; F134-Q396 HydrophobicContact CD1-CB 3.98Å; F134-Q396 HydrophobicContact CD1-CG 4.06Å; F134-Q396 WeakPolarHBondContact CD1-O 3.19Å; F134-Q396 HydrophobicContact CE1-CB 3.59Å; F134-Q396 HydrophobicContact CE1-CG 4.17Å; F134-Q396 VanDerWaalsContact CE1-O 3.23Å; F134-Q396 WeakPolarHBondContact CE1-O 3.41Å; F134-Q396 HydrophobicContact CZ-CB 4.2Å; F134-C400 HydrophobicContact CD1-CB 3.59Å; F134-C400 HydrophobicContact CE1-CB 3.91Å
135	S	93.8	Very high	91.5	Very high	81 Å²	81	66.5 Å²	66.5	57%	0.566	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.7	-170.4	62.8	0	0	0	0	114.2	D133	D133-S135 VanDerWaalsContact CG-OG 3.3Å; D133-S135 WeakPolarHBondContact OD1-CB 3.44Å; D133-S135 PolarHBondContact OD1-N 3.28Å; D133-S135 PolarHBondContact OD1-OG 3.2Å; D133-S135 PolarHBondContact OD2-OG 3.16Å
136	K	90.9	Very high	91.6	Very high	189 Å²	189	65.5 Å²	65.5	82%	0.822	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	0.8	-179.8	-60.4	-178.3	-176.2	174.7	0	114	F134	F134-K136 PolarHBondContact O-N 2.92Å; F134-K136 VanDerWaalsContact O-N 3.09Å
137	C	92.2	Very high	91.9	Very high	11 Å²	11	63 Å²	63	7%	0.074	35%	0.345	C	S	.	.	S	Bend	trans	-85.1	152.5	-178.7	-58.2	0	0	0	0	111.4	F134 A139 C397	F134-C137 WeakPolarHBondContact O-CB 3.1Å; F134-C137 PolarHBondContact O-N 3.42Å; C137-A139 WeakPolarHBondContact CB-O 3.4Å; C137-A139 PolarHBondContact O-N 2.99Å; C137-C397 VanDerWaalsContact CA-SG 3.54Å; C137-C397 HydrophobicContact CB-CB 3.6Å; C137-C397 WeakPolarHBondContact CB-SG 3.38Å; C137-C397 WeakPolarHBondContact SG-CA 3.36Å; C137-C397 WeakPolarHBondContact SG-CB 3.45Å; C137-C397 CovalentContact SG-SG 2.04Å; C137-C397 PolarHBondContact SG-SG 3.39Å
138	H	89.6	Confident	92.4	Very high	87 Å²	87	60.8 Å²	60.8	40%	0.403	33%	0.328	S	S	.	.	S	Bend	trans	-57.1	-50.3	174.1	-170.7	81.7	0	0	0	111.2	E105 Y108 D109	E105-H138 HydrophobicContact CG-CB 4.29Å; E105-H138 IonicContact OE1-CG 3.65Å; Y108-H138 AromaticContact CD1-CD2 3.71Å; D109-H138 VanDerWaalsContact CG-NE2 3.34Å; D109-H138 IonicContact OD1-CD2 3.73Å; D109-H138 IonicContact OD1-CE1 2.97Å; D109-H138 IonicContact OD1-NE2 2.68Å; D109-H138 PolarHBondContact OD1-NE2 3.2Å; D109-H138 VanDerWaalsContact OD1-NE2 3.08Å; D109-H138 IonicContact OD2-CE1 3.83Å; D109-H138 PolarHBondContact OD2-CE1 2.64Å; D109-H138 IonicContact OD2-NE2 3.58Å; D109-H138 PolarHBondContact OD2-NE2 2.89Å
139	A	91.5	Very high	92.8	Very high	1 Å²	1	66 Å²	66	1%	0.008	36%	0.356	C	S	.	.	S	Bend	trans	-89.1	108.3	161	0	0	0	0	0	109.4	Y108 C137 C400 L401	Y108-A139 HydrophobicContact CD1-CB 4.21Å; Y108-A139 HydrophobicContact CD2-CB 4.11Å; Y108-A139 HydrophobicContact CE1-CB 3.83Å; Y108-A139 HydrophobicContact CE2-CB 3.76Å; Y108-A139 HydrophobicContact CG-CB 4.31Å; C137-A139 WeakPolarHBondContact CB-O 3.4Å; C137-A139 PolarHBondContact O-N 2.99Å; A139-C400 HydrophobicContact CB-CB 4.38Å; A139-C400 WeakPolarHBondContact O-CB 3.21Å; A139-C400 PolarHBondContact O-SG 3.29Å; A139-L401 HydrophobicContact CB-CB 4.19Å; A139-L401 HydrophobicContact CB-CD1 3.99Å
140	S	93.4	Very high	93.4	Very high	52 Å²	52	64 Å²	64	36%	0.364	34%	0.344	S	S	.	.			trans	-112.4	-10.6	-174.1	55.7	0	0	0	0	114.8	F134 C142	F134-S140 VanDerWaalsContact O-CA 3.28Å; F134-S140 WeakPolarHBondContact O-CA 3.48Å; F134-S140 WeakPolarHBondContact O-CB 3.31Å; S140-C142 PolarHBondContact O-N 3.34Å
141	K	95.4	Very high	94	Very high	92 Å²	92	64.5 Å²	64.5	40%	0.4	35%	0.345	S	S	.	.			trans	-82.8	64	-178.3	-63.6	-165.2	-170.7	-176.6	0	111.8	K115 V117 K118 H404	K115-K141 HydrophobicContact CB-CD 3.7Å; K115-K141 WeakPolarHBondContact O-CD 3.46Å; K115-K141 WeakPolarHBondContact O-CE 3.08Å; K115-K141 PolarHBondContact O-NZ 3.47Å; V117-K141 WeakPolarHBondContact CA-O 3.13Å; K118-K141 PolarHBondContact N-O 3.1Å; K141-H404 PolarHBondContact O-NE2 2.82Å
142	C	96.8	Very high	94.6	Very high	13 Å²	13	66.7 Å²	66.7	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.7	173	-63.5	0	0	0	0	110.3	K118 F120 F134 S140 C400	K118-C142 CarbonylContact O-C 3.59Å; K118-C142 VanDerWaalsContact O-CA 3.22Å; K118-C142 WeakPolarHBondContact O-CA 3.41Å; F120-C142 HydrophobicContact CD2-CB 4.08Å; F120-C142 HydrophobicContact CE2-CB 3.92Å; F134-C142 HydrophobicContact CB-CB 4.41Å; F134-C142 HydrophobicContact CD1-CB 3.83Å; F134-C142 HydrophobicContact CD2-CB 3.84Å; F134-C142 VanDerWaalsContact CD2-O 3.25Å; F134-C142 WeakPolarHBondContact CD2-O 3.13Å; F134-C142 HydrophobicContact CE1-CB 3.93Å; F134-C142 HydrophobicContact CE2-CB 3.99Å; F134-C142 HydrophobicContact CG-CB 3.76Å; F134-C142 HydrophobicContact CZ-CB 4.02Å; S140-C142 PolarHBondContact O-N 3.34Å; C142-C400 HydrophobicContact CB-CB 3.81Å; C142-C400 WeakPolarHBondContact CB-SG 3.43Å; C142-C400 WeakPolarHBondContact SG-CA 3.25Å; C142-C400 WeakPolarHBondContact SG-CB 3.4Å; C142-C400 CovalentContact SG-SG 2.03Å; C142-C400 PolarHBondContact SG-SG 3.12Å
143	A	97.2	Very high	94.8	Very high	41 Å²	41	69.8 Å²	69.8	34%	0.339	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	154.3	175.6	0	0	0	0	0	109.6	V117 K118 F120	V117-A143 HydrophobicContact CG1-CB 3.84Å; K118-A143 PolarHBondContact O-N 2.99Å; F120-A143 PolarHBondContact N-O 3.08Å
144	V	97.1	Very high	95	Very high	50 Å²	50	66.3 Å²	66.3	30%	0.303	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.1	175.1	170.7	0	0	0	0	110.2	F120 M132 F134 I158	F120-V144 HydrophobicContact CB-CG2 3.7Å; F120-V144 CarbonylContact O-C 3.58Å; F120-V144 VanDerWaalsContact O-CA 3.3Å; F120-V144 WeakPolarHBondContact O-CA 3.43Å; M132-V144 HydrophobicContact CB-CB 4.33Å; M132-V144 HydrophobicContact CB-CG2 3.76Å; M132-V144 HydrophobicContact CG-CG2 4.06Å; M132-V144 HydrophobicContact SD-CG2 4.45Å; F134-V144 HydrophobicContact CE2-CG2 3.84Å; F134-V144 HydrophobicContact CZ-CG2 3.95Å; V144-I158 HydrophobicContact CG2-CD1 4.21Å
145	I	96.5	Very high	95.1	Very high	30 Å²	30	68.3 Å²	68.3	15%	0.154	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	158	166.9	61.9	172.1	0	0	0	110.2	T119 F120 L121 N122 R150	T119-I145 HydrophobicContact CG2-CD1 3.79Å; T119-I145 HydrophobicContact CG2-CG1 3.85Å; T119-I145 HydrophobicContact CG2-CG2 4.19Å; F120-I145 WeakPolarHBondContact O-CG1 3.39Å; F120-I145 PolarHBondContact O-N 3.11Å; L121-I145 WeakPolarHBondContact CA-O 3.49Å; L121-I145 HydrophobicContact CB-CD1 4.35Å; L121-I145 HydrophobicContact CB-CG1 3.85Å; L121-I145 HydrophobicContact CD1-CD1 3.78Å; L121-I145 HydrophobicContact CD1-CG1 3.93Å; L121-I145 HydrophobicContact CG-CD1 4.44Å; L121-I145 HydrophobicContact CG-CG1 4.05Å; N122-I145 PolarHBondContact N-O 3.42Å; I145-R150 HydrophobicContact CD1-CB 3.93Å
146	T	94.6	Very high	95.3	Very high	106 Å²	106	64.5 Å²	64.5	65%	0.65	32%	0.323	S	S	*	.			trans	-122.5	-8.8	-174.6	54.6	0	0	0	0	114.2	N122 M148	N122-T146 HydrophobicContact CB-CG2 4.44Å; T146-M148 PolarHBondContact O-N 3.39Å; T146-M148 VanDerWaalsContact O-N 3.09Å
147	D	95.8	Very high	95.6	Very high	69 Å²	69	55.5 Å²	55.5	37%	0.369	28%	0.283	S	S	.	.			trans	-73.8	101.5	175.2	177.3	8.8	0	0	0	110.2	L121 N149 R150	L121-D147 WeakPolarHBondContact CD1-O 3.25Å; D147-N149 PolarHBondContact O-N 2.9Å; D147-N149 WeakPolarHBondContact OD1-CB 3.27Å; D147-N149 PolarHBondContact OD1-N 3.44Å; D147-N149 PolarHBondContact OD1-ND2 3.1Å; D147-R150 HydrophobicContact CB-CG 4.36Å; D147-R150 WeakPolarHBondContact O-CB 3.29Å; D147-R150 PolarHBondContact O-N 2.81Å
148	M	95.6	Very high	95.8	Very high	54 Å²	54	55 Å²	55	27%	0.266	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.9	-18.3	-178.8	-67.8	-171.8	-69	0	0	114.2	Y123 G124 T146 R150 W151	Y123-M148 HydrophobicContact CD2-CB 4.02Å; Y123-M148 HydrophobicContact CD2-CG 3.95Å; Y123-M148 HydrophobicContact CD2-SD 4.31Å; Y123-M148 HydrophobicContact CE2-CB 3.86Å; Y123-M148 HydrophobicContact CE2-CG 4.18Å; Y123-M148 HydrophobicContact CE2-SD 4.33Å; Y123-M148 HydrophobicContact CG-SD 4.47Å; G124-M148 PolarHBondContact N-SD 2.91Å; T146-M148 PolarHBondContact O-N 3.39Å; T146-M148 VanDerWaalsContact O-N 3.09Å; M148-R150 PolarHBondContact O-N 3.1Å; M148-W151 WeakPolarHBondContact O-CB 3.46Å; M148-W151 PolarHBondContact O-N 3.15Å
149	N	95.9	Very high	96.2	Very high	140 Å²	140	51 Å²	51	75%	0.749	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-70.8	-22.1	175.9	-59.6	-59.8	0	0	0	112.5	D147 W151	D147-N149 PolarHBondContact O-N 2.9Å; D147-N149 WeakPolarHBondContact OD1-CB 3.27Å; D147-N149 PolarHBondContact OD1-N 3.44Å; D147-N149 PolarHBondContact OD1-ND2 3.1Å; N149-W151 PolarHBondContact O-N 2.93Å
150	R	96.7	Very high	96.3	Very high	105 Å²	105	51.1 Å²	51.1	40%	0.396	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-87.1	15.4	178.6	-67	174.1	65.9	-164.5	-5.1	112.7	L121 I145 D147 M148 R152 E153	L121-R150 VanDerWaalsContact CD1-C 3.45Å; L121-R150 HydrophobicContact CD1-CB 4.11Å; I145-R150 HydrophobicContact CD1-CB 3.93Å; D147-R150 HydrophobicContact CB-CG 4.36Å; D147-R150 WeakPolarHBondContact O-CB 3.29Å; D147-R150 PolarHBondContact O-N 2.81Å; M148-R150 PolarHBondContact O-N 3.1Å; R150-R152 PolarHBondContact O-N 2.66Å; R150-E153 HydrophobicContact CB-CG 3.79Å; R150-E153 IonicContact CZ-OE1 3.94Å; R150-E153 IonicContact CZ-OE2 3.91Å; R150-E153 IonicContact NE-OE1 3.98Å; R150-E153 PolarHBondContact NE-OE1 3.28Å; R150-E153 IonicContact NE-OE2 3.92Å; R150-E153 PolarHBondContact NE-OE2 3.41Å; R150-E153 VanDerWaalsContact NE-OE2 3.12Å; R150-E153 IonicContact NH2-OE1 3.88Å; R150-E153 PolarHBondContact NH2-OE1 3.37Å; R150-E153 IonicContact NH2-OE2 3.64Å; R150-E153 WeakPolarHBondContact O-CG 3.44Å; R150-E153 PolarHBondContact O-N 2.75Å
151	W	97.1	Very high	96.2	Very high	22 Å²	22	49.8 Å²	49.8	8%	0.083	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.3	-177.5	75.1	-90.7	0	0	0	113.9	L121 Y123 M148 N149 L157 P165 T168 P170 Q173	L121-W151 HydrophobicContact CD1-CB 4.3Å; L121-W151 HydrophobicContact CD2-CB 4.36Å; Y123-W151 HydrophobicContact CD2-CB 4.18Å; Y123-W151 HydrophobicContact CE2-CB 4.21Å; M148-W151 WeakPolarHBondContact O-CB 3.46Å; M148-W151 PolarHBondContact O-N 3.15Å; N149-W151 PolarHBondContact O-N 2.93Å; W151-L157 HydrophobicContact CB-CD2 4.1Å; W151-L157 HydrophobicContact CE3-CD1 4.44Å; W151-P165 HydrophobicContact CB-CB 4.48Å; W151-P165 HydrophobicContact CB-CG 4Å; W151-P165 HydrophobicContact CD2-CB 3.27Å; W151-P165 HydrophobicContact CD2-CG 3.49Å; W151-P165 VanDerWaalsContact CD2-CG 3.49Å; W151-P165 HydrophobicContact CE3-CB 3.61Å; W151-P165 HydrophobicContact CE3-CG 3.54Å; W151-P165 HydrophobicContact CG-CB 3.68Å; W151-P165 HydrophobicContact CG-CG 3.71Å; W151-P165 HydrophobicContact CH2-CB 3.86Å; W151-P165 HydrophobicContact CZ2-CB 3.57Å; W151-P165 HydrophobicContact CZ3-CB 3.88Å; W151-P165 HydrophobicContact CZ3-CG 4.08Å; W151-T168 WeakPolarHBondContact CH2-O 3.41Å; W151-P170 VanDerWaalsContact CZ3-CD 3.46Å; W151-P170 HydrophobicContact CZ3-CG 4.32Å; W151-Q173 PolarHBondContact O-NE2 2.84Å
152	R	97	Very high	95.8	Very high	133 Å²	133	48.9 Å²	48.9	50%	0.502	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-24.6	-179.8	-68.4	-171	178.2	-74.7	-1.8	114.6	R150 T168 P170	R150-R152 PolarHBondContact O-N 2.66Å; R152-T168 PolarHBondContact NH1-O 3.31Å; R152-P170 HydrophobicContact CB-CG 4.44Å
153	E	96.2	Very high	95.4	Very high	104 Å²	104	52.6 Å²	52.6	49%	0.486	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.7	178.9	52.4	166	-108.7	0	0	112.7	R150	R150-E153 HydrophobicContact CB-CG 3.79Å; R150-E153 IonicContact CZ-OE1 3.94Å; R150-E153 IonicContact CZ-OE2 3.91Å; R150-E153 IonicContact NE-OE1 3.98Å; R150-E153 PolarHBondContact NE-OE1 3.28Å; R150-E153 IonicContact NE-OE2 3.92Å; R150-E153 PolarHBondContact NE-OE2 3.41Å; R150-E153 VanDerWaalsContact NE-OE2 3.12Å; R150-E153 IonicContact NH2-OE1 3.88Å; R150-E153 PolarHBondContact NH2-OE1 3.37Å; R150-E153 IonicContact NH2-OE2 3.64Å; R150-E153 WeakPolarHBondContact O-CG 3.44Å; R150-E153 PolarHBondContact O-N 2.75Å
154	A	97.7	Very high	95.2	Very high	5 Å²	5	52.3 Å²	52.3	4%	0.041	26%	0.258	C	S	.	.			trans	-74.2	135.1	178.6	0	0	0	0	0	111.3	T119 L121 A156 L157 Q173	T119-A154 CarbonylContact O-C 3.53Å; L121-A154 HydrophobicContact CB-CB 3.61Å; L121-A154 HydrophobicContact CD1-CB 4.49Å; A154-A156 VanDerWaalsContact C-N 3.27Å; A154-L157 HydrophobicContact CB-CD2 3.98Å; A154-Q173 PolarHBondContact O-NE2 2.73Å
155	D	96.5	Very high	95	Very high	50 Å²	50	50.3 Å²	50.3	27%	0.267	25%	0.246	S	C	.	.	S	Bend	trans	-67.3	-31.3	169.9	-62.9	-93.8	0	0	0	111.5	K118 T119 Q173 L174	K118-D155 WeakPolarHBondContact CA-OD2 3.37Å; K118-D155 HydrophobicContact CB-CB 4.48Å; K118-D155 HydrophobicContact CD-CB 3.87Å; K118-D155 WeakPolarHBondContact CD-OD1 3.43Å; K118-D155 IonicContact NZ-OD1 3.17Å; K118-D155 PolarHBondContact NZ-OD1 2.88Å; T119-D155 PolarHBondContact N-OD2 3.08Å; T119-D155 PolarHBondContact O-N 2.88Å; D155-Q173 CarbonylContact O-C 3.46Å; D155-Q173 VanDerWaalsContact O-CA 3.31Å; D155-Q173 WeakPolarHBondContact O-CA 3.44Å; D155-L174 PolarHBondContact O-N 3.37Å
156	A	97.4	Very high	94.8	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.008	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	141.8	-179.1	0	0	0	0	0	112.5	T119 F120 L121 A154 L174 F176	T119-A156 PolarHBondContact O-N 3.02Å; T119-A156 VanDerWaalsContact O-N 3.12Å; F120-A156 CarbonylContact C-O 3.42Å; F120-A156 VanDerWaalsContact CA-O 3.25Å; F120-A156 WeakPolarHBondContact CA-O 3.33Å; F120-A156 HydrophobicContact CD1-CB 3.52Å; F120-A156 HydrophobicContact CE1-CB 3.55Å; F120-A156 HydrophobicContact CG-CB 4.15Å; F120-A156 HydrophobicContact CZ-CB 4.19Å; L121-A156 PolarHBondContact N-O 3.11Å; A154-A156 VanDerWaalsContact C-N 3.27Å; A156-L174 CarbonylContact C-O 3.55Å; A156-L174 WeakPolarHBondContact CA-O 3.33Å; A156-L174 HydrophobicContact CB-CB 4.03Å; A156-F176 HydrophobicContact CB-CD2 4.06Å; A156-F176 HydrophobicContact CB-CE2 3.88Å
157	L	97.5	Very high	94.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.9	170.1	-54.5	-168.5	0	0	0	110.1	L121 W151 A154 L159 P165 Q173 L174 W175 F176	L121-L157 HydrophobicContact CB-CD2 3.93Å; L121-L157 HydrophobicContact CD2-CD2 3.99Å; L121-L157 HydrophobicContact CG-CD2 4.48Å; L121-L157 CarbonylContact O-C 3.58Å; L121-L157 WeakPolarHBondContact O-CA 3.42Å; W151-L157 HydrophobicContact CB-CD2 4.1Å; W151-L157 HydrophobicContact CE3-CD1 4.44Å; A154-L157 HydrophobicContact CB-CD2 3.98Å; L157-L159 HydrophobicContact CB-CD2 3.96Å; L157-L159 HydrophobicContact CD1-CD2 4.35Å; L157-P165 HydrophobicContact CD1-CG 3.58Å; L157-Q173 HydrophobicContact CG-CG 4.46Å; L157-L174 PolarHBondContact N-O 2.95Å; L157-W175 HydrophobicContact CB-CG 4.48Å; L157-W175 HydrophobicContact CD1-CZ2 4.25Å; L157-F176 PolarHBondContact O-N 3.48Å
158	I	97.3	Very high	94.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	100	168.6	-50.6	166.8	0	0	0	106.7	F120 L121 Y123 I128 M132 V144 T160 F176 L178 M399	F120-I158 HydrophobicContact CB-CD1 4Å; F120-I158 HydrophobicContact CB-CG1 4.34Å; F120-I158 HydrophobicContact CD1-CD1 4.09Å; F120-I158 HydrophobicContact CD1-CG1 3.85Å; F120-I158 HydrophobicContact CG-CD1 4.4Å; L121-I158 PolarHBondContact O-N 3.2Å; Y123-I158 PolarHBondContact N-O 3.46Å; I128-I158 HydrophobicContact CD1-CD1 4.46Å; I128-I158 HydrophobicContact CD1-CG2 3.79Å; M132-I158 HydrophobicContact CE-CD1 4.09Å; M132-I158 HydrophobicContact SD-CD1 4.31Å; V144-I158 HydrophobicContact CG2-CD1 4.21Å; I158-T160 HydrophobicContact CG2-CG2 4.29Å; I158-F176 CarbonylContact C-O 3.4Å; I158-F176 WeakPolarHBondContact CA-O 3.42Å; I158-L178 HydrophobicContact CG2-CB 3.67Å; I158-L178 HydrophobicContact CG2-CD1 3.94Å; I158-L178 HydrophobicContact CG2-CG 4.47Å; I158-M399 HydrophobicContact CD1-CE 3.56Å; I158-M399 HydrophobicContact CG1-CE 3.72Å
159	L	96.3	Very high	94.3	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	114.8	177.7	-50.8	-175.1	0	0	0	108.8	Y123 L157 V164 W175 F176 L178 L192 I196	Y123-L159 HydrophobicContact CD1-CD2 4.06Å; Y123-L159 HydrophobicContact CG-CD2 4.27Å; L157-L159 HydrophobicContact CB-CD2 3.96Å; L157-L159 HydrophobicContact CD1-CD2 4.35Å; L159-V164 HydrophobicContact CD1-CG1 4.09Å; L159-W175 HydrophobicContact CD1-CB 4.43Å; L159-W175 HydrophobicContact CD1-CD2 4.21Å; L159-W175 HydrophobicContact CD1-CE3 3.73Å; L159-W175 HydrophobicContact CD1-CZ3 4.34Å; L159-F176 PolarHBondContact N-O 2.88Å; L159-L178 PolarHBondContact O-N 2.84Å; L159-L192 HydrophobicContact CD1-CD2 4.11Å; L159-I196 HydrophobicContact CD1-CD1 3.57Å
160	T	94.4	Very high	94.3	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.031	27%	0.266	C	S	.	.	S	Bend	trans	-100.1	-0.8	-179	56.8	0	0	0	0	113.8	N122 Y123 G124 I128 I158 L178	N122-T160 WeakPolarHBondContact OD1-CG2 3.4Å; Y123-T160 PolarHBondContact O-N 3.5Å; G124-T160 WeakPolarHBondContact CA-OG1 3.32Å; I128-T160 HydrophobicContact CD1-CG2 3.72Å; I128-T160 HydrophobicContact CG1-CG2 3.62Å; I158-T160 HydrophobicContact CG2-CG2 4.29Å; T160-L178 WeakPolarHBondContact CA-O 3.44Å
161	E	91.3	Very high	94	Very high	24 Å²	24	54.1 Å²	54.1	11%	0.112	29%	0.285	C	S	.	.	S	Bend	trans	-155.7	-175.3	-179.8	55.7	-178.2	136.4	0	0	108.9	G124 H125 K163	G124-E161 VanDerWaalsContact CA-OE1 3.25Å; G124-E161 WeakPolarHBondContact CA-OE1 3.4Å; H125-E161 IonicContact CE1-OE1 2.94Å; H125-E161 IonicContact CG-OE1 3.37Å; H125-E161 PolarHBondContact N-OE1 2.95Å; H125-E161 IonicContact ND1-OE1 2.63Å; H125-E161 PolarHBondContact ND1-OE1 3.15Å; E161-K163 VanDerWaalsContact CD-CD 3.49Å; E161-K163 HydrophobicContact CG-CB 3.97Å; E161-K163 HydrophobicContact CG-CD 4.22Å; E161-K163 HydrophobicContact CG-CG 3.94Å; E161-K163 PolarHBondContact O-N 3.37Å; E161-K163 IonicContact OE1-NZ 3.41Å; E161-K163 PolarHBondContact OE1-NZ 3.18Å; E161-K163 VanDerWaalsContact OE2-CD 3.32Å; E161-K163 WeakPolarHBondContact OE2-CD 3.27Å; E161-K163 WeakPolarHBondContact OE2-CE 3.31Å; E161-K163 IonicContact OE2-NZ 3.08Å; E161-K163 PolarHBondContact OE2-NZ 3.06Å
162	D	87.4	Confident	93.7	Very high	72 Å²	72	59.8 Å²	59.8	39%	0.385	31%	0.312	S	S	.	.	S	Bend	trans	-78.9	12.9	179.5	67.3	-25.2	0	0	0	114.1	A189 F191	D162-A189 HydrophobicContact CB-CB 4.04Å; D162-F191 VanDerWaalsContact O-CZ 3.26Å; D162-F191 WeakPolarHBondContact O-CZ 3.44Å
163	K	88	Confident	93.6	Very high	91 Å²	91	53.8 Å²	53.8	40%	0.396	29%	0.29	S	S	.	.			trans	-87.9	137.5	179	-65.5	-175.2	-176	133.5	0	111	Y123 H125 E161	Y123-K163 WeakPolarHBondContact CD1-O 3.42Å; Y123-K163 HydrophobicContact CE1-CB 4.22Å; H125-K163 PolarHBondContact ND1-NZ 2.79Å; E161-K163 VanDerWaalsContact CD-CD 3.49Å; E161-K163 HydrophobicContact CG-CB 3.97Å; E161-K163 HydrophobicContact CG-CD 4.22Å; E161-K163 HydrophobicContact CG-CG 3.94Å; E161-K163 PolarHBondContact O-N 3.37Å; E161-K163 IonicContact OE1-NZ 3.41Å; E161-K163 PolarHBondContact OE1-NZ 3.18Å; E161-K163 VanDerWaalsContact OE2-CD 3.32Å; E161-K163 WeakPolarHBondContact OE2-CD 3.27Å; E161-K163 WeakPolarHBondContact OE2-CE 3.31Å; E161-K163 IonicContact OE2-NZ 3.08Å; E161-K163 PolarHBondContact OE2-NZ 3.06Å
164	V	92.4	Very high	93.6	Very high	35 Å²	35	49.6 Å²	49.6	21%	0.212	27%	0.27	C	S	.	.			trans	-130.3	158.3	174.4	-63.3	0	0	0	0	111.2	Y123 L159 W175 F191 L192	Y123-V164 PolarHBondContact OH-O 3.49Å; L159-V164 HydrophobicContact CD1-CG1 4.09Å; V164-W175 HydrophobicContact CB-CH2 3.71Å; V164-W175 HydrophobicContact CB-CZ3 3.95Å; V164-W175 HydrophobicContact CG1-CE3 4.27Å; V164-W175 HydrophobicContact CG1-CH2 3.75Å; V164-W175 HydrophobicContact CG1-CZ3 3.43Å; V164-W175 VanDerWaalsContact CG1-CZ3 3.43Å; V164-W175 HydrophobicContact CG2-CH2 4.47Å; V164-F191 HydrophobicContact CB-CE2 4.33Å; V164-F191 HydrophobicContact CG1-CE2 3.89Å; V164-F191 HydrophobicContact CG2-CD2 4.22Å; V164-F191 HydrophobicContact CG2-CE2 3.48Å; V164-F191 VanDerWaalsContact CG2-CE2 3.48Å; V164-F191 HydrophobicContact CG2-CZ 4.13Å; V164-L192 HydrophobicContact CG1-CD2 3.36Å
165	P	93.3	Very high	93.6	Very high	8 Å²	8	50 Å²	50	5%	0.052	27%	0.271	C	S	.	.			trans	-61.6	146.4	171.1	-15.5	26.2	0	0	0	112.6	Y123 W151 L157	Y123-P165 HydrophobicContact CD2-CG 4.01Å; Y123-P165 HydrophobicContact CE1-CG 4.2Å; Y123-P165 HydrophobicContact CE2-CB 4.15Å; Y123-P165 HydrophobicContact CE2-CG 3.61Å; Y123-P165 HydrophobicContact CG-CG 4.46Å; Y123-P165 VanDerWaalsContact OH-CA 3.23Å; Y123-P165 WeakPolarHBondContact OH-CA 3.39Å; W151-P165 HydrophobicContact CB-CB 4.48Å; W151-P165 HydrophobicContact CB-CG 4Å; W151-P165 HydrophobicContact CD2-CB 3.27Å; W151-P165 HydrophobicContact CD2-CG 3.49Å; W151-P165 VanDerWaalsContact CD2-CG 3.49Å; W151-P165 HydrophobicContact CE3-CB 3.61Å; W151-P165 HydrophobicContact CE3-CG 3.54Å; W151-P165 HydrophobicContact CG-CB 3.68Å; W151-P165 HydrophobicContact CG-CG 3.71Å; W151-P165 HydrophobicContact CH2-CB 3.86Å; W151-P165 HydrophobicContact CZ2-CB 3.57Å; W151-P165 HydrophobicContact CZ3-CB 3.88Å; W151-P165 HydrophobicContact CZ3-CG 4.08Å; L157-P165 HydrophobicContact CD1-CG 3.58Å
166	K	91.7	Very high	93.5	Very high	202 Å²	202	47.7 Å²	47.7	88%	0.878	26%	0.258	S	S	*	.	S	Bend	trans	-82.2	123.4	171.9	-67.8	-174.9	-179.5	-179.3	0	110
167	G	91.3	Very high	93.5	Very high	58 Å²	58	47.9 Å²	47.9	60%	0.598	26%	0.26	S	S	*	.	S	Bend	trans	118.3	-175.8	173	0	0	0	0	0	112.9	R169	G167-R169 PolarHBondContact O-N 3.1Å
168	T	92.5	Very high	93.4	Very high	119 Å²	119	48.6 Å²	48.6	73%	0.73	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-70.6	126.9	-176.4	-45.7	0	0	0	0	111.2	W151 R152	W151-T168 WeakPolarHBondContact CH2-O 3.41Å; R152-T168 PolarHBondContact NH1-O 3.31Å
169	R	93.2	Very high	93.2	Very high	55 Å²	55	48.8 Å²	48.8	21%	0.208	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-60.2	127.3	171.3	-179.7	-180	176.8	164.8	3.6	110.6	G167 Q173 W175 E195 N197	G167-R169 PolarHBondContact O-N 3.1Å; R169-Q173 HydrophobicContact CG-CB 4.39Å; R169-Q173 PolarHBondContact NE-O 3.29Å; R169-Q173 PolarHBondContact NH2-O 3.01Å; R169-W175 HydrophobicContact CB-CZ2 4.46Å; R169-W175 HydrophobicContact CG-CZ2 4.36Å; R169-E195 PolarHBondContact NH1-O 2.83Å; R169-E195 IonicContact NH1-OE2 3.39Å; R169-E195 PolarHBondContact NH1-OE2 2.91Å; R169-N197 PolarHBondContact NH2-OD1 2.91Å
170	P	95	Very high	93	Very high	30 Å²	30	49.7 Å²	49.7	20%	0.195	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-54.8	146.8	173.5	-25.5	32.8	0	0	0	112	W151 R152 Q173	W151-P170 VanDerWaalsContact CZ3-CD 3.46Å; W151-P170 HydrophobicContact CZ3-CG 4.32Å; R152-P170 HydrophobicContact CB-CG 4.44Å; P170-Q173 HydrophobicContact CB-CB 4.21Å; P170-Q173 PolarHBondContact O-N 2.93Å
171	P	91.5	Very high	93	Very high	121 Å²	121	52.2 Å²	52.2	79%	0.786	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	143.5	171.3	-23.9	33.9	0	0	0	111.1	Q173	P171-Q173 PolarHBondContact O-N 2.87Å
172	E	90.4	Very high	93.2	Very high	141 Å²	141	51 Å²	51	66%	0.659	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	-10.2	176.6	-52.2	178.5	175	0	0	116.9	L174 Q407	E172-L174 PolarHBondContact O-N 2.9Å; E172-Q407 PolarHBondContact OE2-NE2 3.12Å
173	Q	95.3	Very high	93.6	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.033	26%	0.259	C	S	.	.			trans	-59.2	131.5	174.3	176.1	175	92.4	0	0	109.6	W151 A154 D155 L157 R169 P170 P171	W151-Q173 PolarHBondContact O-NE2 2.84Å; A154-Q173 PolarHBondContact O-NE2 2.73Å; D155-Q173 CarbonylContact O-C 3.46Å; D155-Q173 VanDerWaalsContact O-CA 3.31Å; D155-Q173 WeakPolarHBondContact O-CA 3.44Å; L157-Q173 HydrophobicContact CG-CG 4.46Å; R169-Q173 HydrophobicContact CG-CB 4.39Å; R169-Q173 PolarHBondContact NE-O 3.29Å; R169-Q173 PolarHBondContact NH2-O 3.01Å; P170-Q173 HydrophobicContact CB-CB 4.21Å; P170-Q173 PolarHBondContact O-N 2.93Å; P171-Q173 PolarHBondContact O-N 2.87Å
174	L	95.7	Very high	93.8	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	144	-179.1	-58.3	169.3	0	0	0	111.7	D155 A156 L157 E172 F176 N197 F198 A403 S406	D155-L174 PolarHBondContact O-N 3.37Å; A156-L174 CarbonylContact C-O 3.55Å; A156-L174 WeakPolarHBondContact CA-O 3.33Å; A156-L174 HydrophobicContact CB-CB 4.03Å; L157-L174 PolarHBondContact N-O 2.95Å; E172-L174 PolarHBondContact O-N 2.9Å; L174-F176 HydrophobicContact CB-CD2 4.28Å; L174-F176 HydrophobicContact CB-CE2 3.8Å; L174-F176 HydrophobicContact CD1-CE2 4.09Å; L174-F176 HydrophobicContact CD1-CZ 4.48Å; L174-N197 WeakPolarHBondContact CA-OD1 3.35Å; L174-N197 HydrophobicContact CD2-CB 4.38Å; L174-F198 HydrophobicContact CD1-CE2 4.33Å; L174-F198 HydrophobicContact CD2-CE2 4.28Å; L174-A403 HydrophobicContact CD1-CB 4.24Å; L174-S406 VanDerWaalsContact CD1-OG 3.28Å; L174-S406 WeakPolarHBondContact CD1-OG 3.48Å
175	W	96.4	Very high	93.9	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.057	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	113.6	176.3	-73.9	18.2	0	0	0	108.6	L157 L159 V164 R169 L192 E195 I196 N197 F198	L157-W175 HydrophobicContact CB-CG 4.48Å; L157-W175 HydrophobicContact CD1-CZ2 4.25Å; L159-W175 HydrophobicContact CD1-CB 4.43Å; L159-W175 HydrophobicContact CD1-CD2 4.21Å; L159-W175 HydrophobicContact CD1-CE3 3.73Å; L159-W175 HydrophobicContact CD1-CZ3 4.34Å; V164-W175 HydrophobicContact CB-CH2 3.71Å; V164-W175 HydrophobicContact CB-CZ3 3.95Å; V164-W175 HydrophobicContact CG1-CE3 4.27Å; V164-W175 HydrophobicContact CG1-CH2 3.75Å; V164-W175 HydrophobicContact CG1-CZ3 3.43Å; V164-W175 VanDerWaalsContact CG1-CZ3 3.43Å; V164-W175 HydrophobicContact CG2-CH2 4.47Å; R169-W175 HydrophobicContact CB-CZ2 4.46Å; R169-W175 HydrophobicContact CG-CZ2 4.36Å; W175-L192 HydrophobicContact CE3-CD2 4.43Å; W175-L192 HydrophobicContact CZ3-CD2 4.13Å; W175-E195 HydrophobicContact CE3-CB 4.02Å; W175-E195 HydrophobicContact CZ3-CB 4.06Å; W175-I196 HydrophobicContact CB-CD1 4.44Å; W175-N197 PolarHBondContact N-OD1 3.08Å; W175-N197 PolarHBondContact O-N 2.61Å; W175-F198 PolarHBondContact O-N 2.74Å
176	F	96.1	Very high	93.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.5	172.4	-68.7	-105.1	0	0	0	108.2	F120 A156 L157 I158 L159 L174 F198 I200 I208 M399 L402	F120-F176 AromaticContact CE1-CD2 3.91Å; F120-F176 HydrophobicContact CE1-CD2 3.91Å; F120-F176 AromaticContact CE1-CE2 3.67Å; F120-F176 HydrophobicContact CE1-CE2 3.67Å; F120-F176 HydrophobicContact CE1-CZ 4.09Å; F120-F176 HydrophobicContact CZ-CE2 4.28Å; F120-F176 HydrophobicContact CZ-CZ 4.4Å; A156-F176 HydrophobicContact CB-CD2 4.06Å; A156-F176 HydrophobicContact CB-CE2 3.88Å; L157-F176 PolarHBondContact O-N 3.48Å; I158-F176 CarbonylContact C-O 3.4Å; I158-F176 WeakPolarHBondContact CA-O 3.42Å; L159-F176 PolarHBondContact N-O 2.88Å; L174-F176 HydrophobicContact CB-CD2 4.28Å; L174-F176 HydrophobicContact CB-CE2 3.8Å; L174-F176 HydrophobicContact CD1-CE2 4.09Å; L174-F176 HydrophobicContact CD1-CZ 4.48Å; F176-F198 CarbonylContact C-O 3.55Å; F176-F198 VanDerWaalsContact CA-O 3.3Å; F176-F198 WeakPolarHBondContact CA-O 3.47Å; F176-F198 HydrophobicContact CD1-CB 3.58Å; F176-F198 AromaticContact CD1-CD2 4Å; F176-F198 HydrophobicContact CD1-CD2 4Å; F176-F198 HydrophobicContact CD1-CG 4.22Å; F176-F198 HydrophobicContact CD2-CD2 4.42Å; F176-F198 HydrophobicContact CE1-CB 3.71Å; F176-F198 AromaticContact CE1-CD2 3.41Å; F176-F198 HydrophobicContact CE1-CD2 3.41Å; F176-F198 VanDerWaalsContact CE1-CD2 3.41Å; F176-F198 HydrophobicContact CE1-CE2 4.33Å; F176-F198 AromaticContact CE1-CG 3.86Å; F176-F198 HydrophobicContact CE1-CG 3.86Å; F176-F198 AromaticContact CE2-CD2 3.89Å; F176-F198 HydrophobicContact CE2-CD2 3.89Å; F176-F198 HydrophobicContact CE2-CE2 4.47Å; F176-F198 HydrophobicContact CG-CB 4.29Å; F176-F198 HydrophobicContact CG-CD2 4.47Å; F176-F198 HydrophobicContact CZ-CB 4.49Å; F176-F198 AromaticContact CZ-CD2 3.36Å; F176-F198 HydrophobicContact CZ-CD2 3.36Å; F176-F198 AromaticContact CZ-CE2 3.94Å; F176-F198 HydrophobicContact CZ-CE2 3.94Å; F176-F198 HydrophobicContact CZ-CG 4.27Å; F176-I200 HydrophobicContact CB-CD1 4.19Å; F176-I200 HydrophobicContact CD1-CD1 4.01Å; F176-I200 HydrophobicContact CD1-CG1 4.43Å; F176-I208 HydrophobicContact CE1-CD1 4.34Å; F176-M399 HydrophobicContact CD1-CG 4.04Å; F176-M399 HydrophobicContact CE1-CB 4.19Å; F176-M399 HydrophobicContact CE1-CG 4.07Å; F176-L402 HydrophobicContact CE1-CB 4.26Å; F176-L402 HydrophobicContact CE1-CD1 4.1Å; F176-L402 HydrophobicContact CZ-CB 4.05Å
177	S	95.9	Very high	94	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.4	167.2	170.8	0	0	0	0	109.5	I179 M188 F198 I200	S177-I179 WeakPolarHBondContact OG-CD1 3.45Å; S177-M188 WeakPolarHBondContact OG-CE 3.47Å; S177-F198 PolarHBondContact N-O 3.29Å; S177-I200 WeakPolarHBondContact O-CA 3.32Å; S177-I200 WeakPolarHBondContact O-CB 3.46Å; S177-I200 PolarHBondContact O-N 3.41Å
178	L	95.8	Very high	94.2	Very high	15 Å²	15	39.1 Å²	39.1	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	97.3	174.3	-164.7	168	0	0	0	109.7	I128 M132 I158 L159 T160 Q180 I200	I128-L178 HydrophobicContact CD1-CD1 4.31Å; I128-L178 HydrophobicContact CG2-CD1 4.18Å; M132-L178 HydrophobicContact CE-CD1 3.59Å; I158-L178 HydrophobicContact CG2-CB 3.67Å; I158-L178 HydrophobicContact CG2-CD1 3.94Å; I158-L178 HydrophobicContact CG2-CG 4.47Å; L159-L178 PolarHBondContact O-N 2.84Å; T160-L178 WeakPolarHBondContact CA-O 3.44Å; L178-Q180 HydrophobicContact CD2-CG 4.14Å; L178-I200 HydrophobicContact CB-CB 4.27Å; L178-I200 HydrophobicContact CB-CD1 4.21Å; L178-I200 HydrophobicContact CD1-CD1 4.2Å; L178-I200 HydrophobicContact CG-CB 4.11Å; L178-I200 HydrophobicContact CG-CD1 4.25Å; L178-I200 HydrophobicContact CG-CG2 4.1Å
179	I	94.2	Very high	94.2	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	19%	0.189	C	C	.	.			trans	-127	117.8	-178.1	-55.7	176.8	0	0	0	109	S177 I186 M188 I200 S201 W421	S177-I179 WeakPolarHBondContact OG-CD1 3.45Å; I179-I186 HydrophobicContact CD1-CG2 4.02Å; I179-I186 HydrophobicContact CG1-CG2 4.4Å; I179-I186 HydrophobicContact CG2-CB 3.89Å; I179-I186 HydrophobicContact CG2-CD1 4.07Å; I179-I186 HydrophobicContact CG2-CG2 3.87Å; I179-M188 HydrophobicContact CD1-CE 3.59Å; I179-M188 HydrophobicContact CD1-CG 3.93Å; I179-I200 PolarHBondContact N-O 2.89Å; I179-I200 VanDerWaalsContact N-O 3.08Å; I179-S201 WeakPolarHBondContact O-CA 3.38Å; I179-S201 WeakPolarHBondContact O-CB 3.46Å; I179-W421 HydrophobicContact CB-CH2 4.18Å; I179-W421 HydrophobicContact CB-CZ2 3.97Å; I179-W421 HydrophobicContact CG2-CH2 3.84Å; I179-W421 HydrophobicContact CG2-CZ2 3.29Å
180	Q	92.2	Very high	94.1	Very high	22 Å²	22	34.5 Å²	34.5	10%	0.103	21%	0.208	C	C	.	.			trans	-103.6	-19.9	179.8	-74.1	-66.2	-19.1	0	0	113.1	L178 F202 S210 Y212	L178-Q180 HydrophobicContact CD2-CG 4.14Å; Q180-F202 WeakPolarHBondContact O-CD1 3.09Å; Q180-S210 PolarHBondContact NE2-O 3.11Å; Q180-S210 PolarHBondContact NE2-OG 2.99Å; Q180-S210 VanDerWaalsContact NE2-OG 3.15Å; Q180-S210 PolarHBondContact OE1-O 3.16Å; Q180-Y212 VanDerWaalsContact C-OH 3.32Å; Q180-Y212 VanDerWaalsContact O-CE2 3.29Å; Q180-Y212 WeakPolarHBondContact O-CE2 3.22Å; Q180-Y212 PolarHBondContact O-OH 2.81Å
181	E	93.6	Very high	93.9	Very high	57 Å²	57	38.7 Å²	38.7	27%	0.266	22%	0.224	S	C	.	.	S	Bend	trans	-80.1	164.8	176.4	-81.4	-65.3	174.7	0	0	112.3	H185 I186 Y315 W421	E181-H185 HydrophobicContact CB-CB 4.23Å; E181-I186 HydrophobicContact CB-CD1 3.66Å; E181-I186 HydrophobicContact CB-CG1 3.84Å; E181-I186 HydrophobicContact CG-CD1 4.13Å; E181-Y315 PolarHBondContact OE2-OH 3.4Å; E181-W421 VanDerWaalsContact O-CH2 3.3Å; E181-W421 WeakPolarHBondContact O-CH2 3.44Å; E181-W421 WeakPolarHBondContact O-CZ2 3.34Å
182	S	95.4	Very high	93.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.187	C	C	.	.			trans	-67.8	154.9	177.8	75.6	0	0	0	0	112.4	V184 H185 I186 S310	S182-V184 PolarHBondContact O-N 3.35Å; S182-H185 PolarHBondContact O-N 3.5Å; S182-H185 PolarHBondContact OG-ND1 2.92Å; S182-I186 PolarHBondContact O-N 2.97Å; S182-S310 VanDerWaalsContact OG-CB 3.32Å; S182-S310 WeakPolarHBondContact OG-CB 3.38Å; S182-S310 PolarHBondContact OG-OG 2.7Å
183	P	95.1	Very high	93.7	Very high	10 Å²	10	28.8 Å²	28.8	7%	0.065	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.4	176.8	-26.2	31	0	0	0	115.1	H185 I186 A187 W421	P183-H185 VanDerWaalsContact C-N 3.34Å; P183-I186 WeakPolarHBondContact CA-O 3.49Å; P183-I186 CarbonylContact O-C 3.58Å; P183-A187 PolarHBondContact O-N 3.06Å; P183-W421 WeakPolarHBondContact CB-O 3.32Å; P183-W421 HydrophobicContact CG-CD2 4.1Å; P183-W421 HydrophobicContact CG-CH2 4.48Å; P183-W421 HydrophobicContact CG-CZ2 4Å; P183-W421 WeakPolarHBondContact CG-O 3.36Å
184	V	93.7	Very high	93.2	Very high	72 Å²	72	32 Å²	32	44%	0.436	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-27.9	176.5	-171.1	0	0	0	0	112.2	S182 K253 C425	S182-V184 PolarHBondContact O-N 3.35Å; V184-K253 HydrophobicContact CG1-CB 3.7Å; V184-K253 HydrophobicContact CG1-CD 4.23Å; V184-K253 HydrophobicContact CG1-CG 3.59Å; V184-C425 HydrophobicContact CG2-CB 4.06Å
185	H	93.2	Very high	93	Very high	67 Å²	67	35 Å²	35	31%	0.31	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-29.9	179.1	-66.9	90.4	0	0	0	112.6	E181 S182 P183 S310	E181-H185 HydrophobicContact CB-CB 4.23Å; S182-H185 PolarHBondContact O-N 3.5Å; S182-H185 PolarHBondContact OG-ND1 2.92Å; P183-H185 VanDerWaalsContact C-N 3.34Å; H185-S310 PolarHBondContact CE1-OG 3.06Å; H185-S310 VanDerWaalsContact CE1-OG 3.31Å; H185-S310 PolarHBondContact ND1-OG 3.16Å
186	I	94	Very high	92.9	Very high	12 Å²	12	34.2 Å²	34.2	6%	0.062	20%	0.195	C	C	.	.	S	Bend	trans	-136.7	100.1	174.8	-54.8	-177.8	0	0	0	107.2	R126 I179 E181 S182 P183 W421	R126-I186 VanDerWaalsContact CD-CD1 3.43Å; I179-I186 HydrophobicContact CD1-CG2 4.02Å; I179-I186 HydrophobicContact CG1-CG2 4.4Å; I179-I186 HydrophobicContact CG2-CB 3.89Å; I179-I186 HydrophobicContact CG2-CD1 4.07Å; I179-I186 HydrophobicContact CG2-CG2 3.87Å; E181-I186 HydrophobicContact CB-CD1 3.66Å; E181-I186 HydrophobicContact CB-CG1 3.84Å; E181-I186 HydrophobicContact CG-CD1 4.13Å; S182-I186 PolarHBondContact O-N 2.97Å; P183-I186 WeakPolarHBondContact CA-O 3.49Å; P183-I186 CarbonylContact O-C 3.58Å; I186-W421 PolarHBondContact O-NE1 2.83Å
187	A	94.5	Very high	92.8	Very high	49 Å²	49	34.9 Å²	34.9	41%	0.405	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-82.8	156.4	170.6	0	0	0	0	0	110	P183 N422	P183-A187 PolarHBondContact O-N 3.06Å; A187-N422 VanDerWaalsContact CA-OD1 3.28Å; A187-N422 WeakPolarHBondContact CA-OD1 3.34Å; A187-N422 WeakPolarHBondContact CB-OD1 3.24Å
188	M	94	Very high	92.7	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.03	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-93.8	130.2	167.3	-79.7	-175	175.2	0	0	109.8	S177 I179 L192 V417 A418 W421 N422	S177-M188 WeakPolarHBondContact OG-CE 3.47Å; I179-M188 HydrophobicContact CD1-CE 3.59Å; I179-M188 HydrophobicContact CD1-CG 3.93Å; M188-L192 HydrophobicContact CB-CD1 4.39Å; M188-L192 HydrophobicContact CG-CD1 4.47Å; M188-V417 HydrophobicContact CE-CG2 4.21Å; M188-V417 HydrophobicContact SD-CB 4.5Å; M188-V417 HydrophobicContact SD-CG1 4.36Å; M188-V417 HydrophobicContact SD-CG2 3.76Å; M188-A418 HydrophobicContact CB-CB 4.05Å; M188-W421 HydrophobicContact CB-CB 4.47Å; M188-W421 HydrophobicContact CE-CB 4.4Å; M188-W421 HydrophobicContact CE-CG 4.3Å; M188-W421 HydrophobicContact CG-CB 4.13Å; M188-W421 HydrophobicContact CG-CG 3.96Å; M188-W421 HydrophobicContact SD-CB 3.66Å; M188-W421 HydrophobicContact SD-CG 3.96Å; M188-N422 PolarHBondContact N-OD1 3.03Å; M188-N422 PolarHBondContact O-ND2 3.27Å
189	A	92.9	Very high	92.6	Very high	17 Å²	17	34.2 Å²	34.2	14%	0.14	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-69.8	144.8	176.7	0	0	0	0	0	111.8	D162 F191 L192	D162-A189 HydrophobicContact CB-CB 4.04Å; A189-F191 HydrophobicContact CB-CD1 3.59Å; A189-F191 HydrophobicContact CB-CE1 3.2Å; A189-F191 HydrophobicContact CB-CE2 4.22Å; A189-F191 HydrophobicContact CB-CG 4.26Å; A189-F191 HydrophobicContact CB-CZ 3.56Å; A189-F191 PolarHBondContact O-N 3.01Å; A189-F191 VanDerWaalsContact O-N 3.13Å; A189-L192 WeakPolarHBondContact O-CB 3.26Å; A189-L192 PolarHBondContact O-N 3.11Å
190	G	90.9	Very high	92.7	Very high	59 Å²	59	34 Å²	34	61%	0.608	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-63.7	-17.7	-178.4	0	0	0	0	0	114.9	L192 E193	G190-L192 VanDerWaalsContact C-N 3.26Å; G190-L192 PolarHBondContact O-N 3.02Å; G190-E193 WeakPolarHBondContact O-CB 3.32Å; G190-E193 PolarHBondContact O-N 3.23Å
191	F	90.3	Very high	92.8	Very high	119 Å²	119	33.1 Å²	33.1	52%	0.522	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-76.6	-10.8	174.3	64.5	-106.8	0	0	0	113.5	D162 V164 A189 E193	D162-F191 VanDerWaalsContact O-CZ 3.26Å; D162-F191 WeakPolarHBondContact O-CZ 3.44Å; V164-F191 HydrophobicContact CB-CE2 4.33Å; V164-F191 HydrophobicContact CG1-CE2 3.89Å; V164-F191 HydrophobicContact CG2-CD2 4.22Å; V164-F191 HydrophobicContact CG2-CE2 3.48Å; V164-F191 VanDerWaalsContact CG2-CE2 3.48Å; V164-F191 HydrophobicContact CG2-CZ 4.13Å; A189-F191 HydrophobicContact CB-CD1 3.59Å; A189-F191 HydrophobicContact CB-CE1 3.2Å; A189-F191 HydrophobicContact CB-CE2 4.22Å; A189-F191 HydrophobicContact CB-CG 4.26Å; A189-F191 HydrophobicContact CB-CZ 3.56Å; A189-F191 PolarHBondContact O-N 3.01Å; A189-F191 VanDerWaalsContact O-N 3.13Å; F191-E193 PolarHBondContact O-N 2.84Å
192	L	91.2	Very high	92.7	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-78.4	-5.2	173.3	-69.5	173.2	0	0	0	112.7	L159 V164 W175 M188 A189 G190 N194 E195 I196 V417	L159-L192 HydrophobicContact CD1-CD2 4.11Å; V164-L192 HydrophobicContact CG1-CD2 3.36Å; W175-L192 HydrophobicContact CE3-CD2 4.43Å; W175-L192 HydrophobicContact CZ3-CD2 4.13Å; M188-L192 HydrophobicContact CB-CD1 4.39Å; M188-L192 HydrophobicContact CG-CD1 4.47Å; A189-L192 WeakPolarHBondContact O-CB 3.26Å; A189-L192 PolarHBondContact O-N 3.11Å; G190-L192 VanDerWaalsContact C-N 3.26Å; G190-L192 PolarHBondContact O-N 3.02Å; L192-N194 PolarHBondContact O-N 3.26Å; L192-E195 WeakPolarHBondContact O-CB 3.43Å; L192-E195 PolarHBondContact O-N 3.4Å; L192-I196 HydrophobicContact CB-CG1 4.35Å; L192-I196 HydrophobicContact CD2-CD1 4.09Å; L192-V417 HydrophobicContact CB-CG1 4.47Å; L192-V417 WeakPolarHBondContact O-CG1 3.37Å
193	E	88.3	Confident	92.5	Very high	49 Å²	49	31.9 Å²	31.9	23%	0.229	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	122.8	-179.7	-167.7	60.4	-152.6	0	0	110.9	G190 F191 E195 K416 V417 A418	G190-E193 WeakPolarHBondContact O-CB 3.32Å; G190-E193 PolarHBondContact O-N 3.23Å; F191-E193 PolarHBondContact O-N 2.84Å; E193-E195 PolarHBondContact O-N 3.46Å; E193-K416 WeakPolarHBondContact OE1-CA 2.97Å; E193-K416 WeakPolarHBondContact OE1-CB 3.42Å; E193-K416 WeakPolarHBondContact OE1-CG 3.44Å; E193-K416 PolarHBondContact OE1-N 2.77Å; E193-V417 PolarHBondContact OE2-N 3.15Å; E193-V417 VanDerWaalsContact OE2-N 3.12Å; E193-A418 PolarHBondContact OE2-N 3.32Å
194	N	84.6	Confident	92.2	Very high	76 Å²	76	32.4 Å²	32.4	41%	0.406	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	11.5	-172.8	-47.8	-61.9	0	0	0	115.9	L192 W413	L192-N194 PolarHBondContact O-N 3.26Å; N194-W413 VanDerWaalsContact CB-CD1 3.5Å; N194-W413 HydrophobicContact CB-CG 4.11Å; N194-W413 WeakPolarHBondContact O-CB 3.45Å; N194-W413 PolarHBondContact OD1-NE1 2.69Å
195	E	91.1	Very high	91.9	Very high	76 Å²	76	31.4 Å²	31.4	36%	0.355	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-32.4	175.3	-66.3	-63.9	157.2	0	0	112.3	R169 W175 L192 E193 N197	R169-E195 PolarHBondContact NH1-O 2.83Å; R169-E195 IonicContact NH1-OE2 3.39Å; R169-E195 PolarHBondContact NH1-OE2 2.91Å; W175-E195 HydrophobicContact CE3-CB 4.02Å; W175-E195 HydrophobicContact CZ3-CB 4.06Å; L192-E195 WeakPolarHBondContact O-CB 3.43Å; L192-E195 PolarHBondContact O-N 3.4Å; E193-E195 PolarHBondContact O-N 3.46Å; E195-N197 PolarHBondContact O-N 3.41Å
196	I	93.9	Very high	91.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.162	C	C	.	.			trans	-75.1	123.7	-178.6	-57.8	-58.3	0	0	0	110.3	L159 W175 L192 F198 T199 W413 V414 V417	L159-I196 HydrophobicContact CD1-CD1 3.57Å; W175-I196 HydrophobicContact CB-CD1 4.44Å; L192-I196 HydrophobicContact CB-CG1 4.35Å; L192-I196 HydrophobicContact CD2-CD1 4.09Å; I196-F198 WeakPolarHBondContact CG2-O 3.24Å; I196-T199 HydrophobicContact CG2-CG2 3.98Å; I196-W413 CarbonylContact O-C 3.5Å; I196-W413 VanDerWaalsContact O-CA 3.23Å; I196-W413 WeakPolarHBondContact O-CA 3.37Å; I196-W413 WeakPolarHBondContact O-CB 3.31Å; I196-V414 PolarHBondContact O-N 2.81Å; I196-V417 HydrophobicContact CB-CG1 4.26Å; I196-V417 HydrophobicContact CB-CG2 4.21Å; I196-V417 HydrophobicContact CG1-CG1 3.92Å; I196-V417 HydrophobicContact CG1-CG2 4.28Å; I196-V417 HydrophobicContact CG2-CG2 4.4Å
197	N	93.7	Very high	91.7	Very high	14 Å²	14	27.8 Å²	27.8	8%	0.075	16%	0.16	C	C	.	.	S	Bend	trans	-77.8	-46.2	172.1	-52.2	91	0	0	0	111.1	R169 L174 W175 E195 Y412	R169-N197 PolarHBondContact NH2-OD1 2.91Å; 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 2.61Å; E195-N197 PolarHBondContact O-N 3.41Å; N197-Y412 WeakPolarHBondContact CA-O 3.31Å; N197-Y412 WeakPolarHBondContact CB-O 3.45Å; N197-Y412 PolarHBondContact ND2-O 2.89Å; N197-Y412 WeakPolarHBondContact O-CD1 3.16Å; N197-Y412 WeakPolarHBondContact O-CE1 3.32Å
198	F	94.3	Very high	91.6	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137	-171.2	-55	-63	0	0	0	111.3	L174 W175 F176 S177 I196 T207 L402 F409 Y412	L174-F198 HydrophobicContact CD1-CE2 4.33Å; L174-F198 HydrophobicContact CD2-CE2 4.28Å; W175-F198 PolarHBondContact O-N 2.74Å; F176-F198 CarbonylContact C-O 3.55Å; F176-F198 VanDerWaalsContact CA-O 3.3Å; F176-F198 WeakPolarHBondContact CA-O 3.47Å; F176-F198 HydrophobicContact CD1-CB 3.58Å; F176-F198 AromaticContact CD1-CD2 4Å; F176-F198 HydrophobicContact CD1-CD2 4Å; F176-F198 HydrophobicContact CD1-CG 4.22Å; F176-F198 HydrophobicContact CD2-CD2 4.42Å; F176-F198 HydrophobicContact CE1-CB 3.71Å; F176-F198 AromaticContact CE1-CD2 3.41Å; F176-F198 HydrophobicContact CE1-CD2 3.41Å; F176-F198 VanDerWaalsContact CE1-CD2 3.41Å; F176-F198 HydrophobicContact CE1-CE2 4.33Å; F176-F198 AromaticContact CE1-CG 3.86Å; F176-F198 HydrophobicContact CE1-CG 3.86Å; F176-F198 AromaticContact CE2-CD2 3.89Å; F176-F198 HydrophobicContact CE2-CD2 3.89Å; F176-F198 HydrophobicContact CE2-CE2 4.47Å; F176-F198 HydrophobicContact CG-CB 4.29Å; F176-F198 HydrophobicContact CG-CD2 4.47Å; F176-F198 HydrophobicContact CZ-CB 4.49Å; F176-F198 AromaticContact CZ-CD2 3.36Å; F176-F198 HydrophobicContact CZ-CD2 3.36Å; F176-F198 AromaticContact CZ-CE2 3.94Å; F176-F198 HydrophobicContact CZ-CE2 3.94Å; F176-F198 HydrophobicContact CZ-CG 4.27Å; S177-F198 PolarHBondContact N-O 3.29Å; I196-F198 WeakPolarHBondContact CG2-O 3.24Å; F198-T207 HydrophobicContact CB-CG2 4.05Å; F198-T207 HydrophobicContact CD1-CG2 3.49Å; F198-T207 VanDerWaalsContact CD1-CG2 3.49Å; F198-T207 HydrophobicContact CE1-CG2 4.37Å; F198-T207 HydrophobicContact CG-CG2 4.16Å; F198-L402 HydrophobicContact CB-CD1 4.46Å; F198-L402 HydrophobicContact CD1-CD1 3.89Å; F198-L402 HydrophobicContact CD2-CB 4.43Å; F198-L402 HydrophobicContact CD2-CD1 4.17Å; F198-L402 HydrophobicContact CE1-CD1 4.09Å; F198-L402 HydrophobicContact CE1-CD2 3.95Å; F198-L402 HydrophobicContact CE2-CB 4.07Å; F198-L402 HydrophobicContact CE2-CD1 4.36Å; F198-L402 HydrophobicContact CG-CD1 3.9Å; F198-L402 HydrophobicContact CZ-CB 4.27Å; F198-L402 HydrophobicContact CZ-CD1 4.32Å; F198-L402 HydrophobicContact CZ-CD2 3.96Å; F198-L402 HydrophobicContact CZ-CG 4.43Å; F198-F409 HydrophobicContact CE1-CZ 4.41Å; F198-F409 HydrophobicContact CZ-CE2 4.37Å; F198-F409 HydrophobicContact CZ-CZ 4.04Å; F198-Y412 HydrophobicContact CD1-CD1 4.08Å; F198-Y412 HydrophobicContact CD1-CE1 4.11Å; F198-Y412 AromaticContact CE1-CD1 3.71Å; F198-Y412 HydrophobicContact CE1-CD1 3.71Å; F198-Y412 HydrophobicContact CE1-CE1 4.1Å; F198-Y412 HydrophobicContact CZ-CD1 4.47Å
199	T	94.4	Very high	91.4	Very high	4 Å²	4	26 Å²	26	3%	0.025	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.6	178.2	52.5	0	0	0	0	110.8	I196 S206 T207 I208 V414 V417 W420	I196-T199 HydrophobicContact CG2-CG2 3.98Å; T199-S206 WeakPolarHBondContact OG1-CA 3.31Å; T199-T207 PolarHBondContact N-OG1 2.98Å; T199-T207 VanDerWaalsContact N-OG1 3.07Å; T199-T207 WeakPolarHBondContact O-CB 3.48Å; T199-T207 PolarHBondContact O-N 3.37Å; T199-T207 VanDerWaalsContact O-N 3.13Å; T199-T207 PolarHBondContact OG1-N 2.93Å; T199-T207 PolarHBondContact OG1-OG1 2.82Å; T199-I208 PolarHBondContact O-N 2.82Å; T199-V414 HydrophobicContact CG2-CB 4.48Å; T199-V414 HydrophobicContact CG2-CG1 4.46Å; T199-V414 HydrophobicContact CG2-CG2 4.02Å; T199-V417 HydrophobicContact CG2-CG2 3.68Å; T199-W420 HydrophobicContact CG2-CE3 4.41Å; T199-W420 HydrophobicContact CG2-CH2 4.13Å; T199-W420 HydrophobicContact CG2-CZ3 3.7Å
200	I	94.8	Very high	91.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	109.1	177.8	-45.1	173	0	0	0	107.4	F176 S177 L178 I179 I208 P395 M399	F176-I200 HydrophobicContact CB-CD1 4.19Å; F176-I200 HydrophobicContact CD1-CD1 4.01Å; F176-I200 HydrophobicContact CD1-CG1 4.43Å; S177-I200 WeakPolarHBondContact O-CA 3.32Å; S177-I200 WeakPolarHBondContact O-CB 3.46Å; S177-I200 PolarHBondContact O-N 3.41Å; L178-I200 HydrophobicContact CB-CB 4.27Å; L178-I200 HydrophobicContact CB-CD1 4.21Å; L178-I200 HydrophobicContact CD1-CD1 4.2Å; L178-I200 HydrophobicContact CG-CB 4.11Å; L178-I200 HydrophobicContact CG-CD1 4.25Å; L178-I200 HydrophobicContact CG-CG2 4.1Å; I179-I200 PolarHBondContact N-O 2.89Å; I179-I200 VanDerWaalsContact N-O 3.08Å; I200-I208 WeakPolarHBondContact CA-O 3.34Å; I200-I208 HydrophobicContact CB-CB 4.4Å; I200-I208 HydrophobicContact CD1-CD1 4.23Å; I200-I208 HydrophobicContact CG1-CB 4.05Å; I200-I208 HydrophobicContact CG1-CD1 4Å; I200-I208 HydrophobicContact CG1-CG1 4.48Å; I200-I208 HydrophobicContact CG2-CB 4.2Å; I200-I208 HydrophobicContact CG2-CG2 4.1Å; I200-P395 HydrophobicContact CG2-CB 3.64Å; I200-P395 HydrophobicContact CG2-CG 4.28Å; I200-M399 HydrophobicContact CD1-CE 4.29Å; I200-M399 HydrophobicContact CD1-CG 3.57Å; I200-M399 HydrophobicContact CD1-SD 3.48Å; I200-M399 WeakPolarHBondContact CD1-SD 3.49Å
201	S	94.3	Very high	91.5	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	178.6	178.6	86.7	0	0	0	0	112.2	I179 R203 S206 I208 S210	I179-S201 WeakPolarHBondContact O-CA 3.38Å; I179-S201 WeakPolarHBondContact O-CB 3.46Å; S201-R203 PolarHBondContact O-N 2.84Å; S201-R203 PolarHBondContact OG-N 3.44Å; S201-S206 PolarHBondContact OG-OG 3.03Å; S201-I208 PolarHBondContact N-O 3.5Å; S201-S210 CarbonylContact C-O 3.55Å; S201-S210 PolarHBondContact O-N 2.79Å
202	F	92.8	Very high	91.6	Very high	5 Å²	5	18.6 Å²	18.6	2%	0.022	9%	0.092	C	C	.	.	S	Bend	trans	-70.9	-9.5	172	60.8	-98.6	0	0	0	113.8	Q180 Y209 Y212 E314 Y315 W421	Q180-F202 WeakPolarHBondContact O-CD1 3.09Å; F202-Y209 WeakPolarHBondContact O-CE2 3.41Å; F202-Y212 HydrophobicContact CD1-CE2 4.37Å; F202-E314 WeakPolarHBondContact CD2-O 3.21Å; F202-Y315 AromaticContact CD1-CD2 3.75Å; F202-Y315 HydrophobicContact CD1-CD2 3.75Å; F202-Y315 HydrophobicContact CD1-CE2 4.23Å; F202-Y315 HydrophobicContact CD2-CD2 4.23Å; F202-Y315 AromaticContact CE1-CD2 3.36Å; F202-Y315 HydrophobicContact CE1-CD2 3.36Å; F202-Y315 AromaticContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CG 4.41Å; F202-Y315 AromaticContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CG 4.29Å; F202-Y315 HydrophobicContact CG-CD2 4.18Å; F202-Y315 AromaticContact CZ-CD2 3.46Å; F202-Y315 HydrophobicContact CZ-CD2 3.46Å; F202-Y315 VanDerWaalsContact CZ-CD2 3.46Å; F202-Y315 HydrophobicContact CZ-CE2 4.36Å; F202-Y315 HydrophobicContact CZ-CG 4.1Å; F202-W421 AromaticContact CE1-CH2 3.6Å; F202-W421 HydrophobicContact CE1-CH2 3.6Å; F202-W421 HydrophobicContact CE1-CZ3 4.2Å; F202-W421 AromaticContact CZ-CH2 3.79Å; F202-W421 HydrophobicContact CZ-CH2 3.79Å; F202-W421 HydrophobicContact CZ-CZ3 4.11Å
203	R	91.5	Very high	91.7	Very high	25 Å²	25	18.5 Å²	18.5	9%	0.094	9%	0.092	C	C	.	.	S	Bend	trans	-74	135.2	178.2	-63.5	-180	56.5	132.7	0.3	110.9	S201 D205 S206 E314 W420 W421	S201-R203 PolarHBondContact O-N 2.84Å; S201-R203 PolarHBondContact OG-N 3.44Å; R203-D205 VanDerWaalsContact CB-OD1 3.23Å; R203-D205 WeakPolarHBondContact CB-OD1 3.25Å; R203-D205 IonicContact CZ-OD1 3.23Å; R203-D205 IonicContact CZ-OD2 2.75Å; R203-D205 IonicContact NE-OD1 3.99Å; R203-D205 PolarHBondContact NE-OD1 2.68Å; R203-D205 IonicContact NE-OD2 2.75Å; R203-D205 IonicContact NH2-OD1 3.21Å; R203-D205 PolarHBondContact NH2-OD1 2.97Å; R203-D205 IonicContact NH2-OD2 3.87Å; R203-D205 PolarHBondContact NH2-OD2 3.25Å; R203-D205 PolarHBondContact O-N 3.2Å; R203-S206 WeakPolarHBondContact O-CB 3.38Å; R203-S206 PolarHBondContact O-N 3.36Å; R203-S206 VanDerWaalsContact O-N 3.09Å; R203-S206 PolarHBondContact O-OG 3.45Å; R203-E314 WeakPolarHBondContact CA-OE2 3.35Å; R203-W420 HydrophobicContact CB-CZ2 4.07Å; R203-W420 HydrophobicContact CG-CZ2 4.42Å; R203-W420 PolarHBondContact NH1-O 3.36Å; R203-W420 VanDerWaalsContact NH2-NE1 3.18Å; R203-W421 HydrophobicContact CG-CZ3 4.26Å
204	L	87.6	Confident	92	Very high	22 Å²	22	17.8 Å²	17.8	12%	0.115	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.2	178.9	-68.3	178.4	0	0	0	112.8	V90 R96 Y209 E314	V90-L204 HydrophobicContact CB-CD2 4.32Å; V90-L204 HydrophobicContact CG1-CD2 3.75Å; V90-L204 HydrophobicContact CG2-CD1 4.08Å; V90-L204 HydrophobicContact CG2-CD2 3.55Å; R96-L204 WeakPolarHBondContact CG-O 3.41Å; L204-Y209 HydrophobicContact CD2-CD2 3.97Å; L204-Y209 HydrophobicContact CD2-CE1 4.13Å; L204-Y209 HydrophobicContact CD2-CE2 3.45Å; L204-Y209 VanDerWaalsContact CD2-CE2 3.45Å; L204-Y209 HydrophobicContact CD2-CG 4.48Å; L204-Y209 HydrophobicContact CG-CE2 4.23Å; L204-E314 VanDerWaalsContact CD1-OE1 3.31Å; L204-E314 WeakPolarHBondContact CD1-OE1 3.48Å; L204-E314 PolarHBondContact N-OE2 2.97Å
205	D	87.2	Confident	92.4	Very high	50 Å²	50	15.5 Å²	15.5	27%	0.267	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	21	179.1	71.3	-13.1	0	0	0	113.1	F97 R203 W420	F97-D205 VanDerWaalsContact CE2-C 3.42Å; F97-D205 HydrophobicContact CE2-CB 4.48Å; F97-D205 WeakPolarHBondContact CE2-O 3.43Å; F97-D205 VanDerWaalsContact CZ-CA 3.47Å; F97-D205 HydrophobicContact CZ-CB 3.71Å; F97-D205 WeakPolarHBondContact CZ-O 3.23Å; R203-D205 VanDerWaalsContact CB-OD1 3.23Å; R203-D205 WeakPolarHBondContact CB-OD1 3.25Å; R203-D205 IonicContact CZ-OD1 3.23Å; R203-D205 IonicContact CZ-OD2 2.75Å; R203-D205 IonicContact NE-OD1 3.99Å; R203-D205 PolarHBondContact NE-OD1 2.68Å; R203-D205 IonicContact NE-OD2 2.75Å; R203-D205 IonicContact NH2-OD1 3.21Å; R203-D205 PolarHBondContact NH2-OD1 2.97Å; R203-D205 IonicContact NH2-OD2 3.87Å; R203-D205 PolarHBondContact NH2-OD2 3.25Å; R203-D205 PolarHBondContact O-N 3.2Å; D205-W420 WeakPolarHBondContact OD1-CZ2 3.23Å; D205-W420 PolarHBondContact OD1-NE1 3.49Å; D205-W420 PolarHBondContact OD2-NE1 2.98Å
206	S	91.8	Very high	92.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	S	Bend	trans	-80.6	154.7	166.2	-50.2	0	0	0	0	111	R96 T199 S201 R203 I208	R96-S206 WeakPolarHBondContact CB-O 3.17Å; T199-S206 WeakPolarHBondContact OG1-CA 3.31Å; S201-S206 PolarHBondContact OG-OG 3.03Å; R203-S206 WeakPolarHBondContact O-CB 3.38Å; R203-S206 PolarHBondContact O-N 3.36Å; R203-S206 VanDerWaalsContact O-N 3.09Å; R203-S206 PolarHBondContact O-OG 3.45Å; S206-I208 VanDerWaalsContact C-N 3.27Å; S206-I208 WeakPolarHBondContact CB-O 3.48Å; S206-I208 PolarHBondContact O-N 3.14Å
207	T	91.1	Very high	92.5	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.018	9%	0.085	C	C	.	.	S	Bend	trans	-54.5	-47.3	171.8	-49.2	0	0	0	0	111.2	R96 L99 F198 T199 L402	R96-T207 PolarHBondContact N-O 3.25Å; L99-T207 HydrophobicContact CD1-CG2 3.47Å; L99-T207 VanDerWaalsContact CD1-CG2 3.47Å; F198-T207 HydrophobicContact CB-CG2 4.05Å; F198-T207 HydrophobicContact CD1-CG2 3.49Å; F198-T207 VanDerWaalsContact CD1-CG2 3.49Å; F198-T207 HydrophobicContact CE1-CG2 4.37Å; F198-T207 HydrophobicContact CG-CG2 4.16Å; T199-T207 PolarHBondContact N-OG1 2.98Å; T199-T207 VanDerWaalsContact N-OG1 3.07Å; T199-T207 WeakPolarHBondContact O-CB 3.48Å; T199-T207 PolarHBondContact O-N 3.37Å; T199-T207 VanDerWaalsContact O-N 3.13Å; T199-T207 PolarHBondContact OG1-N 2.93Å; T199-T207 PolarHBondContact OG1-OG1 2.82Å; T207-L402 HydrophobicContact CG2-CD1 4.13Å
208	I	92.4	Very high	92.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	111.2	174.6	-59.7	169.7	0	0	0	108.1	P94 L95 F176 T199 I200 S201 S206 S210 P395 A398 M399 L402	P94-I208 HydrophobicContact CB-CG2 4.04Å; P94-I208 CarbonylContact O-C 3.44Å; P94-I208 WeakPolarHBondContact O-CA 3.49Å; L95-I208 HydrophobicContact CD2-CG1 3.9Å; F176-I208 HydrophobicContact CE1-CD1 4.34Å; T199-I208 PolarHBondContact O-N 2.82Å; I200-I208 WeakPolarHBondContact CA-O 3.34Å; I200-I208 HydrophobicContact CB-CB 4.4Å; I200-I208 HydrophobicContact CD1-CD1 4.23Å; I200-I208 HydrophobicContact CG1-CB 4.05Å; I200-I208 HydrophobicContact CG1-CD1 4Å; I200-I208 HydrophobicContact CG1-CG1 4.48Å; I200-I208 HydrophobicContact CG2-CB 4.2Å; I200-I208 HydrophobicContact CG2-CG2 4.1Å; S201-I208 PolarHBondContact N-O 3.5Å; S206-I208 VanDerWaalsContact C-N 3.27Å; S206-I208 WeakPolarHBondContact CB-O 3.48Å; S206-I208 PolarHBondContact O-N 3.14Å; I208-S210 PolarHBondContact O-N 3.41Å; I208-P395 HydrophobicContact CG2-CB 3.72Å; I208-A398 HydrophobicContact CD1-CB 3.71Å; I208-A398 HydrophobicContact CG1-CB 3.87Å; I208-A398 HydrophobicContact CG2-CB 4.19Å; I208-M399 HydrophobicContact CD1-CG 3.77Å; I208-L402 HydrophobicContact CD1-CD1 3.98Å; I208-L402 HydrophobicContact CG1-CD1 4.28Å
209	Y	90.6	Very high	92.5	Very high	17 Å²	17	26.4 Å²	26.4	7%	0.067	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	118.4	171.5	179	-119.5	0	0	0	110.6	V90 P94 R96 F202 L204 P211	V90-Y209 HydrophobicContact CG1-CD1 4.04Å; V90-Y209 HydrophobicContact CG1-CE1 3.17Å; P94-Y209 PolarHBondContact O-N 3.49Å; R96-Y209 VanDerWaalsContact NH2-CD1 3.3Å; F202-Y209 WeakPolarHBondContact O-CE2 3.41Å; L204-Y209 HydrophobicContact CD2-CD2 3.97Å; L204-Y209 HydrophobicContact CD2-CE1 4.13Å; L204-Y209 HydrophobicContact CD2-CE2 3.45Å; L204-Y209 VanDerWaalsContact CD2-CE2 3.45Å; L204-Y209 HydrophobicContact CD2-CG 4.48Å; L204-Y209 HydrophobicContact CG-CE2 4.23Å; Y209-P211 HydrophobicContact CD1-CG 4.12Å; Y209-P211 HydrophobicContact CE1-CB 4.02Å; Y209-P211 VanDerWaalsContact CE1-CD 3.5Å; Y209-P211 HydrophobicContact CE1-CG 3.42Å; Y209-P211 VanDerWaalsContact CE1-CG 3.42Å; Y209-P211 HydrophobicContact CE2-CB 3.91Å; Y209-P211 HydrophobicContact CE2-CG 4.18Å; Y209-P211 VanDerWaalsContact CZ-CB 3.49Å; Y209-P211 VanDerWaalsContact CZ-CG 3.47Å; Y209-P211 WeakPolarHBondContact OH-CB 3.23Å
210	S	92.3	Very high	92.1	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.014	16%	0.156	C	C	.	.			trans	-134.8	78.5	-179.3	-176.3	0	0	0	0	109.4	Q180 S201 I208	Q180-S210 PolarHBondContact NE2-O 3.11Å; Q180-S210 PolarHBondContact NE2-OG 2.99Å; Q180-S210 VanDerWaalsContact NE2-OG 3.15Å; Q180-S210 PolarHBondContact OE1-O 3.16Å; S201-S210 CarbonylContact C-O 3.55Å; S201-S210 PolarHBondContact O-N 2.79Å; I208-S210 PolarHBondContact O-N 3.41Å
211	P	93.2	Very high	91.7	Very high	16 Å²	16	40.8 Å²	40.8	10%	0.104	19%	0.191	C	C	.	.			trans	-77.1	166.3	-179.1	34.9	-38.7	0	0	0	112.6	Y209 G213	Y209-P211 HydrophobicContact CD1-CG 4.12Å; Y209-P211 HydrophobicContact CE1-CB 4.02Å; Y209-P211 VanDerWaalsContact CE1-CD 3.5Å; Y209-P211 HydrophobicContact CE1-CG 3.42Å; Y209-P211 VanDerWaalsContact CE1-CG 3.42Å; Y209-P211 HydrophobicContact CE2-CB 3.91Å; Y209-P211 HydrophobicContact CE2-CG 4.18Å; Y209-P211 VanDerWaalsContact CZ-CB 3.49Å; Y209-P211 VanDerWaalsContact CZ-CG 3.47Å; Y209-P211 WeakPolarHBondContact OH-CB 3.23Å; P211-G213 WeakPolarHBondContact CB-O 3.24Å; P211-G213 PolarHBondContact O-N 3.11Å
212	Y	93.4	Very high	91.5	Very high	23 Å²	23	42.2 Å²	42.2	9%	0.09	20%	0.198	C	C	.	.	S	Bend	trans	-71	-16.2	170.7	-75.3	-94.7	0	0	0	113.7	Q180 F202 Y315 T317 Y391	Q180-Y212 VanDerWaalsContact C-OH 3.32Å; Q180-Y212 VanDerWaalsContact O-CE2 3.29Å; Q180-Y212 WeakPolarHBondContact O-CE2 3.22Å; Q180-Y212 PolarHBondContact O-OH 2.81Å; F202-Y212 HydrophobicContact CD1-CE2 4.37Å; Y212-Y315 HydrophobicContact CE2-CE2 4.14Å; Y212-T317 HydrophobicContact CD2-CG2 4.01Å; Y212-T317 HydrophobicContact CE2-CG2 4.01Å; Y212-T317 HydrophobicContact CG-CG2 4.37Å; Y212-Y391 HydrophobicContact CD1-CD2 4.15Å; Y212-Y391 HydrophobicContact CD1-CE2 4.1Å; Y212-Y391 HydrophobicContact CE1-CE2 4.29Å; Y212-Y391 PolarHBondContact O-N 2.82Å
213	G	93.6	Very high	91.3	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.1	172.2	177.4	0	0	0	0	0	111.5	P211 Y321 H389	P211-G213 WeakPolarHBondContact CB-O 3.24Å; P211-G213 PolarHBondContact O-N 3.11Å; G213-Y321 WeakPolarHBondContact O-CE2 3.46Å; G213-Y321 VanDerWaalsContact O-CZ 3.32Å; G213-Y321 PolarHBondContact O-OH 3.27Å; G213-H389 CarbonylContact C-O 3.47Å; G213-H389 WeakPolarHBondContact CA-O 3.44Å
214	S	93	Very high	91.2	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	162.8	179.9	60	0	0	0	0	111.2	I388 H389	S214-I388 WeakPolarHBondContact O-CA 3.32Å; S214-H389 PolarHBondContact N-O 2.85Å; S214-H389 PolarHBondContact O-N 3.3Å
215	Y	94.3	Very high	91.4	Very high	28 Å²	28	49.8 Å²	49.8	11%	0.11	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126	168.2	173	-115.7	0	0	0	110.3	P217 Y228 P346 W382 H385 I387 I388	Y215-P217 HydrophobicContact CE1-CB 3.82Å; Y215-P217 HydrophobicContact CE1-CG 4.3Å; Y215-Y228 PolarHBondContact OH-OH 3.28Å; Y215-P346 HydrophobicContact CD1-CB 4.04Å; Y215-P346 HydrophobicContact CD1-CG 4.31Å; Y215-P346 HydrophobicContact CD2-CB 3.97Å; Y215-P346 HydrophobicContact CD2-CG 3.62Å; Y215-P346 HydrophobicContact CE1-CB 4.16Å; Y215-P346 HydrophobicContact CE2-CB 4.06Å; Y215-P346 HydrophobicContact CE2-CG 4.12Å; Y215-P346 HydrophobicContact CG-CB 3.94Å; Y215-P346 HydrophobicContact CG-CG 3.71Å; Y215-W382 HydrophobicContact CD2-CE3 4.45Å; Y215-W382 AromaticContact CE2-CE3 3.94Å; Y215-W382 HydrophobicContact CE2-CE3 3.94Å; Y215-H385 PolarHBondContact OH-O 2.81Å; Y215-I387 WeakPolarHBondContact CD2-O 3.34Å; Y215-I388 HydrophobicContact CD2-CD1 3.95Å; Y215-I388 HydrophobicContact CG-CD1 4.45Å
216	E	92.3	Very high	91.7	Very high	75 Å²	75	48.9 Å²	48.9	35%	0.35	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	106	172.4	-175.7	174.7	160.3	0	0	109.1	K92 G386 I387 H389	K92-E216 IonicContact NZ-OE2 3.96Å; E216-G386 CarbonylContact O-C 3.6Å; E216-G386 WeakPolarHBondContact O-CA 3.3Å; E216-I387 HydrophobicContact CB-CG2 3.92Å; E216-I387 PolarHBondContact N-O 2.69Å; E216-I387 PolarHBondContact O-N 3.07Å; E216-H389 IonicContact OE2-NE2 3.91Å; E216-H389 PolarHBondContact OE2-NE2 3.22Å
217	P	94.6	Very high	91.9	Very high	21 Å²	21	57.4 Å²	57.4	14%	0.136	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.2	173.8	28.9	-32.9	0	0	0	110.3	Y215 I219 H222	Y215-P217 HydrophobicContact CE1-CB 3.82Å; Y215-P217 HydrophobicContact CE1-CG 4.3Å; P217-I219 PolarHBondContact O-N 2.99Å; P217-H222 HydrophobicContact CB-CB 4.05Å; P217-H222 HydrophobicContact CG-CB 4.47Å
218	Y	94.6	Very high	92.1	Very high	149 Å²	149	58.5 Å²	58.5	58%	0.584	28%	0.276	S	S	*	.	S	Bend	trans	-65.1	-27.3	176.8	-60.4	-34.4	0	0	0	112.5	G384 H385 G386 I387	Y218-G384 WeakPolarHBondContact CE2-O 3.18Å; Y218-H385 VanDerWaalsContact CD2-C 3.4Å; Y218-H385 PolarHBondContact N-O 3.05Å; Y218-G386 PolarHBondContact OH-O 3.44Å; Y218-I387 HydrophobicContact CE1-CB 4.17Å; Y218-I387 HydrophobicContact CE1-CG2 4.27Å
219	I	93.1	Very high	92.3	Very high	75 Å²	75	62.6 Å²	62.6	39%	0.385	30%	0.303	S	S	.	.	S	Bend	trans	-101.5	110.8	172.5	-63.3	171.1	0	0	0	108.1	P217 H221 H222	P217-I219 PolarHBondContact O-N 2.99Å; I219-H221 VanDerWaalsContact C-N 3.27Å; I219-H221 WeakPolarHBondContact CG2-CE1 3.24Å; I219-H221 VanDerWaalsContact CG2-ND1 3.35Å; I219-H221 WeakPolarHBondContact CG2-ND1 3.49Å; I219-H221 PolarHBondContact O-N 3.14Å; I219-H221 VanDerWaalsContact O-N 3.11Å; I219-H222 VanDerWaalsContact CD1-CE1 3.41Å; I219-H222 WeakPolarHBondContact CD1-CE1 2.97Å; I219-H222 VanDerWaalsContact CG2-CD2 3.41Å; I219-H222 WeakPolarHBondContact CG2-CD2 3.47Å; I219-H222 WeakPolarHBondContact CG2-NE2 3.46Å; I219-H222 WeakPolarHBondContact O-CB 3.5Å; I219-H222 PolarHBondContact O-N 3.14Å
220	K	84.9	Confident	92.5	Very high	144 Å²	144	66.1 Å²	66.1	63%	0.626	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.8	-168.8	-171.3	179.6	177.3	-172	0	115.3	H222	K220-H222 VanDerWaalsContact C-N 3.34Å
221	H	87.5	Confident	92.6	Very high	162 Å²	162	67.2 Å²	67.2	75%	0.75	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.9	-178.1	64.6	-93.2	0	0	0	113.6	I219	I219-H221 VanDerWaalsContact C-N 3.27Å; I219-H221 WeakPolarHBondContact CG2-CE1 3.24Å; I219-H221 VanDerWaalsContact CG2-ND1 3.35Å; I219-H221 WeakPolarHBondContact CG2-ND1 3.49Å; I219-H221 PolarHBondContact O-N 3.14Å; I219-H221 VanDerWaalsContact O-N 3.11Å
222	H	90.5	Very high	92.6	Very high	34 Å²	34	73 Å²	73	16%	0.157	37%	0.371	C	S	.	.			trans	-70.4	136.4	173.1	-69.1	-172.3	0	0	0	110.3	P217 I219 K220 T226 Y228	P217-H222 HydrophobicContact CB-CB 4.05Å; P217-H222 HydrophobicContact CG-CB 4.47Å; I219-H222 VanDerWaalsContact CD1-CE1 3.41Å; I219-H222 WeakPolarHBondContact CD1-CE1 2.97Å; I219-H222 VanDerWaalsContact CG2-CD2 3.41Å; I219-H222 WeakPolarHBondContact CG2-CD2 3.47Å; I219-H222 WeakPolarHBondContact CG2-NE2 3.46Å; I219-H222 WeakPolarHBondContact O-CB 3.5Å; I219-H222 PolarHBondContact O-N 3.14Å; K220-H222 VanDerWaalsContact C-N 3.34Å; H222-T226 WeakPolarHBondContact CA-OG1 3.49Å; H222-T226 HydrophobicContact CB-CG2 4.19Å; H222-Y228 VanDerWaalsContact CB-OH 3.31Å; H222-Y228 WeakPolarHBondContact CB-OH 3.27Å; H222-Y228 AromaticContact CE1-CE1 3.63Å; H222-Y228 AromaticContact ND1-CE1 3.25Å; H222-Y228 VanDerWaalsContact ND1-CE1 3.25Å; H222-Y228 WeakPolarHBondContact ND1-CE1 3.28Å; H222-Y228 AromaticContact ND1-CZ 3.46Å; H222-Y228 PolarHBondContact ND1-OH 2.82Å
223	G	88.3	Confident	92.7	Very high	24 Å²	24	77.5 Å²	77.5	25%	0.247	39%	0.388	C	S	.	.			trans	-131.4	-172.9	-175.2	0	0	0	0	0	112.4	E225 T226 P347	G223-E225 PolarHBondContact O-N 3.36Å; G223-T226 PolarHBondContact N-OG1 2.94Å; G223-T226 WeakPolarHBondContact O-CB 3.49Å; G223-T226 PolarHBondContact O-N 3.27Å; G223-T226 PolarHBondContact O-OG1 3.21Å; G223-P347 WeakPolarHBondContact O-CG 2.9Å
224	P	89.6	Confident	92.9	Very high	49 Å²	49	80.1 Å²	80.1	32%	0.318	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.5	-176.3	-29.2	37.1	0	0	0	115.2	E342 P347	P224-E342 WeakPolarHBondContact CB-O 3.37Å; P224-E342 WeakPolarHBondContact CG-O 3.4Å; P224-P347 VanDerWaalsContact O-CB 3.32Å; P224-P347 WeakPolarHBondContact O-CB 3.12Å
225	E	91.4	Very high	93	Very high	137 Å²	137	78.6 Å²	78.6	64%	0.64	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.4	-179.4	-60.3	-62.5	173	0	0	114.1	G223 R227 Y348	G223-E225 PolarHBondContact O-N 3.36Å; E225-R227 PolarHBondContact O-N 3.47Å; E225-Y348 PolarHBondContact OE2-OH 3.46Å
226	T	93.4	Very high	93.2	Very high	31 Å²	31	77.4 Å²	77.4	19%	0.19	39%	0.386	C	S	.	.			trans	-65.3	124.5	-178.3	-63.3	0	0	0	0	110.7	H222 G223 Y228 P347	H222-T226 WeakPolarHBondContact CA-OG1 3.49Å; H222-T226 HydrophobicContact CB-CG2 4.19Å; G223-T226 PolarHBondContact N-OG1 2.94Å; G223-T226 WeakPolarHBondContact O-CB 3.49Å; G223-T226 PolarHBondContact O-N 3.27Å; G223-T226 PolarHBondContact O-OG1 3.21Å; T226-Y228 HydrophobicContact CG2-CD1 4.13Å; T226-Y228 HydrophobicContact CG2-CD2 4.24Å; T226-Y228 HydrophobicContact CG2-CE1 3.69Å; T226-Y228 HydrophobicContact CG2-CE2 3.8Å; T226-Y228 HydrophobicContact CG2-CG 4.4Å; T226-Y228 VanDerWaalsContact CG2-CZ 3.5Å; T226-P347 VanDerWaalsContact O-CB 3.24Å; T226-P347 WeakPolarHBondContact O-CB 3.42Å
227	R	95.4	Very high	93.4	Very high	180 Å²	180	78 Å²	78	68%	0.679	40%	0.398	S	S	*	.			trans	-97.4	107.7	175.6	-64.6	-74.1	-179.8	170.5	0.7	109.8	E225 Y348	E225-R227 PolarHBondContact O-N 3.47Å; R227-Y348 HydrophobicContact CG-CE2 4.14Å; R227-Y348 VanDerWaalsContact CZ-CE2 3.4Å; R227-Y348 VanDerWaalsContact CZ-OH 3.23Å; R227-Y348 PolarHBondContact NE-OH 2.94Å; R227-Y348 PolarHBondContact NH2-OH 3Å
228	Y	96.3	Very high	93.5	Very high	25 Å²	25	80.1 Å²	80.1	10%	0.098	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-85.7	156.2	176.6	-64.6	-72.9	0	0	0	111.8	Y215 H222 T226 P347 A381 W382 H385	Y215-Y228 PolarHBondContact OH-OH 3.28Å; H222-Y228 VanDerWaalsContact CB-OH 3.31Å; H222-Y228 WeakPolarHBondContact CB-OH 3.27Å; H222-Y228 AromaticContact CE1-CE1 3.63Å; H222-Y228 AromaticContact ND1-CE1 3.25Å; H222-Y228 VanDerWaalsContact ND1-CE1 3.25Å; H222-Y228 WeakPolarHBondContact ND1-CE1 3.28Å; H222-Y228 AromaticContact ND1-CZ 3.46Å; H222-Y228 PolarHBondContact ND1-OH 2.82Å; T226-Y228 HydrophobicContact CG2-CD1 4.13Å; T226-Y228 HydrophobicContact CG2-CD2 4.24Å; T226-Y228 HydrophobicContact CG2-CE1 3.69Å; T226-Y228 HydrophobicContact CG2-CE2 3.8Å; T226-Y228 HydrophobicContact CG2-CG 4.4Å; T226-Y228 VanDerWaalsContact CG2-CZ 3.5Å; Y228-P347 HydrophobicContact CE2-CB 4.43Å; Y228-P347 HydrophobicContact CE2-CG 3.99Å; Y228-A381 WeakPolarHBondContact CB-O 3.43Å; Y228-W382 HydrophobicContact CD2-CB 4.08Å; Y228-W382 HydrophobicContact CE2-CB 4.25Å; Y228-H385 HydrophobicContact CD1-CB 3.59Å; Y228-H385 AromaticContact CD1-CD2 3.56Å; Y228-H385 AromaticContact CD1-CG 3.29Å; Y228-H385 AromaticContact CD1-ND1 3.64Å; Y228-H385 HydrophobicContact CE1-CB 3.33Å; Y228-H385 AromaticContact CE1-CG 3.55Å; Y228-H385 AromaticContact CE1-ND1 3.89Å; Y228-H385 HydrophobicContact CE2-CB 4.42Å; Y228-H385 HydrophobicContact CG-CB 4.22Å; Y228-H385 AromaticContact CG-CD2 3.86Å; Y228-H385 AromaticContact CG-CG 3.99Å
229	P	96	Very high	93.7	Very high	87 Å²	87	73.7 Å²	73.7	57%	0.565	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-64.6	158.5	168.3	29.8	-35.4	0	0	0	111.1	A381	P229-A381 WeakPolarHBondContact O-CB 3.37Å
230	L	95.3	Very high	93.9	Very high	90 Å²	90	74.7 Å²	74.7	47%	0.471	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-59.6	145	173.8	-72.4	177.8	0	0	0	111.4	T374 N377 E378	L230-T374 HydrophobicContact CD1-CG2 4.11Å; L230-N377 HydrophobicContact CD2-CB 4.42Å; L230-E378 HydrophobicContact CD2-CB 4.29Å; L230-E378 HydrophobicContact CD2-CG 3.72Å
231	P	94.5	Very high	94.5	Very high	26 Å²	26	71.4 Å²	71.4	17%	0.169	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-63.9	147.2	176	28.8	-34.4	0	0	0	110.5	R233 I235 N377 F380	P231-R233 PolarHBondContact O-N 2.98Å; P231-I235 HydrophobicContact CG-CD1 4.28Å; P231-N377 HydrophobicContact CG-CB 4.17Å; P231-F380 HydrophobicContact CG-CB 4.45Å
232	S	93	Very high	95	Very high	138 Å²	138	66.5 Å²	66.5	97%	0.965	38%	0.376	S	S	*	.	S	Bend	trans	-66.6	-27.3	177.5	56.9	0	0	0	0	113.1
233	R	95.3	Very high	95.4	Very high	116 Å²	116	65 Å²	65	44%	0.438	37%	0.368	S	S	.	.	S	Bend	trans	-97.3	133.5	175.7	-179.3	178.2	62.9	121.5	-4.1	110	P231 I235 E328 N377	P231-R233 PolarHBondContact O-N 2.98Å; R233-I235 PolarHBondContact O-N 3.4Å; R233-E328 IonicContact CZ-OE1 3.76Å; R233-E328 IonicContact CZ-OE2 3.49Å; R233-E328 IonicContact NH1-OE1 3.98Å; R233-E328 IonicContact NH1-OE2 3.32Å; R233-E328 PolarHBondContact NH1-OE2 2.78Å; R233-E328 IonicContact NH2-OE1 2.72Å; R233-E328 PolarHBondContact NH2-OE1 3.41Å; R233-E328 IonicContact NH2-OE2 2.81Å; R233-E328 PolarHBondContact NH2-OE2 2.97Å; R233-N377 PolarHBondContact O-OD1 2.98Å
234	N	97	Very high	95.9	Very high	57 Å²	57	63.8 Å²	63.8	31%	0.305	36%	0.357	S	S	.	.			trans	-71.2	104.5	165.7	179.5	1.9	0	0	0	110.2	A236 S237 D373 N377	N234-A236 VanDerWaalsContact C-N 3.29Å; N234-A236 PolarHBondContact O-N 3.29Å; N234-A236 WeakPolarHBondContact OD1-CB 3.41Å; N234-A236 PolarHBondContact OD1-N 2.88Å; N234-S237 VanDerWaalsContact O-CB 3.22Å; N234-S237 WeakPolarHBondContact O-CB 3.39Å; N234-S237 PolarHBondContact O-N 3.48Å; N234-S237 PolarHBondContact OD1-N 3.14Å; N234-D373 PolarHBondContact ND2-OD2 3.45Å; N234-N377 PolarHBondContact OD1-ND2 2.86Å
235	I	96.8	Very high	96.2	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.3	180	-69.2	164.1	0	0	0	111.8	P231 R233 S237 K239 E328 Y376 N377 F380 H383	P231-I235 HydrophobicContact CG-CD1 4.28Å; R233-I235 PolarHBondContact O-N 3.4Å; I235-S237 PolarHBondContact O-N 3.24Å; I235-K239 VanDerWaalsContact O-CD 3.3Å; I235-K239 WeakPolarHBondContact O-CD 3.4Å; I235-K239 WeakPolarHBondContact O-CE 3.24Å; I235-E328 HydrophobicContact CG2-CB 4.03Å; I235-Y376 HydrophobicContact CB-CE1 4.48Å; I235-Y376 HydrophobicContact CG2-CE1 4.19Å; I235-N377 PolarHBondContact N-OD1 2.93Å; 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 4.35Å; I235-F380 HydrophobicContact CG2-CE1 4.19Å; I235-F380 HydrophobicContact CG2-CE2 4.28Å; I235-F380 HydrophobicContact CG2-CG 4.35Å; I235-F380 HydrophobicContact CG2-CZ 4.16Å; I235-H383 HydrophobicContact CD1-CB 4.41Å
236	A	97.5	Very high	96.3	Very high	3 Å²	3	56.7 Å²	56.7	3%	0.025	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.1	173.6	0	0	0	0	0	113.3	N234 G238 K239 D373 Y376	N234-A236 VanDerWaalsContact C-N 3.29Å; N234-A236 PolarHBondContact O-N 3.29Å; N234-A236 WeakPolarHBondContact OD1-CB 3.41Å; N234-A236 PolarHBondContact OD1-N 2.88Å; A236-G238 PolarHBondContact O-N 3.47Å; A236-K239 WeakPolarHBondContact O-CB 3.4Å; A236-K239 PolarHBondContact O-N 3.04Å; A236-K239 VanDerWaalsContact O-N 3.17Å; A236-D373 HydrophobicContact CB-CB 4.42Å; A236-Y376 HydrophobicContact CB-CD1 3.51Å; A236-Y376 HydrophobicContact CB-CE1 3.81Å; A236-Y376 HydrophobicContact CB-CG 4.23Å
237	S	97.1	Very high	96.3	Very high	87 Å²	87	55.7 Å²	55.7	61%	0.608	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	130	-174.6	-171	0	0	0	0	112.3	N234 I235 K239	N234-S237 VanDerWaalsContact O-CB 3.22Å; N234-S237 WeakPolarHBondContact O-CB 3.39Å; N234-S237 PolarHBondContact O-N 3.48Å; N234-S237 PolarHBondContact OD1-N 3.14Å; I235-S237 PolarHBondContact O-N 3.24Å; S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.39Å
238	G	96.4	Very high	96	Very high	67 Å²	67	50 Å²	50	69%	0.691	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-18.8	-179.9	0	0	0	0	0	115.5	A236 S240	A236-G238 PolarHBondContact O-N 3.47Å; G238-S240 PolarHBondContact O-N 3.4Å
239	K	98.2	Very high	95.8	Very high	14 Å²	14	51.1 Å²	51.1	6%	0.061	31%	0.308	C	S	.	.			trans	-78.1	114.7	179.5	-63.5	162.9	-179.9	-77	0	110.4	I235 A236 S237 R298 N300 Y301 K302 E328	I235-K239 VanDerWaalsContact O-CD 3.3Å; I235-K239 WeakPolarHBondContact O-CD 3.4Å; I235-K239 WeakPolarHBondContact O-CE 3.24Å; A236-K239 WeakPolarHBondContact O-CB 3.4Å; A236-K239 PolarHBondContact O-N 3.04Å; A236-K239 VanDerWaalsContact O-N 3.17Å; S237-K239 VanDerWaalsContact C-N 3.28Å; S237-K239 PolarHBondContact O-N 3.39Å; K239-R298 WeakPolarHBondContact CE-O 3.18Å; K239-R298 PolarHBondContact NZ-O 2.88Å; K239-N300 CarbonylContact C-O 3.59Å; K239-Y301 VanDerWaalsContact CD-O 3.25Å; K239-Y301 WeakPolarHBondContact CD-O 3.22Å; K239-Y301 PolarHBondContact NZ-O 2.84Å; K239-K302 HydrophobicContact CB-CG 3.81Å; K239-K302 HydrophobicContact CD-CG 4.05Å; K239-E328 WeakPolarHBondContact CE-O 3.21Å; K239-E328 PolarHBondContact NZ-O 3.21Å
240	S	96.8	Very high	95.6	Very high	95 Å²	95	49.5 Å²	49.5	66%	0.664	30%	0.298	S	S	*	.			trans	-102.2	-16.8	-179.2	59.7	0	0	0	0	114.1	G238 N300	G238-S240 PolarHBondContact O-N 3.4Å; S240-N300 PolarHBondContact N-O 3.32Å; S240-N300 VanDerWaalsContact N-O 3.17Å
241	K	98.3	Very high	95.4	Very high	75 Å²	75	52.3 Å²	52.3	33%	0.326	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	152	-179.9	-59.4	-170.9	169.5	-159.3	0	111.3	D270 N300 Y301 K302	K241-D270 IonicContact NZ-OD2 3.72Å; K241-D270 PolarHBondContact NZ-OD2 2.75Å; K241-N300 WeakPolarHBondContact CA-O 3.5Å; K241-N300 VanDerWaalsContact CB-O 3.3Å; K241-N300 WeakPolarHBondContact CB-O 3.35Å; K241-N300 HydrophobicContact CD-CB 4.32Å; K241-N300 HydrophobicContact CG-CB 4.42Å; K241-N300 PolarHBondContact N-O 3.2Å; K241-Y301 HydrophobicContact CB-CD1 3.46Å; K241-Y301 VanDerWaalsContact CB-CD1 3.46Å; K241-Y301 HydrophobicContact CB-CD2 4.33Å; K241-Y301 HydrophobicContact CB-CE1 3.54Å; K241-Y301 HydrophobicContact CB-CE2 4.43Å; K241-Y301 HydrophobicContact CB-CG 3.9Å; K241-Y301 HydrophobicContact CD-CD1 4.24Å; K241-Y301 HydrophobicContact CD-CD2 4.29Å; K241-Y301 HydrophobicContact CD-CE1 3.56Å; K241-Y301 HydrophobicContact CD-CE2 3.67Å; K241-Y301 WeakPolarHBondContact CD-OH 3.35Å; K241-Y301 HydrophobicContact CG-CE1 4.23Å; K241-Y301 PolarHBondContact NZ-OH 2.95Å; K241-Y301 WeakPolarHBondContact O-CA 3.42Å; K241-K302 PolarHBondContact O-N 2.76Å; K241-K302 VanDerWaalsContact O-N 3.09Å
242	K	98.4	Very high	95.2	Very high	60 Å²	60	52 Å²	52	26%	0.261	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-85.6	-173.8	-62.1	174.2	-174.5	166	0	110.7	I267 K302 F303 D370	K242-I267 HydrophobicContact CB-CD1 4.13Å; K242-I267 HydrophobicContact CB-CG1 4.13Å; K242-I267 HydrophobicContact CD-CD1 3.86Å; K242-I267 HydrophobicContact CD-CG1 3.56Å; K242-I267 HydrophobicContact CG-CD1 4.45Å; K242-I267 HydrophobicContact CG-CG1 4.44Å; K242-K302 PolarHBondContact O-N 2.87Å; K242-F303 HydrophobicContact CB-CD2 4.4Å; K242-F303 WeakPolarHBondContact O-CD2 3.46Å; K242-F303 PolarHBondContact O-N 3.33Å; K242-D370 WeakPolarHBondContact CE-OD2 3.38Å
243	V	98.8	Very high	95	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128	-169.5	-171.8	0	0	0	0	110.8	I267 S268 V269 D270 F303 L305 I332 L366	V243-I267 HydrophobicContact CG2-CD1 4.18Å; V243-I267 HydrophobicContact CG2-CG1 4.46Å; V243-I267 HydrophobicContact CG2-CG2 4.32Å; V243-S268 PolarHBondContact N-O 3.04Å; V243-V269 HydrophobicContact CB-CB 4.44Å; V243-V269 HydrophobicContact CB-CG1 4.42Å; V243-V269 HydrophobicContact CB-CG2 4.05Å; V243-V269 HydrophobicContact CG1-CG1 4.1Å; V243-V269 HydrophobicContact CG1-CG2 4.2Å; V243-V269 HydrophobicContact CG2-CG2 4.46Å; V243-D270 PolarHBondContact O-N 3.05Å; V243-F303 WeakPolarHBondContact CA-O 3.03Å; V243-F303 HydrophobicContact CG2-CB 4.14Å; V243-F303 HydrophobicContact CG2-CD2 4.09Å; V243-L305 HydrophobicContact CG1-CD1 4.23Å; V243-L305 HydrophobicContact CG1-CD2 3.64Å; V243-L305 HydrophobicContact CG1-CG 3.55Å; V243-I332 HydrophobicContact CG1-CD1 4.5Å; V243-L366 HydrophobicContact CG2-CD1 4.16Å
244	A	97.9	Very high	94.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.2	166.5	0	0	0	0	0	110.8	F246 M297 Y301 F303 Y304 L305	A244-F246 HydrophobicContact CB-CE2 4.48Å; A244-M297 HydrophobicContact CB-SD 4.39Å; A244-Y301 HydrophobicContact CB-CD1 3.61Å; 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 3.33Å; A244-Y304 HydrophobicContact CB-CD2 4.3Å; A244-Y304 WeakPolarHBondContact O-CA 3.02Å; A244-L305 PolarHBondContact O-N 3.36Å
245	W	97.1	Very high	94.7	Very high	6 Å²	6	46.4 Å²	46.4	2%	0.023	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	121.1	171.1	-171.2	28.9	0	0	0	111.8	V247 R256 M257 A260 V269 D270 I271 Y272 L305 F307	W245-V247 HydrophobicContact CD2-CB 4.16Å; W245-V247 HydrophobicContact CD2-CG1 3.84Å; W245-V247 HydrophobicContact CE3-CG1 3.92Å; W245-V247 HydrophobicContact CG-CG1 4.33Å; W245-V247 HydrophobicContact CH2-CG1 4.5Å; W245-V247 HydrophobicContact CH2-CG2 4.4Å; W245-V247 HydrophobicContact CZ2-CB 4.2Å; W245-V247 HydrophobicContact CZ2-CG1 4.42Å; W245-V247 HydrophobicContact CZ2-CG2 4.04Å; W245-V247 HydrophobicContact CZ3-CG1 4.22Å; W245-R256 WeakPolarHBondContact CH2-O 3.33Å; W245-R256 HydrophobicContact CZ2-CB 4.29Å; W245-R256 HydrophobicContact CZ2-CG 4.16Å; W245-M257 HydrophobicContact CH2-CE 4.37Å; W245-M257 HydrophobicContact CH2-SD 3.48Å; W245-M257 WeakPolarHBondContact CH2-SD 3.5Å; W245-M257 HydrophobicContact CZ2-SD 4.32Å; W245-M257 HydrophobicContact CZ3-CE 4.43Å; W245-M257 HydrophobicContact CZ3-SD 4.11Å; W245-A260 HydrophobicContact CD2-CB 4.37Å; W245-A260 HydrophobicContact CE3-CB 3.56Å; W245-A260 HydrophobicContact CH2-CB 3.48Å; W245-A260 VanDerWaalsContact CH2-CB 3.48Å; W245-A260 HydrophobicContact CZ2-CB 4.3Å; W245-A260 HydrophobicContact CZ3-CB 3.08Å; W245-V269 HydrophobicContact CB-CG1 4.3Å; W245-D270 PolarHBondContact N-O 3.46Å; W245-I271 HydrophobicContact CE3-CD1 4.13Å; W245-I271 HydrophobicContact CE3-CG1 4.17Å; W245-I271 HydrophobicContact CE3-CG2 3.98Å; W245-I271 HydrophobicContact CZ3-CD1 4.45Å; W245-I271 CarbonylContact O-C 3.54Å; W245-I271 WeakPolarHBondContact O-CA 3.28Å; W245-Y272 PolarHBondContact O-N 2.67Å; W245-L305 HydrophobicContact CB-CB 3.94Å; W245-L305 HydrophobicContact CB-CD1 3.92Å; W245-L305 HydrophobicContact CB-CG 4.1Å; W245-L305 VanDerWaalsContact CD1-CB 3.47Å; W245-L305 VanDerWaalsContact CD1-O 3.26Å; W245-L305 HydrophobicContact CD2-CB 4.36Å; W245-L305 HydrophobicContact CD2-CD1 3.96Å; W245-L305 HydrophobicContact CE3-CD1 4.25Å; W245-L305 HydrophobicContact CG-CB 3.68Å; W245-L305 HydrophobicContact CG-CD1 3.86Å; W245-L305 HydrophobicContact CG-CG 4.19Å; W245-F307 HydrophobicContact CZ2-CD2 4.16Å
246	F	93.8	Very high	94.6	Very high	30 Å²	30	46.6 Å²	46.6	13%	0.132	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.4	177.5	-77.2	-125.1	0	0	0	108.9	A244 Y272 C280 S289 C293 M297 Y304	A244-F246 HydrophobicContact CB-CE2 4.48Å; F246-Y272 AromaticContact CD2-CD2 3.88Å; F246-Y272 HydrophobicContact CD2-CD2 3.88Å; F246-Y272 HydrophobicContact CD2-CG 4.11Å; F246-Y272 HydrophobicContact CE1-CD1 4.46Å; F246-Y272 HydrophobicContact CE1-CG 4.16Å; F246-Y272 HydrophobicContact CE2-CD1 4.36Å; F246-Y272 AromaticContact CE2-CD2 3.34Å; F246-Y272 HydrophobicContact CE2-CD2 3.34Å; F246-Y272 AromaticContact CE2-CE2 3.89Å; F246-Y272 HydrophobicContact CE2-CE2 3.89Å; F246-Y272 AromaticContact CE2-CG 3.61Å; F246-Y272 HydrophobicContact CE2-CG 3.61Å; F246-Y272 AromaticContact CZ-CD1 3.99Å; F246-Y272 HydrophobicContact CZ-CD1 3.99Å; F246-Y272 AromaticContact CZ-CD2 3.82Å; F246-Y272 HydrophobicContact CZ-CD2 3.82Å; F246-Y272 HydrophobicContact CZ-CE1 4.45Å; F246-Y272 HydrophobicContact CZ-CE2 4.3Å; F246-Y272 AromaticContact CZ-CG 3.65Å; F246-Y272 HydrophobicContact CZ-CG 3.65Å; F246-C280 HydrophobicContact CD1-CB 4.47Å; F246-C280 HydrophobicContact CE1-CB 3.62Å; F246-C280 HydrophobicContact CZ-CB 4.29Å; F246-S289 WeakPolarHBondContact CD1-OG 3.39Å; F246-C293 HydrophobicContact CE1-CB 4.15Å; F246-C293 HydrophobicContact CZ-CB 4.29Å; F246-M297 HydrophobicContact CD2-SD 3.61Å; F246-M297 HydrophobicContact CE1-SD 4.49Å; F246-M297 HydrophobicContact CE2-CG 3.76Å; F246-M297 HydrophobicContact CE2-SD 3.18Å; F246-M297 WeakPolarHBondContact CE2-SD 3.39Å; F246-M297 HydrophobicContact CG-SD 4.46Å; F246-M297 HydrophobicContact CZ-CG 3.96Å; F246-M297 HydrophobicContact CZ-SD 3.69Å; F246-Y304 HydrophobicContact CB-CE2 4.39Å; F246-Y304 AromaticContact CD2-CE2 3.97Å; F246-Y304 HydrophobicContact CD2-CE2 3.97Å; F246-Y304 HydrophobicContact CG-CE2 4.47Å
247	V	92.8	Very high	94.5	Very high	11 Å²	11	48.7 Å²	48.7	7%	0.067	28%	0.283	C	S	.	.			trans	-149.4	126.8	-168.8	54.8	0	0	0	0	111.4	W245 M257 I271 Y272 G273 E274 C275	W245-V247 HydrophobicContact CD2-CB 4.16Å; W245-V247 HydrophobicContact CD2-CG1 3.84Å; W245-V247 HydrophobicContact CE3-CG1 3.92Å; W245-V247 HydrophobicContact CG-CG1 4.33Å; W245-V247 HydrophobicContact CH2-CG1 4.5Å; W245-V247 HydrophobicContact CH2-CG2 4.4Å; W245-V247 HydrophobicContact CZ2-CB 4.2Å; W245-V247 HydrophobicContact CZ2-CG1 4.42Å; W245-V247 HydrophobicContact CZ2-CG2 4.04Å; W245-V247 HydrophobicContact CZ3-CG1 4.22Å; V247-M257 HydrophobicContact CG2-SD 4.35Å; V247-I271 HydrophobicContact CG1-CG2 3.5Å; V247-Y272 PolarHBondContact N-O 2.93Å; V247-G273 CarbonylContact O-C 3.39Å; V247-E274 PolarHBondContact O-N 3.11Å; V247-C275 HydrophobicContact CG1-CB 3.88Å; V247-C275 HydrophobicContact CG2-CB 4.16Å; V247-C275 PolarHBondContact O-N 3.27Å
248	S	89.5	Confident	94.5	Very high	59 Å²	59	49.5 Å²	49.5	41%	0.413	28%	0.277	S	S	.	.			trans	-114.1	-35.3	175	52.4	0	0	0	0	113.3	C250 C275	S248-C250 PolarHBondContact O-N 3.41Å; S248-C250 PolarHBondContact O-SG 2.04Å; S248-C250 VanDerWaalsContact O-SG 3.41Å; S248-C275 VanDerWaalsContact C-SG 3.57Å; S248-C275 PolarHBondContact O-SG 2.91Å; S248-C275 VanDerWaalsContact O-SG 3.36Å
249	N	90.5	Very high	94.6	Very high	50 Å²	50	46.3 Å²	46.3	27%	0.267	25%	0.245	S	C	.	.			trans	-79.2	107	175.2	174.9	3.6	0	0	0	109.7	I251 R256 C275	N249-I251 PolarHBondContact OD1-N 3.23Å; N249-I251 VanDerWaalsContact OD1-N 3.16Å; N249-I251 PolarHBondContact OD1-O 3.22Å; N249-R256 VanDerWaalsContact CB-NH2 3.34Å; N249-R256 PolarHBondContact O-NH1 2.87Å; N249-R256 PolarHBondContact O-NH2 3.02Å; N249-C275 VanDerWaalsContact C-SG 3.52Å
250	C	93	Very high	94.5	Very high	52 Å²	52	45.7 Å²	45.7	35%	0.351	24%	0.242	S	C	.	.	S	Bend	trans	-91.6	-8.6	-175.6	-46.5	0	0	0	0	113.9	S248 P252 C275	S248-C250 PolarHBondContact O-N 3.41Å; S248-C250 PolarHBondContact O-SG 2.04Å; S248-C250 VanDerWaalsContact O-SG 3.41Å; C250-P252 WeakPolarHBondContact O-CD 3.37Å; C250-C275 WeakPolarHBondContact CA-SG 3.06Å; C250-C275 HydrophobicContact CB-CB 3.89Å; C250-C275 WeakPolarHBondContact CB-SG 3.35Å; C250-C275 PolarHBondContact N-SG 3.12Å; C250-C275 WeakPolarHBondContact SG-CA 3.37Å; C250-C275 WeakPolarHBondContact SG-CB 3.5Å; C250-C275 CovalentContact SG-SG 2.04Å; C250-C275 PolarHBondContact SG-SG 3.16Å
251	I	91.3	Very high	94.6	Very high	150 Å²	150	47.8 Å²	47.8	77%	0.769	24%	0.239	S	C	*	.	S	Bend	trans	-124.1	60.3	179.8	-45.5	176.8	0	0	0	108.8	N249	N249-I251 PolarHBondContact OD1-N 3.23Å; N249-I251 VanDerWaalsContact OD1-N 3.16Å; N249-I251 PolarHBondContact OD1-O 3.22Å
252	P	89.7	Confident	94.6	Very high	19 Å²	19	46.6 Å²	46.6	12%	0.123	23%	0.234	C	C	.	.			trans	-69.2	162	178.7	30.5	-34.7	0	0	0	111.5	C250 S254 R256 M257	C250-P252 WeakPolarHBondContact O-CD 3.37Å; P252-S254 WeakPolarHBondContact CG-O 3.17Å; P252-S254 PolarHBondContact O-N 3.48Å; P252-R256 HydrophobicContact CB-CG 4.03Å; P252-R256 HydrophobicContact CG-CG 3.5Å; P252-M257 HydrophobicContact CG-CG 3.8Å
253	K	89.1	Confident	94.6	Very high	155 Å²	155	43.7 Å²	43.7	67%	0.674	22%	0.222	S	C	*	.	S	Bend	trans	-87.8	12.3	171.4	-59.8	-71.7	-172.6	-178	0	112.3	V184 N309	V184-K253 HydrophobicContact CG1-CB 3.7Å; V184-K253 HydrophobicContact CG1-CD 4.23Å; V184-K253 HydrophobicContact CG1-CG 3.59Å; K253-N309 PolarHBondContact N-O 3.19Å
254	S	91.7	Very high	94.5	Very high	7 Å²	7	46.2 Å²	46.2	5%	0.049	24%	0.24	C	C	.	.	S	Bend	trans	-116.6	158.2	172.5	66.2	0	0	0	0	110.1	P252 R256 E308	P252-S254 WeakPolarHBondContact CG-O 3.17Å; P252-S254 PolarHBondContact O-N 3.48Å; S254-R256 PolarHBondContact O-N 2.85Å; S254-R256 WeakPolarHBondContact OG-CG 3.49Å; S254-E308 PolarHBondContact OG-O 2.68Å
255	P	93.7	Very high	94.6	Very high	32 Å²	32	54.3 Å²	54.3	21%	0.208	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	20	179.8	34.1	-37.9	0	0	0	113.6	M257 Q258 Y259 L311 M334 L430	P255-M257 VanDerWaalsContact C-N 3.27Å; P255-M257 PolarHBondContact O-N 3.12Å; P255-Q258 PolarHBondContact O-N 3.13Å; P255-Q258 VanDerWaalsContact O-N 3.13Å; P255-Q258 PolarHBondContact O-OE1 3.24Å; P255-Q258 VanDerWaalsContact O-OE1 3.12Å; P255-Y259 PolarHBondContact O-N 2.84Å; P255-L311 HydrophobicContact CG-CD1 4.3Å; P255-M334 HydrophobicContact CG-SD 4.4Å; P255-L430 HydrophobicContact CG-CD1 3.42Å; P255-L430 VanDerWaalsContact CG-CD1 3.42Å; P255-L430 HydrophobicContact CG-CG 4.22Å
256	R	95.4	Very high	94.6	Very high	5 Å²	5	57 Å²	57	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-31.8	-171	65.8	175.6	172.2	73.2	-9.9	113.7	W245 N249 P252 S254 A260 F307 E308 N309 M334	W245-R256 WeakPolarHBondContact CH2-O 3.33Å; W245-R256 HydrophobicContact CZ2-CB 4.29Å; W245-R256 HydrophobicContact CZ2-CG 4.16Å; N249-R256 VanDerWaalsContact CB-NH2 3.34Å; N249-R256 PolarHBondContact O-NH1 2.87Å; N249-R256 PolarHBondContact O-NH2 3.02Å; P252-R256 HydrophobicContact CB-CG 4.03Å; P252-R256 HydrophobicContact CG-CG 3.5Å; S254-R256 PolarHBondContact O-N 2.85Å; S254-R256 WeakPolarHBondContact OG-CG 3.49Å; R256-A260 VanDerWaalsContact O-CB 3.22Å; R256-A260 WeakPolarHBondContact O-CB 3.38Å; R256-A260 PolarHBondContact O-N 2.74Å; R256-F307 HydrophobicContact CB-CB 3.77Å; R256-F307 HydrophobicContact CB-CD2 3.83Å; R256-F307 HydrophobicContact CB-CG 4.2Å; R256-E308 WeakPolarHBondContact CD-O 3.29Å; R256-N309 PolarHBondContact NH2-OD1 2.87Å; R256-M334 HydrophobicContact CB-SD 3.97Å
257	M	96	Very high	94.9	Very high	47 Å²	47	56 Å²	56	23%	0.232	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-43.6	175.8	-63.5	-55.4	-61.7	0	0	111.3	W245 V247 P252 P255 K261 C275	W245-M257 HydrophobicContact CH2-CE 4.37Å; W245-M257 HydrophobicContact CH2-SD 3.48Å; W245-M257 WeakPolarHBondContact CH2-SD 3.5Å; W245-M257 HydrophobicContact CZ2-SD 4.32Å; W245-M257 HydrophobicContact CZ3-CE 4.43Å; W245-M257 HydrophobicContact CZ3-SD 4.11Å; V247-M257 HydrophobicContact CG2-SD 4.35Å; P252-M257 HydrophobicContact CG-CG 3.8Å; P255-M257 VanDerWaalsContact C-N 3.27Å; P255-M257 PolarHBondContact O-N 3.12Å; M257-K261 VanDerWaalsContact O-CB 3.23Å; M257-K261 WeakPolarHBondContact O-CB 3.45Å; M257-K261 PolarHBondContact O-N 2.95Å; M257-C275 HydrophobicContact CE-CB 3.85Å
258	Q	95.9	Very high	95.1	Very high	105 Å²	105	59 Å²	59	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-46.3	176.7	-63.6	84.3	-7.9	0	0	110.8	P255 K261 E262 W432	P255-Q258 PolarHBondContact O-N 3.13Å; P255-Q258 VanDerWaalsContact O-N 3.13Å; P255-Q258 PolarHBondContact O-OE1 3.24Å; P255-Q258 VanDerWaalsContact O-OE1 3.12Å; Q258-K261 PolarHBondContact O-N 3.37Å; Q258-E262 PolarHBondContact O-N 2.71Å; Q258-W432 HydrophobicContact CB-CH2 4.09Å; Q258-W432 HydrophobicContact CB-CZ3 4.32Å
259	Y	97.9	Very high	95.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-47.4	-179.3	-162.3	-69.5	0	0	0	111.8	P255 K261 E262 L263 F307 M334 V353 P359 L362 L430 W432	P255-Y259 PolarHBondContact O-N 2.84Å; Y259-K261 VanDerWaalsContact C-N 3.33Å; Y259-K261 PolarHBondContact O-N 2.79Å; Y259-E262 PolarHBondContact O-N 3.44Å; Y259-L263 HydrophobicContact CD1-CB 4.47Å; Y259-L263 VanDerWaalsContact O-CB 3.31Å; Y259-L263 WeakPolarHBondContact O-CB 3.21Å; Y259-L263 PolarHBondContact O-N 3.27Å; Y259-F307 AromaticContact CD1-CE2 3.92Å; Y259-F307 HydrophobicContact CD1-CE2 3.92Å; Y259-F307 AromaticContact CD1-CZ 3.73Å; Y259-F307 HydrophobicContact CD1-CZ 3.73Å; Y259-F307 HydrophobicContact CE1-CZ 4.15Å; Y259-F307 HydrophobicContact CG-CE2 4.4Å; Y259-F307 HydrophobicContact CG-CZ 4.45Å; Y259-M334 VanDerWaalsContact CB-CE 3.44Å; Y259-M334 HydrophobicContact CD1-CE 3.97Å; Y259-M334 HydrophobicContact CD2-CE 3.31Å; Y259-M334 HydrophobicContact CE2-CE 4.06Å; Y259-M334 HydrophobicContact CG-CE 3.3Å; Y259-V353 HydrophobicContact CD1-CG1 4.46Å; Y259-V353 HydrophobicContact CE1-CB 4.41Å; Y259-V353 HydrophobicContact CE1-CG1 3.81Å; Y259-V353 HydrophobicContact CE2-CB 3.9Å; Y259-V353 HydrophobicContact CE2-CG1 4.11Å; Y259-P359 HydrophobicContact CD1-CB 4.29Å; Y259-P359 HydrophobicContact CD1-CG 4.02Å; Y259-P359 HydrophobicContact CD2-CG 4.1Å; Y259-P359 HydrophobicContact CE1-CB 3.86Å; Y259-P359 HydrophobicContact CE1-CG 3.79Å; Y259-P359 HydrophobicContact CE2-CG 3.87Å; Y259-P359 HydrophobicContact CG-CG 4.15Å; Y259-L362 HydrophobicContact CE1-CD2 3.89Å; Y259-L430 HydrophobicContact CD2-CD1 4.38Å; Y259-W432 HydrophobicContact CD2-CB 4.48Å; Y259-W432 AromaticContact CD2-CD2 3.86Å; Y259-W432 HydrophobicContact CD2-CD2 3.86Å; Y259-W432 AromaticContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CG 4.43Å; Y259-W432 AromaticContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CE2-CB 3.98Å; Y259-W432 HydrophobicContact CE2-CD2 4.09Å; Y259-W432 AromaticContact CE2-CE3 3.9Å; Y259-W432 HydrophobicContact CE2-CE3 3.9Å; Y259-W432 HydrophobicContact CE2-CG 4.19Å; Y259-W432 HydrophobicContact CG-CE3 4.07Å; Y259-W432 AromaticContact CG-CZ3 3.98Å; Y259-W432 HydrophobicContact CG-CZ3 3.98Å
260	A	97.9	Very high	95.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-38.2	178.7	0	0	0	0	0	112.1	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 3.48Å; W245-A260 VanDerWaalsContact CH2-CB 3.48Å; W245-A260 HydrophobicContact CZ2-CB 4.3Å; W245-A260 HydrophobicContact CZ3-CB 3.08Å; R256-A260 VanDerWaalsContact O-CB 3.22Å; R256-A260 WeakPolarHBondContact O-CB 3.38Å; R256-A260 PolarHBondContact O-N 2.74Å; A260-L263 PolarHBondContact O-N 2.93Å; A260-S264 WeakPolarHBondContact O-CB 3.33Å; A260-S264 PolarHBondContact O-N 3Å; A260-L305 HydrophobicContact CB-CD1 4.03Å; A260-F307 HydrophobicContact CB-CE2 4.17Å
261	K	97.1	Very high	96.1	Very high	140 Å²	140	56.1 Å²	56.1	61%	0.609	28%	0.277	S	S	*	.	H	α-helix	trans	-60.7	-46.5	173.1	-178.3	179	-179.8	178.8	0	111.3	M257 Q258 Y259 S264	M257-K261 VanDerWaalsContact O-CB 3.23Å; M257-K261 WeakPolarHBondContact O-CB 3.45Å; M257-K261 PolarHBondContact O-N 2.95Å; Q258-K261 PolarHBondContact O-N 3.37Å; Y259-K261 VanDerWaalsContact C-N 3.33Å; Y259-K261 PolarHBondContact O-N 2.79Å; K261-S264 PolarHBondContact O-N 3.15Å; K261-S264 PolarHBondContact O-OG 2.86Å
262	E	98.3	Very high	96.3	Very high	49 Å²	49	49.7 Å²	49.7	23%	0.229	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-45.4	177.6	-175.9	54	-145.1	0	0	111.4	Q258 Y259 S264 R265 H266 P359 W432	Q258-E262 PolarHBondContact O-N 2.71Å; Y259-E262 PolarHBondContact O-N 3.44Å; E262-S264 VanDerWaalsContact C-N 3.26Å; E262-S264 PolarHBondContact O-N 2.67Å; E262-R265 WeakPolarHBondContact O-CB 3.16Å; E262-R265 PolarHBondContact O-N 2.95Å; E262-R265 VanDerWaalsContact O-N 3.1Å; E262-R265 WeakPolarHBondContact OE2-CD 3.3Å; E262-R265 IonicContact OE2-CZ 3.41Å; E262-R265 IonicContact OE2-NE 3.85Å; E262-R265 IonicContact OE2-NH1 2.84Å; E262-R265 PolarHBondContact OE2-NH1 3.22Å; E262-H266 PolarHBondContact O-CD2 2.82Å; E262-H266 IonicContact OE1-CD2 2.69Å; E262-H266 IonicContact OE1-CE1 2.98Å; E262-H266 IonicContact OE1-NE2 2.8Å; E262-H266 PolarHBondContact OE1-NE2 3.39Å; E262-P359 HydrophobicContact CB-CB 4.23Å; E262-P359 HydrophobicContact CB-CG 3.98Å; E262-P359 HydrophobicContact CG-CB 3.92Å; E262-P359 HydrophobicContact CG-CG 3.72Å; E262-W432 HydrophobicContact CB-CH2 4.29Å; E262-W432 HydrophobicContact CB-CZ2 4.07Å; E262-W432 HydrophobicContact CG-CZ2 4.13Å
263	L	98.7	Very high	96.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.8	-41	175.9	-175.9	63.4	0	0	0	112.2	Y259 A260 R265 H266 I267 V269 L305 P359 L362 A363	Y259-L263 HydrophobicContact CD1-CB 4.47Å; Y259-L263 VanDerWaalsContact O-CB 3.31Å; Y259-L263 WeakPolarHBondContact O-CB 3.21Å; Y259-L263 PolarHBondContact O-N 3.27Å; A260-L263 PolarHBondContact O-N 2.93Å; L263-R265 PolarHBondContact O-N 3.4Å; L263-R265 VanDerWaalsContact O-N 3.1Å; L263-H266 PolarHBondContact O-N 2.98Å; L263-I267 HydrophobicContact CD1-CG2 3.76Å; L263-I267 HydrophobicContact CG-CG2 3.84Å; L263-I267 PolarHBondContact O-N 2.75Å; L263-I267 VanDerWaalsContact O-N 3.14Å; L263-V269 HydrophobicContact CD2-CG2 4.33Å; L263-V269 HydrophobicContact CG-CG2 4.24Å; L263-L305 HydrophobicContact CD2-CD1 4.34Å; L263-L305 HydrophobicContact CD2-CD2 3.88Å; L263-P359 HydrophobicContact CB-CB 4.08Å; L263-P359 HydrophobicContact CD1-CB 4.3Å; L263-P359 VanDerWaalsContact CD1-O 3.27Å; L263-P359 WeakPolarHBondContact CD1-O 3.14Å; L263-L362 HydrophobicContact CD1-CD2 4.15Å; L263-L362 HydrophobicContact CD1-CG 4.3Å; L263-L362 HydrophobicContact CD2-CD2 4.35Å; L263-A363 HydrophobicContact CD1-CB 3.96Å
264	S	98.3	Very high	96.4	Very high	54 Å²	54	49 Å²	49	38%	0.378	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-17.9	-179.5	75.8	0	0	0	0	114.5	A260 K261 E262 H266 I267	A260-S264 WeakPolarHBondContact O-CB 3.33Å; A260-S264 PolarHBondContact O-N 3Å; K261-S264 PolarHBondContact O-N 3.15Å; K261-S264 PolarHBondContact O-OG 2.86Å; E262-S264 VanDerWaalsContact C-N 3.26Å; E262-S264 PolarHBondContact O-N 2.67Å; S264-H266 VanDerWaalsContact C-N 3.3Å; S264-I267 WeakPolarHBondContact CA-O 3.39Å
265	R	98.5	Very high	96.5	Very high	170 Å²	170	50 Å²	50	64%	0.642	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-23.6	173.3	-64	173.7	163.8	170.9	-10.6	112.7	E262 L263	E262-R265 WeakPolarHBondContact O-CB 3.16Å; E262-R265 PolarHBondContact O-N 2.95Å; E262-R265 VanDerWaalsContact O-N 3.1Å; E262-R265 WeakPolarHBondContact OE2-CD 3.3Å; E262-R265 IonicContact OE2-CZ 3.41Å; E262-R265 IonicContact OE2-NE 3.85Å; E262-R265 IonicContact OE2-NH1 2.84Å; E262-R265 PolarHBondContact OE2-NH1 3.22Å; L263-R265 PolarHBondContact O-N 3.4Å; L263-R265 VanDerWaalsContact O-N 3.1Å
266	H	98.7	Very high	96.5	Very high	63 Å²	63	49.8 Å²	49.8	29%	0.292	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-22.4	-170.1	-56.7	-69.3	0	0	0	113	E262 L263 S264 A363 K367	E262-H266 PolarHBondContact O-CD2 2.82Å; E262-H266 IonicContact OE1-CD2 2.69Å; E262-H266 IonicContact OE1-CE1 2.98Å; E262-H266 IonicContact OE1-NE2 2.8Å; E262-H266 PolarHBondContact OE1-NE2 3.39Å; L263-H266 PolarHBondContact O-N 2.98Å; S264-H266 VanDerWaalsContact C-N 3.3Å; H266-A363 HydrophobicContact CB-CB 3.38Å; H266-K367 WeakPolarHBondContact O-CE 3.43Å; H266-K367 PolarHBondContact O-NZ 2.78Å
267	I	98.8	Very high	96.4	Very high	8 Å²	8	56 Å²	56	4%	0.041	30%	0.297	C	S	.	.	S	Bend	trans	-149.8	147.7	177.9	-169.5	167.9	0	0	0	110	K242 V243 L263 S264 V269 A363 L366 K367	K242-I267 HydrophobicContact CB-CD1 4.13Å; K242-I267 HydrophobicContact CB-CG1 4.13Å; K242-I267 HydrophobicContact CD-CD1 3.86Å; K242-I267 HydrophobicContact CD-CG1 3.56Å; K242-I267 HydrophobicContact CG-CD1 4.45Å; K242-I267 HydrophobicContact CG-CG1 4.44Å; V243-I267 HydrophobicContact CG2-CD1 4.18Å; V243-I267 HydrophobicContact CG2-CG1 4.46Å; V243-I267 HydrophobicContact CG2-CG2 4.32Å; L263-I267 HydrophobicContact CD1-CG2 3.76Å; L263-I267 HydrophobicContact CG-CG2 3.84Å; L263-I267 PolarHBondContact O-N 2.75Å; L263-I267 VanDerWaalsContact O-N 3.14Å; S264-I267 WeakPolarHBondContact CA-O 3.39Å; I267-V269 HydrophobicContact CG2-CG2 4.32Å; I267-V269 PolarHBondContact O-N 3.23Å; I267-A363 HydrophobicContact CB-CB 3.99Å; I267-A363 HydrophobicContact CG2-CB 3.9Å; I267-L366 HydrophobicContact CD1-CB 3.54Å; I267-L366 HydrophobicContact CD1-CD1 4.11Å; I267-K367 HydrophobicContact CD1-CG 4.39Å
268	S	98.4	Very high	96.3	Very high	73 Å²	73	56.4 Å²	56.4	51%	0.51	30%	0.3	S	S	.	.			trans	-63	120.4	177.8	-51.1	0	0	0	0	111.3	V243	V243-S268 PolarHBondContact N-O 3.04Å
269	V	98.6	Very high	96	Very high	20 Å²	20	56.8 Å²	56.8	12%	0.121	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	112.2	175.2	-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 4.05Å; V243-V269 HydrophobicContact CG1-CG1 4.1Å; V243-V269 HydrophobicContact CG1-CG2 4.2Å; V243-V269 HydrophobicContact CG2-CG2 4.46Å; W245-V269 HydrophobicContact CB-CG1 4.3Å; L263-V269 HydrophobicContact CD2-CG2 4.33Å; L263-V269 HydrophobicContact CG-CG2 4.24Å; I267-V269 HydrophobicContact CG2-CG2 4.32Å; I267-V269 PolarHBondContact O-N 3.23Å; V269-I271 HydrophobicContact CG1-CG1 3.95Å; V269-L305 HydrophobicContact CG1-CD1 4.01Å
270	D	98	Very high	95.4	Very high	45 Å²	45	57.7 Å²	57.7	24%	0.241	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.6	175.2	-76.5	-3.5	0	0	0	109	K241 V243 W245 Y272 L278 Y301	K241-D270 IonicContact NZ-OD2 3.72Å; K241-D270 PolarHBondContact NZ-OD2 2.75Å; V243-D270 PolarHBondContact O-N 3.05Å; W245-D270 PolarHBondContact N-O 3.46Å; D270-Y272 HydrophobicContact CB-CE2 3.95Å; D270-L278 HydrophobicContact CB-CD1 3.59Å; D270-Y301 HydrophobicContact CB-CE1 3.73Å; D270-Y301 VanDerWaalsContact CB-OH 3.24Å; D270-Y301 WeakPolarHBondContact CB-OH 3.48Å; D270-Y301 VanDerWaalsContact CG-OH 3.29Å; D270-Y301 WeakPolarHBondContact OD2-CE1 3.12Å; D270-Y301 PolarHBondContact OD2-OH 3.42Å
271	I	97	Very high	94.5	Very high	37 Å²	37	62.3 Å²	62.3	19%	0.19	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	118	-173.6	-49.8	178.2	0	0	0	109.8	W245 V247 V269 G276 T277 L278	W245-I271 HydrophobicContact CE3-CD1 4.13Å; W245-I271 HydrophobicContact CE3-CG1 4.17Å; W245-I271 HydrophobicContact CE3-CG2 3.98Å; W245-I271 HydrophobicContact CZ3-CD1 4.45Å; W245-I271 CarbonylContact O-C 3.54Å; W245-I271 WeakPolarHBondContact O-CA 3.28Å; V247-I271 HydrophobicContact CG1-CG2 3.5Å; V269-I271 HydrophobicContact CG1-CG1 3.95Å; I271-G276 WeakPolarHBondContact O-CA 3.07Å; I271-T277 PolarHBondContact O-N 3.09Å; I271-L278 WeakPolarHBondContact O-CB 3.23Å; I271-L278 PolarHBondContact O-N 3.03Å; I271-L278 VanDerWaalsContact O-N 3.15Å
272	Y	94	Very high	93.1	Very high	14 Å²	14	59.7 Å²	59.7	6%	0.055	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	146.5	179.1	-66.3	-99.7	0	0	0	111.7	W245 F246 V247 D270 L278 C280 M296 Y301	W245-Y272 PolarHBondContact O-N 2.67Å; F246-Y272 AromaticContact CD2-CD2 3.88Å; F246-Y272 HydrophobicContact CD2-CD2 3.88Å; F246-Y272 HydrophobicContact CD2-CG 4.11Å; F246-Y272 HydrophobicContact CE1-CD1 4.46Å; F246-Y272 HydrophobicContact CE1-CG 4.16Å; F246-Y272 HydrophobicContact CE2-CD1 4.36Å; F246-Y272 AromaticContact CE2-CD2 3.34Å; F246-Y272 HydrophobicContact CE2-CD2 3.34Å; F246-Y272 AromaticContact CE2-CE2 3.89Å; F246-Y272 HydrophobicContact CE2-CE2 3.89Å; F246-Y272 AromaticContact CE2-CG 3.61Å; F246-Y272 HydrophobicContact CE2-CG 3.61Å; F246-Y272 AromaticContact CZ-CD1 3.99Å; F246-Y272 HydrophobicContact CZ-CD1 3.99Å; F246-Y272 AromaticContact CZ-CD2 3.82Å; F246-Y272 HydrophobicContact CZ-CD2 3.82Å; F246-Y272 HydrophobicContact CZ-CE1 4.45Å; F246-Y272 HydrophobicContact CZ-CE2 4.3Å; F246-Y272 AromaticContact CZ-CG 3.65Å; F246-Y272 HydrophobicContact CZ-CG 3.65Å; V247-Y272 PolarHBondContact N-O 2.93Å; D270-Y272 HydrophobicContact CB-CE2 3.95Å; Y272-L278 VanDerWaalsContact CA-O 3.29Å; Y272-L278 WeakPolarHBondContact CA-O 3.34Å; Y272-L278 HydrophobicContact CD1-CB 3.48Å; Y272-L278 VanDerWaalsContact CD1-CB 3.48Å; Y272-L278 HydrophobicContact CD1-CD1 4.49Å; Y272-L278 HydrophobicContact CD2-CB 4.31Å; Y272-L278 HydrophobicContact CD2-CD1 4.2Å; Y272-L278 HydrophobicContact CE1-CB 3.61Å; Y272-L278 HydrophobicContact CE1-CD1 4.04Å; Y272-L278 HydrophobicContact CE1-CG 4.44Å; Y272-L278 HydrophobicContact CE2-CB 4.42Å; Y272-L278 HydrophobicContact CE2-CD1 3.72Å; Y272-L278 HydrophobicContact CG-CB 3.86Å; Y272-C280 HydrophobicContact CD1-CB 4.19Å; Y272-M296 HydrophobicContact CE1-CE 3.89Å; Y272-Y301 PolarHBondContact OH-OH 2.85Å
273	G	91.2	Very high	91.5	Very high	29 Å²	29	64 Å²	64	30%	0.299	35%	0.354	S	S	.	.	S	Bend	trans	99.8	-164.7	175.7	0	0	0	0	0	112.9	V247 C275 G276 L278	V247-G273 CarbonylContact O-C 3.39Å; G273-C275 PolarHBondContact O-N 3.13Å; G273-C275 VanDerWaalsContact O-N 3.11Å; G273-G276 PolarHBondContact O-N 3.38Å; G273-G276 VanDerWaalsContact O-N 3.08Å; G273-L278 PolarHBondContact N-O 3.25Å
274	E	91.3	Very high	89.4	Confident	132 Å²	132	70.6 Å²	70.6	62%	0.617	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-19	-169.1	-68.2	154.5	-136.4	0	0	113.8	V247 K282	V247-E274 PolarHBondContact O-N 3.11Å; E274-K282 IonicContact OE1-NZ 3.9Å; E274-K282 PolarHBondContact OE1-NZ 3.42Å
275	C	94.1	Very high	87.4	Confident	28 Å²	28	72.6 Å²	72.6	19%	0.189	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	3.7	179.5	-38.3	0	0	0	0	113.6	V247 S248 N249 C250 M257 G273	V247-C275 HydrophobicContact CG1-CB 3.88Å; V247-C275 HydrophobicContact CG2-CB 4.16Å; V247-C275 PolarHBondContact O-N 3.27Å; S248-C275 VanDerWaalsContact C-SG 3.57Å; S248-C275 PolarHBondContact O-SG 2.91Å; S248-C275 VanDerWaalsContact O-SG 3.36Å; N249-C275 VanDerWaalsContact C-SG 3.52Å; C250-C275 WeakPolarHBondContact CA-SG 3.06Å; C250-C275 HydrophobicContact CB-CB 3.89Å; C250-C275 WeakPolarHBondContact CB-SG 3.35Å; C250-C275 PolarHBondContact N-SG 3.12Å; C250-C275 WeakPolarHBondContact SG-CA 3.37Å; C250-C275 WeakPolarHBondContact SG-CB 3.5Å; C250-C275 CovalentContact SG-SG 2.04Å; C250-C275 PolarHBondContact SG-SG 3.16Å; M257-C275 HydrophobicContact CE-CB 3.85Å; G273-C275 PolarHBondContact O-N 3.13Å; G273-C275 VanDerWaalsContact O-N 3.11Å
276	G	92.5	Very high	85.5	Confident	26 Å²	26	67.9 Å²	67.9	27%	0.268	39%	0.39	S	S	.	.	S	Bend	trans	-122.9	-178	-179.1	0	0	0	0	0	112.4	I271 G273	I271-G276 WeakPolarHBondContact O-CA 3.07Å; G273-G276 PolarHBondContact O-N 3.38Å; G273-G276 VanDerWaalsContact O-N 3.08Å
277	T	93.6	Very high	83.7	Confident	136 Å²	136	72.1 Å²	72.1	83%	0.834	41%	0.408	S	S	*	.	S	Bend	trans	-99.1	-15	176.3	54.1	0	0	0	0	112.5	I271	I271-T277 PolarHBondContact O-N 3.09Å
278	L	94.5	Very high	82.1	Confident	56 Å²	56	73.8 Å²	73.8	29%	0.293	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-94.4	145.5	179.9	-55.5	174.9	0	0	0	110.4	D270 I271 Y272 G273	D270-L278 HydrophobicContact CB-CD1 3.59Å; I271-L278 WeakPolarHBondContact O-CB 3.23Å; I271-L278 PolarHBondContact O-N 3.03Å; I271-L278 VanDerWaalsContact O-N 3.15Å; Y272-L278 VanDerWaalsContact CA-O 3.29Å; Y272-L278 WeakPolarHBondContact CA-O 3.34Å; Y272-L278 HydrophobicContact CD1-CB 3.48Å; Y272-L278 VanDerWaalsContact CD1-CB 3.48Å; Y272-L278 HydrophobicContact CD1-CD1 4.49Å; Y272-L278 HydrophobicContact CD2-CB 4.31Å; Y272-L278 HydrophobicContact CD2-CD1 4.2Å; Y272-L278 HydrophobicContact CE1-CB 3.61Å; Y272-L278 HydrophobicContact CE1-CD1 4.04Å; Y272-L278 HydrophobicContact CE1-CG 4.44Å; Y272-L278 HydrophobicContact CE2-CB 4.42Å; Y272-L278 HydrophobicContact CE2-CD1 3.72Å; Y272-L278 HydrophobicContact CG-CB 3.86Å; G273-L278 PolarHBondContact N-O 3.25Å
279	S	89.4	Confident	80.7	Confident	113 Å²	113	71.4 Å²	71.4	79%	0.79	40%	0.402	S	S	*	.			trans	-114.1	141.9	178.7	-70.5	0	0	0	0	110.7
280	C	84.7	Confident	79.5	Confident	19 Å²	19	71.8 Å²	71.8	13%	0.128	41%	0.405	C	S	.	.			trans	-127.4	126.1	168.2	164	0	0	0	0	107.6	F246 Y272 K282 C293	F246-C280 HydrophobicContact CD1-CB 4.47Å; F246-C280 HydrophobicContact CE1-CB 3.62Å; F246-C280 HydrophobicContact CZ-CB 4.29Å; Y272-C280 HydrophobicContact CD1-CB 4.19Å; C280-K282 PolarHBondContact O-N 2.04Å; C280-C293 VanDerWaalsContact CA-SG 3.56Å; C280-C293 HydrophobicContact CB-CB 4Å; C280-C293 WeakPolarHBondContact CB-SG 3.14Å; C280-C293 WeakPolarHBondContact SG-CB 3.44Å; C280-C293 CovalentContact SG-SG 1.99Å; C280-C293 PolarHBondContact SG-SG 3.09Å
281	P	78.1	Confident	78.7	Confident	97 Å²	97	75.6 Å²	75.6	63%	0.63	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-55.5	128.1	172.5	-24.2	33.9	0	0	0	110.6	S290	P281-S290 WeakPolarHBondContact O-CB 3.35Å; P281-S290 PolarHBondContact O-N 3.37Å; P281-S290 VanDerWaalsContact O-N 3.14Å; P281-S290 PolarHBondContact O-OG 3.41Å
282	K	69.7	Low	78.2	Confident	85 Å²	85	76.2 Å²	76.2	37%	0.37	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	146.3	174	-65.2	-178.4	-174.5	170.8	0	109.6	E274 C280 I284 F287 T288	E274-K282 IonicContact OE1-NZ 3.9Å; E274-K282 PolarHBondContact OE1-NZ 3.42Å; C280-K282 PolarHBondContact O-N 2.04Å; K282-I284 PolarHBondContact O-N 2.9Å; K282-F287 HydrophobicContact CD-CD1 4.31Å; K282-T288 WeakPolarHBondContact CA-O 3.4Å
283	Y	64.4	Low	78	Confident	138 Å²	138	76 Å²	76	54%	0.541	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.7	164.5	-173.1	-111.8	0	0	0	108.5	P285 T286 F287 T288	Y283-P285 HydrophobicContact CD1-CB 4.14Å; Y283-P285 HydrophobicContact CD1-CG 4.04Å; Y283-P285 HydrophobicContact CE1-CB 3.65Å; Y283-P285 VanDerWaalsContact CE1-CD 3.45Å; Y283-P285 HydrophobicContact CE1-CG 3.44Å; Y283-P285 VanDerWaalsContact CE1-CG 3.44Å; Y283-P285 HydrophobicContact CE2-CG 4.4Å; Y283-T286 HydrophobicContact CD1-CG2 4.22Å; Y283-T286 WeakPolarHBondContact CD1-OG1 3.49Å; Y283-T286 HydrophobicContact CE1-CG2 4.44Å; Y283-T286 PolarHBondContact O-N 3.07Å; Y283-F287 VanDerWaalsContact O-CA 3.32Å; Y283-F287 WeakPolarHBondContact O-CA 3.39Å; Y283-F287 PolarHBondContact O-N 3.5Å; Y283-T288 PolarHBondContact N-O 2.67Å
284	I	54.2	Low	77.9	Confident	139 Å²	139	75.7 Å²	75.7	71%	0.713	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-38.6	-167.9	-61.4	178.8	0	0	0	113.4	K282 T286	K282-I284 PolarHBondContact O-N 2.9Å; I284-T286 PolarHBondContact O-N 2.95Å
285	P	56.6	Low	77.9	Confident	96 Å²	96	75.1 Å²	75.1	62%	0.623	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-28.8	-180	-26.8	35.1	0	0	0	115.9	Y283	Y283-P285 HydrophobicContact CD1-CB 4.14Å; Y283-P285 HydrophobicContact CD1-CG 4.04Å; Y283-P285 HydrophobicContact CE1-CB 3.65Å; Y283-P285 VanDerWaalsContact CE1-CD 3.45Å; Y283-P285 HydrophobicContact CE1-CG 3.44Å; Y283-P285 VanDerWaalsContact CE1-CG 3.44Å; Y283-P285 HydrophobicContact CE2-CG 4.4Å
286	T	57.6	Low	77.9	Confident	72 Å²	72	76.1 Å²	76.1	44%	0.442	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-5.4	-174.5	59.4	0	0	0	0	113.3	Y283 I284 T288	Y283-T286 HydrophobicContact CD1-CG2 4.22Å; Y283-T286 WeakPolarHBondContact CD1-OG1 3.49Å; Y283-T286 HydrophobicContact CE1-CG2 4.44Å; Y283-T286 PolarHBondContact O-N 3.07Å; I284-T286 PolarHBondContact O-N 2.95Å; T286-T288 PolarHBondContact O-N 3.18Å; T286-T288 WeakPolarHBondContact OG1-CG2 3.32Å; T286-T288 PolarHBondContact OG1-N 2.73Å; T286-T288 PolarHBondContact OG1-OG1 2.88Å
287	F	60.2	Low	78	Confident	151 Å²	151	74.9 Å²	74.9	66%	0.662	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	19.2	-169.1	-68.7	-89.1	0	0	0	114.4	K282 Y283	K282-F287 HydrophobicContact CD-CD1 4.31Å; Y283-F287 VanDerWaalsContact O-CA 3.32Å; Y283-F287 WeakPolarHBondContact O-CA 3.39Å; Y283-F287 PolarHBondContact O-N 3.5Å
288	T	65.4	Low	78	Confident	44 Å²	44	73.1 Å²	73.1	27%	0.27	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	155.7	178.3	59.7	0	0	0	0	111	K282 Y283 T286 S290	K282-T288 WeakPolarHBondContact CA-O 3.4Å; Y283-T288 PolarHBondContact N-O 2.67Å; T286-T288 PolarHBondContact O-N 3.18Å; T286-T288 WeakPolarHBondContact OG1-CG2 3.32Å; T286-T288 PolarHBondContact OG1-N 2.73Å; T286-T288 PolarHBondContact OG1-OG1 2.88Å; T288-S290 PolarHBondContact O-N 2.88Å
289	S	69.1	Low	78.1	Confident	23 Å²	23	75.3 Å²	75.3	16%	0.161	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.7	134	168.8	-59.3	0	0	0	0	110.3	F246	F246-S289 WeakPolarHBondContact CD1-OG 3.39Å
290	S	74.3	Confident	78.5	Confident	27 Å²	27	72.3 Å²	72.3	19%	0.189	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-60	151.5	175.8	58.4	0	0	0	0	111.2	P281 T288 G292 C293 L294	P281-S290 WeakPolarHBondContact O-CB 3.35Å; P281-S290 PolarHBondContact O-N 3.37Å; P281-S290 VanDerWaalsContact O-N 3.14Å; P281-S290 PolarHBondContact O-OG 3.41Å; T288-S290 PolarHBondContact O-N 2.88Å; S290-G292 PolarHBondContact O-N 3.02Å; S290-G292 VanDerWaalsContact O-N 3.14Å; S290-C293 PolarHBondContact O-N 3.45Å; S290-C293 PolarHBondContact OG-N 3.31Å; S290-C293 PolarHBondContact OG-SG 2.91Å; S290-L294 PolarHBondContact O-N 3.42Å; S290-L294 VanDerWaalsContact O-N 3.1Å
291	V	80.3	Confident	79.2	Confident	126 Å²	126	71.5 Å²	71.5	76%	0.764	38%	0.378	S	S	*	.	H	α-helix	trans	-51.2	-37.5	174.2	178	0	0	0	0	111	C293 L294 K295	V291-C293 PolarHBondContact O-N 3.42Å; V291-L294 PolarHBondContact O-N 3.42Å; V291-K295 WeakPolarHBondContact O-CB 3.36Å; V291-K295 PolarHBondContact O-N 3.32Å
292	G	86.4	Confident	80.2	Confident	50 Å²	50	67.4 Å²	67.4	52%	0.515	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-40.3	176.2	0	0	0	0	0	113.8	S290 M296	S290-G292 PolarHBondContact O-N 3.02Å; S290-G292 VanDerWaalsContact O-N 3.14Å; G292-M296 WeakPolarHBondContact O-CB 3.42Å; G292-M296 PolarHBondContact O-N 2.77Å
293	C	90	Very high	81.5	Confident	9 Å²	9	63.4 Å²	63.4	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-72.7	-39.7	177.3	-63.4	0	0	0	0	112.8	F246 C280 S290 V291 K295 M296 M297	F246-C293 HydrophobicContact CE1-CB 4.15Å; F246-C293 HydrophobicContact CZ-CB 4.29Å; C280-C293 VanDerWaalsContact CA-SG 3.56Å; C280-C293 HydrophobicContact CB-CB 4Å; C280-C293 WeakPolarHBondContact CB-SG 3.14Å; C280-C293 WeakPolarHBondContact SG-CB 3.44Å; C280-C293 CovalentContact SG-SG 1.99Å; C280-C293 PolarHBondContact SG-SG 3.09Å; S290-C293 PolarHBondContact O-N 3.45Å; S290-C293 PolarHBondContact OG-N 3.31Å; S290-C293 PolarHBondContact OG-SG 2.91Å; V291-C293 PolarHBondContact O-N 3.42Å; C293-K295 VanDerWaalsContact C-N 3.3Å; C293-K295 PolarHBondContact O-N 2.9Å; C293-M296 HydrophobicContact CB-CE 4.34Å; C293-M296 PolarHBondContact O-N 3.28Å; C293-M297 WeakPolarHBondContact O-CG 3.49Å; C293-M297 PolarHBondContact O-N 3.43Å
294	L	88.5	Confident	83.2	Confident	23 Å²	23	56.9 Å²	56.9	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-43.3	175.6	-65.2	-178	0	0	0	110.9	S290 V291 M297 R298	S290-L294 PolarHBondContact O-N 3.42Å; S290-L294 VanDerWaalsContact O-N 3.1Å; V291-L294 PolarHBondContact O-N 3.42Å; L294-M297 HydrophobicContact CD2-CE 3.54Å; L294-M297 WeakPolarHBondContact O-CB 3.46Å; L294-M297 PolarHBondContact O-N 3.44Å; L294-R298 PolarHBondContact O-N 3.42Å
295	K	91.7	Very high	85.3	Confident	120 Å²	120	50.2 Å²	50.2	52%	0.522	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-49.1	172	-177.9	-177.7	172.8	-172.3	0	112	V291 C293 M297 R298 E299	V291-K295 WeakPolarHBondContact O-CB 3.36Å; V291-K295 PolarHBondContact O-N 3.32Å; C293-K295 VanDerWaalsContact C-N 3.3Å; C293-K295 PolarHBondContact O-N 2.9Å; K295-M297 VanDerWaalsContact C-N 3.28Å; K295-M297 PolarHBondContact O-N 3Å; K295-R298 WeakPolarHBondContact O-CB 3.3Å; K295-R298 PolarHBondContact O-N 2.76Å; K295-R298 VanDerWaalsContact O-N 3.13Å; K295-E299 VanDerWaalsContact CE-CD 3.47Å; K295-E299 WeakPolarHBondContact CE-OE1 3.37Å; K295-E299 HydrophobicContact CG-CG 4.44Å; K295-E299 IonicContact NZ-OE1 3.74Å; K295-E299 WeakPolarHBondContact O-CG 3.2Å; K295-E299 PolarHBondContact O-N 3.28Å
296	M	93.8	Very high	87.3	Confident	49 Å²	49	45.7 Å²	45.7	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-38	177.8	173.4	-88.4	-64.5	0	0	112.3	Y272 G292 C293 E299 N300 Y301	Y272-M296 HydrophobicContact CE1-CE 3.89Å; G292-M296 WeakPolarHBondContact O-CB 3.42Å; G292-M296 PolarHBondContact O-N 2.77Å; C293-M296 HydrophobicContact CB-CE 4.34Å; C293-M296 PolarHBondContact O-N 3.28Å; M296-E299 PolarHBondContact O-N 2.87Å; M296-N300 WeakPolarHBondContact O-CB 3.38Å; M296-N300 PolarHBondContact O-N 3.43Å; M296-N300 VanDerWaalsContact O-N 3.08Å; M296-N300 PolarHBondContact O-ND2 3.02Å; M296-Y301 HydrophobicContact SD-CE2 3.8Å
297	M	94.5	Very high	89.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-51.1	172.1	-71.9	-165.1	-41.5	0	0	111.4	A244 F246 C293 L294 K295 E299 N300 Y301 Y304 N323 L329	A244-M297 HydrophobicContact CB-SD 4.39Å; F246-M297 HydrophobicContact CD2-SD 3.61Å; F246-M297 HydrophobicContact CE1-SD 4.49Å; F246-M297 HydrophobicContact CE2-CG 3.76Å; F246-M297 HydrophobicContact CE2-SD 3.18Å; F246-M297 WeakPolarHBondContact CE2-SD 3.39Å; F246-M297 HydrophobicContact CG-SD 4.46Å; F246-M297 HydrophobicContact CZ-CG 3.96Å; F246-M297 HydrophobicContact CZ-SD 3.69Å; C293-M297 WeakPolarHBondContact O-CG 3.49Å; C293-M297 PolarHBondContact O-N 3.43Å; L294-M297 HydrophobicContact CD2-CE 3.54Å; L294-M297 WeakPolarHBondContact O-CB 3.46Å; L294-M297 PolarHBondContact O-N 3.44Å; K295-M297 VanDerWaalsContact C-N 3.28Å; K295-M297 PolarHBondContact O-N 3Å; M297-E299 PolarHBondContact O-N 2.84Å; M297-N300 PolarHBondContact O-N 3.38Å; M297-Y301 PolarHBondContact O-N 3.43Å; M297-Y304 HydrophobicContact CE-CD2 4.34Å; M297-Y304 HydrophobicContact CE-CE2 4.22Å; M297-Y304 HydrophobicContact SD-CD2 3.86Å; M297-Y304 HydrophobicContact SD-CE2 3.76Å; M297-N323 WeakPolarHBondContact CE-O 3.44Å; M297-L329 HydrophobicContact CB-CD1 4.13Å; M297-L329 HydrophobicContact CB-CD2 4.06Å
298	R	95.4	Very high	91	Very high	98 Å²	98	35.1 Å²	35.1	37%	0.37	19%	0.192	S	C	.	.	H	α-helix	trans	-55.9	-39.6	178.8	-179.7	-179.2	-61.5	-171	0.5	112	K239 L294 K295 N326 N327 E328	K239-R298 WeakPolarHBondContact CE-O 3.18Å; K239-R298 PolarHBondContact NZ-O 2.88Å; L294-R298 PolarHBondContact O-N 3.42Å; K295-R298 WeakPolarHBondContact O-CB 3.3Å; K295-R298 PolarHBondContact O-N 2.76Å; K295-R298 VanDerWaalsContact O-N 3.13Å; R298-N326 PolarHBondContact NH2-O 3.15Å; R298-N327 WeakPolarHBondContact CA-O 3.25Å; R298-N327 WeakPolarHBondContact CB-O 3.4Å; R298-N327 WeakPolarHBondContact CG-O 3.43Å; R298-E328 HydrophobicContact CG-CB 4.32Å; R298-E328 HydrophobicContact CG-CG 4.47Å
299	E	96.2	Very high	92.4	Very high	102 Å²	102	34.2 Å²	34.2	48%	0.477	19%	0.186	S	C	.	.	H	α-helix	trans	-81.9	-27.9	-175.9	-69.8	174	165	0	0	113.3	K295 M296 M297	K295-E299 VanDerWaalsContact CE-CD 3.47Å; K295-E299 WeakPolarHBondContact CE-OE1 3.37Å; K295-E299 HydrophobicContact CG-CG 4.44Å; K295-E299 IonicContact NZ-OE1 3.74Å; K295-E299 WeakPolarHBondContact O-CG 3.2Å; K295-E299 PolarHBondContact O-N 3.28Å; M296-E299 PolarHBondContact O-N 2.87Å; M297-E299 PolarHBondContact O-N 2.84Å
300	N	97.6	Very high	93.6	Very high	51 Å²	51	33.2 Å²	33.2	27%	0.273	18%	0.178	S	C	.	.	H	α-helix	trans	-113.7	-29.1	-168.4	-63.4	-71.6	0	0	0	115.2	K239 S240 K241 M296 M297	K239-N300 CarbonylContact C-O 3.59Å; S240-N300 PolarHBondContact N-O 3.32Å; S240-N300 VanDerWaalsContact N-O 3.17Å; K241-N300 WeakPolarHBondContact CA-O 3.5Å; K241-N300 VanDerWaalsContact CB-O 3.3Å; K241-N300 WeakPolarHBondContact CB-O 3.35Å; K241-N300 HydrophobicContact CD-CB 4.32Å; K241-N300 HydrophobicContact CG-CB 4.42Å; K241-N300 PolarHBondContact N-O 3.2Å; M296-N300 WeakPolarHBondContact O-CB 3.38Å; M296-N300 PolarHBondContact O-N 3.43Å; M296-N300 VanDerWaalsContact O-N 3.08Å; M296-N300 PolarHBondContact O-ND2 3.02Å; M297-N300 PolarHBondContact O-N 3.38Å
301	Y	98.6	Very high	94.7	Very high	1 Å²	1	33 Å²	33	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	143.2	-170.6	-67.5	-96	0	0	0	112.9	K239 K241 A244 D270 Y272 M296 M297	K239-Y301 VanDerWaalsContact CD-O 3.25Å; K239-Y301 WeakPolarHBondContact CD-O 3.22Å; K239-Y301 PolarHBondContact NZ-O 2.84Å; K241-Y301 HydrophobicContact CB-CD1 3.46Å; K241-Y301 VanDerWaalsContact CB-CD1 3.46Å; K241-Y301 HydrophobicContact CB-CD2 4.33Å; K241-Y301 HydrophobicContact CB-CE1 3.54Å; K241-Y301 HydrophobicContact CB-CE2 4.43Å; K241-Y301 HydrophobicContact CB-CG 3.9Å; K241-Y301 HydrophobicContact CD-CD1 4.24Å; K241-Y301 HydrophobicContact CD-CD2 4.29Å; K241-Y301 HydrophobicContact CD-CE1 3.56Å; K241-Y301 HydrophobicContact CD-CE2 3.67Å; K241-Y301 WeakPolarHBondContact CD-OH 3.35Å; K241-Y301 HydrophobicContact CG-CE1 4.23Å; K241-Y301 PolarHBondContact NZ-OH 2.95Å; K241-Y301 WeakPolarHBondContact O-CA 3.42Å; A244-Y301 HydrophobicContact CB-CD1 3.61Å; 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 3.73Å; D270-Y301 VanDerWaalsContact CB-OH 3.24Å; D270-Y301 WeakPolarHBondContact CB-OH 3.48Å; D270-Y301 VanDerWaalsContact CG-OH 3.29Å; D270-Y301 WeakPolarHBondContact OD2-CE1 3.12Å; D270-Y301 PolarHBondContact OD2-OH 3.42Å; Y272-Y301 PolarHBondContact OH-OH 2.85Å; M296-Y301 HydrophobicContact SD-CE2 3.8Å; M297-Y301 PolarHBondContact O-N 3.43Å
302	K	98.7	Very high	95.4	Very high	12 Å²	12	27 Å²	27	5%	0.052	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-37.9	174.2	-69.7	-173.8	-178.5	175.6	0	113.3	K239 K241 K242 L330 D370 Y376	K239-K302 HydrophobicContact CB-CG 3.81Å; K239-K302 HydrophobicContact CD-CG 4.05Å; K241-K302 PolarHBondContact O-N 2.76Å; K241-K302 VanDerWaalsContact O-N 3.09Å; K242-K302 PolarHBondContact O-N 2.87Å; K302-L330 PolarHBondContact O-N 2.73Å; K302-D370 WeakPolarHBondContact CD-OD1 3.32Å; K302-D370 WeakPolarHBondContact CE-OD1 3.3Å; K302-D370 PolarHBondContact NZ-O 2.57Å; K302-D370 IonicContact NZ-OD1 2.81Å; K302-D370 PolarHBondContact NZ-OD1 2.61Å; K302-Y376 WeakPolarHBondContact CA-OH 3.39Å; K302-Y376 HydrophobicContact CB-CE2 3.77Å; K302-Y376 HydrophobicContact CG-CE2 4.31Å; K302-Y376 PolarHBondContact O-OH 2.77Å
303	F	98.9	Very high	95.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	148.8	-172	-44.2	-73.8	0	0	0	111.6	K242 V243 A244 L330 I332 L366 L369 D370 Y376	K242-F303 HydrophobicContact CB-CD2 4.4Å; K242-F303 WeakPolarHBondContact O-CD2 3.46Å; K242-F303 PolarHBondContact O-N 3.33Å; V243-F303 WeakPolarHBondContact CA-O 3.03Å; V243-F303 HydrophobicContact CG2-CB 4.14Å; V243-F303 HydrophobicContact CG2-CD2 4.09Å; A244-F303 PolarHBondContact N-O 3.33Å; F303-L330 WeakPolarHBondContact CA-O 3.35Å; F303-L330 HydrophobicContact CD1-CB 4.02Å; F303-L330 HydrophobicContact CD1-CD2 4.16Å; F303-L330 HydrophobicContact CD1-CG 4.27Å; F303-L330 HydrophobicContact CE1-CD2 4.08Å; F303-I332 HydrophobicContact CB-CD1 3.77Å; F303-I332 HydrophobicContact CB-CG1 4.38Å; F303-I332 HydrophobicContact CG-CD1 4.37Å; F303-L366 HydrophobicContact CD1-CD2 3.72Å; F303-L366 HydrophobicContact CD2-CB 4.47Å; F303-L366 HydrophobicContact CD2-CD2 4.32Å; F303-L366 HydrophobicContact CE1-CD2 3.77Å; F303-L366 HydrophobicContact CE2-CB 4.08Å; F303-L366 HydrophobicContact CE2-CD2 4.36Å; F303-L366 HydrophobicContact CG-CD2 4.02Å; F303-L366 HydrophobicContact CZ-CB 4.23Å; F303-L366 HydrophobicContact CZ-CD2 4.1Å; F303-L366 WeakPolarHBondContact CZ-O 3.02Å; F303-L369 HydrophobicContact CE1-CB 4.1Å; F303-L369 HydrophobicContact CE1-CD1 4.09Å; F303-L369 HydrophobicContact CZ-CB 3.9Å; F303-D370 HydrophobicContact CE2-CB 4.43Å; F303-Y376 HydrophobicContact CD1-CE2 4.23Å; F303-Y376 AromaticContact CE1-CD2 3.93Å; F303-Y376 HydrophobicContact CE1-CD2 3.93Å; F303-Y376 AromaticContact CE1-CE2 3.79Å; F303-Y376 HydrophobicContact CE1-CE2 3.79Å; F303-Y376 HydrophobicContact CZ-CD2 4.34Å; F303-Y376 HydrophobicContact CZ-CE2 4.37Å
304	Y	98.6	Very high	96	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.6	175.7	-175.5	-93.7	0	0	0	110.5	A244 F246 M297 S306 N323 A324 L329 L330 I332	A244-Y304 HydrophobicContact CB-CD2 4.3Å; A244-Y304 WeakPolarHBondContact O-CA 3.02Å; F246-Y304 HydrophobicContact CB-CE2 4.39Å; F246-Y304 AromaticContact CD2-CE2 3.97Å; F246-Y304 HydrophobicContact CD2-CE2 3.97Å; F246-Y304 HydrophobicContact CG-CE2 4.47Å; M297-Y304 HydrophobicContact CE-CD2 4.34Å; M297-Y304 HydrophobicContact CE-CE2 4.22Å; M297-Y304 HydrophobicContact SD-CD2 3.86Å; M297-Y304 HydrophobicContact SD-CE2 3.76Å; Y304-S306 WeakPolarHBondContact CD1-OG 3.45Å; Y304-S306 PolarHBondContact O-N 2.92Å; Y304-S306 VanDerWaalsContact O-N 3.15Å; Y304-N323 HydrophobicContact CD1-CB 4.4Å; Y304-N323 HydrophobicContact CE1-CB 3.7Å; Y304-N323 HydrophobicContact CE2-CB 4.16Å; Y304-N323 PolarHBondContact OH-ND2 3.03Å; Y304-A324 HydrophobicContact CD1-CB 3.87Å; Y304-A324 HydrophobicContact CG-CB 4.14Å; Y304-L329 HydrophobicContact CD2-CD2 4.2Å; Y304-L329 HydrophobicContact CG-CD2 4.42Å; Y304-L330 PolarHBondContact N-O 3.38Å; Y304-I332 PolarHBondContact O-N 3.26Å
305	L	98.8	Very high	96.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	98.9	172.4	-61.5	-170.9	0	0	0	110.3	V243 A244 W245 A260 L263 V269 F307 I332	V243-L305 HydrophobicContact CG1-CD1 4.23Å; V243-L305 HydrophobicContact CG1-CD2 3.64Å; V243-L305 HydrophobicContact CG1-CG 3.55Å; A244-L305 PolarHBondContact O-N 3.36Å; W245-L305 HydrophobicContact CB-CB 3.94Å; W245-L305 HydrophobicContact CB-CD1 3.92Å; W245-L305 HydrophobicContact CB-CG 4.1Å; W245-L305 VanDerWaalsContact CD1-CB 3.47Å; W245-L305 VanDerWaalsContact CD1-O 3.26Å; W245-L305 HydrophobicContact CD2-CB 4.36Å; W245-L305 HydrophobicContact CD2-CD1 3.96Å; W245-L305 HydrophobicContact CE3-CD1 4.25Å; W245-L305 HydrophobicContact CG-CB 3.68Å; W245-L305 HydrophobicContact CG-CD1 3.86Å; W245-L305 HydrophobicContact CG-CG 4.19Å; A260-L305 HydrophobicContact CB-CD1 4.03Å; L263-L305 HydrophobicContact CD2-CD1 4.34Å; L263-L305 HydrophobicContact CD2-CD2 3.88Å; V269-L305 HydrophobicContact CG1-CD1 4.01Å; L305-F307 HydrophobicContact CB-CD1 4.29Å; L305-F307 HydrophobicContact CB-CD2 4.33Å; L305-F307 HydrophobicContact CB-CE1 4.4Å; L305-F307 HydrophobicContact CB-CE2 4.46Å; L305-F307 HydrophobicContact CB-CG 4.28Å; L305-F307 HydrophobicContact CD1-CD2 4.24Å; L305-F307 HydrophobicContact CD1-CE2 3.83Å; L305-F307 HydrophobicContact CD1-CZ 4.18Å; L305-F307 HydrophobicContact CD2-CE1 3.99Å; L305-F307 HydrophobicContact CD2-CE2 4.28Å; L305-F307 HydrophobicContact CD2-CZ 3.77Å; L305-F307 HydrophobicContact CG-CE2 4.41Å; L305-F307 HydrophobicContact CG-CZ 4.37Å; L305-F307 PolarHBondContact O-N 2.92Å; L305-F307 VanDerWaalsContact O-N 3.14Å; L305-I332 HydrophobicContact CD2-CB 3.91Å; L305-I332 HydrophobicContact CD2-CD1 3.76Å; L305-I332 HydrophobicContact CD2-CG1 4.44Å; L305-I332 HydrophobicContact CD2-CG2 4.12Å
306	S	98.4	Very high	96.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	50.2	173.8	-59.3	0	0	0	0	111.1	Y304 K319 P331 I332	Y304-S306 WeakPolarHBondContact CD1-OG 3.45Å; Y304-S306 PolarHBondContact O-N 2.92Å; Y304-S306 VanDerWaalsContact O-N 3.15Å; S306-K319 WeakPolarHBondContact CB-O 3.42Å; S306-K319 PolarHBondContact OG-O 3.16Å; S306-P331 WeakPolarHBondContact OG-CB 3.09Å; S306-I332 PolarHBondContact N-O 2.88Å
307	F	98.2	Very high	96.8	Very high	1 Å²	1	18.9 Å²	18.9	0%	0.004	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.8	-176.6	-68	-5.4	0	0	0	112	W245 R256 Y259 A260 L305 K319 I332 M334 V353	W245-F307 HydrophobicContact CZ2-CD2 4.16Å; R256-F307 HydrophobicContact CB-CB 3.77Å; R256-F307 HydrophobicContact CB-CD2 3.83Å; R256-F307 HydrophobicContact CB-CG 4.2Å; Y259-F307 AromaticContact CD1-CE2 3.92Å; Y259-F307 HydrophobicContact CD1-CE2 3.92Å; Y259-F307 AromaticContact CD1-CZ 3.73Å; Y259-F307 HydrophobicContact CD1-CZ 3.73Å; Y259-F307 HydrophobicContact CE1-CZ 4.15Å; Y259-F307 HydrophobicContact CG-CE2 4.4Å; Y259-F307 HydrophobicContact CG-CZ 4.45Å; A260-F307 HydrophobicContact CB-CE2 4.17Å; L305-F307 HydrophobicContact CB-CD1 4.29Å; L305-F307 HydrophobicContact CB-CD2 4.33Å; L305-F307 HydrophobicContact CB-CE1 4.4Å; L305-F307 HydrophobicContact CB-CE2 4.46Å; L305-F307 HydrophobicContact CB-CG 4.28Å; L305-F307 HydrophobicContact CD1-CD2 4.24Å; L305-F307 HydrophobicContact CD1-CE2 3.83Å; L305-F307 HydrophobicContact CD1-CZ 4.18Å; L305-F307 HydrophobicContact CD2-CE1 3.99Å; L305-F307 HydrophobicContact CD2-CE2 4.28Å; L305-F307 HydrophobicContact CD2-CZ 3.77Å; L305-F307 HydrophobicContact CG-CE2 4.41Å; L305-F307 HydrophobicContact CG-CZ 4.37Å; L305-F307 PolarHBondContact O-N 2.92Å; L305-F307 VanDerWaalsContact O-N 3.14Å; F307-K319 VanDerWaalsContact O-CD 3.24Å; F307-K319 WeakPolarHBondContact O-CD 3.36Å; F307-I332 WeakPolarHBondContact CD1-O 3.48Å; F307-I332 HydrophobicContact CE1-CG2 3.97Å; F307-M334 HydrophobicContact CB-CB 4.3Å; F307-M334 HydrophobicContact CD1-CB 3.42Å; F307-M334 VanDerWaalsContact CD1-CB 3.42Å; F307-M334 HydrophobicContact CD2-CE 4.32Å; F307-M334 HydrophobicContact CD2-SD 4.49Å; F307-M334 HydrophobicContact CE1-CB 3.83Å; F307-M334 HydrophobicContact CE1-CE 4.31Å; F307-M334 HydrophobicContact CE2-CE 4.06Å; F307-M334 HydrophobicContact CG-CB 3.93Å; F307-M334 HydrophobicContact CG-SD 4.41Å; F307-M334 HydrophobicContact CZ-CE 4.06Å; F307-V353 HydrophobicContact CE1-CG1 3.7Å; F307-V353 HydrophobicContact CZ-CG1 3.96Å
308	E	97	Very high	96.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.			trans	-80.3	153.7	-176	-64.5	-63.1	174.9	0	0	113.9	S254 R256 S310 Y315 T317 K319 M334	S254-E308 PolarHBondContact OG-O 2.68Å; R256-E308 WeakPolarHBondContact CD-O 3.29Å; E308-S310 PolarHBondContact O-N 3.44Å; E308-Y315 HydrophobicContact CB-CD1 4.16Å; E308-Y315 HydrophobicContact CB-CE1 4.32Å; E308-Y315 HydrophobicContact CG-CD1 4.38Å; E308-T317 WeakPolarHBondContact OE1-CB 3.47Å; E308-T317 PolarHBondContact OE1-N 3.24Å; E308-T317 PolarHBondContact OE1-OG1 3.1Å; E308-T317 WeakPolarHBondContact OE2-CG2 3.23Å; E308-T317 PolarHBondContact OE2-OG1 3.19Å; E308-K319 IonicContact OE2-NZ 2.74Å; E308-K319 PolarHBondContact OE2-NZ 3.24Å; E308-M334 WeakPolarHBondContact CB-O 3.46Å; E308-M334 PolarHBondContact N-O 3.32Å
309	N	95.1	Very high	96.7	Very high	26 Å²	26	18 Å²	18	14%	0.139	9%	0.092	C	C	.	.	S	Bend	trans	-67	-19.4	179.3	-71.4	-37	0	0	0	113.3	K253 R256	K253-N309 PolarHBondContact N-O 3.19Å; R256-N309 PolarHBondContact NH2-OD1 2.87Å
310	S	95.6	Very high	96.8	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.007	7%	0.069	C	C	.	.	S	Bend	trans	-150.2	148	179.2	-54.7	0	0	0	0	109.8	S182 H185 E308 C312	S182-S310 VanDerWaalsContact OG-CB 3.32Å; S182-S310 WeakPolarHBondContact OG-CB 3.38Å; S182-S310 PolarHBondContact OG-OG 2.7Å; H185-S310 PolarHBondContact CE1-OG 3.06Å; H185-S310 VanDerWaalsContact CE1-OG 3.31Å; H185-S310 PolarHBondContact ND1-OG 3.16Å; E308-S310 PolarHBondContact O-N 3.44Å; S310-C312 WeakPolarHBondContact CB-SG 3.23Å; S310-C312 PolarHBondContact O-N 3.45Å
311	L	95.9	Very high	96.8	Very high	23 Å²	23	10.9 Å²	10.9	12%	0.12	6%	0.056	C	C	.	.			trans	-88.3	86.8	173.7	-53.6	-177	0	0	0	108.2	P255 M334 R428 L430	P255-L311 HydrophobicContact CG-CD1 4.3Å; L311-M334 HydrophobicContact CD2-CG 3.8Å; L311-M334 HydrophobicContact CD2-SD 4.41Å; L311-R428 HydrophobicContact CB-CB 4.27Å; L311-R428 HydrophobicContact CB-CG 3.6Å; L311-L430 HydrophobicContact CD1-CD1 4.49Å; L311-L430 HydrophobicContact CD1-CD2 3.95Å; L311-L430 HydrophobicContact CD1-CG 3.82Å; L311-L430 HydrophobicContact CD2-CD2 4.07Å
312	C	96.6	Very high	96.5	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.007	7%	0.068	C	C	.	.			trans	-128.3	149.5	-176.1	-54.2	0	0	0	0	110.9	S310 E314 Y315 A336 C425	S310-C312 WeakPolarHBondContact CB-SG 3.23Å; S310-C312 PolarHBondContact O-N 3.45Å; C312-E314 PolarHBondContact O-N 2.74Å; C312-Y315 PolarHBondContact O-N 2.94Å; C312-A336 WeakPolarHBondContact O-CA 3.34Å; C312-C425 HydrophobicContact CB-CB 3.93Å; C312-C425 WeakPolarHBondContact CB-SG 3.16Å; C312-C425 WeakPolarHBondContact SG-CB 3.42Å; C312-C425 CovalentContact SG-SG 2.03Å; C312-C425 PolarHBondContact SG-SG 3.41Å
313	S	94.7	Very high	96.3	Very high	40 Å²	40	13.8 Å²	13.8	28%	0.28	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	132	174.7	-175.1	0	0	0	0	109.9	Y315 E340 G424	S313-Y315 PolarHBondContact O-N 3.08Å; S313-E340 WeakPolarHBondContact CA-OE1 3.22Å; S313-E340 WeakPolarHBondContact CB-OE1 3.45Å; S313-E340 PolarHBondContact OG-OE1 3.27Å; S313-G424 WeakPolarHBondContact CB-O 3.49Å; S313-G424 PolarHBondContact N-O 3.25Å
314	E	94.2	Very high	96.2	Very high	32 Å²	32	13.8 Å²	13.8	15%	0.15	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	3.7	175.8	-49.7	-174.4	145.3	0	0	116.5	F202 R203 L204 C312 V316 E340 R343	F202-E314 WeakPolarHBondContact CD2-O 3.21Å; R203-E314 WeakPolarHBondContact CA-OE2 3.35Å; L204-E314 VanDerWaalsContact CD1-OE1 3.31Å; L204-E314 WeakPolarHBondContact CD1-OE1 3.48Å; L204-E314 PolarHBondContact N-OE2 2.97Å; C312-E314 PolarHBondContact O-N 2.74Å; E314-V316 PolarHBondContact O-N 3.41Å; E314-E340 WeakPolarHBondContact CG-OE1 3.31Å; E314-E340 PolarHBondContact N-OE1 3.45Å; E314-R343 IonicContact OE1-CZ 2.75Å; E314-R343 IonicContact OE1-NH2 3.04Å; E314-R343 PolarHBondContact OE1-NH2 2.88Å
315	Y	97	Very high	96.1	Very high	2 Å²	2	14 Å²	14	1%	0.008	7%	0.071	C	C	.	.			trans	-77.4	88.4	178.3	-173.7	-115.3	0	0	0	110.5	E181 F202 Y212 E308 C312 S313 T317	E181-Y315 PolarHBondContact OE2-OH 3.4Å; F202-Y315 AromaticContact CD1-CD2 3.75Å; F202-Y315 HydrophobicContact CD1-CD2 3.75Å; F202-Y315 HydrophobicContact CD1-CE2 4.23Å; F202-Y315 HydrophobicContact CD2-CD2 4.23Å; F202-Y315 AromaticContact CE1-CD2 3.36Å; F202-Y315 HydrophobicContact CE1-CD2 3.36Å; F202-Y315 AromaticContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CE2 3.89Å; F202-Y315 HydrophobicContact CE1-CG 4.41Å; F202-Y315 AromaticContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CD2 3.9Å; F202-Y315 HydrophobicContact CE2-CG 4.29Å; F202-Y315 HydrophobicContact CG-CD2 4.18Å; F202-Y315 AromaticContact CZ-CD2 3.46Å; F202-Y315 HydrophobicContact CZ-CD2 3.46Å; F202-Y315 VanDerWaalsContact CZ-CD2 3.46Å; F202-Y315 HydrophobicContact CZ-CE2 4.36Å; F202-Y315 HydrophobicContact CZ-CG 4.1Å; Y212-Y315 HydrophobicContact CE2-CE2 4.14Å; E308-Y315 HydrophobicContact CB-CD1 4.16Å; E308-Y315 HydrophobicContact CB-CE1 4.32Å; E308-Y315 HydrophobicContact CG-CD1 4.38Å; C312-Y315 PolarHBondContact O-N 2.94Å; S313-Y315 PolarHBondContact O-N 3.08Å; Y315-T317 HydrophobicContact CD1-CG2 4.21Å; Y315-T317 HydrophobicContact CD2-CG2 4.13Å; Y315-T317 HydrophobicContact CE1-CG2 3.75Å; Y315-T317 HydrophobicContact CE2-CG2 3.71Å; Y315-T317 HydrophobicContact CG-CG2 4.4Å
316	V	96.7	Very high	96	Very high	6 Å²	6	16.2 Å²	16.2	4%	0.036	8%	0.083	C	C	.	.			trans	-123.3	116.7	179.8	-179.3	0	0	0	0	108.9	E314 L320 Y321 A336 Y341 V344	E314-V316 PolarHBondContact O-N 3.41Å; V316-L320 HydrophobicContact CG1-CB 3.92Å; V316-L320 HydrophobicContact CG1-CD2 3.38Å; V316-L320 HydrophobicContact CG1-CG 4.28Å; V316-Y321 HydrophobicContact CG1-CE2 3.8Å; V316-A336 HydrophobicContact CG2-CB 4.21Å; V316-Y341 HydrophobicContact CB-CE1 4.26Å; V316-Y341 HydrophobicContact CG1-CD1 4.03Å; V316-Y341 HydrophobicContact CG1-CE1 3.7Å; V316-Y341 HydrophobicContact CG2-CD1 3.89Å; V316-Y341 HydrophobicContact CG2-CE1 3.65Å; V316-Y341 HydrophobicContact CG2-CG 4.43Å; V316-V344 HydrophobicContact CB-CG2 4.41Å; V316-V344 HydrophobicContact CG1-CG2 4.28Å; V316-V344 HydrophobicContact CG2-CG2 4.25Å
317	T	95.6	Very high	95.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.			trans	-110.1	-170.8	-163.4	70.8	0	0	0	0	113.9	Y212 E308 Y315 K319 L320 Y321	Y212-T317 HydrophobicContact CD2-CG2 4.01Å; Y212-T317 HydrophobicContact CE2-CG2 4.01Å; Y212-T317 HydrophobicContact CG-CG2 4.37Å; E308-T317 WeakPolarHBondContact OE1-CB 3.47Å; E308-T317 PolarHBondContact OE1-N 3.24Å; E308-T317 PolarHBondContact OE1-OG1 3.1Å; E308-T317 WeakPolarHBondContact OE2-CG2 3.23Å; E308-T317 PolarHBondContact OE2-OG1 3.19Å; Y315-T317 HydrophobicContact CD1-CG2 4.21Å; Y315-T317 HydrophobicContact CD2-CG2 4.13Å; Y315-T317 HydrophobicContact CE1-CG2 3.75Å; Y315-T317 HydrophobicContact CE2-CG2 3.71Å; Y315-T317 HydrophobicContact CG-CG2 4.4Å; T317-K319 PolarHBondContact O-N 3.2Å; T317-K319 PolarHBondContact OG1-N 2.85Å; T317-K319 PolarHBondContact OG1-NZ 3.37Å; T317-L320 PolarHBondContact O-N 3.31Å; T317-L320 VanDerWaalsContact O-N 3.11Å; T317-Y321 VanDerWaalsContact O-CD2 3.24Å; T317-Y321 WeakPolarHBondContact O-CD2 3.37Å
318	E	93.8	Very high	95.7	Very high	58 Å²	58	17.9 Å²	17.9	27%	0.271	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.6	174.2	79.5	-65.8	153.4	0	0	113.2	L320 Y321 K322 N323	E318-L320 VanDerWaalsContact C-N 3.29Å; E318-L320 PolarHBondContact O-N 3.31Å; E318-Y321 PolarHBondContact O-N 3.01Å; E318-K322 HydrophobicContact CB-CB 4.01Å; E318-K322 WeakPolarHBondContact O-CA 3.39Å; E318-K322 WeakPolarHBondContact O-CB 3.5Å; E318-K322 PolarHBondContact O-N 3.09Å; E318-N323 PolarHBondContact O-N 3.01Å
319	K	95.6	Very high	95.8	Very high	22 Å²	22	17.9 Å²	17.9	10%	0.096	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-35	177.6	-66.8	171.4	-156.6	61.1	0	112.6	S306 F307 E308 T317	S306-K319 WeakPolarHBondContact CB-O 3.42Å; S306-K319 PolarHBondContact OG-O 3.16Å; F307-K319 VanDerWaalsContact O-CD 3.24Å; F307-K319 WeakPolarHBondContact O-CD 3.36Å; E308-K319 IonicContact OE2-NZ 2.74Å; E308-K319 PolarHBondContact OE2-NZ 3.24Å; T317-K319 PolarHBondContact O-N 3.2Å; T317-K319 PolarHBondContact OG1-N 2.85Å; T317-K319 PolarHBondContact OG1-NZ 3.37Å
320	L	97.9	Very high	95.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-55.5	174.1	176.7	66	0	0	0	110	V316 T317 E318 A324 L325 P331 V333 Y341 A345	V316-L320 HydrophobicContact CG1-CB 3.92Å; V316-L320 HydrophobicContact CG1-CD2 3.38Å; V316-L320 HydrophobicContact CG1-CG 4.28Å; T317-L320 PolarHBondContact O-N 3.31Å; T317-L320 VanDerWaalsContact O-N 3.11Å; E318-L320 VanDerWaalsContact C-N 3.29Å; E318-L320 PolarHBondContact O-N 3.31Å; L320-A324 WeakPolarHBondContact O-CB 3.44Å; L320-L325 HydrophobicContact CD1-CD1 3.97Å; L320-L325 HydrophobicContact CD1-CG 4.27Å; L320-L325 HydrophobicContact CG-CD1 3.9Å; L320-L325 WeakPolarHBondContact O-CG 3.39Å; L320-L325 PolarHBondContact O-N 2.95Å; L320-P331 HydrophobicContact CD1-CB 3.7Å; L320-P331 HydrophobicContact CD1-CG 3.55Å; L320-V333 HydrophobicContact CD1-CG1 3.91Å; L320-Y341 HydrophobicContact CD2-CD1 4.06Å; L320-Y341 HydrophobicContact CD2-CE1 4.32Å; L320-A345 HydrophobicContact CD2-CB 4.06Å
321	Y	96.1	Very high	96.1	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.008	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-71.6	-169.2	-52.8	-73.9	0	0	0	111.9	G213 V316 T317 E318 L325 N326 V344 I388	G213-Y321 WeakPolarHBondContact O-CE2 3.46Å; G213-Y321 VanDerWaalsContact O-CZ 3.32Å; G213-Y321 PolarHBondContact O-OH 3.27Å; V316-Y321 HydrophobicContact CG1-CE2 3.8Å; T317-Y321 VanDerWaalsContact O-CD2 3.24Å; T317-Y321 WeakPolarHBondContact O-CD2 3.37Å; E318-Y321 PolarHBondContact O-N 3.01Å; Y321-L325 HydrophobicContact CD1-CD1 4.42Å; Y321-L325 PolarHBondContact O-N 2.77Å; Y321-N326 WeakPolarHBondContact O-CB 3.07Å; Y321-N326 PolarHBondContact O-N 2.89Å; Y321-V344 WeakPolarHBondContact OH-CB 3.31Å; Y321-V344 VanDerWaalsContact OH-CG2 3.27Å; Y321-V344 WeakPolarHBondContact OH-CG2 3.47Å; Y321-I388 HydrophobicContact CD1-CG2 4.03Å; Y321-I388 HydrophobicContact CG-CG2 4.42Å
322	K	93.5	Very high	96.2	Very high	57 Å²	57	15.6 Å²	15.6	25%	0.248	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-49.9	-173.9	-177	173.7	-175.8	158.4	0	112.7	E318 N327 D390	E318-K322 HydrophobicContact CB-CB 4.01Å; E318-K322 WeakPolarHBondContact O-CA 3.39Å; E318-K322 WeakPolarHBondContact O-CB 3.5Å; E318-K322 PolarHBondContact O-N 3.09Å; K322-N327 PolarHBondContact O-ND2 2.98Å; K322-D390 HydrophobicContact CB-CB 4.03Å; K322-D390 WeakPolarHBondContact CD-OD2 3.49Å; K322-D390 WeakPolarHBondContact CG-OD2 3.33Å
323	N	93.5	Very high	96.3	Very high	18 Å²	18	15.5 Å²	15.5	10%	0.096	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-32.3	-170.5	-64	-22	0	0	0	113	M297 Y304 E318	M297-N323 WeakPolarHBondContact CE-O 3.44Å; Y304-N323 HydrophobicContact CD1-CB 4.4Å; Y304-N323 HydrophobicContact CE1-CB 3.7Å; Y304-N323 HydrophobicContact CE2-CB 4.16Å; Y304-N323 PolarHBondContact OH-ND2 3.03Å; E318-N323 PolarHBondContact O-N 3.01Å
324	A	96.9	Very high	96.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-71.1	-175.9	0	0	0	0	0	113.1	Y304 L320 N326 N327 E328 L329 P331	Y304-A324 HydrophobicContact CD1-CB 3.87Å; Y304-A324 HydrophobicContact CG-CB 4.14Å; L320-A324 WeakPolarHBondContact O-CB 3.44Å; A324-N326 PolarHBondContact O-N 2.03Å; A324-N327 CarbonylContact O-C 3.47Å; A324-N327 WeakPolarHBondContact O-CA 3.3Å; A324-N327 PolarHBondContact O-N 2.84Å; A324-E328 PolarHBondContact O-N 2.81Å; A324-E328 VanDerWaalsContact O-N 3.11Å; A324-L329 CarbonylContact C-O 3.56Å; A324-L329 PolarHBondContact O-N 3.3Å; A324-L329 VanDerWaalsContact O-N 3.08Å; A324-P331 HydrophobicContact CB-CB 3.7Å; A324-P331 HydrophobicContact CB-CG 4.29Å
325	L	97.5	Very high	96.6	Very high	5 Å²	5	12.1 Å²	12.1	3%	0.026	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-61.5	-48.1	-171.4	-65.4	174	0	0	0	112.5	L320 Y321 N327 E328 P331 P346 W382 I388	L320-L325 HydrophobicContact CD1-CD1 3.97Å; L320-L325 HydrophobicContact CD1-CG 4.27Å; L320-L325 HydrophobicContact CG-CD1 3.9Å; L320-L325 WeakPolarHBondContact O-CG 3.39Å; L320-L325 PolarHBondContact O-N 2.95Å; Y321-L325 HydrophobicContact CD1-CD1 4.42Å; Y321-L325 PolarHBondContact O-N 2.77Å; L325-N327 PolarHBondContact O-N 3.08Å; L325-N327 VanDerWaalsContact O-N 3.08Å; L325-E328 PolarHBondContact O-N 3.11Å; L325-E328 VanDerWaalsContact O-N 3.1Å; L325-P331 HydrophobicContact CD2-CG 3.86Å; L325-P331 HydrophobicContact CG-CG 4.22Å; L325-P346 HydrophobicContact CD1-CG 4.18Å; L325-W382 HydrophobicContact CB-CH2 4.35Å; L325-W382 HydrophobicContact CB-CZ2 4.26Å; L325-W382 HydrophobicContact CD2-CZ2 3.78Å; L325-I388 HydrophobicContact CB-CD1 4.28Å; L325-I388 HydrophobicContact CB-CG1 4.13Å; L325-I388 HydrophobicContact CD1-CD1 3.83Å
326	N	95.3	Very high	96.6	Very high	46 Å²	46	12 Å²	12	25%	0.246	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-62.8	-15	175.3	-88.2	-12.7	0	0	0	113.5	R298 Y321 A324 I388 D390	R298-N326 PolarHBondContact NH2-O 3.15Å; Y321-N326 WeakPolarHBondContact O-CB 3.07Å; Y321-N326 PolarHBondContact O-N 2.89Å; A324-N326 PolarHBondContact O-N 2.03Å; N326-I388 WeakPolarHBondContact OD1-CB 3.09Å; N326-I388 VanDerWaalsContact OD1-CG2 3.31Å; N326-I388 WeakPolarHBondContact OD1-CG2 3.33Å; N326-D390 PolarHBondContact ND2-OD1 3.37Å; N326-D390 VanDerWaalsContact ND2-OD1 3.08Å
327	N	94.8	Very high	96.6	Very high	13 Å²	13	13.1 Å²	13.1	7%	0.07	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-110.8	11.8	178.6	-76.6	-68.7	0	0	0	113.5	R298 K322 A324 L325 L329	R298-N327 WeakPolarHBondContact CA-O 3.25Å; R298-N327 WeakPolarHBondContact CB-O 3.4Å; R298-N327 WeakPolarHBondContact CG-O 3.43Å; K322-N327 PolarHBondContact O-ND2 2.98Å; A324-N327 CarbonylContact O-C 3.47Å; A324-N327 WeakPolarHBondContact O-CA 3.3Å; A324-N327 PolarHBondContact O-N 2.84Å; L325-N327 PolarHBondContact O-N 3.08Å; L325-N327 VanDerWaalsContact O-N 3.08Å; N327-L329 VanDerWaalsContact C-N 3.29Å; N327-L329 HydrophobicContact CB-CD1 3.9Å; N327-L329 WeakPolarHBondContact O-CD1 3.1Å; N327-L329 PolarHBondContact O-N 2.84Å
328	E	96.3	Very high	96.6	Very high	24 Å²	24	14.8 Å²	14.8	11%	0.112	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	39.3	177.7	-46.7	177.8	170.7	0	0	112.8	R233 I235 K239 R298 A324 L325 H383	R233-E328 IonicContact CZ-OE1 3.76Å; R233-E328 IonicContact CZ-OE2 3.49Å; R233-E328 IonicContact NH1-OE1 3.98Å; R233-E328 IonicContact NH1-OE2 3.32Å; R233-E328 PolarHBondContact NH1-OE2 2.78Å; R233-E328 IonicContact NH2-OE1 2.72Å; R233-E328 PolarHBondContact NH2-OE1 3.41Å; R233-E328 IonicContact NH2-OE2 2.81Å; R233-E328 PolarHBondContact NH2-OE2 2.97Å; I235-E328 HydrophobicContact CG2-CB 4.03Å; K239-E328 WeakPolarHBondContact CE-O 3.21Å; K239-E328 PolarHBondContact NZ-O 3.21Å; R298-E328 HydrophobicContact CG-CB 4.32Å; R298-E328 HydrophobicContact CG-CG 4.47Å; A324-E328 PolarHBondContact O-N 2.81Å; A324-E328 VanDerWaalsContact O-N 3.11Å; L325-E328 PolarHBondContact O-N 3.11Å; L325-E328 VanDerWaalsContact O-N 3.1Å; E328-H383 IonicContact OE1-NE2 2.94Å
329	L	98.2	Very high	96.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.			trans	-110.4	145	167.6	-74.4	74.7	0	0	0	108.5	M297 Y304 A324 N327 P331	M297-L329 HydrophobicContact CB-CD1 4.13Å; M297-L329 HydrophobicContact CB-CD2 4.06Å; Y304-L329 HydrophobicContact CD2-CD2 4.2Å; Y304-L329 HydrophobicContact CG-CD2 4.42Å; A324-L329 CarbonylContact C-O 3.56Å; A324-L329 PolarHBondContact O-N 3.3Å; A324-L329 VanDerWaalsContact O-N 3.08Å; N327-L329 VanDerWaalsContact C-N 3.29Å; N327-L329 HydrophobicContact CB-CD1 3.9Å; N327-L329 WeakPolarHBondContact O-CD1 3.1Å; N327-L329 PolarHBondContact O-N 2.84Å; L329-P331 WeakPolarHBondContact O-CD 3.48Å
330	L	98.8	Very high	96.6	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	110.7	175.4	176.5	48.3	0	0	0	108.7	K302 F303 Y304 I332 S349 I351 L369 Y376 Y379 F380	K302-L330 PolarHBondContact O-N 2.73Å; F303-L330 WeakPolarHBondContact CA-O 3.35Å; F303-L330 HydrophobicContact CD1-CB 4.02Å; F303-L330 HydrophobicContact CD1-CD2 4.16Å; F303-L330 HydrophobicContact CD1-CG 4.27Å; F303-L330 HydrophobicContact CE1-CD2 4.08Å; Y304-L330 PolarHBondContact N-O 3.38Å; L330-I332 PolarHBondContact O-N 2.64Å; L330-S349 WeakPolarHBondContact CD1-O 3.3Å; L330-I351 HydrophobicContact CD1-CG1 4.35Å; L330-I351 HydrophobicContact CD2-CD1 3.64Å; L330-I351 HydrophobicContact CD2-CG1 4.1Å; L330-I351 HydrophobicContact CG-CD1 4.07Å; L330-I351 HydrophobicContact CG-CG1 4.24Å; L330-L369 HydrophobicContact CD2-CD1 4Å; L330-Y376 HydrophobicContact CB-CE2 3.96Å; L330-Y376 HydrophobicContact CD2-CD2 4.28Å; L330-Y376 HydrophobicContact CD2-CE2 4.2Å; L330-Y379 HydrophobicContact CD1-CD1 3.64Å; L330-Y379 HydrophobicContact CD1-CE1 4.41Å; L330-Y379 HydrophobicContact CD1-CG 3.75Å; L330-Y379 HydrophobicContact CD2-CD1 4.12Å; L330-Y379 HydrophobicContact CD2-CD2 3.65Å; L330-Y379 HydrophobicContact CD2-CE2 4.18Å; L330-Y379 HydrophobicContact CD2-CG 3.61Å; L330-Y379 HydrophobicContact CG-CG 4.35Å; L330-F380 HydrophobicContact CB-CE2 4.06Å; L330-F380 HydrophobicContact CB-CZ 4.02Å
331	P	98.8	Very high	96.6	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	131.3	179.5	26.4	-35.4	0	0	0	111.6	S306 L320 A324 L325 L329 V333 S349 F350 I351	S306-P331 WeakPolarHBondContact OG-CB 3.09Å; L320-P331 HydrophobicContact CD1-CB 3.7Å; L320-P331 HydrophobicContact CD1-CG 3.55Å; A324-P331 HydrophobicContact CB-CB 3.7Å; A324-P331 HydrophobicContact CB-CG 4.29Å; L325-P331 HydrophobicContact CD2-CG 3.86Å; L325-P331 HydrophobicContact CG-CG 4.22Å; L329-P331 WeakPolarHBondContact O-CD 3.48Å; P331-V333 HydrophobicContact CB-CG1 4.11Å; P331-S349 VanDerWaalsContact CD-O 3.32Å; P331-S349 WeakPolarHBondContact CD-O 3.34Å; P331-S349 WeakPolarHBondContact CG-O 3.34Å; P331-F350 HydrophobicContact CB-CB 4.49Å; P331-F350 HydrophobicContact CG-CB 3.75Å; P331-I351 PolarHBondContact O-N 3.48Å
332	I	98.9	Very high	96.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	107.9	165.3	-56.5	164	0	0	0	106.7	V243 F303 Y304 L305 S306 F307 L330 I351 V353 L362 L366	V243-I332 HydrophobicContact CG1-CD1 4.5Å; F303-I332 HydrophobicContact CB-CD1 3.77Å; F303-I332 HydrophobicContact CB-CG1 4.38Å; F303-I332 HydrophobicContact CG-CD1 4.37Å; Y304-I332 PolarHBondContact O-N 3.26Å; L305-I332 HydrophobicContact CD2-CB 3.91Å; L305-I332 HydrophobicContact CD2-CD1 3.76Å; L305-I332 HydrophobicContact CD2-CG1 4.44Å; L305-I332 HydrophobicContact CD2-CG2 4.12Å; S306-I332 PolarHBondContact N-O 2.88Å; F307-I332 WeakPolarHBondContact CD1-O 3.48Å; F307-I332 HydrophobicContact CE1-CG2 3.97Å; L330-I332 PolarHBondContact O-N 2.64Å; I332-I351 CarbonylContact C-O 3.56Å; I332-I351 VanDerWaalsContact CA-O 3.24Å; I332-I351 WeakPolarHBondContact CA-O 3.25Å; I332-I351 HydrophobicContact CG1-CB 4.48Å; I332-V353 HydrophobicContact CG2-CG1 4.15Å; I332-L362 HydrophobicContact CG2-CD2 3.86Å; I332-L366 HydrophobicContact CD1-CD1 3.51Å; I332-L366 HydrophobicContact CD1-CD2 3.76Å; I332-L366 HydrophobicContact CD1-CG 4.27Å; I332-L366 HydrophobicContact CG1-CD2 4.22Å
333	V	98.8	Very high	96.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145	-169.3	-61.5	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 4.19Å; V333-Y341 HydrophobicContact CB-CD2 4.49Å; V333-Y341 HydrophobicContact CB-CE1 3.66Å; V333-Y341 HydrophobicContact CB-CE2 4Å; V333-Y341 HydrophobicContact CG1-CD1 4.04Å; V333-Y341 HydrophobicContact CG1-CE1 3.61Å; V333-Y341 HydrophobicContact CG2-CD1 4.12Å; V333-Y341 HydrophobicContact CG2-CD2 3.97Å; V333-Y341 HydrophobicContact CG2-CE1 4.05Å; V333-Y341 HydrophobicContact CG2-CE2 3.91Å; V333-Y341 HydrophobicContact CG2-CG 4.1Å; V333-F350 HydrophobicContact CG1-CB 4.26Å; V333-F350 HydrophobicContact CG2-CB 4.48Å; V333-F350 HydrophobicContact CG2-CD2 3.53Å; V333-F350 HydrophobicContact CG2-CE2 4.13Å; V333-F350 HydrophobicContact CG2-CG 4.27Å; V333-I351 WeakPolarHBondContact CG2-O 3.4Å; V333-I351 PolarHBondContact N-O 3.26Å; V333-H352 HydrophobicContact CG2-CB 3.84Å; V333-H352 VanDerWaalsContact CG2-CD2 3.5Å; V333-H352 WeakPolarHBondContact CG2-CD2 3.48Å; V333-V353 WeakPolarHBondContact O-CG1 3.47Å; V333-V353 PolarHBondContact O-N 2.81Å; V333-V353 VanDerWaalsContact O-N 3.11Å
334	M	98.1	Very high	96.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	114.5	171.4	174.3	-168.3	-68.2	0	0	107.9	P255 R256 Y259 F307 E308 L311 V353 L430	P255-M334 HydrophobicContact CG-SD 4.4Å; R256-M334 HydrophobicContact CB-SD 3.97Å; Y259-M334 VanDerWaalsContact CB-CE 3.44Å; Y259-M334 HydrophobicContact CD1-CE 3.97Å; Y259-M334 HydrophobicContact CD2-CE 3.31Å; Y259-M334 HydrophobicContact CE2-CE 4.06Å; Y259-M334 HydrophobicContact CG-CE 3.3Å; F307-M334 HydrophobicContact CB-CB 4.3Å; F307-M334 HydrophobicContact CD1-CB 3.42Å; F307-M334 VanDerWaalsContact CD1-CB 3.42Å; F307-M334 HydrophobicContact CD2-CE 4.32Å; F307-M334 HydrophobicContact CD2-SD 4.49Å; F307-M334 HydrophobicContact CE1-CB 3.83Å; F307-M334 HydrophobicContact CE1-CE 4.31Å; F307-M334 HydrophobicContact CE2-CE 4.06Å; F307-M334 HydrophobicContact CG-CB 3.93Å; F307-M334 HydrophobicContact CG-SD 4.41Å; F307-M334 HydrophobicContact CZ-CE 4.06Å; E308-M334 WeakPolarHBondContact CB-O 3.46Å; E308-M334 PolarHBondContact N-O 3.32Å; L311-M334 HydrophobicContact CD2-CG 3.8Å; L311-M334 HydrophobicContact CD2-SD 4.41Å; M334-V353 HydrophobicContact CB-CG1 4.22Å; M334-V353 HydrophobicContact CB-CG2 3.86Å; M334-V353 HydrophobicContact CE-CG1 4.14Å; M334-V353 HydrophobicContact CE-CG2 4.12Å; M334-V353 HydrophobicContact CG-CG2 4.01Å; M334-L430 HydrophobicContact CE-CD1 3.62Å; M334-L430 HydrophobicContact CG-CD1 4.08Å; M334-L430 HydrophobicContact CG-CD2 3.91Å; M334-L430 HydrophobicContact SD-CD1 3.78Å
335	G	96.9	Very high	96.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	175.3	-109.8	-176.4	0	0	0	0	0	111.3	R428	G335-R428 PolarHBondContact O-NE 3.4Å; G335-R428 PolarHBondContact O-NH2 3.39Å
336	A	96.4	Very high	96.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-57.7	176.1	170	0	0	0	0	0	112.4	C312 V316 E340 Y341 H352 R428	C312-A336 WeakPolarHBondContact O-CA 3.34Å; V316-A336 HydrophobicContact CG2-CB 4.21Å; A336-E340 HydrophobicContact CB-CB 3.75Å; A336-E340 HydrophobicContact CB-CG 4.46Å; A336-E340 WeakPolarHBondContact CB-OE2 3.46Å; A336-Y341 HydrophobicContact CB-CD2 4.19Å; A336-Y341 HydrophobicContact CB-CE2 3.91Å; A336-H352 PolarHBondContact O-NE2 2.8Å; A336-R428 PolarHBondContact O-NE 2.83Å; A336-R428 PolarHBondContact O-NH2 3.29Å
337	S	95.9	Very high	96.4	Very high	29 Å²	29	20.1 Å²	20.1	20%	0.203	10%	0.098	C	C	.	.			trans	-72.6	164.7	174.4	93.2	0	0	0	0	112	E339 E340 Y341	S337-E339 VanDerWaalsContact C-N 3.28Å; S337-E339 VanDerWaalsContact CB-OE2 3.3Å; S337-E339 WeakPolarHBondContact CB-OE2 3.23Å; S337-E339 PolarHBondContact O-N 2.82Å; S337-E339 PolarHBondContact OG-N 2.93Å; S337-E339 PolarHBondContact OG-OE2 3.2Å; S337-E340 PolarHBondContact N-OE2 3.48Å; S337-E340 WeakPolarHBondContact O-CB 3.42Å; S337-E340 PolarHBondContact O-N 2.96Å; S337-E340 VanDerWaalsContact O-N 3.12Å; S337-E340 WeakPolarHBondContact OG-CG 3.38Å; S337-E340 PolarHBondContact OG-N 2.03Å; S337-Y341 VanDerWaalsContact O-CD2 3.3Å; S337-Y341 WeakPolarHBondContact O-CD2 3.4Å; S337-Y341 PolarHBondContact O-N 2.82Å; S337-Y341 VanDerWaalsContact O-N 3.11Å
338	I	96.6	Very high	96.5	Very high	36 Å²	36	22.9 Å²	22.9	19%	0.185	11%	0.108	C	C	.	.	H	α-helix	trans	-56	-47.6	177.3	-64.8	171.3	0	0	0	110.1	E340 Y341 E342 H352 D354 Q355	I338-E340 PolarHBondContact O-N 3.14Å; I338-Y341 PolarHBondContact O-N 3.36Å; I338-Y341 VanDerWaalsContact O-N 3.13Å; I338-E342 HydrophobicContact CG2-CG 4.32Å; I338-E342 WeakPolarHBondContact O-CG 3.04Å; I338-E342 PolarHBondContact O-N 3.37Å; I338-H352 HydrophobicContact CD1-CB 4.43Å; I338-H352 HydrophobicContact CG1-CB 3.78Å; I338-H352 VanDerWaalsContact CG1-CG 3.5Å; I338-D354 HydrophobicContact CD1-CB 4.46Å; I338-Q355 HydrophobicContact CD1-CG 3.83Å
339	E	94.9	Very high	96.6	Very high	109 Å²	109	21.8 Å²	21.8	51%	0.509	10%	0.103	S	C	.	.	H	α-helix	trans	-65.5	-26.6	-178.5	-53.4	75.5	-166.3	0	0	112	S337 R343	S337-E339 VanDerWaalsContact C-N 3.28Å; S337-E339 VanDerWaalsContact CB-OE2 3.3Å; S337-E339 WeakPolarHBondContact CB-OE2 3.23Å; S337-E339 PolarHBondContact O-N 2.82Å; S337-E339 PolarHBondContact OG-N 2.93Å; S337-E339 PolarHBondContact OG-OE2 3.2Å; E339-R343 WeakPolarHBondContact O-CG 3.39Å; E339-R343 PolarHBondContact O-N 3.18Å; E339-R343 PolarHBondContact O-NH1 2.9Å
340	E	94.8	Very high	96.6	Very high	21 Å²	21	22.4 Å²	22.4	10%	0.098	11%	0.106	C	C	.	.	H	α-helix	trans	-74.5	-41.4	174.3	-62.7	-178.7	106.2	0	0	111.4	S313 E314 A336 S337 I338 R343	S313-E340 WeakPolarHBondContact CA-OE1 3.22Å; S313-E340 WeakPolarHBondContact CB-OE1 3.45Å; S313-E340 PolarHBondContact OG-OE1 3.27Å; E314-E340 WeakPolarHBondContact CG-OE1 3.31Å; E314-E340 PolarHBondContact N-OE1 3.45Å; A336-E340 HydrophobicContact CB-CB 3.75Å; A336-E340 HydrophobicContact CB-CG 4.46Å; A336-E340 WeakPolarHBondContact CB-OE2 3.46Å; S337-E340 PolarHBondContact N-OE2 3.48Å; S337-E340 WeakPolarHBondContact O-CB 3.42Å; S337-E340 PolarHBondContact O-N 2.96Å; S337-E340 VanDerWaalsContact O-N 3.12Å; S337-E340 WeakPolarHBondContact OG-CG 3.38Å; S337-E340 PolarHBondContact OG-N 2.03Å; I338-E340 PolarHBondContact O-N 3.14Å; E340-R343 PolarHBondContact O-N 2.88Å
341	Y	96.6	Very high	96.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.1	-42	172.1	-80.4	-80.8	0	0	0	112	V316 L320 V333 A336 S337 I338 R343 V344 A345 F350 H352	V316-Y341 HydrophobicContact CB-CE1 4.26Å; V316-Y341 HydrophobicContact CG1-CD1 4.03Å; V316-Y341 HydrophobicContact CG1-CE1 3.7Å; V316-Y341 HydrophobicContact CG2-CD1 3.89Å; V316-Y341 HydrophobicContact CG2-CE1 3.65Å; V316-Y341 HydrophobicContact CG2-CG 4.43Å; L320-Y341 HydrophobicContact CD2-CD1 4.06Å; L320-Y341 HydrophobicContact CD2-CE1 4.32Å; V333-Y341 HydrophobicContact CB-CD1 4.19Å; V333-Y341 HydrophobicContact CB-CD2 4.49Å; V333-Y341 HydrophobicContact CB-CE1 3.66Å; V333-Y341 HydrophobicContact CB-CE2 4Å; V333-Y341 HydrophobicContact CG1-CD1 4.04Å; V333-Y341 HydrophobicContact CG1-CE1 3.61Å; V333-Y341 HydrophobicContact CG2-CD1 4.12Å; V333-Y341 HydrophobicContact CG2-CD2 3.97Å; V333-Y341 HydrophobicContact CG2-CE1 4.05Å; V333-Y341 HydrophobicContact CG2-CE2 3.91Å; V333-Y341 HydrophobicContact CG2-CG 4.1Å; A336-Y341 HydrophobicContact CB-CD2 4.19Å; A336-Y341 HydrophobicContact CB-CE2 3.91Å; S337-Y341 VanDerWaalsContact O-CD2 3.3Å; S337-Y341 WeakPolarHBondContact O-CD2 3.4Å; S337-Y341 PolarHBondContact O-N 2.82Å; S337-Y341 VanDerWaalsContact O-N 3.11Å; I338-Y341 PolarHBondContact O-N 3.36Å; I338-Y341 VanDerWaalsContact O-N 3.13Å; Y341-R343 PolarHBondContact O-N 3.13Å; Y341-V344 PolarHBondContact O-N 2.98Å; Y341-V344 VanDerWaalsContact O-N 3.14Å; Y341-A345 VanDerWaalsContact O-CB 3.24Å; Y341-A345 WeakPolarHBondContact O-CB 3.17Å; Y341-A345 PolarHBondContact O-N 3.18Å; Y341-F350 HydrophobicContact CG-CE2 4.36Å; Y341-F350 HydrophobicContact CG-CZ 4.39Å; Y341-H352 AromaticContact CD2-CD2 3.61Å; Y341-H352 AromaticContact CE2-CD2 3.82Å; Y341-H352 AromaticContact CE2-NE2 3.93Å
342	E	95.4	Very high	96.6	Very high	77 Å²	77	22.3 Å²	22.3	36%	0.36	11%	0.105	S	C	.	.	H	α-helix	trans	-59.6	-30.2	178.1	-72.8	172.7	163.6	0	0	113.1	P224 I338 V344 F350	P224-E342 WeakPolarHBondContact CB-O 3.37Å; P224-E342 WeakPolarHBondContact CG-O 3.4Å; I338-E342 HydrophobicContact CG2-CG 4.32Å; I338-E342 WeakPolarHBondContact O-CG 3.04Å; I338-E342 PolarHBondContact O-N 3.37Å; E342-V344 VanDerWaalsContact C-N 3.33Å; E342-V344 PolarHBondContact O-N 3.09Å; E342-F350 HydrophobicContact CG-CE1 4.23Å; E342-F350 HydrophobicContact CG-CZ 3.85Å
343	R	92.2	Very high	96.6	Very high	80 Å²	80	22.4 Å²	22.4	30%	0.302	11%	0.106	S	C	.	.	H	α-helix	trans	-71.1	-25.6	178.3	-74.8	-169.5	-49.2	-94.2	19.6	114	E314 E339 E340 Y341	E314-R343 IonicContact OE1-CZ 2.75Å; E314-R343 IonicContact OE1-NH2 3.04Å; E314-R343 PolarHBondContact OE1-NH2 2.88Å; E339-R343 WeakPolarHBondContact O-CG 3.39Å; E339-R343 PolarHBondContact O-N 3.18Å; E339-R343 PolarHBondContact O-NH1 2.9Å; E340-R343 PolarHBondContact O-N 2.88Å; Y341-R343 PolarHBondContact O-N 3.13Å
344	V	92.9	Very high	96.6	Very high	18 Å²	18	23.5 Å²	23.5	11%	0.109	11%	0.112	C	C	.	.	H	α-helix	trans	-119.3	-25.9	-168	-59.8	0	0	0	0	113.8	V90 V316 Y321 Y341 E342	V90-V344 HydrophobicContact CG2-CG1 4.07Å; V316-V344 HydrophobicContact CB-CG2 4.41Å; V316-V344 HydrophobicContact CG1-CG2 4.28Å; V316-V344 HydrophobicContact CG2-CG2 4.25Å; Y321-V344 WeakPolarHBondContact OH-CB 3.31Å; Y321-V344 VanDerWaalsContact OH-CG2 3.27Å; Y321-V344 WeakPolarHBondContact OH-CG2 3.47Å; Y341-V344 PolarHBondContact O-N 2.98Å; Y341-V344 VanDerWaalsContact O-N 3.14Å; E342-V344 VanDerWaalsContact C-N 3.33Å; E342-V344 PolarHBondContact O-N 3.09Å
345	A	96	Very high	96.6	Very high	5 Å²	5	27.3 Å²	27.3	4%	0.041	13%	0.129	C	C	.	.	S	Bend	trans	-83.9	160.5	176.4	0	0	0	0	0	111.2	L320 Y341 F350	L320-A345 HydrophobicContact CD2-CB 4.06Å; Y341-A345 VanDerWaalsContact O-CB 3.24Å; Y341-A345 WeakPolarHBondContact O-CB 3.17Å; Y341-A345 PolarHBondContact O-N 3.18Å; A345-F350 HydrophobicContact CB-CD1 3.76Å; A345-F350 HydrophobicContact CB-CE1 3.96Å
346	P	96.9	Very high	96.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-57.4	151.5	165.7	-15.4	24.2	0	0	0	111.5	Y215 L325 Y348 S349 W382 I388	Y215-P346 HydrophobicContact CD1-CB 4.04Å; Y215-P346 HydrophobicContact CD1-CG 4.31Å; Y215-P346 HydrophobicContact CD2-CB 3.97Å; Y215-P346 HydrophobicContact CD2-CG 3.62Å; Y215-P346 HydrophobicContact CE1-CB 4.16Å; Y215-P346 HydrophobicContact CE2-CB 4.06Å; Y215-P346 HydrophobicContact CE2-CG 4.12Å; Y215-P346 HydrophobicContact CG-CB 3.94Å; Y215-P346 HydrophobicContact CG-CG 3.71Å; L325-P346 HydrophobicContact CD1-CG 4.18Å; P346-Y348 PolarHBondContact O-N 3.25Å; P346-S349 WeakPolarHBondContact CD-OG 3.31Å; P346-S349 VanDerWaalsContact O-CB 3.26Å; P346-S349 WeakPolarHBondContact O-CB 3.44Å; P346-S349 PolarHBondContact O-N 3.04Å; P346-S349 PolarHBondContact O-OG 3.16Å; P346-W382 HydrophobicContact CB-CB 3.69Å; P346-W382 HydrophobicContact CB-CD2 3.54Å; P346-W382 HydrophobicContact CB-CE3 3.93Å; P346-W382 HydrophobicContact CB-CG 3.41Å; P346-W382 VanDerWaalsContact CB-CG 3.41Å; P346-W382 HydrophobicContact CG-CD2 3.69Å; P346-W382 HydrophobicContact CG-CE3 3.81Å; P346-W382 HydrophobicContact CG-CG 4.11Å; P346-W382 HydrophobicContact CG-CH2 4.48Å; P346-W382 HydrophobicContact CG-CZ2 4.39Å; P346-W382 HydrophobicContact CG-CZ3 4.21Å; P346-I388 HydrophobicContact CG-CD1 3.54Å
347	P	95.8	Very high	96.7	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.058	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	132.5	176.1	-30.5	38.7	0	0	0	112.5	G223 P224 T226 Y228 S349	G223-P347 WeakPolarHBondContact O-CG 2.9Å; P224-P347 VanDerWaalsContact O-CB 3.32Å; P224-P347 WeakPolarHBondContact O-CB 3.12Å; T226-P347 VanDerWaalsContact O-CB 3.24Å; T226-P347 WeakPolarHBondContact O-CB 3.42Å; Y228-P347 HydrophobicContact CE2-CB 4.43Å; Y228-P347 HydrophobicContact CE2-CG 3.99Å; P347-S349 PolarHBondContact O-N 3.4Å; P347-S349 VanDerWaalsContact O-N 3.16Å
348	Y	97.2	Very high	96.8	Very high	70 Å²	70	34.9 Å²	34.9	28%	0.275	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	37	174.2	-48	-71.5	0	0	0	114.3	E225 R227 P346 Y379	E225-Y348 PolarHBondContact OE2-OH 3.46Å; R227-Y348 HydrophobicContact CG-CE2 4.14Å; R227-Y348 VanDerWaalsContact CZ-CE2 3.4Å; R227-Y348 VanDerWaalsContact CZ-OH 3.23Å; R227-Y348 PolarHBondContact NE-OH 2.94Å; R227-Y348 PolarHBondContact NH2-OH 3Å; P346-Y348 PolarHBondContact O-N 3.25Å; Y348-Y379 VanDerWaalsContact O-CA 3.26Å; Y348-Y379 WeakPolarHBondContact O-CA 3.49Å; Y348-Y379 WeakPolarHBondContact O-CD1 3.49Å
349	S	98.5	Very high	96.9	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	16%	0.156	C	C	.	.			trans	-106.4	2.5	-170.2	65.2	0	0	0	0	115.8	L330 P331 P346 P347 Y379 W382	L330-S349 WeakPolarHBondContact CD1-O 3.3Å; P331-S349 VanDerWaalsContact CD-O 3.32Å; P331-S349 WeakPolarHBondContact CD-O 3.34Å; P331-S349 WeakPolarHBondContact CG-O 3.34Å; P346-S349 WeakPolarHBondContact CD-OG 3.31Å; P346-S349 VanDerWaalsContact O-CB 3.26Å; P346-S349 WeakPolarHBondContact O-CB 3.44Å; P346-S349 PolarHBondContact O-N 3.04Å; P346-S349 PolarHBondContact O-OG 3.16Å; P347-S349 PolarHBondContact O-N 3.4Å; P347-S349 VanDerWaalsContact O-N 3.16Å; S349-Y379 WeakPolarHBondContact CA-O 3.47Å; S349-W382 VanDerWaalsContact CB-CD1 3.48Å
350	F	98.7	Very high	97	Very high	13 Å²	13	29.2 Å²	29.2	6%	0.057	14%	0.142	C	C	.	.			trans	-142.9	160.1	-177.1	66.8	-91.3	0	0	0	112.2	P331 V333 Y341 E342 A345 H352 Y379	P331-F350 HydrophobicContact CB-CB 4.49Å; P331-F350 HydrophobicContact CG-CB 3.75Å; V333-F350 HydrophobicContact CG1-CB 4.26Å; V333-F350 HydrophobicContact CG2-CB 4.48Å; V333-F350 HydrophobicContact CG2-CD2 3.53Å; V333-F350 HydrophobicContact CG2-CE2 4.13Å; V333-F350 HydrophobicContact CG2-CG 4.27Å; Y341-F350 HydrophobicContact CG-CE2 4.36Å; Y341-F350 HydrophobicContact CG-CZ 4.39Å; E342-F350 HydrophobicContact CG-CE1 4.23Å; E342-F350 HydrophobicContact CG-CZ 3.85Å; A345-F350 HydrophobicContact CB-CD1 3.76Å; A345-F350 HydrophobicContact CB-CE1 3.96Å; F350-H352 HydrophobicContact CD2-CB 4.14Å; F350-H352 HydrophobicContact CE2-CB 3.92Å; F350-Y379 WeakPolarHBondContact O-CE1 2.9Å
351	I	98.9	Very high	97.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124	169.3	-62.1	173.6	0	0	0	107.9	L330 P331 I332 V333 F356 L362 Y365 L366 L369 Y379	L330-I351 HydrophobicContact CD1-CG1 4.35Å; L330-I351 HydrophobicContact CD2-CD1 3.64Å; L330-I351 HydrophobicContact CD2-CG1 4.1Å; L330-I351 HydrophobicContact CG-CD1 4.07Å; L330-I351 HydrophobicContact CG-CG1 4.24Å; P331-I351 PolarHBondContact O-N 3.48Å; I332-I351 CarbonylContact C-O 3.56Å; I332-I351 VanDerWaalsContact CA-O 3.24Å; I332-I351 WeakPolarHBondContact CA-O 3.25Å; I332-I351 HydrophobicContact CG1-CB 4.48Å; V333-I351 WeakPolarHBondContact CG2-O 3.4Å; V333-I351 PolarHBondContact N-O 3.26Å; I351-F356 HydrophobicContact CG2-CE2 3.48Å; I351-F356 VanDerWaalsContact CG2-CE2 3.48Å; I351-F356 HydrophobicContact CG2-CZ 4.07Å; I351-L362 HydrophobicContact CG2-CD1 3.73Å; I351-Y365 HydrophobicContact CD1-CD1 4.14Å; I351-Y365 HydrophobicContact CD1-CE1 3.91Å; I351-Y365 HydrophobicContact CG1-CE1 4.41Å; I351-L366 HydrophobicContact CD1-CD2 3.76Å; I351-L369 HydrophobicContact CD1-CD1 3.61Å; I351-Y379 HydrophobicContact CG1-CE1 3.86Å
352	H	98.8	Very high	97.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.4	178.3	-169.7	-70.5	0	0	0	110.8	V333 A336 I338 Y341 F350 D354 Q355 R428	V333-H352 HydrophobicContact CG2-CB 3.84Å; V333-H352 VanDerWaalsContact CG2-CD2 3.5Å; V333-H352 WeakPolarHBondContact CG2-CD2 3.48Å; A336-H352 PolarHBondContact O-NE2 2.8Å; I338-H352 HydrophobicContact CD1-CB 4.43Å; I338-H352 HydrophobicContact CG1-CB 3.78Å; I338-H352 VanDerWaalsContact CG1-CG 3.5Å; Y341-H352 AromaticContact CD2-CD2 3.61Å; Y341-H352 AromaticContact CE2-CD2 3.82Å; Y341-H352 AromaticContact CE2-NE2 3.93Å; F350-H352 HydrophobicContact CD2-CB 4.14Å; F350-H352 HydrophobicContact CE2-CB 3.92Å; H352-D354 IonicContact CE1-OD2 3.29Å; H352-D354 PolarHBondContact CE1-OD2 2.71Å; H352-D354 VanDerWaalsContact CE1-OD2 3.23Å; H352-D354 WeakPolarHBondContact ND1-CB 3.3Å; H352-D354 PolarHBondContact ND1-N 3.09Å; H352-D354 IonicContact ND1-OD2 3.61Å; H352-D354 PolarHBondContact O-N 3.16Å; H352-D354 VanDerWaalsContact O-N 3.14Å; H352-Q355 HydrophobicContact CB-CG 4.22Å; H352-Q355 VanDerWaalsContact O-CB 3.28Å; H352-Q355 WeakPolarHBondContact O-CB 3.17Å; H352-Q355 WeakPolarHBondContact O-CG 3.4Å; H352-Q355 PolarHBondContact O-N 3.12Å; H352-Q355 PolarHBondContact O-OE1 2.99Å; H352-R428 PolarHBondContact CE1-NH2 3.33Å; H352-R428 PolarHBondContact NE2-NH2 3.19Å
353	V	98.6	Very high	97.5	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-55.7	-34.6	-176.8	-68.3	0	0	0	0	114	Y259 F307 I332 V333 M334 Q355 F356 L362 L430	Y259-V353 HydrophobicContact CD1-CG1 4.46Å; Y259-V353 HydrophobicContact CE1-CB 4.41Å; Y259-V353 HydrophobicContact CE1-CG1 3.81Å; Y259-V353 HydrophobicContact CE2-CB 3.9Å; Y259-V353 HydrophobicContact CE2-CG1 4.11Å; F307-V353 HydrophobicContact CE1-CG1 3.7Å; F307-V353 HydrophobicContact CZ-CG1 3.96Å; I332-V353 HydrophobicContact CG2-CG1 4.15Å; V333-V353 WeakPolarHBondContact O-CG1 3.47Å; V333-V353 PolarHBondContact O-N 2.81Å; V333-V353 VanDerWaalsContact O-N 3.11Å; M334-V353 HydrophobicContact CB-CG1 4.22Å; M334-V353 HydrophobicContact CB-CG2 3.86Å; M334-V353 HydrophobicContact CE-CG1 4.14Å; M334-V353 HydrophobicContact CE-CG2 4.12Å; M334-V353 HydrophobicContact CG-CG2 4.01Å; V353-Q355 PolarHBondContact O-N 2.91Å; V353-F356 PolarHBondContact O-N 3.2Å; V353-F356 VanDerWaalsContact O-N 3.14Å; V353-L362 HydrophobicContact CG1-CD2 4.3Å; V353-L430 HydrophobicContact CG2-CD2 4.11Å
354	D	98	Very high	97.8	Very high	24 Å²	24	29.9 Å²	29.9	13%	0.128	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-70.7	-9.4	178.8	-66	-24.4	0	0	0	114.7	I338 H352 F356 R428 L430 R431	I338-D354 HydrophobicContact CD1-CB 4.46Å; H352-D354 IonicContact CE1-OD2 3.29Å; H352-D354 PolarHBondContact CE1-OD2 2.71Å; H352-D354 VanDerWaalsContact CE1-OD2 3.23Å; H352-D354 WeakPolarHBondContact ND1-CB 3.3Å; H352-D354 PolarHBondContact ND1-N 3.09Å; H352-D354 IonicContact ND1-OD2 3.61Å; H352-D354 PolarHBondContact O-N 3.16Å; H352-D354 VanDerWaalsContact O-N 3.14Å; D354-F356 PolarHBondContact O-N 3.15Å; D354-R428 IonicContact OD2-CZ 2.86Å; D354-R428 IonicContact OD2-NH1 3.12Å; D354-R428 PolarHBondContact OD2-NH1 3.33Å; D354-R428 IonicContact OD2-NH2 3.42Å; D354-R428 PolarHBondContact OD2-NH2 2.92Å; D354-L430 WeakPolarHBondContact OD1-CA 3.18Å; D354-R431 HydrophobicContact CB-CB 4.06Å; D354-R431 WeakPolarHBondContact O-CD 2.93Å; D354-R431 PolarHBondContact O-NH1 3.36Å; D354-R431 PolarHBondContact OD1-N 3.45Å
355	Q	98.4	Very high	98.1	Very high	80 Å²	80	32.2 Å²	32.2	37%	0.374	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-67.4	-15.1	169.1	-65.7	172.1	-46.6	0	0	111.7	I338 H352 V353	I338-Q355 HydrophobicContact CD1-CG 3.83Å; H352-Q355 HydrophobicContact CB-CG 4.22Å; H352-Q355 VanDerWaalsContact O-CB 3.28Å; H352-Q355 WeakPolarHBondContact O-CB 3.17Å; H352-Q355 WeakPolarHBondContact O-CG 3.4Å; H352-Q355 PolarHBondContact O-N 3.12Å; H352-Q355 PolarHBondContact O-OE1 2.99Å; V353-Q355 PolarHBondContact O-N 2.91Å
356	F	98.5	Very high	98.2	Very high	29 Å²	29	32 Å²	32	13%	0.127	16%	0.155	C	C	.	.	S	Bend	trans	-120.4	148.5	-176.3	-54.2	-88.3	0	0	0	111.5	I351 V353 D354 S358 K361 L362 Y365	I351-F356 HydrophobicContact CG2-CE2 3.48Å; I351-F356 VanDerWaalsContact CG2-CE2 3.48Å; I351-F356 HydrophobicContact CG2-CZ 4.07Å; V353-F356 PolarHBondContact O-N 3.2Å; V353-F356 VanDerWaalsContact O-N 3.14Å; D354-F356 PolarHBondContact O-N 3.15Å; F356-S358 VanDerWaalsContact C-N 3.31Å; F356-K361 HydrophobicContact CB-CB 4.24Å; F356-K361 HydrophobicContact CD1-CB 4.37Å; F356-L362 HydrophobicContact CB-CB 4.15Å; F356-L362 HydrophobicContact CD1-CB 4.38Å; F356-L362 HydrophobicContact CD2-CB 3.99Å; F356-L362 HydrophobicContact CD2-CD1 3.67Å; F356-L362 HydrophobicContact CD2-CG 4.36Å; F356-L362 HydrophobicContact CE2-CD1 3.52Å; F356-L362 HydrophobicContact CG-CB 3.88Å; F356-L362 HydrophobicContact CG-CD1 4.32Å; F356-L362 HydrophobicContact CZ-CD1 4.02Å; F356-Y365 VanDerWaalsContact CE1-CB 3.45Å; F356-Y365 AromaticContact CE1-CD1 3.89Å; F356-Y365 HydrophobicContact CE1-CD1 3.89Å; F356-Y365 HydrophobicContact CE1-CD2 4.47Å; F356-Y365 AromaticContact CE1-CG 3.69Å; F356-Y365 HydrophobicContact CE1-CG 3.69Å; F356-Y365 AromaticContact CZ-CD1 3.43Å; F356-Y365 HydrophobicContact CZ-CD1 3.43Å; F356-Y365 VanDerWaalsContact CZ-CD1 3.43Å; F356-Y365 HydrophobicContact CZ-CE1 4.12Å; F356-Y365 AromaticContact CZ-CG 3.75Å; F356-Y365 HydrophobicContact CZ-CG 3.75Å
357	E	97.1	Very high	98.3	Very high	126 Å²	126	35 Å²	35	59%	0.589	17%	0.167	S	C	*	.	S	Bend	trans	-70.1	-29.3	177.5	-67.4	173.6	176.2	0	0	112.9	R431	E357-R431 VanDerWaalsContact CG-NH2 3.3Å; E357-R431 IonicContact OE1-NH2 3.32Å
358	S	97.8	Very high	98.5	Very high	32 Å²	32	39.8 Å²	39.8	22%	0.224	19%	0.185	C	C	.	.	S	Bend	trans	-155.2	161.5	-176.8	70.6	0	0	0	0	112	F356 A360 K361 L362	F356-S358 VanDerWaalsContact C-N 3.31Å; S358-A360 PolarHBondContact O-N 3.04Å; S358-A360 PolarHBondContact OG-N 2.93Å; S358-K361 PolarHBondContact O-N 3.29Å; S358-K361 VanDerWaalsContact O-N 3.1Å; S358-K361 PolarHBondContact OG-N 3.36Å; S358-L362 PolarHBondContact O-N 2.9Å
359	P	98.6	Very high	98.6	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-29.6	171.9	-24.3	32.5	0	0	0	113.4	Y259 E262 L263 L362 A363 W432	Y259-P359 HydrophobicContact CD1-CB 4.29Å; Y259-P359 HydrophobicContact CD1-CG 4.02Å; Y259-P359 HydrophobicContact CD2-CG 4.1Å; Y259-P359 HydrophobicContact CE1-CB 3.86Å; Y259-P359 HydrophobicContact CE1-CG 3.79Å; Y259-P359 HydrophobicContact CE2-CG 3.87Å; Y259-P359 HydrophobicContact CG-CG 4.15Å; E262-P359 HydrophobicContact CB-CB 4.23Å; E262-P359 HydrophobicContact CB-CG 3.98Å; E262-P359 HydrophobicContact CG-CB 3.92Å; E262-P359 HydrophobicContact CG-CG 3.72Å; L263-P359 HydrophobicContact CB-CB 4.08Å; L263-P359 HydrophobicContact CD1-CB 4.3Å; L263-P359 VanDerWaalsContact CD1-O 3.27Å; L263-P359 WeakPolarHBondContact CD1-O 3.14Å; P359-L362 PolarHBondContact O-N 2.98Å; P359-A363 WeakPolarHBondContact O-CB 3.47Å; P359-A363 PolarHBondContact O-N 3.49Å; P359-W432 VanDerWaalsContact CD-CD1 3.5Å; P359-W432 HydrophobicContact CG-CD2 4.08Å; P359-W432 HydrophobicContact CG-CG 4.4Å; P359-W432 HydrophobicContact CG-CZ2 4.03Å
360	A	98.6	Very high	98.6	Very high	25 Å²	25	38 Å²	38	21%	0.207	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-44.2	175.1	0	0	0	0	0	112	S358 A363 D364	S358-A360 PolarHBondContact O-N 3.04Å; S358-A360 PolarHBondContact OG-N 2.93Å; A360-A363 WeakPolarHBondContact O-CB 3.34Å; A360-A363 PolarHBondContact O-N 2.91Å; A360-D364 PolarHBondContact O-N 2.72Å
361	K	98.7	Very high	98.5	Very high	112 Å²	112	45.7 Å²	45.7	49%	0.487	21%	0.214	S	C	.	.	H	α-helix	trans	-66.1	-38.1	176	-69.8	-61.3	-173.7	-176.1	0	112.3	F356 S358 D364 Y365	F356-K361 HydrophobicContact CB-CB 4.24Å; F356-K361 HydrophobicContact CD1-CB 4.37Å; S358-K361 PolarHBondContact O-N 3.29Å; S358-K361 VanDerWaalsContact O-N 3.1Å; S358-K361 PolarHBondContact OG-N 3.36Å; K361-D364 PolarHBondContact O-N 3.39Å; K361-Y365 PolarHBondContact O-N 3.48Å
362	L	98.8	Very high	98.5	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-48.4	169.7	173.2	62.6	0	0	0	110.6	Y259 L263 I332 I351 V353 F356 S358 P359 D364 Y365 L366	Y259-L362 HydrophobicContact CE1-CD2 3.89Å; L263-L362 HydrophobicContact CD1-CD2 4.15Å; L263-L362 HydrophobicContact CD1-CG 4.3Å; L263-L362 HydrophobicContact CD2-CD2 4.35Å; I332-L362 HydrophobicContact CG2-CD2 3.86Å; I351-L362 HydrophobicContact CG2-CD1 3.73Å; V353-L362 HydrophobicContact CG1-CD2 4.3Å; F356-L362 HydrophobicContact CB-CB 4.15Å; F356-L362 HydrophobicContact CD1-CB 4.38Å; F356-L362 HydrophobicContact CD2-CB 3.99Å; F356-L362 HydrophobicContact CD2-CD1 3.67Å; F356-L362 HydrophobicContact CD2-CG 4.36Å; F356-L362 HydrophobicContact CE2-CD1 3.52Å; F356-L362 HydrophobicContact CG-CB 3.88Å; F356-L362 HydrophobicContact CG-CD1 4.32Å; F356-L362 HydrophobicContact CZ-CD1 4.02Å; S358-L362 PolarHBondContact O-N 2.9Å; P359-L362 PolarHBondContact O-N 2.98Å; L362-D364 VanDerWaalsContact C-N 3.29Å; L362-D364 PolarHBondContact O-N 2.93Å; L362-Y365 WeakPolarHBondContact O-CB 3.4Å; L362-Y365 PolarHBondContact O-N 3.43Å; 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 4.25Å; L362-L366 VanDerWaalsContact O-CG 3.32Å; L362-L366 WeakPolarHBondContact O-CG 3.12Å; L362-L366 PolarHBondContact O-N 3.22Å
363	A	98.9	Very high	98.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.4	-38.7	178.9	0	0	0	0	0	113.1	L263 H266 I267 P359 A360 L366 K367	L263-A363 HydrophobicContact CD1-CB 3.96Å; H266-A363 HydrophobicContact CB-CB 3.38Å; I267-A363 HydrophobicContact CB-CB 3.99Å; I267-A363 HydrophobicContact CG2-CB 3.9Å; P359-A363 WeakPolarHBondContact O-CB 3.47Å; P359-A363 PolarHBondContact O-N 3.49Å; A360-A363 WeakPolarHBondContact O-CB 3.34Å; A360-A363 PolarHBondContact O-N 2.91Å; A363-L366 PolarHBondContact O-N 3Å; A363-K367 VanDerWaalsContact O-CG 3.25Å; A363-K367 WeakPolarHBondContact O-CG 3.28Å; A363-K367 PolarHBondContact O-N 3.25Å
364	D	98.9	Very high	98.5	Very high	80 Å²	80	54.9 Å²	54.9	43%	0.428	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-42	175.3	-69.3	-20.7	0	0	0	111.8	A360 K361 L362 K367 Y368	A360-D364 PolarHBondContact O-N 2.72Å; K361-D364 PolarHBondContact O-N 3.39Å; L362-D364 VanDerWaalsContact C-N 3.29Å; L362-D364 PolarHBondContact O-N 2.93Å; D364-K367 PolarHBondContact O-N 2.79Å; D364-K367 IonicContact OD1-NZ 3.36Å; D364-K367 PolarHBondContact OD1-NZ 2.94Å; D364-Y368 PolarHBondContact O-N 3.02Å
365	Y	98.9	Very high	98.5	Very high	68 Å²	68	54 Å²	54	27%	0.267	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-41.6	175.1	-173.4	-113.1	0	0	0	112.6	I351 F356 K361 L362 K367 Y368 L369 Y379	I351-Y365 HydrophobicContact CD1-CD1 4.14Å; I351-Y365 HydrophobicContact CD1-CE1 3.91Å; I351-Y365 HydrophobicContact CG1-CE1 4.41Å; F356-Y365 VanDerWaalsContact CE1-CB 3.45Å; F356-Y365 AromaticContact CE1-CD1 3.89Å; F356-Y365 HydrophobicContact CE1-CD1 3.89Å; F356-Y365 HydrophobicContact CE1-CD2 4.47Å; F356-Y365 AromaticContact CE1-CG 3.69Å; F356-Y365 HydrophobicContact CE1-CG 3.69Å; F356-Y365 AromaticContact CZ-CD1 3.43Å; F356-Y365 HydrophobicContact CZ-CD1 3.43Å; F356-Y365 VanDerWaalsContact CZ-CD1 3.43Å; F356-Y365 HydrophobicContact CZ-CE1 4.12Å; F356-Y365 AromaticContact CZ-CG 3.75Å; F356-Y365 HydrophobicContact CZ-CG 3.75Å; K361-Y365 PolarHBondContact O-N 3.48Å; L362-Y365 WeakPolarHBondContact O-CB 3.4Å; L362-Y365 PolarHBondContact O-N 3.43Å; L362-Y365 VanDerWaalsContact O-N 3.09Å; Y365-K367 VanDerWaalsContact C-N 3.31Å; Y365-K367 PolarHBondContact O-N 2.75Å; 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 4.13Å; Y365-Y368 WeakPolarHBondContact O-CB 3.47Å; Y365-Y368 PolarHBondContact O-N 3.5Å; Y365-Y368 VanDerWaalsContact O-N 3.12Å; Y365-L369 HydrophobicContact CD1-CD1 4Å; Y365-L369 HydrophobicContact CD1-CG 4.38Å; Y365-L369 HydrophobicContact CE1-CD1 3.53Å; Y365-L369 HydrophobicContact CE1-CD2 4.44Å; Y365-L369 HydrophobicContact CE1-CG 4.02Å; Y365-L369 PolarHBondContact O-N 2.69Å; Y365-Y379 HydrophobicContact CE1-CE2 4.42Å; Y365-Y379 WeakPolarHBondContact CE1-OH 3.42Å; Y365-Y379 PolarHBondContact OH-OH 3.15Å
366	L	98.9	Very high	98.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-37.1	174.9	-62.7	177	0	0	0	112	V243 I267 F303 I332 I351 L362 A363 Y368 L369 D370	V243-L366 HydrophobicContact CG2-CD1 4.16Å; I267-L366 HydrophobicContact CD1-CB 3.54Å; I267-L366 HydrophobicContact CD1-CD1 4.11Å; F303-L366 HydrophobicContact CD1-CD2 3.72Å; F303-L366 HydrophobicContact CD2-CB 4.47Å; F303-L366 HydrophobicContact CD2-CD2 4.32Å; F303-L366 HydrophobicContact CE1-CD2 3.77Å; F303-L366 HydrophobicContact CE2-CB 4.08Å; F303-L366 HydrophobicContact CE2-CD2 4.36Å; F303-L366 HydrophobicContact CG-CD2 4.02Å; F303-L366 HydrophobicContact CZ-CB 4.23Å; F303-L366 HydrophobicContact CZ-CD2 4.1Å; F303-L366 WeakPolarHBondContact CZ-O 3.02Å; I332-L366 HydrophobicContact CD1-CD1 3.51Å; I332-L366 HydrophobicContact CD1-CD2 3.76Å; I332-L366 HydrophobicContact CD1-CG 4.27Å; I332-L366 HydrophobicContact CG1-CD2 4.22Å; 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 4.25Å; L362-L366 VanDerWaalsContact O-CG 3.32Å; L362-L366 WeakPolarHBondContact O-CG 3.12Å; L362-L366 PolarHBondContact O-N 3.22Å; A363-L366 PolarHBondContact O-N 3Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; L366-L369 PolarHBondContact O-N 3.45Å; L366-D370 VanDerWaalsContact O-CB 3.25Å; L366-D370 WeakPolarHBondContact O-CB 3.1Å; L366-D370 PolarHBondContact O-N 3Å
367	K	98.8	Very high	98.5	Very high	63 Å²	63	49.2 Å²	49.2	27%	0.274	24%	0.24	S	C	.	.	H	α-helix	trans	-66.9	-33.4	173.1	-70.3	164.7	-165.8	160.1	0	112.4	H266 I267 A363 D364 Y365 K371	H266-K367 WeakPolarHBondContact O-CE 3.43Å; H266-K367 PolarHBondContact O-NZ 2.78Å; I267-K367 HydrophobicContact CD1-CG 4.39Å; A363-K367 VanDerWaalsContact O-CG 3.25Å; A363-K367 WeakPolarHBondContact O-CG 3.28Å; A363-K367 PolarHBondContact O-N 3.25Å; D364-K367 PolarHBondContact O-N 2.79Å; D364-K367 IonicContact OD1-NZ 3.36Å; D364-K367 PolarHBondContact OD1-NZ 2.94Å; Y365-K367 VanDerWaalsContact C-N 3.31Å; Y365-K367 PolarHBondContact O-N 2.75Å; K367-K371 WeakPolarHBondContact O-CG 3.25Å; K367-K371 PolarHBondContact O-N 3.05Å
368	Y	98.8	Very high	98.5	Very high	110 Å²	110	48.6 Å²	48.6	43%	0.431	24%	0.237	S	C	.	.	H	α-helix	trans	-64.7	-51.8	172.7	159.2	-102.9	0	0	0	110.7	D364 Y365 L366 D370 K371 N372 A375	D364-Y368 PolarHBondContact O-N 3.02Å; 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 4.13Å; Y365-Y368 WeakPolarHBondContact O-CB 3.47Å; Y365-Y368 PolarHBondContact O-N 3.5Å; Y365-Y368 VanDerWaalsContact O-N 3.12Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; Y368-D370 VanDerWaalsContact C-N 3.28Å; Y368-D370 PolarHBondContact O-N 3.32Å; Y368-K371 PolarHBondContact O-N 3.21Å; Y368-N372 HydrophobicContact CD2-CB 4.48Å; Y368-N372 HydrophobicContact CE2-CB 4.06Å; Y368-N372 WeakPolarHBondContact O-CB 3.34Å; Y368-N372 PolarHBondContact O-N 3.12Å; Y368-N372 PolarHBondContact OH-ND2 3.04Å; Y368-A375 HydrophobicContact CE1-CB 3.79Å; Y368-A375 WeakPolarHBondContact OH-CB 3.4Å
369	L	98.7	Very high	98.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-37.3	177.1	-66.9	-178.5	0	0	0	112.2	F303 L330 I351 Y365 L366 K371 N372 A375 Y376 Y379	F303-L369 HydrophobicContact CE1-CB 4.1Å; F303-L369 HydrophobicContact CE1-CD1 4.09Å; F303-L369 HydrophobicContact CZ-CB 3.9Å; L330-L369 HydrophobicContact CD2-CD1 4Å; I351-L369 HydrophobicContact CD1-CD1 3.61Å; Y365-L369 HydrophobicContact CD1-CD1 4Å; Y365-L369 HydrophobicContact CD1-CG 4.38Å; Y365-L369 HydrophobicContact CE1-CD1 3.53Å; Y365-L369 HydrophobicContact CE1-CD2 4.44Å; Y365-L369 HydrophobicContact CE1-CG 4.02Å; Y365-L369 PolarHBondContact O-N 2.69Å; L366-L369 PolarHBondContact O-N 3.45Å; L369-K371 PolarHBondContact O-N 2.86Å; L369-N372 CarbonylContact O-C 3.58Å; L369-N372 PolarHBondContact O-N 2.75Å; L369-A375 HydrophobicContact CD2-CB 3.82Å; L369-Y376 HydrophobicContact CB-CD2 4.46Å; L369-Y379 HydrophobicContact CD1-CD2 4.32Å; L369-Y379 HydrophobicContact CD1-CE2 3.85Å; L369-Y379 HydrophobicContact CD2-CE2 4.12Å
370	D	98.5	Very high	98.5	Very high	33 Å²	33	48.5 Å²	48.5	18%	0.176	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-26.9	175.2	-177.7	45.8	0	0	0	113.1	K242 K302 F303 L366 Y368	K242-D370 WeakPolarHBondContact CE-OD2 3.38Å; K302-D370 WeakPolarHBondContact CD-OD1 3.32Å; K302-D370 WeakPolarHBondContact CE-OD1 3.3Å; K302-D370 PolarHBondContact NZ-O 2.57Å; K302-D370 IonicContact NZ-OD1 2.81Å; K302-D370 PolarHBondContact NZ-OD1 2.61Å; F303-D370 HydrophobicContact CE2-CB 4.43Å; L366-D370 VanDerWaalsContact O-CB 3.25Å; L366-D370 WeakPolarHBondContact O-CB 3.1Å; L366-D370 PolarHBondContact O-N 3Å; Y368-D370 VanDerWaalsContact C-N 3.28Å; Y368-D370 PolarHBondContact O-N 3.32Å
371	K	98.2	Very high	98.5	Very high	175 Å²	175	48 Å²	48	76%	0.761	23%	0.228	S	C	*	.	H	α-helix	trans	-100.7	-9.3	179.7	-67.2	175.7	-179.5	-178.5	0	113.8	K367 Y368 L369	K367-K371 WeakPolarHBondContact O-CG 3.25Å; K367-K371 PolarHBondContact O-N 3.05Å; Y368-K371 PolarHBondContact O-N 3.21Å; L369-K371 PolarHBondContact O-N 2.86Å
372	N	98.4	Very high	98.4	Very high	50 Å²	50	43.1 Å²	43.1	27%	0.267	21%	0.206	S	C	.	.			trans	-126.6	89.2	-176.4	-174.4	-14	0	0	0	109.7	Y368 L369 T374 A375 Y376	Y368-N372 HydrophobicContact CD2-CB 4.48Å; Y368-N372 HydrophobicContact CE2-CB 4.06Å; Y368-N372 WeakPolarHBondContact O-CB 3.34Å; Y368-N372 PolarHBondContact O-N 3.12Å; Y368-N372 PolarHBondContact OH-ND2 3.04Å; L369-N372 CarbonylContact O-C 3.58Å; L369-N372 PolarHBondContact O-N 2.75Å; N372-T374 PolarHBondContact O-N 3.18Å; N372-T374 WeakPolarHBondContact OD1-CB 3.42Å; N372-T374 PolarHBondContact OD1-N 2.82Å; N372-A375 HydrophobicContact CB-CB 4.11Å; N372-A375 PolarHBondContact O-N 3.41Å; N372-A375 PolarHBondContact OD1-N 2.99Å; N372-A375 VanDerWaalsContact OD1-N 3.13Å; N372-Y376 PolarHBondContact O-N 2.71Å
373	D	98	Very high	98.2	Very high	59 Å²	59	46.5 Å²	46.5	32%	0.316	22%	0.222	S	C	.	.	H	α-helix	trans	-59	-35.2	-179.5	-74.8	6	0	0	0	112.1	N234 A236 Y376 N377	N234-D373 PolarHBondContact ND2-OD2 3.45Å; A236-D373 HydrophobicContact CB-CB 4.42Å; D373-Y376 PolarHBondContact O-N 2.83Å; D373-N377 WeakPolarHBondContact O-CB 3.12Å; D373-N377 PolarHBondContact O-N 3.2Å; D373-N377 PolarHBondContact O-ND2 3.01Å
374	T	98.3	Very high	97.9	Very high	85 Å²	85	48.9 Å²	48.9	52%	0.521	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-52.3	176.9	-56.8	0	0	0	0	110.7	L230 N372 Y376 N377 E378	L230-T374 HydrophobicContact CD1-CG2 4.11Å; N372-T374 PolarHBondContact O-N 3.18Å; N372-T374 WeakPolarHBondContact OD1-CB 3.42Å; N372-T374 PolarHBondContact OD1-N 2.82Å; T374-Y376 VanDerWaalsContact C-N 3.3Å; T374-Y376 PolarHBondContact O-N 2.63Å; T374-N377 PolarHBondContact O-N 3.31Å; T374-E378 PolarHBondContact O-N 3.12Å; T374-E378 VanDerWaalsContact O-N 3.15Å
375	A	98.4	Very high	97.8	Very high	5 Å²	5	47.8 Å²	47.8	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-34.3	178.6	0	0	0	0	0	112.5	Y368 L369 N372	Y368-A375 HydrophobicContact CE1-CB 3.79Å; Y368-A375 WeakPolarHBondContact OH-CB 3.4Å; L369-A375 HydrophobicContact CD2-CB 3.82Å; N372-A375 HydrophobicContact CB-CB 4.11Å; N372-A375 PolarHBondContact O-N 3.41Å; N372-A375 PolarHBondContact OD1-N 2.99Å; N372-A375 VanDerWaalsContact OD1-N 3.13Å
376	Y	98.6	Very high	97.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-43.9	173.3	179.1	-94.4	0	0	0	112	I235 A236 K302 F303 L330 L369 N372 D373 T374 E378 Y379 F380	I235-Y376 HydrophobicContact CB-CE1 4.48Å; I235-Y376 HydrophobicContact CG2-CE1 4.19Å; A236-Y376 HydrophobicContact CB-CD1 3.51Å; A236-Y376 HydrophobicContact CB-CE1 3.81Å; A236-Y376 HydrophobicContact CB-CG 4.23Å; K302-Y376 WeakPolarHBondContact CA-OH 3.39Å; K302-Y376 HydrophobicContact CB-CE2 3.77Å; K302-Y376 HydrophobicContact CG-CE2 4.31Å; K302-Y376 PolarHBondContact O-OH 2.77Å; F303-Y376 HydrophobicContact CD1-CE2 4.23Å; F303-Y376 AromaticContact CE1-CD2 3.93Å; F303-Y376 HydrophobicContact CE1-CD2 3.93Å; F303-Y376 AromaticContact CE1-CE2 3.79Å; F303-Y376 HydrophobicContact CE1-CE2 3.79Å; F303-Y376 HydrophobicContact CZ-CD2 4.34Å; F303-Y376 HydrophobicContact CZ-CE2 4.37Å; L330-Y376 HydrophobicContact CB-CE2 3.96Å; L330-Y376 HydrophobicContact CD2-CD2 4.28Å; L330-Y376 HydrophobicContact CD2-CE2 4.2Å; L369-Y376 HydrophobicContact CB-CD2 4.46Å; N372-Y376 PolarHBondContact O-N 2.71Å; D373-Y376 PolarHBondContact O-N 2.83Å; T374-Y376 VanDerWaalsContact C-N 3.3Å; T374-Y376 PolarHBondContact O-N 2.63Å; Y376-E378 VanDerWaalsContact C-N 3.28Å; Y376-E378 PolarHBondContact O-N 2.81Å; Y376-Y379 WeakPolarHBondContact O-CB 3.42Å; Y376-Y379 PolarHBondContact O-N 2.79Å; Y376-F380 HydrophobicContact CD1-CD2 4.36Å; Y376-F380 HydrophobicContact CD1-CE2 4.11Å; Y376-F380 HydrophobicContact CE1-CD2 4.02Å; Y376-F380 AromaticContact CE1-CE2 3.45Å; Y376-F380 HydrophobicContact CE1-CE2 3.45Å; Y376-F380 VanDerWaalsContact CE1-CE2 3.45Å; Y376-F380 HydrophobicContact CE1-CZ 4.25Å; Y376-F380 HydrophobicContact CE2-CE2 4.07Å; Y376-F380 AromaticContact CZ-CE2 3.43Å; Y376-F380 VanDerWaalsContact CZ-CE2 3.43Å; Y376-F380 AromaticContact CZ-CZ 3.98Å
377	N	98.3	Very high	97.4	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.053	25%	0.248	C	C	.	.	H	α-helix	trans	-71.5	-18.6	-178.7	-78.2	-81.3	0	0	0	113.5	L230 P231 R233 N234 I235 D373 T374 Y379 F380 A381	L230-N377 HydrophobicContact CD2-CB 4.42Å; P231-N377 HydrophobicContact CG-CB 4.17Å; R233-N377 PolarHBondContact O-OD1 2.98Å; N234-N377 PolarHBondContact OD1-ND2 2.86Å; I235-N377 PolarHBondContact N-OD1 2.93Å; D373-N377 WeakPolarHBondContact O-CB 3.12Å; D373-N377 PolarHBondContact O-N 3.2Å; D373-N377 PolarHBondContact O-ND2 3.01Å; T374-N377 PolarHBondContact O-N 3.31Å; N377-Y379 PolarHBondContact O-N 2.9Å; N377-F380 CarbonylContact O-C 3.47Å; N377-F380 WeakPolarHBondContact O-CA 3.28Å; N377-F380 PolarHBondContact O-N 3.31Å; N377-A381 PolarHBondContact O-N 3.44Å
378	E	98.1	Very high	97.3	Very high	112 Å²	112	46.1 Å²	46.1	52%	0.523	24%	0.238	S	C	.	.	H	α-helix	trans	-56.2	-36.3	169.7	-72.4	174.8	-177.7	0	0	111.8	L230 T374 Y376 F380 A381	L230-E378 HydrophobicContact CD2-CB 4.29Å; L230-E378 HydrophobicContact CD2-CG 3.72Å; T374-E378 PolarHBondContact O-N 3.12Å; T374-E378 VanDerWaalsContact O-N 3.15Å; Y376-E378 VanDerWaalsContact C-N 3.28Å; Y376-E378 PolarHBondContact O-N 2.81Å; E378-F380 PolarHBondContact O-N 2.78Å; E378-F380 VanDerWaalsContact O-N 3.16Å; E378-A381 WeakPolarHBondContact O-CB 3.14Å; E378-A381 PolarHBondContact O-N 2.88Å
379	Y	98.5	Very high	97	Very high	30 Å²	30	42.7 Å²	42.7	12%	0.118	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.9	176.1	-75.9	-83.4	0	0	0	114.5	L330 Y348 S349 F350 I351 Y365 L369 Y376 N377 W382	L330-Y379 HydrophobicContact CD1-CD1 3.64Å; L330-Y379 HydrophobicContact CD1-CE1 4.41Å; L330-Y379 HydrophobicContact CD1-CG 3.75Å; L330-Y379 HydrophobicContact CD2-CD1 4.12Å; L330-Y379 HydrophobicContact CD2-CD2 3.65Å; L330-Y379 HydrophobicContact CD2-CE2 4.18Å; L330-Y379 HydrophobicContact CD2-CG 3.61Å; L330-Y379 HydrophobicContact CG-CG 4.35Å; Y348-Y379 VanDerWaalsContact O-CA 3.26Å; Y348-Y379 WeakPolarHBondContact O-CA 3.49Å; Y348-Y379 WeakPolarHBondContact O-CD1 3.49Å; S349-Y379 WeakPolarHBondContact CA-O 3.47Å; F350-Y379 WeakPolarHBondContact O-CE1 2.9Å; I351-Y379 HydrophobicContact CG1-CE1 3.86Å; Y365-Y379 HydrophobicContact CE1-CE2 4.42Å; Y365-Y379 WeakPolarHBondContact CE1-OH 3.42Å; Y365-Y379 PolarHBondContact OH-OH 3.15Å; L369-Y379 HydrophobicContact CD1-CD2 4.32Å; L369-Y379 HydrophobicContact CD1-CE2 3.85Å; L369-Y379 HydrophobicContact CD2-CE2 4.12Å; Y376-Y379 WeakPolarHBondContact O-CB 3.42Å; Y376-Y379 PolarHBondContact O-N 2.79Å; N377-Y379 PolarHBondContact O-N 2.9Å; Y379-W382 PolarHBondContact O-NE1 2.88Å; Y379-W382 VanDerWaalsContact O-NE1 3.11Å
380	F	98.1	Very high	96.5	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.009	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	14.9	178.2	-63.9	-90.1	0	0	0	112.3	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 4.35Å; I235-F380 HydrophobicContact CG2-CE1 4.19Å; I235-F380 HydrophobicContact CG2-CE2 4.28Å; I235-F380 HydrophobicContact CG2-CG 4.35Å; I235-F380 HydrophobicContact CG2-CZ 4.16Å; L330-F380 HydrophobicContact CB-CE2 4.06Å; L330-F380 HydrophobicContact CB-CZ 4.02Å; Y376-F380 HydrophobicContact CD1-CD2 4.36Å; Y376-F380 HydrophobicContact CD1-CE2 4.11Å; Y376-F380 HydrophobicContact CE1-CD2 4.02Å; Y376-F380 AromaticContact CE1-CE2 3.45Å; Y376-F380 HydrophobicContact CE1-CE2 3.45Å; Y376-F380 VanDerWaalsContact CE1-CE2 3.45Å; Y376-F380 HydrophobicContact CE1-CZ 4.25Å; Y376-F380 HydrophobicContact CE2-CE2 4.07Å; Y376-F380 AromaticContact CZ-CE2 3.43Å; Y376-F380 VanDerWaalsContact CZ-CE2 3.43Å; Y376-F380 AromaticContact CZ-CZ 3.98Å; N377-F380 CarbonylContact O-C 3.47Å; N377-F380 WeakPolarHBondContact O-CA 3.28Å; N377-F380 PolarHBondContact O-N 3.31Å; E378-F380 PolarHBondContact O-N 2.78Å; E378-F380 VanDerWaalsContact O-N 3.16Å; F380-W382 PolarHBondContact O-N 2.81Å; F380-H383 HydrophobicContact CB-CB 4.45Å; F380-H383 WeakPolarHBondContact O-CB 3.33Å; F380-H383 PolarHBondContact O-N 2.75Å
381	A	97.7	Very high	95.7	Very high	13 Å²	13	46.9 Å²	46.9	11%	0.107	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.4	174	0	0	0	0	0	112.4	Y228 P229 N377 E378 H383 H385	Y228-A381 WeakPolarHBondContact CB-O 3.43Å; P229-A381 WeakPolarHBondContact O-CB 3.37Å; N377-A381 PolarHBondContact O-N 3.44Å; E378-A381 WeakPolarHBondContact O-CB 3.14Å; E378-A381 PolarHBondContact O-N 2.88Å; A381-H383 PolarHBondContact O-N 2.9Å; A381-H385 PolarHBondContact O-CD2 3.17Å; A381-H385 VanDerWaalsContact O-CD2 3.27Å
382	W	96.6	Very high	94.9	Very high	11 Å²	11	42.6 Å²	42.6	4%	0.042	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.1	173.6	68.3	-92.1	0	0	0	113.7	Y215 Y228 L325 P346 S349 Y379 F380 G384 H385 I388	Y215-W382 HydrophobicContact CD2-CE3 4.45Å; Y215-W382 AromaticContact CE2-CE3 3.94Å; Y215-W382 HydrophobicContact CE2-CE3 3.94Å; Y228-W382 HydrophobicContact CD2-CB 4.08Å; Y228-W382 HydrophobicContact CE2-CB 4.25Å; L325-W382 HydrophobicContact CB-CH2 4.35Å; L325-W382 HydrophobicContact CB-CZ2 4.26Å; L325-W382 HydrophobicContact CD2-CZ2 3.78Å; P346-W382 HydrophobicContact CB-CB 3.69Å; P346-W382 HydrophobicContact CB-CD2 3.54Å; P346-W382 HydrophobicContact CB-CE3 3.93Å; P346-W382 HydrophobicContact CB-CG 3.41Å; P346-W382 VanDerWaalsContact CB-CG 3.41Å; P346-W382 HydrophobicContact CG-CD2 3.69Å; P346-W382 HydrophobicContact CG-CE3 3.81Å; P346-W382 HydrophobicContact CG-CG 4.11Å; P346-W382 HydrophobicContact CG-CH2 4.48Å; P346-W382 HydrophobicContact CG-CZ2 4.39Å; P346-W382 HydrophobicContact CG-CZ3 4.21Å; S349-W382 VanDerWaalsContact CB-CD1 3.48Å; Y379-W382 PolarHBondContact O-NE1 2.88Å; Y379-W382 VanDerWaalsContact O-NE1 3.11Å; F380-W382 PolarHBondContact O-N 2.81Å; W382-G384 PolarHBondContact O-N 3.3Å; W382-H385 WeakPolarHBondContact O-CB 3.14Å; W382-H385 PolarHBondContact O-N 3.07Å; W382-I388 HydrophobicContact CH2-CD1 4.24Å; W382-I388 HydrophobicContact CH2-CG1 3.74Å; W382-I388 HydrophobicContact CZ3-CD1 4.18Å; W382-I388 HydrophobicContact CZ3-CG1 3.8Å
383	H	94.9	Very high	94.3	Very high	70 Å²	70	41.3 Å²	41.3	32%	0.324	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	124.6	-174.9	-173.7	-78.6	0	0	0	110.6	I235 E328 F380 A381	I235-H383 HydrophobicContact CD1-CB 4.41Å; E328-H383 IonicContact OE1-NE2 2.94Å; F380-H383 HydrophobicContact CB-CB 4.45Å; F380-H383 WeakPolarHBondContact O-CB 3.33Å; F380-H383 PolarHBondContact O-N 2.75Å; A381-H383 PolarHBondContact O-N 2.9Å
384	G	93.4	Very high	93.8	Very high	50 Å²	50	42.6 Å²	42.6	52%	0.515	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-1.3	-174.9	0	0	0	0	0	114.7	Y218 W382	Y218-G384 WeakPolarHBondContact CE2-O 3.18Å; W382-G384 PolarHBondContact O-N 3.3Å
385	H	95.9	Very high	93.5	Very high	58 Å²	58	38.6 Å²	38.6	27%	0.269	21%	0.205	S	C	.	.	S	Bend	trans	-108.2	0.8	174.9	-66.2	-78.5	0	0	0	114.1	Y215 Y218 Y228 A381 W382	Y215-H385 PolarHBondContact OH-O 2.81Å; Y218-H385 VanDerWaalsContact CD2-C 3.4Å; Y218-H385 PolarHBondContact N-O 3.05Å; Y228-H385 HydrophobicContact CD1-CB 3.59Å; Y228-H385 AromaticContact CD1-CD2 3.56Å; Y228-H385 AromaticContact CD1-CG 3.29Å; Y228-H385 AromaticContact CD1-ND1 3.64Å; Y228-H385 HydrophobicContact CE1-CB 3.33Å; Y228-H385 AromaticContact CE1-CG 3.55Å; Y228-H385 AromaticContact CE1-ND1 3.89Å; Y228-H385 HydrophobicContact CE2-CB 4.42Å; Y228-H385 HydrophobicContact CG-CB 4.22Å; Y228-H385 AromaticContact CG-CD2 3.86Å; Y228-H385 AromaticContact CG-CG 3.99Å; A381-H385 PolarHBondContact O-CD2 3.17Å; A381-H385 VanDerWaalsContact O-CD2 3.27Å; W382-H385 WeakPolarHBondContact O-CB 3.14Å; W382-H385 PolarHBondContact O-N 3.07Å
386	G	94.9	Very high	93.3	Very high	6 Å²	6	38.6 Å²	38.6	6%	0.062	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-174.5	173.4	0	0	0	0	0	110.9	E216 Y218	E216-G386 CarbonylContact O-C 3.6Å; E216-G386 WeakPolarHBondContact O-CA 3.3Å; Y218-G386 PolarHBondContact OH-O 3.44Å
387	I	95.1	Very high	93	Very high	78 Å²	78	40 Å²	40	40%	0.4	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.5	-179.2	-173.6	165.3	0	0	0	110.1	Y215 E216 Y218 H389	Y215-I387 WeakPolarHBondContact CD2-O 3.34Å; E216-I387 HydrophobicContact CB-CG2 3.92Å; E216-I387 PolarHBondContact N-O 2.69Å; E216-I387 PolarHBondContact O-N 3.07Å; Y218-I387 HydrophobicContact CE1-CB 4.17Å; Y218-I387 HydrophobicContact CE1-CG2 4.27Å; I387-H389 WeakPolarHBondContact CG2-NE2 3.45Å
388	I	95.5	Very high	92.8	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.062	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.5	170.1	-62	-67.5	0	0	0	107.9	S214 Y215 Y321 L325 N326 P346 W382	S214-I388 WeakPolarHBondContact O-CA 3.32Å; Y215-I388 HydrophobicContact CD2-CD1 3.95Å; Y215-I388 HydrophobicContact CG-CD1 4.45Å; Y321-I388 HydrophobicContact CD1-CG2 4.03Å; Y321-I388 HydrophobicContact CG-CG2 4.42Å; L325-I388 HydrophobicContact CB-CD1 4.28Å; L325-I388 HydrophobicContact CB-CG1 4.13Å; L325-I388 HydrophobicContact CD1-CD1 3.83Å; N326-I388 WeakPolarHBondContact OD1-CB 3.09Å; N326-I388 VanDerWaalsContact OD1-CG2 3.31Å; N326-I388 WeakPolarHBondContact OD1-CG2 3.33Å; P346-I388 HydrophobicContact CG-CD1 3.54Å; W382-I388 HydrophobicContact CH2-CD1 4.24Å; W382-I388 HydrophobicContact CH2-CG1 3.74Å; W382-I388 HydrophobicContact CZ3-CD1 4.18Å; W382-I388 HydrophobicContact CZ3-CG1 3.8Å
389	H	92.9	Very high	92.6	Very high	37 Å²	37	34.2 Å²	34.2	17%	0.171	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.2	169.3	-67.1	-76.2	0	0	0	108.8	G213 S214 E216 I387 D392	G213-H389 CarbonylContact C-O 3.47Å; G213-H389 WeakPolarHBondContact CA-O 3.44Å; S214-H389 PolarHBondContact N-O 2.85Å; S214-H389 PolarHBondContact O-N 3.3Å; E216-H389 IonicContact OE2-NE2 3.91Å; E216-H389 PolarHBondContact OE2-NE2 3.22Å; I387-H389 WeakPolarHBondContact CG2-NE2 3.45Å; H389-D392 HydrophobicContact CB-CB 4.12Å; H389-D392 WeakPolarHBondContact CB-OD2 3.04Å; H389-D392 IonicContact CE1-OD2 3.81Å; H389-D392 IonicContact CG-OD2 3.67Å; H389-D392 IonicContact ND1-OD2 2.82Å; H389-D392 PolarHBondContact ND1-OD2 3.36Å
390	D	88.5	Confident	92.5	Very high	52 Å²	52	32.8 Å²	32.8	28%	0.278	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.2	172.2	69.5	-63.4	0	0	0	111	K322 N326 D392	K322-D390 HydrophobicContact CB-CB 4.03Å; K322-D390 WeakPolarHBondContact CD-OD2 3.49Å; K322-D390 WeakPolarHBondContact CG-OD2 3.33Å; N326-D390 PolarHBondContact ND2-OD1 3.37Å; N326-D390 VanDerWaalsContact ND2-OD1 3.08Å; D390-D392 PolarHBondContact O-N 2.77Å
391	Y	81.7	Confident	92.2	Very high	69 Å²	69	32.9 Å²	32.9	27%	0.271	18%	0.181	S	C	.	.	S	Bend	trans	59.8	27.3	179.2	-143.7	-99.4	0	0	0	115.1	F129 Y212 A393	F129-Y391 HydrophobicContact CB-CE1 3.76Å; F129-Y391 WeakPolarHBondContact CB-OH 3.32Å; Y212-Y391 HydrophobicContact CD1-CD2 4.15Å; Y212-Y391 HydrophobicContact CD1-CE2 4.1Å; Y212-Y391 HydrophobicContact CE1-CE2 4.29Å; Y212-Y391 PolarHBondContact O-N 2.82Å; Y391-A393 VanDerWaalsContact C-N 3.31Å; Y391-A393 PolarHBondContact O-N 3.02Å
392	D	81.3	Confident	92	Very high	85 Å²	85	32.2 Å²	32.2	46%	0.455	18%	0.176	S	C	.	.			trans	-81.9	-5.8	-179.7	-73.3	-21.4	0	0	0	114	H389 D390 Q394	H389-D392 HydrophobicContact CB-CB 4.12Å; H389-D392 WeakPolarHBondContact CB-OD2 3.04Å; H389-D392 IonicContact CE1-OD2 3.81Å; H389-D392 IonicContact CG-OD2 3.67Å; H389-D392 IonicContact ND1-OD2 2.82Å; H389-D392 PolarHBondContact ND1-OD2 3.36Å; D390-D392 PolarHBondContact O-N 2.77Å; D392-Q394 WeakPolarHBondContact O-CG 3.28Å; D392-Q394 PolarHBondContact O-N 2.82Å; D392-Q394 PolarHBondContact O-NE2 3.35Å
393	A	85.2	Confident	91.8	Very high	23 Å²	23	31.9 Å²	31.9	19%	0.19	18%	0.175	C	C	.	.			trans	-57.1	129.4	-179.1	0	0	0	0	0	111.2	Y391 P395	Y391-A393 VanDerWaalsContact C-N 3.31Å; Y391-A393 PolarHBondContact O-N 3.02Å; A393-P395 WeakPolarHBondContact O-CD 3.14Å
394	Q	87.6	Confident	91.7	Very high	87 Å²	87	29.6 Å²	29.6	41%	0.407	16%	0.164	S	C	.	.			trans	-113.7	66.1	179.9	-56.8	-57.5	-52.8	0	0	110.6	D392 Q396 C397	D392-Q394 WeakPolarHBondContact O-CG 3.28Å; D392-Q394 PolarHBondContact O-N 2.82Å; D392-Q394 PolarHBondContact O-NE2 3.35Å; Q394-Q396 PolarHBondContact O-N 2.76Å; Q394-Q396 VanDerWaalsContact O-N 3.09Å; Q394-C397 PolarHBondContact O-N 3.41Å
395	P	92.7	Very high	91.6	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-58	-25.3	-179.1	25.8	-36.6	0	0	0	112.8	T130 I200 I208 A393 C397 A398 M399	T130-P395 HydrophobicContact CG2-CG 4.45Å; I200-P395 HydrophobicContact CG2-CB 3.64Å; I200-P395 HydrophobicContact CG2-CG 4.28Å; I208-P395 HydrophobicContact CG2-CB 3.72Å; A393-P395 WeakPolarHBondContact O-CD 3.14Å; P395-C397 VanDerWaalsContact C-N 3.28Å; P395-C397 PolarHBondContact O-N 3.21Å; P395-A398 PolarHBondContact O-N 3.39Å; P395-M399 HydrophobicContact CB-SD 4.35Å; P395-M399 VanDerWaalsContact O-CG 3.23Å; P395-M399 WeakPolarHBondContact O-CG 3.45Å; P395-M399 PolarHBondContact O-N 3.39Å
396	Q	93.9	Very high	91.3	Very high	5 Å²	5	24.9 Å²	24.9	2%	0.023	13%	0.13	C	C	.	.	H	α-helix	trans	-63.4	-29.5	-175	78.9	-77.2	2.3	0	0	113.6	M132 D133 F134 Q394 M399 C400	M132-Q396 HydrophobicContact SD-CB 3.79Å; D133-Q396 WeakPolarHBondContact O-CG 3.19Å; D133-Q396 PolarHBondContact O-NE2 3.37Å; F134-Q396 HydrophobicContact CD1-CB 3.98Å; F134-Q396 HydrophobicContact CD1-CG 4.06Å; F134-Q396 WeakPolarHBondContact CD1-O 3.19Å; F134-Q396 HydrophobicContact CE1-CB 3.59Å; F134-Q396 HydrophobicContact CE1-CG 4.17Å; F134-Q396 VanDerWaalsContact CE1-O 3.23Å; F134-Q396 WeakPolarHBondContact CE1-O 3.41Å; F134-Q396 HydrophobicContact CZ-CB 4.2Å; Q394-Q396 PolarHBondContact O-N 2.76Å; Q394-Q396 VanDerWaalsContact O-N 3.09Å; Q396-M399 HydrophobicContact CB-SD 4.42Å; Q396-M399 PolarHBondContact O-N 3.41Å; Q396-C400 WeakPolarHBondContact O-CB 3.47Å; Q396-C400 PolarHBondContact O-N 3.02Å
397	C	93.3	Very high	90.8	Very high	29 Å²	29	29 Å²	29	20%	0.196	15%	0.148	C	C	.	.	H	α-helix	trans	-67.8	-46.2	175.1	-63.7	0	0	0	0	111.5	C137 Q394 P395 M399 C400 L401	C137-C397 VanDerWaalsContact CA-SG 3.54Å; C137-C397 HydrophobicContact CB-CB 3.6Å; C137-C397 WeakPolarHBondContact CB-SG 3.38Å; C137-C397 WeakPolarHBondContact SG-CA 3.36Å; C137-C397 WeakPolarHBondContact SG-CB 3.45Å; C137-C397 CovalentContact SG-SG 2.04Å; C137-C397 PolarHBondContact SG-SG 3.39Å; Q394-C397 PolarHBondContact O-N 3.41Å; P395-C397 VanDerWaalsContact C-N 3.28Å; P395-C397 PolarHBondContact O-N 3.21Å; C397-M399 VanDerWaalsContact C-N 3.33Å; C397-M399 PolarHBondContact O-N 3.39Å; C397-C400 PolarHBondContact O-N 3.18Å; C397-L401 WeakPolarHBondContact O-CB 3.32Å; C397-L401 PolarHBondContact O-N 3.48Å
398	A	93.2	Very high	90.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-38.5	174	0	0	0	0	0	112.1	P94 L95 I208 P395 L401 L402	P94-A398 HydrophobicContact CB-CB 4.11Å; P94-A398 HydrophobicContact CG-CB 4.02Å; L95-A398 HydrophobicContact CD1-CB 4.31Å; L95-A398 HydrophobicContact CD2-CB 3.93Å; L95-A398 HydrophobicContact CG-CB 3.8Å; I208-A398 HydrophobicContact CD1-CB 3.71Å; I208-A398 HydrophobicContact CG1-CB 3.87Å; I208-A398 HydrophobicContact CG2-CB 4.19Å; P395-A398 PolarHBondContact O-N 3.39Å; A398-L401 PolarHBondContact O-N 3.13Å; A398-L402 WeakPolarHBondContact O-CB 3.23Å; A398-L402 VanDerWaalsContact O-CG 3.31Å; A398-L402 WeakPolarHBondContact O-CG 3.26Å; A398-L402 PolarHBondContact O-N 2.84Å
399	M	94.8	Very high	89.6	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-52.1	174.5	-69.2	164.4	60.9	0	0	111.3	F120 M132 I158 F176 I200 I208 P395 Q396 C397 L401 L402 A403	F120-M399 HydrophobicContact CD1-CE 3.83Å; F120-M399 HydrophobicContact CE1-CB 4.02Å; F120-M399 HydrophobicContact CE1-CE 3.77Å; F120-M399 HydrophobicContact CZ-CB 3.9Å; F120-M399 WeakPolarHBondContact CZ-O 3.23Å; M132-M399 HydrophobicContact CE-CE 3.96Å; M132-M399 HydrophobicContact CE-SD 4Å; M132-M399 HydrophobicContact SD-CE 4.02Å; M132-M399 HydrophobicContact SD-SD 4.24Å; I158-M399 HydrophobicContact CD1-CE 3.56Å; I158-M399 HydrophobicContact CG1-CE 3.72Å; F176-M399 HydrophobicContact CD1-CG 4.04Å; F176-M399 HydrophobicContact CE1-CB 4.19Å; F176-M399 HydrophobicContact CE1-CG 4.07Å; I200-M399 HydrophobicContact CD1-CE 4.29Å; I200-M399 HydrophobicContact CD1-CG 3.57Å; I200-M399 HydrophobicContact CD1-SD 3.48Å; I200-M399 WeakPolarHBondContact CD1-SD 3.49Å; I208-M399 HydrophobicContact CD1-CG 3.77Å; P395-M399 HydrophobicContact CB-SD 4.35Å; P395-M399 VanDerWaalsContact O-CG 3.23Å; P395-M399 WeakPolarHBondContact O-CG 3.45Å; P395-M399 PolarHBondContact O-N 3.39Å; Q396-M399 HydrophobicContact CB-SD 4.42Å; Q396-M399 PolarHBondContact O-N 3.41Å; C397-M399 VanDerWaalsContact C-N 3.33Å; C397-M399 PolarHBondContact O-N 3.39Å; M399-L401 VanDerWaalsContact C-N 3.32Å; M399-L401 PolarHBondContact O-N 3.26Å; M399-L402 PolarHBondContact O-N 2.8Å; M399-A403 PolarHBondContact O-N 3.12Å
400	C	94.9	Very high	88.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-42.4	-178.4	-171.6	0	0	0	0	111.2	F134 A139 C142 Q396 C397 L402 A403 H404	F134-C400 HydrophobicContact CD1-CB 3.59Å; F134-C400 HydrophobicContact CE1-CB 3.91Å; A139-C400 HydrophobicContact CB-CB 4.38Å; A139-C400 WeakPolarHBondContact O-CB 3.21Å; A139-C400 PolarHBondContact O-SG 3.29Å; C142-C400 HydrophobicContact CB-CB 3.81Å; C142-C400 WeakPolarHBondContact CB-SG 3.43Å; C142-C400 WeakPolarHBondContact SG-CA 3.25Å; C142-C400 WeakPolarHBondContact SG-CB 3.4Å; C142-C400 CovalentContact SG-SG 2.03Å; C142-C400 PolarHBondContact SG-SG 3.12Å; Q396-C400 WeakPolarHBondContact O-CB 3.47Å; Q396-C400 PolarHBondContact O-N 3.02Å; C397-C400 PolarHBondContact O-N 3.18Å; C400-L402 PolarHBondContact O-N 2.88Å; C400-A403 PolarHBondContact O-N 3.06Å; C400-H404 PolarHBondContact O-CD2 2.66Å; C400-H404 VanDerWaalsContact O-CD2 3.25Å; C400-H404 PolarHBondContact O-N 2.71Å; C400-H404 VanDerWaalsContact O-N 3.16Å
401	L	92.2	Very high	88.2	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-56.7	-50.9	175.3	-171.9	62	0	0	0	111	L95 E101 L104 E105 Y108 A139 C397 A398 M399 A403 H404 T405	L95-L401 HydrophobicContact CD1-CD2 4.42Å; E101-L401 HydrophobicContact CG-CD2 4.4Å; L104-L401 HydrophobicContact CB-CD1 4.44Å; L104-L401 HydrophobicContact CB-CD2 3.53Å; L104-L401 HydrophobicContact CB-CG 3.85Å; L104-L401 HydrophobicContact CD1-CD2 4.4Å; E105-L401 HydrophobicContact CG-CD1 4.43Å; E105-L401 HydrophobicContact CG-CD2 3.94Å; Y108-L401 HydrophobicContact CD1-CD1 4.44Å; Y108-L401 HydrophobicContact CD2-CD1 4.45Å; Y108-L401 HydrophobicContact CG-CD1 3.93Å; A139-L401 HydrophobicContact CB-CB 4.19Å; A139-L401 HydrophobicContact CB-CD1 3.99Å; C397-L401 WeakPolarHBondContact O-CB 3.32Å; C397-L401 PolarHBondContact O-N 3.48Å; A398-L401 PolarHBondContact O-N 3.13Å; M399-L401 VanDerWaalsContact C-N 3.32Å; M399-L401 PolarHBondContact O-N 3.26Å; L401-A403 PolarHBondContact O-N 3.02Å; L401-H404 PolarHBondContact O-N 3.3Å; L401-H404 VanDerWaalsContact O-N 3.16Å; L401-T405 HydrophobicContact CD1-CG2 4.38Å; L401-T405 WeakPolarHBondContact O-CG2 3.49Å; L401-T405 PolarHBondContact O-N 2.91Å; L401-T405 PolarHBondContact O-OG1 3.11Å
402	L	92.9	Very high	88.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-40.5	177.7	-74.5	172.2	0	0	0	113	L95 L99 L104 F176 F198 T207 I208 A398 M399 C400 H404 T405 S406 F409	L95-L402 HydrophobicContact CD2-CD1 3.88Å; L95-L402 HydrophobicContact CD2-CG 4.28Å; L99-L402 HydrophobicContact CD1-CD2 4.17Å; L99-L402 HydrophobicContact CD2-CD2 4.42Å; L104-L402 HydrophobicContact CD1-CD2 3.72Å; L104-L402 HydrophobicContact CD1-CG 4.46Å; F176-L402 HydrophobicContact CE1-CB 4.26Å; F176-L402 HydrophobicContact CE1-CD1 4.1Å; F176-L402 HydrophobicContact CZ-CB 4.05Å; F198-L402 HydrophobicContact CB-CD1 4.46Å; F198-L402 HydrophobicContact CD1-CD1 3.89Å; F198-L402 HydrophobicContact CD2-CB 4.43Å; F198-L402 HydrophobicContact CD2-CD1 4.17Å; F198-L402 HydrophobicContact CE1-CD1 4.09Å; F198-L402 HydrophobicContact CE1-CD2 3.95Å; F198-L402 HydrophobicContact CE2-CB 4.07Å; F198-L402 HydrophobicContact CE2-CD1 4.36Å; F198-L402 HydrophobicContact CG-CD1 3.9Å; F198-L402 HydrophobicContact CZ-CB 4.27Å; F198-L402 HydrophobicContact CZ-CD1 4.32Å; F198-L402 HydrophobicContact CZ-CD2 3.96Å; F198-L402 HydrophobicContact CZ-CG 4.43Å; T207-L402 HydrophobicContact CG2-CD1 4.13Å; I208-L402 HydrophobicContact CD1-CD1 3.98Å; I208-L402 HydrophobicContact CG1-CD1 4.28Å; A398-L402 WeakPolarHBondContact O-CB 3.23Å; A398-L402 VanDerWaalsContact O-CG 3.31Å; A398-L402 WeakPolarHBondContact O-CG 3.26Å; A398-L402 PolarHBondContact O-N 2.84Å; M399-L402 PolarHBondContact O-N 2.8Å; C400-L402 PolarHBondContact O-N 2.88Å; L402-H404 PolarHBondContact O-N 2.92Å; L402-T405 PolarHBondContact O-N 2.69Å; L402-S406 WeakPolarHBondContact O-CB 3.07Å; L402-S406 PolarHBondContact O-N 2.73Å; L402-S406 PolarHBondContact O-OG 3.33Å; L402-F409 HydrophobicContact CD2-CZ 4.44Å
403	A	94.2	Very high	88.5	Confident	3 Å²	3	32.8 Å²	32.8	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-26.3	178.2	0	0	0	0	0	113.7	K118 F120 L174 M399 C400 L401	K118-A403 HydrophobicContact CB-CB 4.25Å; K118-A403 WeakPolarHBondContact CE-O 2.91Å; K118-A403 HydrophobicContact CG-CB 4.3Å; F120-A403 HydrophobicContact CE1-CB 4.5Å; F120-A403 HydrophobicContact CE2-CB 3.85Å; F120-A403 HydrophobicContact CZ-CB 3.52Å; L174-A403 HydrophobicContact CD1-CB 4.24Å; M399-A403 PolarHBondContact O-N 3.12Å; C400-A403 PolarHBondContact O-N 3.06Å; L401-A403 PolarHBondContact O-N 3.02Å
404	H	92.8	Very high	88.6	Confident	22 Å²	22	32.5 Å²	32.5	10%	0.102	17%	0.172	C	C	.	.	H	α-helix	trans	-86.5	-28.2	174.5	-81.4	-82.5	0	0	0	113.2	Y108 L111 T116 K118 K141 C400 L401 L402	Y108-H404 HydrophobicContact CD2-CB 3.57Å; Y108-H404 HydrophobicContact CE2-CB 3.65Å; Y108-H404 AromaticContact CE2-CD2 3.97Å; Y108-H404 AromaticContact CE2-CG 3.56Å; Y108-H404 AromaticContact CE2-ND1 3.88Å; L111-H404 WeakPolarHBondContact CD1-O 3.34Å; T116-H404 PolarHBondContact O-CE1 3.08Å; K118-H404 WeakPolarHBondContact CG-NE2 3.04Å; K141-H404 PolarHBondContact O-NE2 2.82Å; C400-H404 PolarHBondContact O-CD2 2.66Å; C400-H404 VanDerWaalsContact O-CD2 3.25Å; C400-H404 PolarHBondContact O-N 2.71Å; C400-H404 VanDerWaalsContact O-N 3.16Å; L401-H404 PolarHBondContact O-N 3.3Å; L401-H404 VanDerWaalsContact O-N 3.16Å; L402-H404 PolarHBondContact O-N 2.92Å
405	T	89.7	Confident	88.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-102.3	-19.7	-172.9	58.2	0	0	0	0	114.7	L107 L111 L401 L402 Q407 A408	L107-T405 HydrophobicContact CB-CG2 4.38Å; L107-T405 HydrophobicContact CD2-CG2 4.13Å; L107-T405 HydrophobicContact CG-CG2 4.09Å; L111-T405 HydrophobicContact CD1-CG2 4.32Å; L401-T405 HydrophobicContact CD1-CG2 4.38Å; L401-T405 WeakPolarHBondContact O-CG2 3.49Å; L401-T405 PolarHBondContact O-N 2.91Å; L401-T405 PolarHBondContact O-OG1 3.11Å; L402-T405 PolarHBondContact O-N 2.69Å; T405-Q407 PolarHBondContact O-N 3.29Å; T405-Q407 VanDerWaalsContact O-N 3.15Å; T405-A408 WeakPolarHBondContact O-CB 3.43Å; T405-A408 PolarHBondContact O-N 3.42Å
406	S	89.5	Confident	88.5	Confident	9 Å²	9	38.4 Å²	38.4	6%	0.063	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60	-31.8	-167.8	63.6	0	0	0	0	114.7	L174 L402 A408 F409	L174-S406 VanDerWaalsContact CD1-OG 3.28Å; L174-S406 WeakPolarHBondContact CD1-OG 3.48Å; L402-S406 WeakPolarHBondContact O-CB 3.07Å; L402-S406 PolarHBondContact O-N 2.73Å; L402-S406 PolarHBondContact O-OG 3.33Å; S406-A408 PolarHBondContact O-N 2.59Å; S406-F409 VanDerWaalsContact CA-CE1 3.48Å; S406-F409 VanDerWaalsContact CA-CZ 3.45Å; S406-F409 PolarHBondContact O-N 3Å
407	Q	85.4	Confident	88.4	Confident	94 Å²	94	38.2 Å²	38.2	44%	0.439	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-64.1	-29.8	179.3	-64.8	-178.4	-14.4	0	0	112	E172 T405 F409 G410	E172-Q407 PolarHBondContact OE2-NE2 3.12Å; T405-Q407 PolarHBondContact O-N 3.29Å; T405-Q407 VanDerWaalsContact O-N 3.15Å; Q407-F409 VanDerWaalsContact C-N 3.3Å; Q407-F409 PolarHBondContact O-N 3.24Å; Q407-G410 PolarHBondContact O-N 2.6Å
408	A	85.1	Confident	88.5	Confident	27 Å²	27	37 Å²	37	22%	0.223	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-74	-16.7	-176.1	0	0	0	0	0	114.1	L107 L111 T405 S406	L107-A408 HydrophobicContact CD1-CB 4.22Å; L107-A408 HydrophobicContact CD2-CB 4.11Å; L111-A408 HydrophobicContact CD2-CB 4.49Å; T405-A408 WeakPolarHBondContact O-CB 3.43Å; T405-A408 PolarHBondContact O-N 3.42Å; S406-A408 PolarHBondContact O-N 2.59Å
409	F	79.7	Confident	88.5	Confident	40 Å²	40	44.7 Å²	44.7	18%	0.175	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-113.1	8.7	176.4	54.9	-106.2	0	0	0	113.6	L78 L104 F198 L402 S406 Q407	L78-F409 HydrophobicContact CD1-CB 4.19Å; L104-F409 HydrophobicContact CD2-CE1 4.24Å; F198-F409 HydrophobicContact CE1-CZ 4.41Å; F198-F409 HydrophobicContact CZ-CE2 4.37Å; F198-F409 HydrophobicContact CZ-CZ 4.04Å; L402-F409 HydrophobicContact CD2-CZ 4.44Å; S406-F409 VanDerWaalsContact CA-CE1 3.48Å; S406-F409 VanDerWaalsContact CA-CZ 3.45Å; S406-F409 PolarHBondContact O-N 3Å; Q407-F409 VanDerWaalsContact C-N 3.3Å; Q407-F409 PolarHBondContact O-N 3.24Å
410	G	76	Confident	88.4	Confident	31 Å²	31	47 Å²	47	32%	0.32	23%	0.234	S	C	.	.			trans	80.1	-179	177.2	0	0	0	0	0	114.4	Q407 Y412	Q407-G410 PolarHBondContact O-N 2.6Å; G410-Y412 PolarHBondContact O-N 2.76Å
411	P	75.9	Confident	88.4	Confident	118 Å²	118	47 Å²	47	77%	0.766	23%	0.234	S	C	*	.			trans	-67.1	127.4	-176.5	29.8	-35.4	0	0	0	110.6	W413	P411-W413 HydrophobicContact CB-CZ3 4.07Å; P411-W413 HydrophobicContact CG-CZ3 4.46Å
412	Y	81.9	Confident	88.6	Confident	75 Å²	75	49.3 Å²	49.3	29%	0.294	25%	0.246	S	C	.	.			trans	-128.3	137.7	179.3	173.8	-95.4	0	0	0	110.1	N197 F198 G410 V414	N197-Y412 WeakPolarHBondContact CA-O 3.31Å; N197-Y412 WeakPolarHBondContact CB-O 3.45Å; N197-Y412 PolarHBondContact ND2-O 2.89Å; N197-Y412 WeakPolarHBondContact O-CD1 3.16Å; N197-Y412 WeakPolarHBondContact O-CE1 3.32Å; F198-Y412 HydrophobicContact CD1-CD1 4.08Å; F198-Y412 HydrophobicContact CD1-CE1 4.11Å; F198-Y412 AromaticContact CE1-CD1 3.71Å; F198-Y412 HydrophobicContact CE1-CD1 3.71Å; F198-Y412 HydrophobicContact CE1-CE1 4.1Å; F198-Y412 HydrophobicContact CZ-CD1 4.47Å; G410-Y412 PolarHBondContact O-N 2.76Å; Y412-V414 HydrophobicContact CE1-CG2 4.34Å
413	W	87.1	Confident	88.7	Confident	120 Å²	120	52.4 Å²	52.4	46%	0.455	26%	0.263	S	S	.	.			trans	-141.5	152.9	172	54.8	85.9	0	0	0	110.9	N194 I196 P411 P415	N194-W413 VanDerWaalsContact CB-CD1 3.5Å; N194-W413 HydrophobicContact CB-CG 4.11Å; N194-W413 WeakPolarHBondContact O-CB 3.45Å; N194-W413 PolarHBondContact OD1-NE1 2.69Å; I196-W413 CarbonylContact O-C 3.5Å; I196-W413 VanDerWaalsContact O-CA 3.23Å; I196-W413 WeakPolarHBondContact O-CA 3.37Å; I196-W413 WeakPolarHBondContact O-CB 3.31Å; P411-W413 HydrophobicContact CB-CZ3 4.07Å; P411-W413 HydrophobicContact CG-CZ3 4.46Å; W413-P415 VanDerWaalsContact O-CD 3.23Å; W413-P415 WeakPolarHBondContact O-CD 3.45Å
414	V	88.9	Confident	88.7	Confident	17 Å²	17	52.8 Å²	52.8	10%	0.103	27%	0.267	C	S	.	.			trans	-77.8	111	174.2	-178.2	0	0	0	0	108.1	I196 T199 Y412 V417	I196-V414 PolarHBondContact O-N 2.81Å; T199-V414 HydrophobicContact CG2-CB 4.48Å; T199-V414 HydrophobicContact CG2-CG1 4.46Å; T199-V414 HydrophobicContact CG2-CG2 4.02Å; Y412-V414 HydrophobicContact CE1-CG2 4.34Å; V414-V417 HydrophobicContact CB-CB 4.11Å; V414-V417 HydrophobicContact CB-CG2 4.03Å; V414-V417 HydrophobicContact CG1-CB 3.94Å; V414-V417 HydrophobicContact CG1-CG2 3.85Å
415	P	87.1	Confident	88.9	Confident	82 Å²	82	52.8 Å²	52.8	53%	0.532	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	153.1	172.3	33.2	-35.2	0	0	0	108.3	W413 V417	W413-P415 VanDerWaalsContact O-CD 3.23Å; W413-P415 WeakPolarHBondContact O-CD 3.45Å; P415-V417 PolarHBondContact O-N 3.41Å
416	K	89.9	Confident	89.1	Confident	131 Å²	131	58 Å²	58	57%	0.57	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-2.8	172.4	31.5	123.5	176.8	171.1	0	112.7	E193 A418 R419 W420	E193-K416 WeakPolarHBondContact OE1-CA 2.97Å; E193-K416 WeakPolarHBondContact OE1-CB 3.42Å; E193-K416 WeakPolarHBondContact OE1-CG 3.44Å; E193-K416 PolarHBondContact OE1-N 2.77Å; K416-A418 VanDerWaalsContact C-N 3.3Å; K416-A418 PolarHBondContact O-N 3.34Å; K416-A418 VanDerWaalsContact O-N 3.12Å; K416-R419 HydrophobicContact CB-CB 4.09Å; K416-R419 CarbonylContact O-C 3.55Å; K416-R419 WeakPolarHBondContact O-CA 3.37Å; K416-R419 WeakPolarHBondContact O-CB 3.49Å; K416-R419 PolarHBondContact O-N 3.41Å; K416-W420 WeakPolarHBondContact O-CB 3.47Å; K416-W420 PolarHBondContact O-N 3.43Å
417	V	92.4	Very high	89.2	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.9	-41.8	-151.5	75.5	0	0	0	0	113	M188 L192 E193 I196 T199 V414 P415 W420 W421	M188-V417 HydrophobicContact CE-CG2 4.21Å; M188-V417 HydrophobicContact SD-CB 4.5Å; M188-V417 HydrophobicContact SD-CG1 4.36Å; M188-V417 HydrophobicContact SD-CG2 3.76Å; L192-V417 HydrophobicContact CB-CG1 4.47Å; L192-V417 WeakPolarHBondContact O-CG1 3.37Å; E193-V417 PolarHBondContact OE2-N 3.15Å; E193-V417 VanDerWaalsContact OE2-N 3.12Å; I196-V417 HydrophobicContact CB-CG1 4.26Å; I196-V417 HydrophobicContact CB-CG2 4.21Å; I196-V417 HydrophobicContact CG1-CG1 3.92Å; I196-V417 HydrophobicContact CG1-CG2 4.28Å; I196-V417 HydrophobicContact CG2-CG2 4.4Å; T199-V417 HydrophobicContact CG2-CG2 3.68Å; V414-V417 HydrophobicContact CB-CB 4.11Å; V414-V417 HydrophobicContact CB-CG2 4.03Å; V414-V417 HydrophobicContact CG1-CB 3.94Å; V414-V417 HydrophobicContact CG1-CG2 3.85Å; P415-V417 PolarHBondContact O-N 3.41Å; V417-W420 HydrophobicContact CG2-CE3 4.12Å; V417-W420 HydrophobicContact CG2-CZ3 4.46Å; V417-W421 WeakPolarHBondContact O-CB 3.23Å; V417-W421 PolarHBondContact O-N 3.39Å; V417-W421 VanDerWaalsContact O-N 3.07Å
418	A	94.2	Very high	89.5	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-67.2	-42.6	179.3	0	0	0	0	0	111.2	M188 E193 K416 N422	M188-A418 HydrophobicContact CB-CB 4.05Å; E193-A418 PolarHBondContact OE2-N 3.32Å; K416-A418 VanDerWaalsContact C-N 3.3Å; K416-A418 PolarHBondContact O-N 3.34Å; K416-A418 VanDerWaalsContact O-N 3.12Å; A418-N422 WeakPolarHBondContact O-CB 2.98Å; A418-N422 PolarHBondContact O-N 3.11Å; A418-N422 PolarHBondContact O-ND2 3.24Å; A418-N422 VanDerWaalsContact O-ND2 3.12Å
419	R	93.6	Very high	89.8	Confident	160 Å²	160	65.9 Å²	65.9	60%	0.604	34%	0.343	S	S	*	.	H	α-helix	trans	-67.8	-47.1	177.4	-175.8	178.9	178.1	176	-4	112	K416 W421 N422 D423	K416-R419 HydrophobicContact CB-CB 4.09Å; K416-R419 CarbonylContact O-C 3.55Å; K416-R419 WeakPolarHBondContact O-CA 3.37Å; K416-R419 WeakPolarHBondContact O-CB 3.49Å; K416-R419 PolarHBondContact O-N 3.41Å; R419-W421 PolarHBondContact O-N 3.36Å; R419-N422 PolarHBondContact O-N 3.05Å; R419-D423 WeakPolarHBondContact CG-OD2 3.23Å; R419-D423 IonicContact NE-OD2 3.11Å; R419-D423 PolarHBondContact NE-OD2 3.44Å; R419-D423 VanDerWaalsContact NE-OD2 3.11Å; R419-D423 WeakPolarHBondContact O-CB 3.45Å; R419-D423 PolarHBondContact O-N 2.97Å
420	W	92.7	Very high	90.5	Very high	48 Å²	48	65 Å²	65	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-50.7	-47.2	176.4	162.2	77.9	0	0	0	111	T199 R203 D205 K416 V417	T199-W420 HydrophobicContact CG2-CE3 4.41Å; T199-W420 HydrophobicContact CG2-CH2 4.13Å; T199-W420 HydrophobicContact CG2-CZ3 3.7Å; R203-W420 HydrophobicContact CB-CZ2 4.07Å; R203-W420 HydrophobicContact CG-CZ2 4.42Å; R203-W420 PolarHBondContact NH1-O 3.36Å; R203-W420 VanDerWaalsContact NH2-NE1 3.18Å; D205-W420 WeakPolarHBondContact OD1-CZ2 3.23Å; D205-W420 PolarHBondContact OD1-NE1 3.49Å; D205-W420 PolarHBondContact OD2-NE1 2.98Å; K416-W420 WeakPolarHBondContact O-CB 3.47Å; K416-W420 PolarHBondContact O-N 3.43Å; V417-W420 HydrophobicContact CG2-CE3 4.12Å; V417-W420 HydrophobicContact CG2-CZ3 4.46Å
421	W	95.2	Very high	91.4	Very high	1 Å²	1	70 Å²	70	0%	0.004	35%	0.35	C	S	.	.	H	α-helix	trans	-72.5	-57	179	-178.6	-107.2	0	0	0	112.4	I179 E181 P183 I186 M188 F202 R203 V417 R419 D423 G424	I179-W421 HydrophobicContact CB-CH2 4.18Å; I179-W421 HydrophobicContact CB-CZ2 3.97Å; I179-W421 HydrophobicContact CG2-CH2 3.84Å; I179-W421 HydrophobicContact CG2-CZ2 3.29Å; E181-W421 VanDerWaalsContact O-CH2 3.3Å; E181-W421 WeakPolarHBondContact O-CH2 3.44Å; E181-W421 WeakPolarHBondContact O-CZ2 3.34Å; P183-W421 WeakPolarHBondContact CB-O 3.32Å; P183-W421 HydrophobicContact CG-CD2 4.1Å; P183-W421 HydrophobicContact CG-CH2 4.48Å; P183-W421 HydrophobicContact CG-CZ2 4Å; P183-W421 WeakPolarHBondContact CG-O 3.36Å; I186-W421 PolarHBondContact O-NE1 2.83Å; M188-W421 HydrophobicContact CB-CB 4.47Å; M188-W421 HydrophobicContact CE-CB 4.4Å; M188-W421 HydrophobicContact CE-CG 4.3Å; M188-W421 HydrophobicContact CG-CB 4.13Å; M188-W421 HydrophobicContact CG-CG 3.96Å; M188-W421 HydrophobicContact SD-CB 3.66Å; M188-W421 HydrophobicContact SD-CG 3.96Å; F202-W421 AromaticContact CE1-CH2 3.6Å; F202-W421 HydrophobicContact CE1-CH2 3.6Å; F202-W421 HydrophobicContact CE1-CZ3 4.2Å; F202-W421 AromaticContact CZ-CH2 3.79Å; F202-W421 HydrophobicContact CZ-CH2 3.79Å; F202-W421 HydrophobicContact CZ-CZ3 4.11Å; R203-W421 HydrophobicContact CG-CZ3 4.26Å; V417-W421 WeakPolarHBondContact O-CB 3.23Å; V417-W421 PolarHBondContact O-N 3.39Å; V417-W421 VanDerWaalsContact O-N 3.07Å; R419-W421 PolarHBondContact O-N 3.36Å; W421-D423 VanDerWaalsContact C-N 3.31Å; W421-D423 PolarHBondContact O-N 3.33Å; W421-G424 PolarHBondContact O-N 3.31Å
422	N	95.6	Very high	92.3	Very high	52 Å²	52	65.9 Å²	65.9	28%	0.278	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-32.9	-172.6	-65.6	-19.3	0	0	0	113.1	A187 M188 A418 R419 G424	A187-N422 VanDerWaalsContact CA-OD1 3.28Å; A187-N422 WeakPolarHBondContact CA-OD1 3.34Å; A187-N422 WeakPolarHBondContact CB-OD1 3.24Å; M188-N422 PolarHBondContact N-OD1 3.03Å; M188-N422 PolarHBondContact O-ND2 3.27Å; A418-N422 WeakPolarHBondContact O-CB 2.98Å; A418-N422 PolarHBondContact O-N 3.11Å; A418-N422 PolarHBondContact O-ND2 3.24Å; A418-N422 VanDerWaalsContact O-ND2 3.12Å; R419-N422 PolarHBondContact O-N 3.05Å; N422-G424 PolarHBondContact O-N 3.42Å
423	D	95.9	Very high	92.5	Very high	66 Å²	66	69.2 Å²	69.2	35%	0.353	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-75.7	-5.6	177.7	-69.4	-10.5	0	0	0	112.6	R419 W421 C425 N426	R419-D423 WeakPolarHBondContact CG-OD2 3.23Å; R419-D423 IonicContact NE-OD2 3.11Å; R419-D423 PolarHBondContact NE-OD2 3.44Å; R419-D423 VanDerWaalsContact NE-OD2 3.11Å; R419-D423 WeakPolarHBondContact O-CB 3.45Å; R419-D423 PolarHBondContact O-N 2.97Å; W421-D423 VanDerWaalsContact C-N 3.31Å; W421-D423 PolarHBondContact O-N 3.33Å; D423-C425 PolarHBondContact O-N 2.91Å; D423-N426 WeakPolarHBondContact CA-ND2 3.44Å; D423-N426 WeakPolarHBondContact O-CB 3.46Å; D423-N426 PolarHBondContact O-N 3.46Å; D423-N426 PolarHBondContact OD1-ND2 3.43Å
424	G	95.1	Very high	91.8	Very high	10 Å²	10	69.5 Å²	69.5	10%	0.103	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-61.3	-13.4	-174.9	0	0	0	0	0	115.5	S313 W421 N422	S313-G424 WeakPolarHBondContact CB-O 3.49Å; S313-G424 PolarHBondContact N-O 3.25Å; W421-G424 PolarHBondContact O-N 3.31Å; N422-G424 PolarHBondContact O-N 3.42Å
425	C	95.5	Very high	92	Very high	22 Å²	22	72.2 Å²	72.2	15%	0.149	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-110.4	-0.9	175.9	-45.4	0	0	0	0	113.2	V184 C312 D423	V184-C425 HydrophobicContact CG2-CB 4.06Å; C312-C425 HydrophobicContact CB-CB 3.93Å; C312-C425 WeakPolarHBondContact CB-SG 3.16Å; C312-C425 WeakPolarHBondContact SG-CB 3.42Å; C312-C425 CovalentContact SG-SG 2.03Å; C312-C425 PolarHBondContact SG-SG 3.41Å; D423-C425 PolarHBondContact O-N 2.91Å
426	N	95.2	Very high	92.2	Very high	109 Å²	109	71.6 Å²	71.6	58%	0.583	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	140.1	-175.2	-70.9	-11	0	0	0	111	D423 R428	D423-N426 WeakPolarHBondContact CA-ND2 3.44Å; D423-N426 WeakPolarHBondContact O-CB 3.46Å; D423-N426 PolarHBondContact O-N 3.46Å; D423-N426 PolarHBondContact OD1-ND2 3.43Å; N426-R428 PolarHBondContact O-N 3.46Å; N426-R428 VanDerWaalsContact O-N 3.11Å
427	G	91.4	Very high	92.4	Very high	74 Å²	74	68.3 Å²	68.3	76%	0.763	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-14.3	173.2	0	0	0	0	0	115.7	K429	G427-K429 PolarHBondContact O-N 3.42Å
428	R	92.3	Very high	92.4	Very high	48 Å²	48	72.4 Å²	72.4	18%	0.181	37%	0.373	C	S	.	.			trans	-68.1	116.6	176.1	-178.1	63.3	178.4	108.5	-6.6	110.5	L311 G335 A336 H352 D354 N426	L311-R428 HydrophobicContact CB-CB 4.27Å; L311-R428 HydrophobicContact CB-CG 3.6Å; G335-R428 PolarHBondContact O-NE 3.4Å; G335-R428 PolarHBondContact O-NH2 3.39Å; A336-R428 PolarHBondContact O-NE 2.83Å; A336-R428 PolarHBondContact O-NH2 3.29Å; H352-R428 PolarHBondContact CE1-NH2 3.33Å; H352-R428 PolarHBondContact NE2-NH2 3.19Å; D354-R428 IonicContact OD2-CZ 2.86Å; D354-R428 IonicContact OD2-NH1 3.12Å; D354-R428 PolarHBondContact OD2-NH1 3.33Å; D354-R428 IonicContact OD2-NH2 3.42Å; D354-R428 PolarHBondContact OD2-NH2 2.92Å; N426-R428 PolarHBondContact O-N 3.46Å; N426-R428 VanDerWaalsContact O-N 3.11Å
429	K	90.5	Very high	92.3	Very high	174 Å²	174	76.6 Å²	76.6	76%	0.757	39%	0.394	S	S	*	.			trans	-131.1	141.7	174.8	-64.2	-178.3	-178.2	-179.5	0	109.7	G427	G427-K429 PolarHBondContact O-N 3.42Å
430	L	94.4	Very high	92.2	Very high	22 Å²	22	71 Å²	71	12%	0.115	38%	0.38	C	S	.	.			trans	-70.2	153.1	172	-59	-175.9	0	0	0	110.4	P255 Y259 L311 M334 V353 D354 W432	P255-L430 HydrophobicContact CG-CD1 3.42Å; P255-L430 VanDerWaalsContact CG-CD1 3.42Å; P255-L430 HydrophobicContact CG-CG 4.22Å; Y259-L430 HydrophobicContact CD2-CD1 4.38Å; L311-L430 HydrophobicContact CD1-CD1 4.49Å; L311-L430 HydrophobicContact CD1-CD2 3.95Å; L311-L430 HydrophobicContact CD1-CG 3.82Å; L311-L430 HydrophobicContact CD2-CD2 4.07Å; M334-L430 HydrophobicContact CE-CD1 3.62Å; M334-L430 HydrophobicContact CG-CD1 4.08Å; M334-L430 HydrophobicContact CG-CD2 3.91Å; M334-L430 HydrophobicContact SD-CD1 3.78Å; V353-L430 HydrophobicContact CG2-CD2 4.11Å; D354-L430 WeakPolarHBondContact OD1-CA 3.18Å; L430-W432 VanDerWaalsContact C-N 3.29Å
431	R	95.7	Very high	92.1	Very high	135 Å²	135	72.6 Å²	72.6	51%	0.509	39%	0.394	S	S	.	.	S	Bend	trans	-62.9	-40.3	169.7	-179.3	176.6	-179.8	177.2	-0.2	111	D354 E357 N433	D354-R431 HydrophobicContact CB-CB 4.06Å; D354-R431 WeakPolarHBondContact O-CD 2.93Å; D354-R431 PolarHBondContact O-NH1 3.36Å; D354-R431 PolarHBondContact OD1-N 3.45Å; E357-R431 VanDerWaalsContact CG-NH2 3.3Å; E357-R431 IonicContact OE1-NH2 3.32Å; R431-N433 PolarHBondContact O-N 2.95Å
432	W	94.7	Very high	91.9	Very high	33 Å²	33	78.2 Å²	78.2	13%	0.125	42%	0.424	C	S	.	.			trans	-74.9	120.4	172.7	178.1	64.6	0	0	0	110.1	Q258 Y259 E262 P359 L430 P434	Q258-W432 HydrophobicContact CB-CH2 4.09Å; Q258-W432 HydrophobicContact CB-CZ3 4.32Å; Y259-W432 HydrophobicContact CD2-CB 4.48Å; Y259-W432 AromaticContact CD2-CD2 3.86Å; Y259-W432 HydrophobicContact CD2-CD2 3.86Å; Y259-W432 AromaticContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CE3 3.24Å; Y259-W432 HydrophobicContact CD2-CG 4.43Å; Y259-W432 AromaticContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CD2-CZ3 3.62Å; Y259-W432 HydrophobicContact CE2-CB 3.98Å; Y259-W432 HydrophobicContact CE2-CD2 4.09Å; Y259-W432 AromaticContact CE2-CE3 3.9Å; Y259-W432 HydrophobicContact CE2-CE3 3.9Å; Y259-W432 HydrophobicContact CE2-CG 4.19Å; Y259-W432 HydrophobicContact CG-CE3 4.07Å; Y259-W432 AromaticContact CG-CZ3 3.98Å; Y259-W432 HydrophobicContact CG-CZ3 3.98Å; E262-W432 HydrophobicContact CB-CH2 4.29Å; E262-W432 HydrophobicContact CB-CZ2 4.07Å; E262-W432 HydrophobicContact CG-CZ2 4.13Å; P359-W432 VanDerWaalsContact CD-CD1 3.5Å; P359-W432 HydrophobicContact CG-CD2 4.08Å; P359-W432 HydrophobicContact CG-CG 4.4Å; P359-W432 HydrophobicContact CG-CZ2 4.03Å; L430-W432 VanDerWaalsContact C-N 3.29Å; W432-P434 HydrophobicContact CE3-CB 4.49Å; W432-P434 HydrophobicContact CH2-CB 3.68Å; W432-P434 HydrophobicContact CZ2-CB 3.83Å; W432-P434 HydrophobicContact CZ3-CB 4Å; W432-P434 HydrophobicContact CZ3-CG 4.41Å
433	N	86.4	Confident	91.6	Very high	145 Å²	145	80.3 Å²	80.3	78%	0.775	44%	0.436	S	S	*	.			trans	-105.6	115.6	169.9	-170.6	40.6	0	0	0	108.1	R431	R431-N433 PolarHBondContact O-N 2.95Å
434	P	72.2	Confident	91.2	Very high	126 Å²	126	81.6 Å²	81.6	82%	0.818	44%	0.443	S	S	*	.			trans	-62.5	0	-176.3	24.3	-33.4	0	0	0	114.6	W432	W432-P434 HydrophobicContact CE3-CB 4.49Å; W432-P434 HydrophobicContact CH2-CB 3.68Å; W432-P434 HydrophobicContact CZ2-CB 3.83Å; W432-P434 HydrophobicContact CZ3-CB 4Å; W432-P434 HydrophobicContact CZ3-CG 4.41Å

Retrieved 434 of 434 residues in 449.5 ms (Link to these results)

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