G4LUA4_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession G4LUA4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 485 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	43.8	Very low	54.1	Low	239 Å²	239	126.8 Å²	126.8	100%	1.177	71%	0.714	S	S	*	*				0	106.2	0	-72.3	168.9	81.2	0	0	106.4	E3	M1-E3 PolarHBondContact O-N 3.07Å
2	V	44	Very low	55.8	Low	143 Å²	143	122.6 Å²	122.6	87%	0.867	69%	0.688	S	S	*	*			trans	-81.7	109.2	173.6	178.4	0	0	0	0	105.1
3	E	42.8	Very low	57.6	Low	171 Å²	171	120.9 Å²	120.9	80%	0.799	68%	0.677	S	S	*	*			trans	-57.4	125.9	170.5	-81.3	-175.3	151.5	0	0	108.1	M1 S5	M1-E3 PolarHBondContact O-N 3.07Å; E3-S5 PolarHBondContact O-N 3.45Å; E3-S5 VanDerWaalsContact O-N 3.07Å
4	P	47.6	Very low	59.5	Low	108 Å²	108	116.9 Å²	116.9	70%	0.701	65%	0.653	S	S	*	*			trans	-66.2	115.1	169.7	28	-28.5	0	0	0	105.8	T6	P4-T6 PolarHBondContact O-N 2.79Å
5	S	49.7	Very low	61.2	Low	113 Å²	113	113.5 Å²	113.5	79%	0.79	64%	0.638	S	S	*	*			trans	-58.4	93.5	168.8	56.5	0	0	0	0	107.6	E3 A7	E3-S5 PolarHBondContact O-N 3.45Å; E3-S5 VanDerWaalsContact O-N 3.07Å; S5-A7 PolarHBondContact O-N 2.74Å
6	T	48.4	Very low	62.6	Low	100 Å²	100	111.6 Å²	111.6	61%	0.613	63%	0.631	S	S	*	*			trans	-67.7	78	164.4	35.4	0	0	0	0	106.1	P4 Y8	P4-T6 PolarHBondContact O-N 2.79Å; T6-Y8 VanDerWaalsContact O-CD2 3.22Å; T6-Y8 WeakPolarHBondContact O-CD2 3.22Å; T6-Y8 PolarHBondContact O-N 2.77Å
7	A	53.6	Low	64.1	Low	79 Å²	79	112.8 Å²	112.8	65%	0.653	63%	0.631	S	S	*	*			trans	-62.7	89.7	163	0	0	0	0	0	105.7	S5 I9	S5-A7 PolarHBondContact O-N 2.74Å; A7-I9 PolarHBondContact O-N 3.42Å
8	Y	55.7	Low	65.5	Low	189 Å²	189	110.9 Å²	110.9	74%	0.741	62%	0.618	S	S	*	*			trans	-51.1	116.6	175.9	-74.5	-86.9	0	0	0	107.1	T6 T10	T6-Y8 VanDerWaalsContact O-CD2 3.22Å; T6-Y8 WeakPolarHBondContact O-CD2 3.22Å; T6-Y8 PolarHBondContact O-N 2.77Å; Y8-T10 PolarHBondContact O-N 2.85Å
9	I	62.6	Low	66.8	Low	140 Å²	140	105.4 Å²	105.4	72%	0.718	59%	0.587	S	S	*	*			trans	-65.9	94.2	174	-60.7	175.3	0	0	0	105.3	A7 N13	A7-I9 PolarHBondContact O-N 3.42Å; I9-N13 HydrophobicContact CG2-CB 3.97Å
10	T	72.1	Confident	68	Low	68 Å²	68	102.9 Å²	102.9	42%	0.417	57%	0.572	S	S	.	*			trans	-72.7	158	174	61.2	0	0	0	0	108.6	Y8 N12 N13	Y8-T10 PolarHBondContact O-N 2.85Å; T10-N12 PolarHBondContact O-N 3.41Å; T10-N13 WeakPolarHBondContact O-CB 3.46Å; T10-N13 PolarHBondContact O-N 2.84Å
11	A	74.9	Confident	69.1	Low	45 Å²	45	106 Å²	106	37%	0.372	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-54.3	-22.1	175.8	0	0	0	0	0	113	N13 L14 L19 W41	A11-N13 PolarHBondContact O-N 2.8Å; A11-L14 HydrophobicContact CB-CD1 4.31Å; A11-L14 WeakPolarHBondContact O-CB 3.39Å; A11-L14 PolarHBondContact O-N 3.05Å; A11-L19 VanDerWaalsContact O-CD1 3.3Å; A11-L19 WeakPolarHBondContact O-CD1 3.45Å; A11-W41 HydrophobicContact CB-CZ2 3.92Å
12	N	74.7	Confident	71.4	Confident	76 Å²	76	98.1 Å²	98.1	41%	0.406	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-66.3	-19.1	174	-65.3	-28	0	0	0	114.1	T10 W41	T10-N12 PolarHBondContact O-N 3.41Å; N12-W41 VanDerWaalsContact OD1-CD1 3.26Å; N12-W41 PolarHBondContact OD1-NE1 3.4Å
13	N	79.4	Confident	73.8	Confident	101 Å²	101	91.5 Å²	91.5	54%	0.54	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-91.6	-1	-179.9	-62.2	-5.2	0	0	0	112.3	I9 T10 A11	I9-N13 HydrophobicContact CG2-CB 3.97Å; T10-N13 WeakPolarHBondContact O-CB 3.46Å; T10-N13 PolarHBondContact O-N 2.84Å; A11-N13 PolarHBondContact O-N 2.8Å
14	L	83.1	Confident	76	Confident	65 Å²	65	85.9 Å²	85.9	34%	0.34	48%	0.475	S	S	.	.	S	Bend	trans	-71.2	143.1	176.5	-70.7	166.9	0	0	0	110.5	A11 I18 L19	A11-L14 HydrophobicContact CB-CD1 4.31Å; A11-L14 WeakPolarHBondContact O-CB 3.39Å; A11-L14 PolarHBondContact O-N 3.05Å; L14-I18 HydrophobicContact CD2-CG2 4.11Å; L14-L19 HydrophobicContact CB-CD1 4.16Å; L14-L19 HydrophobicContact CD1-CD1 4.09Å
15	P	85.6	Confident	78.2	Confident	66 Å²	66	89.3 Å²	89.3	43%	0.429	48%	0.475	S	S	.	.			trans	-55.4	143.4	170.2	-23.2	32.6	0	0	0	111.2	E17 I18 L19	P15-E17 WeakPolarHBondContact CB-OE2 3.44Å; P15-E17 PolarHBondContact O-N 3.21Å; P15-E17 VanDerWaalsContact O-N 3.07Å; P15-I18 HydrophobicContact CB-CG1 4.26Å; P15-I18 HydrophobicContact CG-CG1 4.25Å; P15-I18 PolarHBondContact O-N 3.31Å; P15-L19 PolarHBondContact O-N 2.85Å
16	P	83.8	Confident	80.1	Confident	83 Å²	83	86 Å²	86	54%	0.539	45%	0.449	S	S	.	.	H	α-helix	trans	-52.2	-34.2	-178.5	-27	34.5	0	0	0	113.7	L19 L20	P16-L19 PolarHBondContact O-N 3Å; P16-L20 VanDerWaalsContact O-CB 3.25Å; P16-L20 WeakPolarHBondContact O-CB 3.26Å; P16-L20 PolarHBondContact O-N 3.27Å
17	E	87.1	Confident	82	Confident	132 Å²	132	85.3 Å²	85.3	62%	0.617	44%	0.441	S	S	*	.	H	α-helix	trans	-67.9	-38.1	180	-55.1	76.1	-165.7	0	0	112.1	P15 R21	P15-E17 WeakPolarHBondContact CB-OE2 3.44Å; P15-E17 PolarHBondContact O-N 3.21Å; P15-E17 VanDerWaalsContact O-N 3.07Å; E17-R21 WeakPolarHBondContact O-CB 3.47Å; E17-R21 PolarHBondContact O-N 3.41Å
18	I	89.7	Confident	83.8	Confident	79 Å²	79	82.3 Å²	82.3	41%	0.405	42%	0.415	S	S	.	.	H	α-helix	trans	-72.6	-43.1	177	-57.1	-59.7	0	0	0	109.6	L14 P15 L20 R21 V22	L14-I18 HydrophobicContact CD2-CG2 4.11Å; P15-I18 HydrophobicContact CB-CG1 4.26Å; P15-I18 HydrophobicContact CG-CG1 4.25Å; P15-I18 PolarHBondContact O-N 3.31Å; I18-L20 VanDerWaalsContact C-N 3.31Å; I18-L20 PolarHBondContact O-N 3.35Å; I18-R21 WeakPolarHBondContact O-CB 3.41Å; I18-R21 PolarHBondContact O-N 3.05Å; I18-R21 VanDerWaalsContact O-N 3.15Å; I18-V22 WeakPolarHBondContact O-CG2 3.36Å; I18-V22 PolarHBondContact O-N 2.84Å
19	L	89.7	Confident	85.4	Confident	6 Å²	6	76.2 Å²	76.2	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-60.4	-43.4	176.2	-152.8	89.6	0	0	0	110.9	A11 L14 P15 P16 R21 V22 F23 T44	A11-L19 VanDerWaalsContact O-CD1 3.3Å; A11-L19 WeakPolarHBondContact O-CD1 3.45Å; L14-L19 HydrophobicContact CB-CD1 4.16Å; L14-L19 HydrophobicContact CD1-CD1 4.09Å; P15-L19 PolarHBondContact O-N 2.85Å; P16-L19 PolarHBondContact O-N 3Å; L19-R21 VanDerWaalsContact C-N 3.3Å; L19-R21 PolarHBondContact O-N 3.4Å; L19-V22 PolarHBondContact O-N 3.24Å; L19-F23 HydrophobicContact CD2-CE1 4.14Å; L19-F23 HydrophobicContact CD2-CE2 4.23Å; L19-F23 HydrophobicContact CD2-CZ 3.84Å; L19-F23 HydrophobicContact CG-CD1 4.34Å; L19-F23 HydrophobicContact CG-CE1 3.95Å; L19-F23 HydrophobicContact CG-CZ 4.18Å; L19-F23 WeakPolarHBondContact O-CB 3.25Å; L19-F23 WeakPolarHBondContact O-CD1 3.49Å; L19-F23 WeakPolarHBondContact O-CG 3.38Å; L19-F23 PolarHBondContact O-N 3.48Å; L19-T44 HydrophobicContact CB-CG2 4.1Å; L19-T44 HydrophobicContact CD2-CG2 3.88Å; L19-T44 WeakPolarHBondContact CD2-OG1 3.33Å; L19-T44 HydrophobicContact CG-CG2 4.26Å
20	L	91	Very high	86.7	Confident	54 Å²	54	73.1 Å²	73.1	28%	0.283	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-40	176	-170.3	70.7	0	0	0	111.7	P16 I18 F23 N24 T44 D47 L50	P16-L20 VanDerWaalsContact O-CB 3.25Å; P16-L20 WeakPolarHBondContact O-CB 3.26Å; P16-L20 PolarHBondContact O-N 3.27Å; I18-L20 VanDerWaalsContact C-N 3.31Å; I18-L20 PolarHBondContact O-N 3.35Å; L20-F23 PolarHBondContact O-N 3.38Å; L20-N24 WeakPolarHBondContact O-CB 3.3Å; L20-N24 PolarHBondContact O-N 3.41Å; L20-T44 HydrophobicContact CB-CG2 3.97Å; L20-T44 HydrophobicContact CD1-CG2 3.9Å; L20-D47 HydrophobicContact CD1-CB 3.46Å; L20-D47 VanDerWaalsContact CD1-CB 3.46Å; L20-L50 HydrophobicContact CD1-CB 4.01Å; L20-L50 HydrophobicContact CD1-CD2 4.18Å
21	R	91.4	Very high	87.7	Confident	169 Å²	169	69.9 Å²	69.9	64%	0.638	36%	0.36	S	S	*	.	H	α-helix	trans	-65.4	-40.9	176.6	-169.6	171.6	-177	163.8	-0.4	111.9	E17 I18 L19 N24 Y25	E17-R21 WeakPolarHBondContact O-CB 3.47Å; E17-R21 PolarHBondContact O-N 3.41Å; I18-R21 WeakPolarHBondContact O-CB 3.41Å; I18-R21 PolarHBondContact O-N 3.05Å; I18-R21 VanDerWaalsContact O-N 3.15Å; L19-R21 VanDerWaalsContact C-N 3.3Å; L19-R21 PolarHBondContact O-N 3.4Å; R21-N24 WeakPolarHBondContact O-CB 3.44Å; R21-N24 PolarHBondContact O-N 3.44Å; R21-Y25 HydrophobicContact CG-CE2 4.48Å; R21-Y25 WeakPolarHBondContact O-CD2 3.25Å; R21-Y25 WeakPolarHBondContact O-CE2 3.32Å
22	V	92.2	Very high	88.5	Confident	74 Å²	74	69.5 Å²	69.5	45%	0.448	35%	0.351	S	S	.	.	H	α-helix	trans	-62.6	-48.3	173.4	174.1	0	0	0	0	110.2	I18 L19 N24 Y25	I18-V22 WeakPolarHBondContact O-CG2 3.36Å; I18-V22 PolarHBondContact O-N 2.84Å; L19-V22 PolarHBondContact O-N 3.24Å; V22-N24 PolarHBondContact O-N 3Å; V22-Y25 WeakPolarHBondContact O-CB 3.47Å; V22-Y25 PolarHBondContact O-N 3.35Å
23	F	93.6	Very high	89.4	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-26.1	-178.4	-80.5	24.9	0	0	0	112.8	L19 L20 Y25 L26 L31 C34 W41 T44 A45 L50	L19-F23 HydrophobicContact CD2-CE1 4.14Å; L19-F23 HydrophobicContact CD2-CE2 4.23Å; L19-F23 HydrophobicContact CD2-CZ 3.84Å; L19-F23 HydrophobicContact CG-CD1 4.34Å; L19-F23 HydrophobicContact CG-CE1 3.95Å; L19-F23 HydrophobicContact CG-CZ 4.18Å; L19-F23 WeakPolarHBondContact O-CB 3.25Å; L19-F23 WeakPolarHBondContact O-CD1 3.49Å; L19-F23 WeakPolarHBondContact O-CG 3.38Å; L19-F23 PolarHBondContact O-N 3.48Å; L20-F23 PolarHBondContact O-N 3.38Å; F23-Y25 PolarHBondContact O-N 2.74Å; F23-L26 HydrophobicContact CB-CD1 4.49Å; F23-L26 HydrophobicContact CD1-CD1 3.9Å; F23-L26 HydrophobicContact CE1-CD1 4.36Å; F23-L26 HydrophobicContact CG-CD1 4.19Å; F23-L26 PolarHBondContact O-N 3.36Å; F23-L26 VanDerWaalsContact O-N 3.15Å; F23-L31 HydrophobicContact CB-CD1 3.88Å; F23-L31 HydrophobicContact CD2-CD1 4.15Å; F23-L31 HydrophobicContact CG-CD1 4.24Å; F23-L31 WeakPolarHBondContact O-CD1 3.3Å; F23-C34 HydrophobicContact CE2-CB 4.05Å; F23-C34 HydrophobicContact CZ-CB 4.08Å; F23-W41 HydrophobicContact CE1-CD2 4.35Å; F23-W41 HydrophobicContact CE1-CE3 4.22Å; F23-W41 HydrophobicContact CE1-CZ3 4.45Å; F23-W41 HydrophobicContact CE2-CB 4.44Å; F23-W41 HydrophobicContact CZ-CB 4.12Å; F23-W41 AromaticContact CZ-CD2 3.72Å; F23-W41 HydrophobicContact CZ-CD2 3.72Å; F23-W41 AromaticContact CZ-CE3 3.68Å; F23-W41 HydrophobicContact CZ-CE3 3.68Å; F23-W41 AromaticContact CZ-CG 3.92Å; F23-W41 HydrophobicContact CZ-CG 3.92Å; F23-W41 HydrophobicContact CZ-CZ3 4.33Å; F23-T44 HydrophobicContact CD2-CG2 3.75Å; F23-T44 HydrophobicContact CE2-CG2 4.11Å; F23-T44 HydrophobicContact CG-CG2 4.24Å; F23-A45 HydrophobicContact CD2-CB 3.98Å; F23-A45 HydrophobicContact CE2-CB 3.74Å; F23-L50 HydrophobicContact CB-CD2 4.01Å
24	N	91	Very high	90	Very high	53 Å²	53	66.4 Å²	66.4	28%	0.283	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.9	173.4	-167.8	58.2	0	0	0	113.8	L20 R21 V22 L50 K54	L20-N24 WeakPolarHBondContact O-CB 3.3Å; L20-N24 PolarHBondContact O-N 3.41Å; R21-N24 WeakPolarHBondContact O-CB 3.44Å; R21-N24 PolarHBondContact O-N 3.44Å; V22-N24 PolarHBondContact O-N 3Å; N24-L50 HydrophobicContact CB-CD1 3.95Å; N24-K54 PolarHBondContact O-NZ 3Å
25	Y	91.9	Very high	90.5	Very high	179 Å²	179	64 Å²	64	70%	0.702	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-17.9	175	-67.7	-80.6	0	0	0	114	R21 V22 F23	R21-Y25 HydrophobicContact CG-CE2 4.48Å; R21-Y25 WeakPolarHBondContact O-CD2 3.25Å; R21-Y25 WeakPolarHBondContact O-CE2 3.32Å; V22-Y25 WeakPolarHBondContact O-CB 3.47Å; V22-Y25 PolarHBondContact O-N 3.35Å; F23-Y25 PolarHBondContact O-N 2.74Å
26	L	91	Very high	90.8	Very high	44 Å²	44	66.9 Å²	66.9	23%	0.23	34%	0.335	C	S	.	.	S	Bend	trans	-69.8	145.7	179.5	-61	178.5	0	0	0	111	F23 D30 L31 C34 K54	F23-L26 HydrophobicContact CB-CD1 4.49Å; F23-L26 HydrophobicContact CD1-CD1 3.9Å; F23-L26 HydrophobicContact CE1-CD1 4.36Å; F23-L26 HydrophobicContact CG-CD1 4.19Å; F23-L26 PolarHBondContact O-N 3.36Å; F23-L26 VanDerWaalsContact O-N 3.15Å; L26-D30 HydrophobicContact CB-CB 4.05Å; L26-D30 HydrophobicContact CD2-CB 4.33Å; L26-L31 HydrophobicContact CB-CD1 4.18Å; L26-L31 HydrophobicContact CD1-CD1 4.25Å; L26-C34 VanDerWaalsContact CD1-SG 3.57Å; L26-K54 WeakPolarHBondContact O-CE 3.22Å; L26-K54 PolarHBondContact O-NZ 3.08Å
27	D	88.4	Confident	91.2	Very high	85 Å²	85	67 Å²	67	46%	0.455	33%	0.334	S	S	.	.			trans	-70.3	175.2	168.9	74.3	31	0	0	0	110.9	D29 D30 L31	D27-D29 VanDerWaalsContact C-N 3.32Å; D27-D29 PolarHBondContact O-N 3.28Å; D27-D29 WeakPolarHBondContact OD1-CA 3.5Å; D27-D29 PolarHBondContact OD1-N 3.46Å; D27-D30 WeakPolarHBondContact OD1-CB 3.25Å; D27-D30 PolarHBondContact OD1-N 3.3Å; D27-L31 VanDerWaalsContact O-CB 3.28Å; D27-L31 WeakPolarHBondContact O-CB 3.31Å; D27-L31 PolarHBondContact O-N 2.86Å
28	T	90.1	Very high	91.3	Very high	17 Å²	17	62.6 Å²	62.6	10%	0.104	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-29	-177.8	36.8	0	0	0	0	114.5	I32 W51 I58 Y90	T28-I32 WeakPolarHBondContact O-CD1 3.09Å; T28-I32 VanDerWaalsContact O-CG1 3.22Å; T28-I32 WeakPolarHBondContact O-CG1 3.31Å; T28-I32 PolarHBondContact O-N 3.45Å; T28-W51 HydrophobicContact CG2-CH2 4.17Å; T28-W51 HydrophobicContact CG2-CZ3 3.83Å; T28-I58 HydrophobicContact CG2-CD1 3.39Å; T28-Y90 WeakPolarHBondContact CB-OH 3.18Å; T28-Y90 HydrophobicContact CG2-CD2 4.35Å; T28-Y90 HydrophobicContact CG2-CE1 4.45Å; T28-Y90 HydrophobicContact CG2-CE2 3.83Å; T28-Y90 PolarHBondContact OG1-OH 2.83Å
29	D	89.1	Confident	91.4	Very high	61 Å²	61	63 Å²	63	33%	0.326	33%	0.327	S	S	.	.	H	α-helix	trans	-78.4	-41.4	-178	-71.4	-45.4	0	0	0	110	D27 L31 I32 N33 K94	D27-D29 VanDerWaalsContact C-N 3.32Å; D27-D29 PolarHBondContact O-N 3.28Å; D27-D29 WeakPolarHBondContact OD1-CA 3.5Å; D27-D29 PolarHBondContact OD1-N 3.46Å; D29-L31 VanDerWaalsContact C-N 3.33Å; D29-L31 PolarHBondContact O-N 3.17Å; D29-I32 PolarHBondContact O-N 3.24Å; D29-N33 VanDerWaalsContact O-CG 3.23Å; D29-N33 PolarHBondContact O-N 3.32Å; D29-N33 PolarHBondContact O-ND2 3.46Å; D29-N33 VanDerWaalsContact O-ND2 3.17Å; D29-K94 IonicContact OD1-NZ 2.67Å; D29-K94 PolarHBondContact OD1-NZ 3.19Å; D29-K94 IonicContact OD2-NZ 3.63Å
30	D	91.6	Very high	91.4	Very high	74 Å²	74	65.4 Å²	65.4	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-42.4	169.1	-76	-17.5	0	0	0	111.9	L26 D27 I32 N33 C34	L26-D30 HydrophobicContact CB-CB 4.05Å; L26-D30 HydrophobicContact CD2-CB 4.33Å; D27-D30 WeakPolarHBondContact OD1-CB 3.25Å; D27-D30 PolarHBondContact OD1-N 3.3Å; D30-I32 VanDerWaalsContact C-N 3.28Å; D30-I32 PolarHBondContact O-N 2.96Å; D30-N33 WeakPolarHBondContact O-CB 3.47Å; D30-N33 PolarHBondContact O-N 3.11Å; D30-N33 VanDerWaalsContact O-N 3.17Å; D30-C34 PolarHBondContact O-N 3.37Å; D30-C34 PolarHBondContact O-SG 3.07Å
31	L	92.1	Very high	91.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-38.1	176.9	-154.5	82.2	0	0	0	111.7	F23 L26 D27 D29 C34 I35 A45 L50 W51	F23-L31 HydrophobicContact CB-CD1 3.88Å; F23-L31 HydrophobicContact CD2-CD1 4.15Å; F23-L31 HydrophobicContact CG-CD1 4.24Å; F23-L31 WeakPolarHBondContact O-CD1 3.3Å; L26-L31 HydrophobicContact CB-CD1 4.18Å; L26-L31 HydrophobicContact CD1-CD1 4.25Å; D27-L31 VanDerWaalsContact O-CB 3.28Å; D27-L31 WeakPolarHBondContact O-CB 3.31Å; D27-L31 PolarHBondContact O-N 2.86Å; D29-L31 VanDerWaalsContact C-N 3.33Å; D29-L31 PolarHBondContact O-N 3.17Å; L31-C34 WeakPolarHBondContact O-CB 3.37Å; L31-C34 PolarHBondContact O-N 3.36Å; L31-I35 PolarHBondContact O-N 3.33Å; L31-A45 HydrophobicContact CG-CB 4.42Å; L31-L50 HydrophobicContact CD1-CD2 3.73Å; L31-L50 HydrophobicContact CD2-CD2 3.74Å; L31-L50 HydrophobicContact CD2-CG 4.13Å; L31-L50 HydrophobicContact CG-CD2 4.29Å; L31-W51 HydrophobicContact CD2-CD2 4.18Å; L31-W51 HydrophobicContact CD2-CH2 4.3Å; L31-W51 HydrophobicContact CD2-CZ2 3.62Å; L31-W51 HydrophobicContact CG-CZ2 4.43Å
32	I	92	Very high	91.6	Very high	37 Å²	37	63.7 Å²	63.7	19%	0.19	33%	0.332	C	S	.	.	H	α-helix	trans	-65.6	-42.6	174.5	-73.9	166	0	0	0	110.5	T28 D29 D30 C34 I35 W51 Y90	T28-I32 WeakPolarHBondContact O-CD1 3.09Å; T28-I32 VanDerWaalsContact O-CG1 3.22Å; T28-I32 WeakPolarHBondContact O-CG1 3.31Å; T28-I32 PolarHBondContact O-N 3.45Å; D29-I32 PolarHBondContact O-N 3.24Å; D30-I32 VanDerWaalsContact C-N 3.28Å; D30-I32 PolarHBondContact O-N 2.96Å; I32-C34 VanDerWaalsContact C-N 3.26Å; I32-C34 PolarHBondContact O-N 3.05Å; I32-I35 VanDerWaalsContact O-CB 3.25Å; I32-I35 WeakPolarHBondContact O-CB 3.48Å; I32-I35 PolarHBondContact O-N 2.98Å; I32-I35 VanDerWaalsContact O-N 3.13Å; I32-W51 HydrophobicContact CD1-CH2 4.28Å; I32-W51 HydrophobicContact CG1-CH2 3.98Å; I32-W51 HydrophobicContact CG1-CZ2 4.14Å; I32-Y90 HydrophobicContact CD1-CD1 4.47Å; I32-Y90 HydrophobicContact CD1-CE1 3.81Å
33	N	93.4	Very high	91.6	Very high	101 Å²	101	67.3 Å²	67.3	54%	0.54	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-36	177	-65.3	-32.7	0	0	0	111.6	D29 D30 I35 D36	D29-N33 VanDerWaalsContact O-CG 3.23Å; D29-N33 PolarHBondContact O-N 3.32Å; D29-N33 PolarHBondContact O-ND2 3.46Å; D29-N33 VanDerWaalsContact O-ND2 3.17Å; D30-N33 WeakPolarHBondContact O-CB 3.47Å; D30-N33 PolarHBondContact O-N 3.11Å; D30-N33 VanDerWaalsContact O-N 3.17Å; N33-I35 PolarHBondContact O-N 3.16Å; N33-D36 PolarHBondContact O-N 2.93Å
34	C	93	Very high	91.5	Very high	12 Å²	12	67.8 Å²	67.8	8%	0.081	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-24.5	176.6	-68.6	0	0	0	0	113.7	F23 L26 D30 L31 I32 D36 V37 W41 A45	F23-C34 HydrophobicContact CE2-CB 4.05Å; F23-C34 HydrophobicContact CZ-CB 4.08Å; L26-C34 VanDerWaalsContact CD1-SG 3.57Å; D30-C34 PolarHBondContact O-N 3.37Å; D30-C34 PolarHBondContact O-SG 3.07Å; L31-C34 WeakPolarHBondContact O-CB 3.37Å; L31-C34 PolarHBondContact O-N 3.36Å; I32-C34 VanDerWaalsContact C-N 3.26Å; I32-C34 PolarHBondContact O-N 3.05Å; C34-D36 PolarHBondContact O-N 3.17Å; C34-V37 PolarHBondContact O-N 3.13Å; C34-W41 HydrophobicContact CB-CE3 3.97Å; C34-W41 WeakPolarHBondContact O-CB 3.46Å; C34-A45 HydrophobicContact CB-CB 4.05Å
35	I	93	Very high	91.6	Very high	14 Å²	14	65.2 Å²	65.2	7%	0.072	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.8	178	-63.4	172.8	0	0	0	111.3	L31 I32 N33 R42 A45 L46	L31-I35 PolarHBondContact O-N 3.33Å; I32-I35 VanDerWaalsContact O-CB 3.25Å; I32-I35 WeakPolarHBondContact O-CB 3.48Å; I32-I35 PolarHBondContact O-N 2.98Å; I32-I35 VanDerWaalsContact O-N 3.13Å; N33-I35 PolarHBondContact O-N 3.16Å; I35-R42 HydrophobicContact CG2-CG 3.93Å; I35-R42 WeakPolarHBondContact O-CB 3.34Å; I35-R42 WeakPolarHBondContact O-CG 3.46Å; I35-A45 HydrophobicContact CG1-CB 3.81Å; I35-L46 HydrophobicContact CD1-CD2 3.63Å; I35-L46 HydrophobicContact CD1-CG 4.18Å; I35-L46 HydrophobicContact CG1-CD2 4.19Å; I35-L46 HydrophobicContact CG1-CG 4.19Å; I35-L46 HydrophobicContact CG2-CD1 4.33Å
36	D	92.5	Very high	91.8	Very high	127 Å²	127	59.1 Å²	59.1	68%	0.679	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	3.2	-171.6	-64.5	-32.7	0	0	0	113.2	N33 C34	N33-D36 PolarHBondContact O-N 2.93Å; C34-D36 PolarHBondContact O-N 3.17Å
37	V	91.4	Very high	91.9	Very high	84 Å²	84	59.2 Å²	59.2	51%	0.509	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-58.9	-177	176.3	0	0	0	0	112.5	C34 W41	C34-V37 PolarHBondContact O-N 3.13Å; V37-W41 HydrophobicContact CB-CB 4.28Å; V37-W41 HydrophobicContact CB-CD2 4.1Å; V37-W41 HydrophobicContact CB-CE3 3.77Å; V37-W41 HydrophobicContact CB-CG 4.35Å; V37-W41 HydrophobicContact CB-CZ3 4.45Å; V37-W41 HydrophobicContact CG1-CD2 3.88Å; V37-W41 HydrophobicContact CG1-CE3 3.82Å; V37-W41 HydrophobicContact CG1-CG 4.29Å; V37-W41 HydrophobicContact CG1-CZ3 4.26Å; V37-W41 HydrophobicContact CG2-CE3 3.76Å; V37-W41 HydrophobicContact CG2-CZ3 4.09Å
38	C	90.4	Very high	92.1	Very high	40 Å²	40	58.9 Å²	58.9	27%	0.27	31%	0.312	S	S	.	.			trans	-158	171.7	177.9	76.9	0	0	0	0	110.7	T40 W41 R42	C38-T40 PolarHBondContact O-N 3.36Å; C38-W41 PolarHBondContact O-N 2.92Å; C38-W41 PolarHBondContact SG-N 3.17Å; C38-W41 VanDerWaalsContact SG-N 3.42Å; C38-R42 VanDerWaalsContact O-CB 3.26Å; C38-R42 WeakPolarHBondContact O-CB 3.26Å; C38-R42 PolarHBondContact O-N 3.37Å
39	S	90.5	Very high	92.1	Very high	88 Å²	88	61.7 Å²	61.7	62%	0.615	33%	0.331	S	S	*	.	H	α-helix	trans	-61.6	-39.5	-177.7	53.6	0	0	0	0	113.7	R42 Q43	S39-R42 WeakPolarHBondContact O-CB 3.35Å; S39-R42 PolarHBondContact O-N 3.4Å; S39-Q43 WeakPolarHBondContact O-CG 3.42Å; S39-Q43 PolarHBondContact O-N 3.16Å
40	T	90.1	Very high	92.2	Very high	56 Å²	56	59 Å²	59	34%	0.344	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-49.3	178.8	-50.8	0	0	0	0	110.5	C38 R42 Q43 T44	C38-T40 PolarHBondContact O-N 3.36Å; T40-R42 VanDerWaalsContact C-N 3.26Å; T40-R42 PolarHBondContact O-N 2.95Å; T40-Q43 PolarHBondContact O-N 2.91Å; T40-T44 PolarHBondContact O-N 2.86Å; T40-T44 VanDerWaalsContact O-N 3.08Å; T40-T44 PolarHBondContact O-OG1 3.24Å
41	W	92.6	Very high	92.2	Very high	54 Å²	54	55.5 Å²	55.5	21%	0.205	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-38.1	176.6	-76.1	41.1	0	0	0	111.2	A11 N12 F23 C34 V37 C38 Q43 T44 A45	A11-W41 HydrophobicContact CB-CZ2 3.92Å; N12-W41 VanDerWaalsContact OD1-CD1 3.26Å; N12-W41 PolarHBondContact OD1-NE1 3.4Å; F23-W41 HydrophobicContact CE1-CD2 4.35Å; F23-W41 HydrophobicContact CE1-CE3 4.22Å; F23-W41 HydrophobicContact CE1-CZ3 4.45Å; F23-W41 HydrophobicContact CE2-CB 4.44Å; F23-W41 HydrophobicContact CZ-CB 4.12Å; F23-W41 AromaticContact CZ-CD2 3.72Å; F23-W41 HydrophobicContact CZ-CD2 3.72Å; F23-W41 AromaticContact CZ-CE3 3.68Å; F23-W41 HydrophobicContact CZ-CE3 3.68Å; F23-W41 AromaticContact CZ-CG 3.92Å; F23-W41 HydrophobicContact CZ-CG 3.92Å; F23-W41 HydrophobicContact CZ-CZ3 4.33Å; C34-W41 HydrophobicContact CB-CE3 3.97Å; C34-W41 WeakPolarHBondContact O-CB 3.46Å; V37-W41 HydrophobicContact CB-CB 4.28Å; V37-W41 HydrophobicContact CB-CD2 4.1Å; V37-W41 HydrophobicContact CB-CE3 3.77Å; V37-W41 HydrophobicContact CB-CG 4.35Å; V37-W41 HydrophobicContact CB-CZ3 4.45Å; V37-W41 HydrophobicContact CG1-CD2 3.88Å; V37-W41 HydrophobicContact CG1-CE3 3.82Å; V37-W41 HydrophobicContact CG1-CG 4.29Å; V37-W41 HydrophobicContact CG1-CZ3 4.26Å; V37-W41 HydrophobicContact CG2-CE3 3.76Å; V37-W41 HydrophobicContact CG2-CZ3 4.09Å; C38-W41 PolarHBondContact O-N 2.92Å; C38-W41 PolarHBondContact SG-N 3.17Å; C38-W41 VanDerWaalsContact SG-N 3.42Å; W41-Q43 PolarHBondContact O-N 3.4Å; W41-T44 PolarHBondContact O-N 3.29Å; W41-A45 WeakPolarHBondContact O-CA 3.31Å; W41-A45 WeakPolarHBondContact O-CB 3.34Å; W41-A45 PolarHBondContact O-N 3.21Å
42	R	93.5	Very high	92	Very high	133 Å²	133	60.3 Å²	60.3	50%	0.502	32%	0.32	S	S	.	.	H	α-helix	trans	-59	-46.1	175	-171.9	174.3	-147	-179.6	11.2	112.5	I35 C38 S39 T40 L46	I35-R42 HydrophobicContact CG2-CG 3.93Å; I35-R42 WeakPolarHBondContact O-CB 3.34Å; I35-R42 WeakPolarHBondContact O-CG 3.46Å; C38-R42 VanDerWaalsContact O-CB 3.26Å; C38-R42 WeakPolarHBondContact O-CB 3.26Å; C38-R42 PolarHBondContact O-N 3.37Å; S39-R42 WeakPolarHBondContact O-CB 3.35Å; S39-R42 PolarHBondContact O-N 3.4Å; T40-R42 VanDerWaalsContact C-N 3.26Å; T40-R42 PolarHBondContact O-N 2.95Å; R42-L46 HydrophobicContact CG-CD1 3.97Å; R42-L46 VanDerWaalsContact O-CB 3.25Å; R42-L46 WeakPolarHBondContact O-CB 3.49Å; R42-L46 WeakPolarHBondContact O-CG 3.46Å; R42-L46 PolarHBondContact O-N 3.39Å
43	Q	92.2	Very high	91.8	Very high	151 Å²	151	66.2 Å²	66.2	71%	0.706	34%	0.34	S	S	*	.	H	α-helix	trans	-63.8	-45	178.7	-74.9	177.7	-6	0	0	111.4	S39 T40 W41 L46 D47	S39-Q43 WeakPolarHBondContact O-CG 3.42Å; S39-Q43 PolarHBondContact O-N 3.16Å; T40-Q43 PolarHBondContact O-N 2.91Å; W41-Q43 PolarHBondContact O-N 3.4Å; Q43-L46 CarbonylContact O-C 3.58Å; Q43-L46 PolarHBondContact O-N 3.26Å; Q43-D47 PolarHBondContact O-N 3.06Å
44	T	92.4	Very high	91.7	Very high	13 Å²	13	62.7 Å²	62.7	8%	0.08	32%	0.32	C	S	.	.	H	α-helix	trans	-70.9	-41.4	179.1	-50.5	0	0	0	0	112.8	L19 L20 F23 T40 W41 L46 D47	L19-T44 HydrophobicContact CB-CG2 4.1Å; L19-T44 HydrophobicContact CD2-CG2 3.88Å; L19-T44 WeakPolarHBondContact CD2-OG1 3.33Å; L19-T44 HydrophobicContact CG-CG2 4.26Å; L20-T44 HydrophobicContact CB-CG2 3.97Å; L20-T44 HydrophobicContact CD1-CG2 3.9Å; F23-T44 HydrophobicContact CD2-CG2 3.75Å; F23-T44 HydrophobicContact CE2-CG2 4.11Å; F23-T44 HydrophobicContact CG-CG2 4.24Å; T40-T44 PolarHBondContact O-N 2.86Å; T40-T44 VanDerWaalsContact O-N 3.08Å; T40-T44 PolarHBondContact O-OG1 3.24Å; W41-T44 PolarHBondContact O-N 3.29Å; T44-L46 PolarHBondContact O-N 2.69Å; T44-D47 VanDerWaalsContact O-CB 3.26Å; T44-D47 WeakPolarHBondContact O-CB 3.42Å; T44-D47 PolarHBondContact O-N 3.41Å
45	A	93.7	Very high	91.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-28	176.8	0	0	0	0	0	111.8	F23 L31 C34 I35 W41 W51	F23-A45 HydrophobicContact CD2-CB 3.98Å; F23-A45 HydrophobicContact CE2-CB 3.74Å; L31-A45 HydrophobicContact CG-CB 4.42Å; C34-A45 HydrophobicContact CB-CB 4.05Å; I35-A45 HydrophobicContact CG1-CB 3.81Å; W41-A45 WeakPolarHBondContact O-CA 3.31Å; W41-A45 WeakPolarHBondContact O-CB 3.34Å; W41-A45 PolarHBondContact O-N 3.21Å; A45-W51 VanDerWaalsContact O-CD1 3.26Å; A45-W51 PolarHBondContact O-NE1 2.84Å
46	L	94.4	Very high	91	Very high	50 Å²	50	65.2 Å²	65.2	26%	0.262	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	21.1	173.3	-67.6	175.7	0	0	0	112.7	I35 R42 Q43 T44 N48 H85 H87	I35-L46 HydrophobicContact CD1-CD2 3.63Å; I35-L46 HydrophobicContact CD1-CG 4.18Å; I35-L46 HydrophobicContact CG1-CD2 4.19Å; I35-L46 HydrophobicContact CG1-CG 4.19Å; I35-L46 HydrophobicContact CG2-CD1 4.33Å; R42-L46 HydrophobicContact CG-CD1 3.97Å; R42-L46 VanDerWaalsContact O-CB 3.25Å; R42-L46 WeakPolarHBondContact O-CB 3.49Å; R42-L46 WeakPolarHBondContact O-CG 3.46Å; R42-L46 PolarHBondContact O-N 3.39Å; Q43-L46 CarbonylContact O-C 3.58Å; Q43-L46 PolarHBondContact O-N 3.26Å; T44-L46 PolarHBondContact O-N 2.69Å; L46-N48 PolarHBondContact O-N 3.06Å; L46-H85 PolarHBondContact O-CE1 2.87Å; L46-H85 PolarHBondContact O-NE2 3.23Å; L46-H87 HydrophobicContact CD2-CB 4.24Å; L46-H87 WeakPolarHBondContact CD2-ND1 3.29Å
47	D	94.1	Very high	90.6	Very high	47 Å²	47	63.2 Å²	63.2	25%	0.251	32%	0.324	S	S	.	.			trans	-62.4	135.5	173.9	177.1	-102.6	0	0	0	111.4	L20 Q43 T44 C49 L50 W51	L20-D47 HydrophobicContact CD1-CB 3.46Å; L20-D47 VanDerWaalsContact CD1-CB 3.46Å; Q43-D47 PolarHBondContact O-N 3.06Å; T44-D47 VanDerWaalsContact O-CB 3.26Å; T44-D47 WeakPolarHBondContact O-CB 3.42Å; T44-D47 PolarHBondContact O-N 3.41Å; D47-C49 WeakPolarHBondContact OD1-CA 3.26Å; D47-C49 VanDerWaalsContact OD1-CB 3.29Å; D47-C49 WeakPolarHBondContact OD1-CB 3.42Å; D47-C49 PolarHBondContact OD1-N 3.29Å; D47-L50 HydrophobicContact CB-CB 3.94Å; D47-L50 PolarHBondContact OD1-N 3.39Å; D47-W51 PolarHBondContact O-N 2.85Å; D47-W51 VanDerWaalsContact O-N 3.12Å
48	N	92	Very high	90.5	Very high	78 Å²	78	59.4 Å²	59.4	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-64.6	-45.3	-177.6	-88.8	-38.9	0	0	0	111.5	L46 W51 Q52 H85 P86	L46-N48 PolarHBondContact O-N 3.06Å; N48-W51 PolarHBondContact O-N 3.05Å; N48-Q52 WeakPolarHBondContact O-CB 3.43Å; N48-Q52 VanDerWaalsContact O-CG 3.26Å; N48-Q52 WeakPolarHBondContact O-CG 3.29Å; N48-Q52 PolarHBondContact O-N 2.69Å; N48-H85 PolarHBondContact OD1-CD2 3.44Å; N48-H85 PolarHBondContact OD1-NE2 3.46Å; N48-P86 VanDerWaalsContact OD1-CD 3.29Å; N48-P86 WeakPolarHBondContact OD1-CD 3.4Å
49	C	90.4	Very high	90.3	Very high	76 Å²	76	57.6 Å²	57.6	51%	0.514	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-39.4	-176.4	-66.5	0	0	0	0	111.2	D47 Q52 R53	D47-C49 WeakPolarHBondContact OD1-CA 3.26Å; D47-C49 VanDerWaalsContact OD1-CB 3.29Å; D47-C49 WeakPolarHBondContact OD1-CB 3.42Å; D47-C49 PolarHBondContact OD1-N 3.29Å; C49-Q52 PolarHBondContact O-N 3.15Å; C49-R53 WeakPolarHBondContact O-CG 3.47Å; C49-R53 PolarHBondContact O-N 3.43Å
50	L	91.2	Very high	89.9	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-57.5	-54.6	173	178.3	64.6	0	0	0	111.2	L20 F23 N24 L31 D47 Q52 R53 K54	L20-L50 HydrophobicContact CD1-CB 4.01Å; L20-L50 HydrophobicContact CD1-CD2 4.18Å; F23-L50 HydrophobicContact CB-CD2 4.01Å; N24-L50 HydrophobicContact CB-CD1 3.95Å; L31-L50 HydrophobicContact CD1-CD2 3.73Å; L31-L50 HydrophobicContact CD2-CD2 3.74Å; L31-L50 HydrophobicContact CD2-CG 4.13Å; L31-L50 HydrophobicContact CG-CD2 4.29Å; D47-L50 HydrophobicContact CB-CB 3.94Å; D47-L50 PolarHBondContact OD1-N 3.39Å; L50-Q52 PolarHBondContact O-N 3.06Å; L50-R53 PolarHBondContact O-N 3.43Å; L50-K54 WeakPolarHBondContact O-CG 3.44Å; L50-K54 PolarHBondContact O-N 3.14Å
51	W	92.2	Very high	89.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.3	-33.3	-179.8	-85.1	100.7	0	0	0	113.3	T28 L31 I32 A45 D47 N48 K54 L55 H85 P86 H87 Y90	T28-W51 HydrophobicContact CG2-CH2 4.17Å; T28-W51 HydrophobicContact CG2-CZ3 3.83Å; L31-W51 HydrophobicContact CD2-CD2 4.18Å; L31-W51 HydrophobicContact CD2-CH2 4.3Å; L31-W51 HydrophobicContact CD2-CZ2 3.62Å; L31-W51 HydrophobicContact CG-CZ2 4.43Å; I32-W51 HydrophobicContact CD1-CH2 4.28Å; I32-W51 HydrophobicContact CG1-CH2 3.98Å; I32-W51 HydrophobicContact CG1-CZ2 4.14Å; A45-W51 VanDerWaalsContact O-CD1 3.26Å; A45-W51 PolarHBondContact O-NE1 2.84Å; D47-W51 PolarHBondContact O-N 2.85Å; D47-W51 VanDerWaalsContact O-N 3.12Å; N48-W51 PolarHBondContact O-N 3.05Å; W51-K54 PolarHBondContact O-N 2.97Å; W51-L55 WeakPolarHBondContact O-CB 3.47Å; W51-L55 PolarHBondContact O-N 2.87Å; W51-H85 AromaticContact CD1-CE1 3.94Å; W51-P86 HydrophobicContact CB-CB 3.87Å; W51-P86 HydrophobicContact CB-CG 4.08Å; W51-H87 HydrophobicContact CD2-CB 3.59Å; W51-H87 AromaticContact CE2-CD2 3.73Å; W51-H87 AromaticContact CE2-CG 3.81Å; W51-H87 HydrophobicContact CE3-CB 4.17Å; W51-H87 HydrophobicContact CG-CB 3.79Å; W51-H87 AromaticContact CH2-CD2 3.56Å; W51-H87 HydrophobicContact CZ2-CB 4.11Å; W51-H87 AromaticContact CZ2-CD2 3.31Å; W51-H87 WeakPolarHBondContact CZ2-CD2 3.49Å; W51-H87 AromaticContact CZ2-CG 3.87Å; W51-Y90 HydrophobicContact CE3-CG 4.35Å; W51-Y90 AromaticContact CH2-CD1 3.86Å; W51-Y90 HydrophobicContact CH2-CD1 3.86Å; W51-Y90 HydrophobicContact CH2-CE1 4.22Å; W51-Y90 HydrophobicContact CH2-CG 4.38Å; W51-Y90 AromaticContact CZ3-CD1 3.53Å; W51-Y90 HydrophobicContact CZ3-CD1 3.53Å; W51-Y90 HydrophobicContact CZ3-CD2 4.24Å; W51-Y90 HydrophobicContact CZ3-CE1 4.16Å; W51-Y90 AromaticContact CZ3-CG 3.58Å; W51-Y90 HydrophobicContact CZ3-CG 3.58Å
52	Q	88.3	Confident	89.1	Confident	101 Å²	101	59.3 Å²	59.3	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-59.8	-48.5	172.1	-78	176.3	-3.2	0	0	110.8	N48 C49 L50 L55 V56 P86	N48-Q52 WeakPolarHBondContact O-CB 3.43Å; N48-Q52 VanDerWaalsContact O-CG 3.26Å; N48-Q52 WeakPolarHBondContact O-CG 3.29Å; N48-Q52 PolarHBondContact O-N 2.69Å; C49-Q52 PolarHBondContact O-N 3.15Å; L50-Q52 PolarHBondContact O-N 3.06Å; Q52-L55 PolarHBondContact O-N 2.78Å; Q52-V56 WeakPolarHBondContact O-CB 3.31Å; Q52-V56 VanDerWaalsContact O-CG2 3.28Å; Q52-V56 WeakPolarHBondContact O-CG2 3.33Å; Q52-V56 PolarHBondContact O-N 3.45Å; Q52-P86 HydrophobicContact CB-CG 4.41Å; Q52-P86 HydrophobicContact CG-CB 4.22Å; Q52-P86 HydrophobicContact CG-CG 3.47Å; Q52-P86 VanDerWaalsContact CG-CG 3.47Å
53	R	87.6	Confident	88.9	Confident	162 Å²	162	53.1 Å²	53.1	61%	0.611	26%	0.264	S	S	*	.	H	α-helix	trans	-60.7	-47.6	177.1	-77.8	178.4	166.8	-179.6	-2.3	111.8	C49 L50 L55 V56 I57	C49-R53 WeakPolarHBondContact O-CG 3.47Å; C49-R53 PolarHBondContact O-N 3.43Å; L50-R53 PolarHBondContact O-N 3.43Å; R53-L55 PolarHBondContact O-N 3.47Å; R53-V56 PolarHBondContact O-N 2.91Å; R53-I57 WeakPolarHBondContact O-CG1 3.49Å; R53-I57 PolarHBondContact O-N 3.19Å
54	K	89.9	Confident	88.9	Confident	26 Å²	26	47.4 Å²	47.4	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-48.7	177.1	-68.6	-61.4	-170.9	-174.3	0	111.6	N24 L26 L50 W51 V56 I57 I58	N24-K54 PolarHBondContact O-NZ 3Å; L26-K54 WeakPolarHBondContact O-CE 3.22Å; L26-K54 PolarHBondContact O-NZ 3.08Å; L50-K54 WeakPolarHBondContact O-CG 3.44Å; L50-K54 PolarHBondContact O-N 3.14Å; W51-K54 PolarHBondContact O-N 2.97Å; K54-V56 VanDerWaalsContact C-N 3.33Å; K54-V56 PolarHBondContact O-N 3.42Å; K54-I57 PolarHBondContact O-N 3.26Å; K54-I58 HydrophobicContact CB-CD1 4.43Å; K54-I58 WeakPolarHBondContact O-CB 3.36Å; K54-I58 WeakPolarHBondContact O-CD1 3.36Å; K54-I58 WeakPolarHBondContact O-CG1 3.34Å; K54-I58 PolarHBondContact O-N 2.67Å
55	L	87.9	Confident	89	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-41.6	-179.2	-174.1	66.4	0	0	0	111.9	W51 Q52 R53 I58 L59 P86 I89	W51-L55 WeakPolarHBondContact O-CB 3.47Å; W51-L55 PolarHBondContact O-N 2.87Å; Q52-L55 PolarHBondContact O-N 2.78Å; R53-L55 PolarHBondContact O-N 3.47Å; L55-I58 PolarHBondContact O-N 3.2Å; L55-L59 HydrophobicContact CD1-CD1 3.83Å; L55-L59 HydrophobicContact CD1-CG 4.26Å; L55-L59 HydrophobicContact CD2-CD1 4.5Å; L55-L59 HydrophobicContact CG-CD1 3.81Å; L55-L59 WeakPolarHBondContact O-CB 3.39Å; L55-L59 WeakPolarHBondContact O-CG 3.43Å; L55-L59 PolarHBondContact O-N 2.87Å; L55-P86 HydrophobicContact CD2-CB 4.19Å; L55-I89 HydrophobicContact CD1-CG2 4.47Å; L55-I89 HydrophobicContact CD2-CB 4.1Å; L55-I89 HydrophobicContact CD2-CG2 3.85Å
56	V	83.6	Confident	89	Confident	69 Å²	69	46.8 Å²	46.8	42%	0.418	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-46.6	175.5	168.2	0	0	0	0	111	Q52 R53 K54 K60	Q52-V56 WeakPolarHBondContact O-CB 3.31Å; Q52-V56 VanDerWaalsContact O-CG2 3.28Å; Q52-V56 WeakPolarHBondContact O-CG2 3.33Å; Q52-V56 PolarHBondContact O-N 3.45Å; R53-V56 PolarHBondContact O-N 2.91Å; K54-V56 VanDerWaalsContact C-N 3.33Å; K54-V56 PolarHBondContact O-N 3.42Å; V56-K60 HydrophobicContact CG1-CD 3.8Å; V56-K60 HydrophobicContact CG1-CG 4.45Å; V56-K60 WeakPolarHBondContact O-CB 3.46Å; V56-K60 WeakPolarHBondContact O-CG 3.46Å; V56-K60 PolarHBondContact O-N 2.86Å; V56-K60 VanDerWaalsContact O-N 3.13Å
57	I	84.4	Confident	89.1	Confident	85 Å²	85	44.7 Å²	44.7	44%	0.436	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-51.1	178.3	-68.4	165.3	0	0	0	109.7	R53 K54 L59 K60 T61	R53-I57 WeakPolarHBondContact O-CG1 3.49Å; R53-I57 PolarHBondContact O-N 3.19Å; K54-I57 PolarHBondContact O-N 3.26Å; I57-L59 PolarHBondContact O-N 3.15Å; I57-K60 PolarHBondContact O-N 2.96Å; I57-K60 VanDerWaalsContact O-N 3.1Å; I57-T61 PolarHBondContact O-N 2.85Å; I57-T61 PolarHBondContact O-OG1 3.26Å
58	I	88.8	Confident	89.1	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.026	21%	0.214	C	C	.	.	I	π-helix	trans	-60.1	-48.6	-175.8	-69.1	163.8	0	0	0	112	T28 K54 L55 K60 Q62 W63 Y90	T28-I58 HydrophobicContact CG2-CD1 3.39Å; K54-I58 HydrophobicContact CB-CD1 4.43Å; K54-I58 WeakPolarHBondContact O-CB 3.36Å; K54-I58 WeakPolarHBondContact O-CD1 3.36Å; K54-I58 WeakPolarHBondContact O-CG1 3.34Å; K54-I58 PolarHBondContact O-N 2.67Å; L55-I58 PolarHBondContact O-N 3.2Å; I58-K60 PolarHBondContact O-N 2.66Å; I58-Q62 PolarHBondContact O-N 3.15Å; I58-Q62 VanDerWaalsContact O-N 3.07Å; I58-W63 HydrophobicContact CG2-CD2 3.39Å; I58-W63 HydrophobicContact CG2-CE3 3.91Å; I58-W63 HydrophobicContact CG2-CG 3.78Å; I58-W63 HydrophobicContact CG2-CH2 4.03Å; I58-W63 HydrophobicContact CG2-CZ2 3.56Å; I58-W63 HydrophobicContact CG2-CZ3 4.18Å; I58-W63 PolarHBondContact O-N 2.8Å; I58-Y90 HydrophobicContact CD1-CD2 3.97Å; I58-Y90 HydrophobicContact CD1-CE2 3.78Å
59	L	86.6	Confident	89	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.21	C	C	.	.	I	π-helix	trans	-70.1	-18.6	179.5	-71.7	169.3	0	0	0	113.4	L55 I57 W63 L93 L425 L426 K445	L55-L59 HydrophobicContact CD1-CD1 3.83Å; L55-L59 HydrophobicContact CD1-CG 4.26Å; L55-L59 HydrophobicContact CD2-CD1 4.5Å; L55-L59 HydrophobicContact CG-CD1 3.81Å; L55-L59 WeakPolarHBondContact O-CB 3.39Å; L55-L59 WeakPolarHBondContact O-CG 3.43Å; L55-L59 PolarHBondContact O-N 2.87Å; I57-L59 PolarHBondContact O-N 3.15Å; L59-W63 HydrophobicContact CD2-CE3 3.56Å; L59-W63 HydrophobicContact CD2-CZ3 3.99Å; L59-W63 HydrophobicContact CG-CE3 4.36Å; L59-L93 HydrophobicContact CD1-CD1 4.34Å; L59-L93 HydrophobicContact CD2-CD1 4.19Å; L59-L425 HydrophobicContact CD2-CB 4.2Å; L59-L425 PolarHBondContact O-N 2.89Å; L59-L426 HydrophobicContact CD1-CB 4.07Å; L59-L426 HydrophobicContact CD1-CD1 4.18Å; L59-L426 HydrophobicContact CD1-CD2 4.39Å; L59-L426 HydrophobicContact CD1-CG 4.46Å; L59-K445 PolarHBondContact O-NZ 3.41Å
60	K	82.7	Confident	89.1	Confident	81 Å²	81	41.8 Å²	41.8	35%	0.352	21%	0.212	S	C	.	.	I	π-helix	trans	-90.5	-42	177.5	-75.9	-175	170.7	-173.3	0	113.3	V56 I57 I58 C422 G423 K445	V56-K60 HydrophobicContact CG1-CD 3.8Å; V56-K60 HydrophobicContact CG1-CG 4.45Å; V56-K60 WeakPolarHBondContact O-CB 3.46Å; V56-K60 WeakPolarHBondContact O-CG 3.46Å; V56-K60 PolarHBondContact O-N 2.86Å; V56-K60 VanDerWaalsContact O-N 3.13Å; I57-K60 PolarHBondContact O-N 2.96Å; I57-K60 VanDerWaalsContact O-N 3.1Å; I58-K60 PolarHBondContact O-N 2.66Å; K60-C422 VanDerWaalsContact CD-O 3.29Å; K60-C422 WeakPolarHBondContact CD-O 3.46Å; K60-C422 WeakPolarHBondContact CG-O 3.42Å; K60-G423 WeakPolarHBondContact CA-O 3.5Å; K60-K445 PolarHBondContact O-NZ 2.87Å
61	T	79.9	Confident	89.2	Confident	56 Å²	56	46.5 Å²	46.5	34%	0.344	23%	0.232	S	C	.	.	I	π-helix	trans	-118.5	-29.3	-167.1	62.1	0	0	0	0	114.3	I57	I57-T61 PolarHBondContact O-N 2.85Å; I57-T61 PolarHBondContact O-OG1 3.26Å
62	Q	85.7	Confident	89.2	Confident	98 Å²	98	47.5 Å²	47.5	46%	0.458	24%	0.238	S	C	.	.	I	π-helix	trans	-99.1	-47.1	-173.4	-63.3	-177.4	-3.5	0	0	112.1	I58 S64	I58-Q62 PolarHBondContact O-N 3.15Å; I58-Q62 VanDerWaalsContact O-N 3.07Å; Q62-S64 PolarHBondContact O-N 3.05Å
63	W	90	Very high	89.4	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.011	26%	0.263	C	S	.	.			trans	-89	112.4	-177.7	-62.6	-5.3	0	0	0	110	I58 L59 L66 Y90 L93 K94 V97 L102 L425	I58-W63 HydrophobicContact CG2-CD2 3.39Å; I58-W63 HydrophobicContact CG2-CE3 3.91Å; I58-W63 HydrophobicContact CG2-CG 3.78Å; I58-W63 HydrophobicContact CG2-CH2 4.03Å; I58-W63 HydrophobicContact CG2-CZ2 3.56Å; I58-W63 HydrophobicContact CG2-CZ3 4.18Å; I58-W63 PolarHBondContact O-N 2.8Å; L59-W63 HydrophobicContact CD2-CE3 3.56Å; L59-W63 HydrophobicContact CD2-CZ3 3.99Å; L59-W63 HydrophobicContact CG-CE3 4.36Å; W63-L66 HydrophobicContact CE3-CD2 4.39Å; W63-Y90 AromaticContact CH2-CD2 3.77Å; W63-Y90 HydrophobicContact CH2-CD2 3.77Å; W63-Y90 AromaticContact CH2-CE2 3.93Å; W63-Y90 HydrophobicContact CH2-CE2 3.93Å; W63-Y90 HydrophobicContact CZ2-CD2 4Å; W63-Y90 AromaticContact CZ2-CE2 3.67Å; W63-Y90 HydrophobicContact CZ2-CE2 3.67Å; W63-L93 HydrophobicContact CH2-CB 4.04Å; W63-L93 HydrophobicContact CZ3-CB 3.54Å; W63-L93 HydrophobicContact CZ3-CD1 4.29Å; W63-K94 HydrophobicContact CH2-CB 4.32Å; W63-K94 HydrophobicContact CZ2-CB 4.4Å; W63-V97 HydrophobicContact CD2-CG1 4.29Å; W63-V97 HydrophobicContact CD2-CG2 3.46Å; W63-V97 VanDerWaalsContact CD2-CG2 3.46Å; W63-V97 HydrophobicContact CE3-CG2 3.6Å; W63-V97 HydrophobicContact CG-CG1 4.14Å; W63-V97 HydrophobicContact CG-CG2 4.06Å; W63-V97 HydrophobicContact CH2-CG2 3.98Å; W63-V97 HydrophobicContact CZ2-CG2 3.81Å; W63-V97 HydrophobicContact CZ3-CG2 3.89Å; W63-L102 HydrophobicContact CZ2-CD2 4.49Å; W63-L425 HydrophobicContact CB-CD1 4.31Å; W63-L425 VanDerWaalsContact O-CD1 3.24Å; W63-L425 WeakPolarHBondContact O-CD1 3.35Å
64	S	91.2	Very high	89.6	Confident	31 Å²	31	54.1 Å²	54.1	22%	0.217	27%	0.266	C	S	.	.			trans	-95.9	-22.1	171.2	63.6	0	0	0	0	112.7	Q62 L101 K445	Q62-S64 PolarHBondContact O-N 3.05Å; S64-L101 WeakPolarHBondContact OG-CD1 3.23Å; S64-K445 PolarHBondContact O-N 2.97Å
65	T	93.8	Very high	89.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.6	-170.2	-50.6	0	0	0	0	111.8	I67 P98 R442 L443 Q444	T65-I67 HydrophobicContact CG2-CD1 4.33Å; T65-I67 HydrophobicContact CG2-CG1 4.03Å; T65-P98 HydrophobicContact CG2-CG 4.06Å; T65-P98 WeakPolarHBondContact O-CD 3.47Å; T65-R442 HydrophobicContact CG2-CG 4.19Å; T65-L443 CarbonylContact C-O 3.58Å; T65-L443 VanDerWaalsContact CA-O 3.28Å; T65-L443 WeakPolarHBondContact CA-O 3.47Å; T65-Q444 PolarHBondContact OG1-NE2 3.07Å; T65-Q444 PolarHBondContact OG1-OE1 2.86Å
66	L	95	Very high	89.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.3	168.6	-73.1	159.9	0	0	0	109.6	W63 Y96 V97 L425 L429 W441 R442 L443	W63-L66 HydrophobicContact CE3-CD2 4.39Å; L66-Y96 CarbonylContact C-O 3.51Å; L66-Y96 WeakPolarHBondContact CA-O 3.41Å; L66-V97 HydrophobicContact CD2-CB 4.47Å; L66-V97 HydrophobicContact CD2-CG2 3.42Å; L66-V97 VanDerWaalsContact CD2-CG2 3.42Å; L66-L425 HydrophobicContact CD1-CB 4.41Å; L66-L425 HydrophobicContact CD1-CD1 4.03Å; L66-L425 HydrophobicContact CG-CD1 4.33Å; L66-L429 HydrophobicContact CD1-CD1 3.56Å; L66-L429 HydrophobicContact CD1-CD2 4.03Å; L66-L429 HydrophobicContact CD1-CG 4.17Å; L66-W441 HydrophobicContact CB-CH2 4.47Å; L66-W441 HydrophobicContact CB-CZ3 4.02Å; L66-R442 CarbonylContact O-C 3.59Å; L66-R442 WeakPolarHBondContact O-CA 3.48Å; L66-L443 HydrophobicContact CB-CB 4.41Å; L66-L443 HydrophobicContact CD1-CD2 4.38Å; L66-L443 PolarHBondContact N-O 3.47Å; L66-L443 PolarHBondContact O-N 3.12Å
67	I	94.9	Very high	89.8	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130.4	-176.8	-56.2	177	0	0	0	109.6	T65 Y96 P98 S230 F233 W441 R442 W460	T65-I67 HydrophobicContact CG2-CD1 4.33Å; T65-I67 HydrophobicContact CG2-CG1 4.03Å; I67-Y96 PolarHBondContact N-O 3.46Å; I67-Y96 VanDerWaalsContact O-CB 3.28Å; I67-Y96 WeakPolarHBondContact O-CB 3.39Å; I67-Y96 WeakPolarHBondContact O-CD1 3.25Å; I67-P98 HydrophobicContact CD1-CG 4.11Å; I67-S230 WeakPolarHBondContact CD1-O 3.37Å; I67-F233 HydrophobicContact CD1-CB 4.37Å; I67-W441 WeakPolarHBondContact CA-O 3.36Å; I67-R442 HydrophobicContact CG1-CB 4.42Å; I67-R442 HydrophobicContact CG1-CG 4.17Å; I67-W460 HydrophobicContact CG2-CZ2 4.08Å
68	C	94.4	Very high	89.9	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.1	173.2	-166.2	0	0	0	0	109.7	S70 Y96 P440 W441	C68-S70 PolarHBondContact SG-O 3.39Å; C68-Y96 HydrophobicContact CB-CD1 4.01Å; C68-Y96 HydrophobicContact CB-CE1 4.3Å; C68-Y96 VanDerWaalsContact SG-CE1 3.57Å; C68-P440 CarbonylContact O-C 3.59Å; C68-P440 VanDerWaalsContact O-CA 3.27Å; C68-P440 WeakPolarHBondContact O-CA 2.99Å; C68-W441 HydrophobicContact CB-CD2 3.69Å; C68-W441 HydrophobicContact CB-CE3 4.17Å; C68-W441 HydrophobicContact CB-CG 4.28Å; C68-W441 HydrophobicContact CB-CH2 3.8Å; C68-W441 HydrophobicContact CB-CZ2 3.27Å; C68-W441 HydrophobicContact CB-CZ3 4.21Å; C68-W441 PolarHBondContact N-O 3.48Å; C68-W441 PolarHBondContact O-N 3.24Å
69	D	90.8	Very high	89.4	Confident	62 Å²	62	55.3 Å²	55.3	33%	0.332	28%	0.275	S	S	.	.	S	Bend	trans	-81.2	-18.5	-177.7	-79.1	-11.3	0	0	0	113.9	K464	D69-K464 WeakPolarHBondContact OD1-CE 3.33Å; D69-K464 IonicContact OD1-NZ 3.62Å; D69-K464 PolarHBondContact OD1-NZ 2.99Å; D69-K464 IonicContact OD2-NZ 2.8Å; D69-K464 PolarHBondContact OD2-NZ 2.84Å
70	S	91.2	Very high	89.2	Confident	78 Å²	78	62.4 Å²	62.4	55%	0.545	30%	0.302	S	S	.	.	S	Bend	trans	-163	146.1	-177.7	61.3	0	0	0	0	110.3	C68	C68-S70 PolarHBondContact SG-O 3.39Å
71	K	93.7	Very high	89.1	Confident	103 Å²	103	61.3 Å²	61.3	45%	0.448	30%	0.299	S	S	.	.			trans	-47.1	122.9	175	-174.6	167.5	-175	161.7	0	112	E436 F437 Q438	K71-E436 WeakPolarHBondContact CD-O 3.28Å; K71-E436 WeakPolarHBondContact CE-O 3.17Å; K71-E436 PolarHBondContact NZ-O 3.21Å; K71-F437 WeakPolarHBondContact CB-O 3.4Å; K71-Q438 HydrophobicContact CD-CG 4.42Å
72	P	93.8	Very high	89.2	Confident	20 Å²	20	66 Å²	66	13%	0.13	32%	0.317	C	S	.	.			trans	-69.2	148.1	175.4	28.6	-34.6	0	0	0	111.4	Y74 A75 F92 Y96 F435	P72-Y74 PolarHBondContact O-N 2.98Å; P72-A75 HydrophobicContact CG-CB 4.04Å; P72-F92 HydrophobicContact CB-CE2 4.48Å; P72-F92 HydrophobicContact CG-CZ 4.17Å; P72-Y96 VanDerWaalsContact CB-OH 3.31Å; P72-Y96 WeakPolarHBondContact CB-OH 3.49Å; P72-F435 HydrophobicContact CG-CB 4.27Å; P72-F435 HydrophobicContact CG-CD1 3.84Å; P72-F435 HydrophobicContact CG-CG 4.45Å
73	K	91.7	Very high	89.3	Confident	226 Å²	226	65.8 Å²	65.8	98%	0.983	32%	0.323	S	S	*	.	S	Bend	trans	-61	-34	174.1	-66.8	-172.7	178.1	-173.8	0	112.5
74	Y	91.5	Very high	89.2	Confident	176 Å²	176	66.7 Å²	66.7	69%	0.69	33%	0.329	S	S	*	.			trans	-138.2	124.2	178.3	175.9	-92.3	0	0	0	108.5	P72 F92	P72-Y74 PolarHBondContact O-N 2.98Å; Y74-F92 VanDerWaalsContact O-CE2 3.31Å; Y74-F92 WeakPolarHBondContact O-CE2 3.4Å
75	A	90.6	Very high	89.2	Confident	37 Å²	37	67.4 Å²	67.4	31%	0.306	33%	0.329	S	S	.	.			trans	-121.4	136.4	168.5	0	0	0	0	0	108.4	P72 F92 F435	P72-A75 HydrophobicContact CG-CB 4.04Å; A75-F92 HydrophobicContact CB-CE1 4.42Å; A75-F92 HydrophobicContact CB-CE2 4.35Å; A75-F92 HydrophobicContact CB-CZ 3.77Å; A75-F435 HydrophobicContact CB-CB 3.8Å; A75-F435 HydrophobicContact CB-CG 4.28Å
76	P	90	Very high	89.1	Confident	10 Å²	10	67.8 Å²	67.8	7%	0.065	33%	0.331	C	S	.	.			trans	-62.7	149.2	170.1	28.8	-32.6	0	0	0	109.9	L78 V84 F92	P76-L78 HydrophobicContact CG-CD2 4.09Å; P76-L78 PolarHBondContact O-N 2.96Å; P76-V84 HydrophobicContact CB-CG1 4.1Å; P76-V84 HydrophobicContact CB-CG2 4.29Å; P76-F92 VanDerWaalsContact CD-CD1 3.45Å; P76-F92 VanDerWaalsContact CD-CG 3.5Å; P76-F92 HydrophobicContact CG-CB 4.18Å; P76-F92 HydrophobicContact CG-CD1 3.64Å; P76-F92 HydrophobicContact CG-CD2 4.41Å; P76-F92 HydrophobicContact CG-CE1 4.09Å; P76-F92 HydrophobicContact CG-CG 3.81Å
77	D	86	Confident	89	Confident	60 Å²	60	68.8 Å²	68.8	32%	0.321	34%	0.336	S	S	.	.			trans	-68.7	103.8	172.2	-176.9	-6.3	0	0	0	109.5	Q79 R80	D77-Q79 VanDerWaalsContact C-N 3.28Å; D77-Q79 WeakPolarHBondContact OD1-CA 3.42Å; D77-Q79 VanDerWaalsContact OD1-CB 3.27Å; D77-Q79 WeakPolarHBondContact OD1-CB 3.24Å; D77-Q79 PolarHBondContact OD1-N 3.2Å; D77-R80 PolarHBondContact OD1-N 3.37Å; D77-R80 WeakPolarHBondContact OD2-CB 3.49Å; D77-R80 WeakPolarHBondContact OD2-CD 3.39Å; D77-R80 WeakPolarHBondContact OD2-CG 3.18Å
78	L	85.7	Confident	88.9	Confident	13 Å²	13	75.1 Å²	75.1	7%	0.068	36%	0.363	C	S	.	.	S	Bend	trans	-81.6	-6.7	178.3	-60.4	-177.5	0	0	0	113	P76 L81 I89 L429 T430 F435	P76-L78 HydrophobicContact CG-CD2 4.09Å; P76-L78 PolarHBondContact O-N 2.96Å; L78-L81 HydrophobicContact CB-CD2 4.48Å; L78-L81 HydrophobicContact CD2-CD2 4.29Å; L78-L81 WeakPolarHBondContact O-CD2 3.48Å; L78-L81 WeakPolarHBondContact O-CG 3.14Å; L78-I89 HydrophobicContact CD2-CG2 3.96Å; L78-L429 HydrophobicContact CD1-CB 4.25Å; L78-T430 VanDerWaalsContact O-CG2 3.24Å; L78-T430 WeakPolarHBondContact O-CG2 3.27Å; L78-T430 PolarHBondContact O-OG1 3.44Å; L78-F435 HydrophobicContact CD1-CD2 3.77Å; L78-F435 HydrophobicContact CD1-CE2 3.74Å
79	Q	79	Confident	88.8	Confident	100 Å²	100	75.2 Å²	75.2	47%	0.467	36%	0.363	S	S	.	.	S	Bend	trans	-81.8	-33	172.4	-52.4	-165	-60.2	0	0	111.1	D77 T430 H433	D77-Q79 VanDerWaalsContact C-N 3.28Å; D77-Q79 WeakPolarHBondContact OD1-CA 3.42Å; D77-Q79 VanDerWaalsContact OD1-CB 3.27Å; D77-Q79 WeakPolarHBondContact OD1-CB 3.24Å; D77-Q79 PolarHBondContact OD1-N 3.2Å; Q79-T430 HydrophobicContact CB-CG2 4.25Å; Q79-T430 HydrophobicContact CG-CG2 3.93Å; Q79-H433 PolarHBondContact NE2-CE1 2.68Å; Q79-H433 PolarHBondContact NE2-NE2 2.84Å
80	R	82.6	Confident	88.9	Confident	150 Å²	150	72.5 Å²	72.5	57%	0.566	35%	0.348	S	S	*	.			trans	-109.1	59.8	-179.8	-60.5	-177.8	-179.9	173.2	0.2	111.3	D77 Q82 T83	D77-R80 PolarHBondContact OD1-N 3.37Å; D77-R80 WeakPolarHBondContact OD2-CB 3.49Å; D77-R80 WeakPolarHBondContact OD2-CD 3.39Å; D77-R80 WeakPolarHBondContact OD2-CG 3.18Å; R80-Q82 PolarHBondContact O-N 2.96Å; R80-T83 HydrophobicContact CB-CG2 3.92Å; R80-T83 WeakPolarHBondContact O-CB 3.43Å; R80-T83 PolarHBondContact O-N 3.21Å; R80-T83 PolarHBondContact O-OG1 3.03Å
81	L	79.9	Confident	89	Confident	58 Å²	58	76.1 Å²	76.1	30%	0.304	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-54.5	-29.4	-178	-61.5	168.9	0	0	0	113.1	L78 T83 V84 I89 L426	L78-L81 HydrophobicContact CB-CD2 4.48Å; L78-L81 HydrophobicContact CD2-CD2 4.29Å; L78-L81 WeakPolarHBondContact O-CD2 3.48Å; L78-L81 WeakPolarHBondContact O-CG 3.14Å; L81-T83 PolarHBondContact O-N 2.83Å; L81-V84 PolarHBondContact O-N 3.25Å; L81-I89 HydrophobicContact CD2-CD1 3.64Å; L81-L426 HydrophobicContact CD1-CD2 3.53Å; L81-L426 HydrophobicContact CD1-CG 4.25Å; L81-L426 HydrophobicContact CD2-CD1 4.3Å; L81-L426 HydrophobicContact CD2-CD2 4.41Å
82	Q	82.5	Confident	89	Confident	154 Å²	154	72 Å²	72	72%	0.72	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.6	-21.4	175.1	63.4	-82.3	9.5	0	0	114.2	R80	R80-Q82 PolarHBondContact O-N 2.96Å
83	T	86.5	Confident	89	Confident	94 Å²	94	71 Å²	71	58%	0.577	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-89.4	-17.5	-178.4	66.4	0	0	0	0	113.1	R80 L81	R80-T83 HydrophobicContact CB-CG2 3.92Å; R80-T83 WeakPolarHBondContact O-CB 3.43Å; R80-T83 PolarHBondContact O-N 3.21Å; R80-T83 PolarHBondContact O-OG1 3.03Å; L81-T83 PolarHBondContact O-N 2.83Å
84	V	88.3	Confident	89	Confident	22 Å²	22	62.7 Å²	62.7	13%	0.133	29%	0.29	C	S	.	.	S	Bend	trans	-116.8	123.8	-176.8	-174.5	0	0	0	0	109.3	P76 L81 K88 I89	P76-V84 HydrophobicContact CB-CG1 4.1Å; P76-V84 HydrophobicContact CB-CG2 4.29Å; L81-V84 PolarHBondContact O-N 3.25Å; V84-K88 HydrophobicContact CG1-CB 4.08Å; V84-I89 HydrophobicContact CB-CD1 4.25Å; V84-I89 HydrophobicContact CB-CG1 4.21Å; V84-I89 HydrophobicContact CG1-CD1 4.39Å; V84-I89 HydrophobicContact CG1-CG1 3.82Å
85	H	92.4	Very high	89.1	Confident	47 Å²	47	60 Å²	60	22%	0.218	28%	0.281	C	S	.	.			trans	-53.3	130.2	176.4	-168.9	-69.6	0	0	0	111.4	L46 N48 W51 H87 K88 I89	L46-H85 PolarHBondContact O-CE1 2.87Å; L46-H85 PolarHBondContact O-NE2 3.23Å; N48-H85 PolarHBondContact OD1-CD2 3.44Å; N48-H85 PolarHBondContact OD1-NE2 3.46Å; W51-H85 AromaticContact CD1-CE1 3.94Å; H85-H87 VanDerWaalsContact C-N 3.34Å; H85-H87 VanDerWaalsContact ND1-CB 3.34Å; H85-H87 WeakPolarHBondContact ND1-CB 3.45Å; H85-H87 PolarHBondContact ND1-N 3.32Å; H85-H87 PolarHBondContact O-N 2.97Å; H85-K88 HydrophobicContact CB-CD 4.29Å; H85-K88 HydrophobicContact CB-CG 4.27Å; H85-K88 WeakPolarHBondContact O-CA 3.47Å; H85-K88 VanDerWaalsContact O-CB 3.31Å; H85-K88 WeakPolarHBondContact O-CB 3.44Å; H85-K88 PolarHBondContact O-N 3.21Å; H85-I89 PolarHBondContact O-N 3.01Å
86	P	91.5	Very high	89.2	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.045	27%	0.273	C	S	.	.	H	α-helix	trans	-65.1	-31.4	-170.1	-4.2	8.6	0	0	0	114.3	N48 W51 Q52 L55 K88 I89 Y90	N48-P86 VanDerWaalsContact OD1-CD 3.29Å; N48-P86 WeakPolarHBondContact OD1-CD 3.4Å; W51-P86 HydrophobicContact CB-CB 3.87Å; W51-P86 HydrophobicContact CB-CG 4.08Å; Q52-P86 HydrophobicContact CB-CG 4.41Å; Q52-P86 HydrophobicContact CG-CB 4.22Å; Q52-P86 HydrophobicContact CG-CG 3.47Å; Q52-P86 VanDerWaalsContact CG-CG 3.47Å; L55-P86 HydrophobicContact CD2-CB 4.19Å; P86-K88 VanDerWaalsContact C-N 3.25Å; P86-K88 PolarHBondContact O-N 3.36Å; P86-I89 WeakPolarHBondContact O-CA 3.35Å; P86-I89 WeakPolarHBondContact O-CB 3.28Å; P86-I89 PolarHBondContact O-N 3.32Å; P86-I89 VanDerWaalsContact O-N 3.07Å; P86-Y90 PolarHBondContact O-N 2.99Å
87	H	92.1	Very high	89.3	Confident	21 Å²	21	59.4 Å²	59.4	10%	0.097	27%	0.271	C	S	.	.	H	α-helix	trans	-51.9	-41	166.7	171	-127.7	0	0	0	113.2	L46 W51 H85 I89 Y90 R91	L46-H87 HydrophobicContact CD2-CB 4.24Å; L46-H87 WeakPolarHBondContact CD2-ND1 3.29Å; W51-H87 HydrophobicContact CD2-CB 3.59Å; W51-H87 AromaticContact CE2-CD2 3.73Å; W51-H87 AromaticContact CE2-CG 3.81Å; W51-H87 HydrophobicContact CE3-CB 4.17Å; W51-H87 HydrophobicContact CG-CB 3.79Å; W51-H87 AromaticContact CH2-CD2 3.56Å; W51-H87 HydrophobicContact CZ2-CB 4.11Å; W51-H87 AromaticContact CZ2-CD2 3.31Å; W51-H87 WeakPolarHBondContact CZ2-CD2 3.49Å; W51-H87 AromaticContact CZ2-CG 3.87Å; H85-H87 VanDerWaalsContact C-N 3.34Å; H85-H87 VanDerWaalsContact ND1-CB 3.34Å; H85-H87 WeakPolarHBondContact ND1-CB 3.45Å; H85-H87 PolarHBondContact ND1-N 3.32Å; H85-H87 PolarHBondContact O-N 2.97Å; H87-I89 VanDerWaalsContact C-N 3.33Å; H87-Y90 PolarHBondContact O-N 3.06Å; H87-R91 WeakPolarHBondContact O-CB 3.44Å; H87-R91 PolarHBondContact O-N 3.48Å
88	K	92.8	Very high	89.5	Confident	139 Å²	139	56.6 Å²	56.6	60%	0.604	26%	0.256	S	S	*	.	H	α-helix	trans	-67.6	-37.1	178.3	-65.7	-179.1	178.6	177.5	0	111	V84 H85 P86 F92	V84-K88 HydrophobicContact CG1-CB 4.08Å; H85-K88 HydrophobicContact CB-CD 4.29Å; H85-K88 HydrophobicContact CB-CG 4.27Å; H85-K88 WeakPolarHBondContact O-CA 3.47Å; H85-K88 VanDerWaalsContact O-CB 3.31Å; H85-K88 WeakPolarHBondContact O-CB 3.44Å; H85-K88 PolarHBondContact O-N 3.21Å; P86-K88 VanDerWaalsContact C-N 3.25Å; P86-K88 PolarHBondContact O-N 3.36Å; K88-F92 VanDerWaalsContact O-CB 3.3Å; K88-F92 WeakPolarHBondContact O-CB 3.47Å; K88-F92 PolarHBondContact O-N 2.86Å
89	I	92.2	Very high	89.3	Confident	2 Å²	2	59 Å²	59	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-49.9	174.4	-59.3	172.6	0	0	0	109.7	L55 L78 L81 V84 H85 P86 H87 R91 F92 L93	L55-I89 HydrophobicContact CD1-CG2 4.47Å; L55-I89 HydrophobicContact CD2-CB 4.1Å; L55-I89 HydrophobicContact CD2-CG2 3.85Å; L78-I89 HydrophobicContact CD2-CG2 3.96Å; L81-I89 HydrophobicContact CD2-CD1 3.64Å; V84-I89 HydrophobicContact CB-CD1 4.25Å; V84-I89 HydrophobicContact CB-CG1 4.21Å; V84-I89 HydrophobicContact CG1-CD1 4.39Å; V84-I89 HydrophobicContact CG1-CG1 3.82Å; H85-I89 PolarHBondContact O-N 3.01Å; P86-I89 WeakPolarHBondContact O-CA 3.35Å; P86-I89 WeakPolarHBondContact O-CB 3.28Å; P86-I89 PolarHBondContact O-N 3.32Å; P86-I89 VanDerWaalsContact O-N 3.07Å; H87-I89 VanDerWaalsContact C-N 3.33Å; I89-R91 PolarHBondContact O-N 3.34Å; I89-F92 WeakPolarHBondContact O-CB 3.32Å; I89-F92 PolarHBondContact O-N 3.25Å; I89-F92 VanDerWaalsContact O-N 3.15Å; I89-L93 HydrophobicContact CG2-CD1 3.75Å; I89-L93 HydrophobicContact CG2-CG 4.16Å; I89-L93 WeakPolarHBondContact O-CG 3.35Å; I89-L93 PolarHBondContact O-N 2.85Å
90	Y	92.4	Very high	89.5	Confident	5 Å²	5	57.4 Å²	57.4	2%	0.02	26%	0.259	C	S	.	.	H	α-helix	trans	-53.3	-52.8	175.1	169.3	-96.4	0	0	0	111.4	T28 I32 W51 I58 W63 P86 H87 F92 L93 K94	T28-Y90 WeakPolarHBondContact CB-OH 3.18Å; T28-Y90 HydrophobicContact CG2-CD2 4.35Å; T28-Y90 HydrophobicContact CG2-CE1 4.45Å; T28-Y90 HydrophobicContact CG2-CE2 3.83Å; T28-Y90 PolarHBondContact OG1-OH 2.83Å; I32-Y90 HydrophobicContact CD1-CD1 4.47Å; I32-Y90 HydrophobicContact CD1-CE1 3.81Å; W51-Y90 HydrophobicContact CE3-CG 4.35Å; W51-Y90 AromaticContact CH2-CD1 3.86Å; W51-Y90 HydrophobicContact CH2-CD1 3.86Å; W51-Y90 HydrophobicContact CH2-CE1 4.22Å; W51-Y90 HydrophobicContact CH2-CG 4.38Å; W51-Y90 AromaticContact CZ3-CD1 3.53Å; W51-Y90 HydrophobicContact CZ3-CD1 3.53Å; W51-Y90 HydrophobicContact CZ3-CD2 4.24Å; W51-Y90 HydrophobicContact CZ3-CE1 4.16Å; W51-Y90 AromaticContact CZ3-CG 3.58Å; W51-Y90 HydrophobicContact CZ3-CG 3.58Å; I58-Y90 HydrophobicContact CD1-CD2 3.97Å; I58-Y90 HydrophobicContact CD1-CE2 3.78Å; W63-Y90 AromaticContact CH2-CD2 3.77Å; W63-Y90 HydrophobicContact CH2-CD2 3.77Å; W63-Y90 AromaticContact CH2-CE2 3.93Å; W63-Y90 HydrophobicContact CH2-CE2 3.93Å; W63-Y90 HydrophobicContact CZ2-CD2 4Å; W63-Y90 AromaticContact CZ2-CE2 3.67Å; W63-Y90 HydrophobicContact CZ2-CE2 3.67Å; P86-Y90 PolarHBondContact O-N 2.99Å; H87-Y90 PolarHBondContact O-N 3.06Å; Y90-F92 PolarHBondContact O-N 2.82Å; Y90-L93 PolarHBondContact O-N 2.89Å; Y90-K94 HydrophobicContact CE1-CD 3.93Å; Y90-K94 WeakPolarHBondContact O-CB 3.44Å; Y90-K94 PolarHBondContact O-N 2.76Å; Y90-K94 PolarHBondContact OH-NZ 3.29Å
91	R	93	Very high	89.6	Confident	154 Å²	154	51.8 Å²	51.8	58%	0.581	24%	0.24	S	C	*	.	H	α-helix	trans	-63.5	-30.4	-178.8	-170	176.4	-177.2	141.5	-0.9	112.8	H87 I89	H87-R91 WeakPolarHBondContact O-CB 3.44Å; H87-R91 PolarHBondContact O-N 3.48Å; I89-R91 PolarHBondContact O-N 3.34Å
92	F	94.1	Very high	89.7	Confident	16 Å²	16	50.9 Å²	50.9	7%	0.07	24%	0.235	C	C	.	.	H	α-helix	trans	-71.1	-52.1	173.3	174.2	-100.9	0	0	0	110.9	P72 Y74 A75 P76 K88 I89 Y90 K95 Y96 F435	P72-F92 HydrophobicContact CB-CE2 4.48Å; P72-F92 HydrophobicContact CG-CZ 4.17Å; Y74-F92 VanDerWaalsContact O-CE2 3.31Å; Y74-F92 WeakPolarHBondContact O-CE2 3.4Å; A75-F92 HydrophobicContact CB-CE1 4.42Å; A75-F92 HydrophobicContact CB-CE2 4.35Å; A75-F92 HydrophobicContact CB-CZ 3.77Å; P76-F92 VanDerWaalsContact CD-CD1 3.45Å; P76-F92 VanDerWaalsContact CD-CG 3.5Å; P76-F92 HydrophobicContact CG-CB 4.18Å; P76-F92 HydrophobicContact CG-CD1 3.64Å; P76-F92 HydrophobicContact CG-CD2 4.41Å; P76-F92 HydrophobicContact CG-CE1 4.09Å; P76-F92 HydrophobicContact CG-CG 3.81Å; K88-F92 VanDerWaalsContact O-CB 3.3Å; K88-F92 WeakPolarHBondContact O-CB 3.47Å; K88-F92 PolarHBondContact O-N 2.86Å; I89-F92 WeakPolarHBondContact O-CB 3.32Å; I89-F92 PolarHBondContact O-N 3.25Å; I89-F92 VanDerWaalsContact O-N 3.15Å; Y90-F92 PolarHBondContact O-N 2.82Å; F92-K95 WeakPolarHBondContact O-CB 3.41Å; F92-K95 PolarHBondContact O-N 3.04Å; F92-Y96 HydrophobicContact CD1-CE2 4.19Å; F92-Y96 HydrophobicContact CD2-CE2 4.2Å; F92-Y96 HydrophobicContact CE1-CD2 4.47Å; F92-Y96 AromaticContact CE1-CE2 3.77Å; F92-Y96 HydrophobicContact CE1-CE2 3.77Å; F92-Y96 AromaticContact CE2-CE2 3.78Å; F92-Y96 HydrophobicContact CE2-CE2 3.78Å; F92-Y96 WeakPolarHBondContact CE2-OH 3.49Å; F92-Y96 HydrophobicContact CG-CE2 4.4Å; F92-Y96 AromaticContact CZ-CE2 3.55Å; F92-Y96 HydrophobicContact CZ-CE2 3.55Å; F92-Y96 AromaticContact CZ-CZ 3.98Å; F92-Y96 WeakPolarHBondContact O-CD2 3.35Å; F92-Y96 WeakPolarHBondContact O-CE2 3.28Å; F92-F435 HydrophobicContact CD1-CZ 4.45Å; F92-F435 HydrophobicContact CE1-CD1 4.04Å; F92-F435 AromaticContact CE1-CD2 3.97Å; F92-F435 HydrophobicContact CE1-CD2 3.97Å; F92-F435 AromaticContact CE1-CE1 3.72Å; F92-F435 HydrophobicContact CE1-CE1 3.72Å; F92-F435 AromaticContact CE1-CE2 3.65Å; F92-F435 HydrophobicContact CE1-CE2 3.65Å; F92-F435 HydrophobicContact CE1-CG 4.16Å; F92-F435 AromaticContact CE1-CZ 3.51Å; F92-F435 HydrophobicContact CE1-CZ 3.51Å; F92-F435 AromaticContact CZ-CD1 3.84Å; F92-F435 HydrophobicContact CZ-CD1 3.84Å; F92-F435 HydrophobicContact CZ-CD2 4.44Å; F92-F435 AromaticContact CZ-CE1 3.79Å; F92-F435 HydrophobicContact CZ-CE1 3.79Å; F92-F435 HydrophobicContact CZ-CE2 4.4Å; F92-F435 HydrophobicContact CZ-CG 4.17Å; F92-F435 HydrophobicContact CZ-CZ 4.09Å
93	L	93.7	Very high	88.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-35.8	-176.3	-67.1	178.9	0	0	0	113	L59 W63 I89 Y90 K95 Y96 L429 F435	L59-L93 HydrophobicContact CD1-CD1 4.34Å; L59-L93 HydrophobicContact CD2-CD1 4.19Å; W63-L93 HydrophobicContact CH2-CB 4.04Å; W63-L93 HydrophobicContact CZ3-CB 3.54Å; W63-L93 HydrophobicContact CZ3-CD1 4.29Å; I89-L93 HydrophobicContact CG2-CD1 3.75Å; I89-L93 HydrophobicContact CG2-CG 4.16Å; I89-L93 WeakPolarHBondContact O-CG 3.35Å; I89-L93 PolarHBondContact O-N 2.85Å; Y90-L93 PolarHBondContact O-N 2.89Å; L93-K95 PolarHBondContact O-N 3.29Å; L93-Y96 PolarHBondContact O-N 3.32Å; L93-L429 HydrophobicContact CD1-CD1 4.44Å; L93-L429 HydrophobicContact CD2-CD1 4.24Å; L93-F435 HydrophobicContact CD2-CE2 3.73Å; L93-F435 HydrophobicContact CD2-CZ 3.74Å
94	K	92.8	Very high	87.1	Confident	52 Å²	52	47.3 Å²	47.3	23%	0.226	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-51	-30.2	177.9	-173.3	176.2	-172	162.1	0	112.8	D29 W63 Y90 Y96 V97 L102	D29-K94 IonicContact OD1-NZ 2.67Å; D29-K94 PolarHBondContact OD1-NZ 3.19Å; D29-K94 IonicContact OD2-NZ 3.63Å; W63-K94 HydrophobicContact CH2-CB 4.32Å; W63-K94 HydrophobicContact CZ2-CB 4.4Å; Y90-K94 HydrophobicContact CE1-CD 3.93Å; Y90-K94 WeakPolarHBondContact O-CB 3.44Å; Y90-K94 PolarHBondContact O-N 2.76Å; Y90-K94 PolarHBondContact OH-NZ 3.29Å; K94-Y96 PolarHBondContact O-N 2.99Å; K94-V97 PolarHBondContact O-N 3.5Å; K94-L102 HydrophobicContact CG-CD1 4.32Å; K94-L102 HydrophobicContact CG-CD2 3.87Å
95	K	92.4	Very high	84.8	Confident	118 Å²	118	54 Å²	54	51%	0.513	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-68.6	-17.9	178.2	-59.6	174.4	-174.8	171.2	0	114.2	F92 L93	F92-K95 WeakPolarHBondContact O-CB 3.41Å; F92-K95 PolarHBondContact O-N 3.04Å; L93-K95 PolarHBondContact O-N 3.29Å
96	Y	94.1	Very high	82.4	Confident	34 Å²	34	60.1 Å²	60.1	13%	0.133	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-108.8	4.8	-177.4	-55.4	-75	0	0	0	111.3	L66 I67 C68 P72 F92 L93 K94 F435	L66-Y96 CarbonylContact C-O 3.51Å; L66-Y96 WeakPolarHBondContact CA-O 3.41Å; I67-Y96 PolarHBondContact N-O 3.46Å; I67-Y96 VanDerWaalsContact O-CB 3.28Å; I67-Y96 WeakPolarHBondContact O-CB 3.39Å; I67-Y96 WeakPolarHBondContact O-CD1 3.25Å; C68-Y96 HydrophobicContact CB-CD1 4.01Å; C68-Y96 HydrophobicContact CB-CE1 4.3Å; C68-Y96 VanDerWaalsContact SG-CE1 3.57Å; P72-Y96 VanDerWaalsContact CB-OH 3.31Å; P72-Y96 WeakPolarHBondContact CB-OH 3.49Å; F92-Y96 HydrophobicContact CD1-CE2 4.19Å; F92-Y96 HydrophobicContact CD2-CE2 4.2Å; F92-Y96 HydrophobicContact CE1-CD2 4.47Å; F92-Y96 AromaticContact CE1-CE2 3.77Å; F92-Y96 HydrophobicContact CE1-CE2 3.77Å; F92-Y96 AromaticContact CE2-CE2 3.78Å; F92-Y96 HydrophobicContact CE2-CE2 3.78Å; F92-Y96 WeakPolarHBondContact CE2-OH 3.49Å; F92-Y96 HydrophobicContact CG-CE2 4.4Å; F92-Y96 AromaticContact CZ-CE2 3.55Å; F92-Y96 HydrophobicContact CZ-CE2 3.55Å; F92-Y96 AromaticContact CZ-CZ 3.98Å; F92-Y96 WeakPolarHBondContact O-CD2 3.35Å; F92-Y96 WeakPolarHBondContact O-CE2 3.28Å; L93-Y96 PolarHBondContact O-N 3.32Å; K94-Y96 PolarHBondContact O-N 2.99Å; Y96-F435 HydrophobicContact CD1-CE1 4.28Å; Y96-F435 AromaticContact CD2-CE1 3.73Å; Y96-F435 HydrophobicContact CD2-CE1 3.73Å; Y96-F435 AromaticContact CD2-CZ 3.88Å; Y96-F435 HydrophobicContact CD2-CZ 3.88Å; Y96-F435 HydrophobicContact CE1-CE1 4.13Å; Y96-F435 HydrophobicContact CE2-CD1 4.49Å; Y96-F435 AromaticContact CE2-CE1 3.54Å; Y96-F435 HydrophobicContact CE2-CE1 3.54Å; Y96-F435 HydrophobicContact CE2-CZ 4Å; Y96-F435 HydrophobicContact CG-CE1 4.09Å; Y96-F435 HydrophobicContact CG-CZ 4.4Å; Y96-F435 AromaticContact CZ-CE1 3.75Å
97	V	92.2	Very high	80.1	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.012	30%	0.3	C	S	.	.	S	Bend	trans	-93.7	128.6	-179.1	179.2	0	0	0	0	108.8	W63 L66 K94 L101 L102	W63-V97 HydrophobicContact CD2-CG1 4.29Å; W63-V97 HydrophobicContact CD2-CG2 3.46Å; W63-V97 VanDerWaalsContact CD2-CG2 3.46Å; W63-V97 HydrophobicContact CE3-CG2 3.6Å; W63-V97 HydrophobicContact CG-CG1 4.14Å; W63-V97 HydrophobicContact CG-CG2 4.06Å; W63-V97 HydrophobicContact CH2-CG2 3.98Å; W63-V97 HydrophobicContact CZ2-CG2 3.81Å; W63-V97 HydrophobicContact CZ3-CG2 3.89Å; L66-V97 HydrophobicContact CD2-CB 4.47Å; L66-V97 HydrophobicContact CD2-CG2 3.42Å; L66-V97 VanDerWaalsContact CD2-CG2 3.42Å; K94-V97 PolarHBondContact O-N 3.5Å; V97-L101 HydrophobicContact CG1-CB 3.78Å; V97-L101 HydrophobicContact CG1-CD1 4.4Å; V97-L102 HydrophobicContact CB-CD2 3.92Å; V97-L102 HydrophobicContact CB-CG 4.4Å; V97-L102 HydrophobicContact CG1-CD2 3.67Å; V97-L102 HydrophobicContact CG1-CG 4.05Å
98	P	88.9	Confident	77.5	Confident	1 Å²	1	64 Å²	64	1%	0.006	31%	0.314	C	S	.	.			trans	-54.7	139.3	172.5	-26.6	34.6	0	0	0	112.5	T65 I67 H100 L101	T65-P98 HydrophobicContact CG2-CG 4.06Å; T65-P98 WeakPolarHBondContact O-CD 3.47Å; I67-P98 HydrophobicContact CD1-CG 4.11Å; P98-H100 VanDerWaalsContact C-N 3.25Å; P98-H100 PolarHBondContact O-N 3.21Å; P98-H100 VanDerWaalsContact O-N 3.12Å; P98-L101 HydrophobicContact CG-CD1 4.44Å; P98-L101 WeakPolarHBondContact O-CB 3.28Å; P98-L101 PolarHBondContact O-N 3.4Å
99	Q	82.9	Confident	75.1	Confident	64 Å²	64	60.9 Å²	60.9	30%	0.299	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-57.2	-34	-172.6	-70.7	178.9	-9.9	0	0	114.1	L101 L102 F233	Q99-L101 PolarHBondContact O-N 2.74Å; Q99-L102 WeakPolarHBondContact O-CB 3.37Å; Q99-L102 PolarHBondContact O-N 2.91Å; Q99-F233 HydrophobicContact CG-CE2 4.39Å
100	H	82	Confident	73.1	Confident	66 Å²	66	66.7 Å²	66.7	31%	0.306	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-66.3	-20.7	-179.6	72.7	-91	0	0	0	112.9	P98 D228 S229	P98-H100 VanDerWaalsContact C-N 3.25Å; P98-H100 PolarHBondContact O-N 3.21Å; P98-H100 VanDerWaalsContact O-N 3.12Å; H100-D228 VanDerWaalsContact CE1-CG 3.49Å; H100-D228 IonicContact CE1-OD1 3.83Å; H100-D228 IonicContact CE1-OD2 2.67Å; H100-D228 PolarHBondContact CE1-OD2 2.94Å; H100-D228 VanDerWaalsContact CE1-OD2 3.29Å; H100-D228 IonicContact NE2-OD2 3.96Å; H100-S229 WeakPolarHBondContact CB-OG 3.46Å; H100-S229 PolarHBondContact N-OG 3.4Å; H100-S229 PolarHBondContact ND1-OG 2.91Å
101	L	84.1	Confident	70.9	Confident	32 Å²	32	68.3 Å²	68.3	17%	0.168	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-88.8	-3.7	175.9	-60.1	178.6	0	0	0	112.9	S64 V97 P98 Q99	S64-L101 WeakPolarHBondContact OG-CD1 3.23Å; V97-L101 HydrophobicContact CG1-CB 3.78Å; V97-L101 HydrophobicContact CG1-CD1 4.4Å; P98-L101 HydrophobicContact CG-CD1 4.44Å; P98-L101 WeakPolarHBondContact O-CB 3.28Å; P98-L101 PolarHBondContact O-N 3.4Å; Q99-L101 PolarHBondContact O-N 2.74Å
102	L	82.5	Confident	68.8	Low	39 Å²	39	66.4 Å²	66.4	20%	0.204	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-91.8	1.9	-179.6	-64.3	179.5	0	0	0	113.5	W63 K94 V97 Q99 D104	W63-L102 HydrophobicContact CZ2-CD2 4.49Å; K94-L102 HydrophobicContact CG-CD1 4.32Å; K94-L102 HydrophobicContact CG-CD2 3.87Å; V97-L102 HydrophobicContact CB-CD2 3.92Å; V97-L102 HydrophobicContact CB-CG 4.4Å; V97-L102 HydrophobicContact CG1-CD2 3.67Å; V97-L102 HydrophobicContact CG1-CG 4.05Å; Q99-L102 WeakPolarHBondContact O-CB 3.37Å; Q99-L102 PolarHBondContact O-N 2.91Å; L102-D104 PolarHBondContact O-N 2.95Å
103	G	63.7	Low	67	Low	63 Å²	63	70.9 Å²	70.9	65%	0.649	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	2.4	175	0	0	0	0	0	115.5	Q105	G103-Q105 PolarHBondContact O-N 2.86Å
104	D	51.4	Low	65.1	Low	109 Å²	109	75.5 Å²	75.5	58%	0.583	39%	0.391	S	S	*	.			trans	-71	89.4	175	-99.8	-31.2	0	0	0	110.5	L102 K106 E107 A108	L102-D104 PolarHBondContact O-N 2.95Å; D104-K106 PolarHBondContact O-N 3.07Å; D104-E107 PolarHBondContact O-N 3.33Å; D104-A108 PolarHBondContact O-N 2.97Å
105	Q	40.3	Very low	63	Low	162 Å²	162	75.5 Å²	75.5	76%	0.757	39%	0.393	S	S	*	.	H	α-helix	trans	-50.1	-30.7	179.7	-74.2	-169	-15.7	0	0	113.1	G103 E107 A108 S109	G103-Q105 PolarHBondContact O-N 2.86Å; Q105-E107 VanDerWaalsContact C-N 3.33Å; Q105-E107 PolarHBondContact O-N 2.95Å; Q105-A108 PolarHBondContact O-N 3.16Å; Q105-S109 PolarHBondContact O-N 3.5Å; Q105-S109 PolarHBondContact O-OG 3.48Å
106	K	41.3	Very low	61	Low	177 Å²	177	74 Å²	74	77%	0.77	39%	0.391	S	S	*	.	H	α-helix	trans	-61.5	-33	178.6	-91.9	-179	176.2	172.6	0	114.4	D104 K110	D104-K106 PolarHBondContact O-N 3.07Å; K106-K110 PolarHBondContact O-N 3.49Å
107	E	43.6	Very low	59	Low	60 Å²	60	78.4 Å²	78.4	28%	0.28	41%	0.411	S	S	.	.	H	α-helix	trans	-88.5	-32.3	178.3	-79.7	-68.9	152.3	0	0	111.6	D104 Q105 S109 K110 V111	D104-E107 PolarHBondContact O-N 3.33Å; Q105-E107 VanDerWaalsContact C-N 3.33Å; Q105-E107 PolarHBondContact O-N 2.95Å; E107-S109 PolarHBondContact O-N 3.37Å; E107-K110 VanDerWaalsContact CD-CD 3.49Å; E107-K110 CarbonylContact O-C 3.47Å; E107-K110 WeakPolarHBondContact O-CA 2.96Å; E107-K110 WeakPolarHBondContact O-CB 3.2Å; E107-K110 PolarHBondContact O-N 3.36Å; E107-K110 VanDerWaalsContact OE1-CD 3.23Å; E107-K110 WeakPolarHBondContact OE1-CD 3.48Å; E107-K110 WeakPolarHBondContact OE1-CE 3.47Å; E107-K110 IonicContact OE1-NZ 3.73Å; E107-K110 PolarHBondContact OE1-NZ 3.13Å; E107-K110 WeakPolarHBondContact OE2-CD 3.27Å; E107-V111 WeakPolarHBondContact O-CG2 3.16Å; E107-V111 PolarHBondContact O-N 3.22Å
108	A	36.8	Very low	56.9	Low	48 Å²	48	79.1 Å²	79.1	40%	0.397	41%	0.414	S	S	.	.	H	α-helix	trans	-56.8	-42.3	169.7	0	0	0	0	0	110.9	D104 Q105 K110 V111 Q112	D104-A108 PolarHBondContact O-N 2.97Å; Q105-A108 PolarHBondContact O-N 3.16Å; A108-K110 VanDerWaalsContact C-N 3.32Å; A108-K110 PolarHBondContact O-N 3.37Å; A108-V111 PolarHBondContact O-N 2.67Å; A108-Q112 WeakPolarHBondContact O-CB 3.42Å; A108-Q112 PolarHBondContact O-N 3.48Å
109	S	42.3	Very low	54.6	Low	75 Å²	75	83.5 Å²	83.5	52%	0.524	44%	0.438	S	S	.	.	H	α-helix	trans	-62.3	-35.3	171.9	-49.5	0	0	0	0	113	Q105 E107 L113	Q105-S109 PolarHBondContact O-N 3.5Å; Q105-S109 PolarHBondContact O-OG 3.48Å; E107-S109 PolarHBondContact O-N 3.37Å; S109-L113 WeakPolarHBondContact O-CB 3.5Å; S109-L113 PolarHBondContact O-N 3.28Å
110	K	50.1	Low	53	Low	123 Å²	123	87.7 Å²	87.7	54%	0.535	46%	0.457	S	S	.	.	H	α-helix	trans	-70.6	-39.4	176	-76	173.8	-178.1	177.8	0	112.3	K106 E107 A108 L113 L114	K106-K110 PolarHBondContact O-N 3.49Å; E107-K110 VanDerWaalsContact CD-CD 3.49Å; E107-K110 CarbonylContact O-C 3.47Å; E107-K110 WeakPolarHBondContact O-CA 2.96Å; E107-K110 WeakPolarHBondContact O-CB 3.2Å; E107-K110 PolarHBondContact O-N 3.36Å; E107-K110 VanDerWaalsContact OE1-CD 3.23Å; E107-K110 WeakPolarHBondContact OE1-CD 3.48Å; E107-K110 WeakPolarHBondContact OE1-CE 3.47Å; E107-K110 IonicContact OE1-NZ 3.73Å; E107-K110 PolarHBondContact OE1-NZ 3.13Å; E107-K110 WeakPolarHBondContact OE2-CD 3.27Å; A108-K110 VanDerWaalsContact C-N 3.32Å; A108-K110 PolarHBondContact O-N 3.37Å; K110-L113 PolarHBondContact O-N 3.46Å; K110-L114 VanDerWaalsContact O-CB 3.3Å; K110-L114 WeakPolarHBondContact O-CB 3.41Å; K110-L114 PolarHBondContact O-N 3.43Å
111	V	46.8	Very low	50.9	Low	39 Å²	39	88.4 Å²	88.4	24%	0.236	46%	0.463	C	S	.	.	H	α-helix	trans	-66.4	-43.9	174.5	176.4	0	0	0	0	110	E107 A108 L113 L114 I115	E107-V111 WeakPolarHBondContact O-CG2 3.16Å; E107-V111 PolarHBondContact O-N 3.22Å; A108-V111 PolarHBondContact O-N 2.67Å; V111-L113 VanDerWaalsContact C-N 3.32Å; V111-L113 PolarHBondContact O-N 3.48Å; V111-L114 WeakPolarHBondContact O-CB 3.46Å; V111-L114 PolarHBondContact O-N 3.35Å; V111-I115 HydrophobicContact CG1-CD1 3.89Å; V111-I115 HydrophobicContact CG1-CG1 4.46Å; V111-I115 VanDerWaalsContact O-CG1 3.26Å; V111-I115 WeakPolarHBondContact O-CG1 3.34Å; V111-I115 PolarHBondContact O-N 3Å
112	Q	48.2	Very low	48.5	Very low	114 Å²	114	90.8 Å²	90.8	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-41	174.5	-150.1	76.6	8.6	0	0	111.5	A108 L114 I115 N116	A108-Q112 WeakPolarHBondContact O-CB 3.42Å; A108-Q112 PolarHBondContact O-N 3.48Å; Q112-L114 VanDerWaalsContact C-N 3.35Å; Q112-I115 PolarHBondContact O-N 3.06Å; Q112-N116 WeakPolarHBondContact O-CB 3.27Å; Q112-N116 VanDerWaalsContact O-CG 3.23Å; Q112-N116 PolarHBondContact O-N 3.43Å; Q112-N116 PolarHBondContact O-ND2 3.37Å
113	L	57.9	Low	46.1	Very low	111 Å²	111	96.8 Å²	96.8	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-68.6	-35.7	176.4	-164.7	144.5	0	0	0	111.2	S109 K110 V111 K117	S109-L113 WeakPolarHBondContact O-CB 3.5Å; S109-L113 PolarHBondContact O-N 3.28Å; K110-L113 PolarHBondContact O-N 3.46Å; V111-L113 VanDerWaalsContact C-N 3.32Å; V111-L113 PolarHBondContact O-N 3.48Å; L113-K117 WeakPolarHBondContact O-CB 3.47Å; L113-K117 PolarHBondContact O-N 3.01Å
114	L	52.2	Low	44.3	Very low	96 Å²	96	96.9 Å²	96.9	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-48.9	171.7	-157.4	99.4	0	0	0	110.5	K110 V111 Q112 N116 K117 I118	K110-L114 VanDerWaalsContact O-CB 3.3Å; K110-L114 WeakPolarHBondContact O-CB 3.41Å; K110-L114 PolarHBondContact O-N 3.43Å; V111-L114 WeakPolarHBondContact O-CB 3.46Å; V111-L114 PolarHBondContact O-N 3.35Å; Q112-L114 VanDerWaalsContact C-N 3.35Å; L114-N116 PolarHBondContact O-N 3.04Å; L114-K117 PolarHBondContact O-N 3Å; L114-I118 HydrophobicContact CD2-CD1 3.91Å; L114-I118 HydrophobicContact CG-CD1 4.08Å; L114-I118 WeakPolarHBondContact O-CB 3.45Å; L114-I118 VanDerWaalsContact O-CD1 3.3Å; L114-I118 WeakPolarHBondContact O-CD1 3.11Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 2.67Å
115	I	49.3	Very low	43.2	Very low	53 Å²	53	97 Å²	97	27%	0.272	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.5	-69	166.1	0	0	0	110.8	V111 Q112 K117 I118 N119	V111-I115 HydrophobicContact CG1-CD1 3.89Å; V111-I115 HydrophobicContact CG1-CG1 4.46Å; V111-I115 VanDerWaalsContact O-CG1 3.26Å; V111-I115 WeakPolarHBondContact O-CG1 3.34Å; V111-I115 PolarHBondContact O-N 3Å; Q112-I115 PolarHBondContact O-N 3.06Å; I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 3.01Å; I115-I118 WeakPolarHBondContact O-CB 3.44Å; I115-I118 PolarHBondContact O-N 3.12Å; I115-N119 PolarHBondContact O-N 3.2Å
116	N	50.9	Low	42.4	Very low	86 Å²	86	93.5 Å²	93.5	46%	0.46	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-38.4	178.2	-73.7	-13.3	0	0	0	112.2	Q112 L114 N119 Q120	Q112-N116 WeakPolarHBondContact O-CB 3.27Å; Q112-N116 VanDerWaalsContact O-CG 3.23Å; Q112-N116 PolarHBondContact O-N 3.43Å; Q112-N116 PolarHBondContact O-ND2 3.37Å; L114-N116 PolarHBondContact O-N 3.04Å; N116-N119 PolarHBondContact O-N 3.03Å; N116-Q120 WeakPolarHBondContact O-CG 3.35Å; N116-Q120 PolarHBondContact O-N 2.88Å; N116-Q120 VanDerWaalsContact O-N 3.08Å
117	K	52.7	Low	41.9	Very low	127 Å²	127	89.7 Å²	89.7	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-69.4	-35.1	177	-148.3	171.9	-168	177.8	0	111.7	L113 L114 I115 L121	L113-K117 WeakPolarHBondContact O-CB 3.47Å; L113-K117 PolarHBondContact O-N 3.01Å; L114-K117 PolarHBondContact O-N 3Å; I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 3.01Å; K117-L121 HydrophobicContact CG-CD1 4.47Å; K117-L121 WeakPolarHBondContact O-CB 3.32Å; K117-L121 WeakPolarHBondContact O-CD1 3.34Å; K117-L121 VanDerWaalsContact O-CG 3.25Å; K117-L121 WeakPolarHBondContact O-CG 3.24Å; K117-L121 PolarHBondContact O-N 3.29Å; K117-L121 VanDerWaalsContact O-N 3.14Å
118	I	47.1	Very low	41	Very low	17 Å²	17	96.3 Å²	96.3	9%	0.087	54%	0.54	C	S	.	.	H	α-helix	trans	-65	-43.6	173.6	-70	160.2	0	0	0	110.9	L114 I115 Q120 L121 S122 M224 I261	L114-I118 HydrophobicContact CD2-CD1 3.91Å; L114-I118 HydrophobicContact CG-CD1 4.08Å; L114-I118 WeakPolarHBondContact O-CB 3.45Å; L114-I118 VanDerWaalsContact O-CD1 3.3Å; L114-I118 WeakPolarHBondContact O-CD1 3.11Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 2.67Å; I115-I118 WeakPolarHBondContact O-CB 3.44Å; I115-I118 PolarHBondContact O-N 3.12Å; I118-Q120 VanDerWaalsContact C-N 3.35Å; I118-Q120 PolarHBondContact O-N 3.31Å; I118-L121 PolarHBondContact O-N 3.03Å; I118-S122 PolarHBondContact O-N 3.4Å; I118-S122 VanDerWaalsContact O-N 3.15Å; I118-S122 PolarHBondContact O-OG 2.97Å; I118-M224 HydrophobicContact CG2-CE 3.33Å; I118-I261 HydrophobicContact CD1-CG2 3.76Å; I118-I261 HydrophobicContact CG1-CG2 4.09Å
119	N	40.8	Very low	40.4	Very low	93 Å²	93	102.7 Å²	102.7	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-66.3	-36	178.7	-71.3	-17.2	0	0	0	112.3	I115 N116	I115-N119 PolarHBondContact O-N 3.2Å; N116-N119 PolarHBondContact O-N 3.03Å
120	Q	48.5	Very low	39.6	Very low	152 Å²	152	102.8 Å²	102.8	71%	0.71	58%	0.575	S	S	*	*	H	α-helix	trans	-70	-32.5	175	-75	-179.2	-4	0	0	113.3	N116 I118	N116-Q120 WeakPolarHBondContact O-CG 3.35Å; N116-Q120 PolarHBondContact O-N 2.88Å; N116-Q120 VanDerWaalsContact O-N 3.08Å; I118-Q120 VanDerWaalsContact C-N 3.35Å; I118-Q120 PolarHBondContact O-N 3.31Å
121	L	37.5	Very low	38.5	Very low	80 Å²	80	105.6 Å²	105.6	42%	0.419	59%	0.59	S	S	.	*	H	α-helix	trans	-82.4	-22.2	-178.2	-71.4	166.7	0	0	0	113.5	K117 I118 L123 A124	K117-L121 HydrophobicContact CG-CD1 4.47Å; K117-L121 WeakPolarHBondContact O-CB 3.32Å; K117-L121 WeakPolarHBondContact O-CD1 3.34Å; K117-L121 VanDerWaalsContact O-CG 3.25Å; K117-L121 WeakPolarHBondContact O-CG 3.24Å; K117-L121 PolarHBondContact O-N 3.29Å; K117-L121 VanDerWaalsContact O-N 3.14Å; I118-L121 PolarHBondContact O-N 3.03Å; L121-L123 PolarHBondContact O-N 3.41Å; L121-L123 VanDerWaalsContact O-N 3.16Å; L121-A124 PolarHBondContact O-N 2.87Å
122	S	33.8	Very low	37.5	Very low	83 Å²	83	108.1 Å²	108.1	58%	0.58	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	179.4	-61.5	0	0	0	0	114.3	I118	I118-S122 PolarHBondContact O-N 3.4Å; I118-S122 VanDerWaalsContact O-N 3.15Å; I118-S122 PolarHBondContact O-OG 2.97Å
123	L	32.2	Very low	36.7	Very low	164 Å²	164	109 Å²	109	86%	0.859	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-7.3	176.5	-89.5	141.3	0	0	0	114	L121	L121-L123 PolarHBondContact O-N 3.41Å; L121-L123 VanDerWaalsContact O-N 3.16Å
124	A	26.8	Very low	35.7	Very low	65 Å²	65	108.1 Å²	108.1	54%	0.537	63%	0.625	S	S	.	*	S	Bend	trans	-122.4	120.6	-176.6	0	0	0	0	0	111.6	L121	L121-A124 PolarHBondContact O-N 2.87Å
125	S	27.6	Very low	35	Very low	112 Å²	112	109.7 Å²	109.7	78%	0.783	64%	0.642	S	S	*	*			trans	102.5	120.8	156.1	72	0	0	0	0	119.7
126	A	24.4	Very low	34.5	Very low	89 Å²	89	110.6 Å²	110.6	74%	0.736	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-77.7	159.5	168.2	0	0	0	0	0	111.5
127	P	29.8	Very low	34.1	Very low	97 Å²	97	109.6 Å²	109.6	63%	0.63	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-91.4	141.8	-164.1	34.8	-31.2	0	0	0	113.2
128	H	26.4	Very low	34.3	Very low	198 Å²	198	111.2 Å²	111.2	92%	0.917	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-99.5	118	157	-90.9	-68.6	0	0	0	109.2
129	E	24.1	Very low	34.3	Very low	183 Å²	183	114.1 Å²	114.1	86%	0.855	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-79.1	132.5	170.3	-75.1	-174.8	141.8	0	0	110.9
130	G	23.7	Very low	34.7	Very low	76 Å²	76	114.7 Å²	114.7	78%	0.784	67%	0.674	S	S	*	*			trans	-155.8	84.5	168.6	0	0	0	0	0	109.1
131	Q	26.9	Very low	35	Very low	183 Å²	183	111.8 Å²	111.8	86%	0.855	66%	0.663	S	S	*	*			trans	-79.4	118.8	172.9	-71.2	-177.7	10.2	0	0	109.7
132	S	25.7	Very low	36.1	Very low	91 Å²	91	112.1 Å²	112.1	64%	0.636	66%	0.661	S	S	*	*			trans	-125.4	111	155.1	59.6	0	0	0	0	108.6
133	T	31.5	Very low	37.1	Very low	134 Å²	134	115 Å²	115	82%	0.822	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-87	122.3	175.1	42.6	0	0	0	0	109.1
134	S	37	Very low	38.1	Very low	91 Å²	91	111.4 Å²	111.4	64%	0.636	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-75.2	145.5	168.2	50.4	0	0	0	0	110.1	L136	S134-L136 PolarHBondContact O-N 2.82Å
135	P	38	Very low	40.1	Very low	130 Å²	130	115.1 Å²	115.1	84%	0.844	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-70.7	121.4	-176.5	28.6	-31.7	0	0	0	110.1
136	L	37.9	Very low	41.4	Very low	72 Å²	72	113.5 Å²	113.5	38%	0.377	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-67.1	144.4	171.5	-75.7	160.1	0	0	0	109.7	S134 E140 L141 K144	S134-L136 PolarHBondContact O-N 2.82Å; L136-E140 HydrophobicContact CD2-CB 4.46Å; L136-E140 VanDerWaalsContact CD2-OE2 3.28Å; L136-E140 WeakPolarHBondContact CD2-OE2 3.35Å; L136-L141 HydrophobicContact CB-CD1 4.21Å; L136-L141 HydrophobicContact CB-CG 3.89Å; L136-L141 WeakPolarHBondContact O-CD1 3.06Å; L136-K144 HydrophobicContact CD1-CD 4.41Å
137	S	44.3	Very low	42.6	Very low	65 Å²	65	112.5 Å²	112.5	46%	0.455	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-56.4	142.2	174.3	160.4	0	0	0	0	110.6	C139 E140 L141	S137-C139 PolarHBondContact O-N 2.71Å; S137-C139 VanDerWaalsContact O-N 3.13Å; S137-C139 PolarHBondContact OG-N 3.32Å; S137-E140 WeakPolarHBondContact O-CA 3.24Å; S137-E140 WeakPolarHBondContact O-CB 3.36Å; S137-E140 PolarHBondContact O-N 2.83Å; S137-L141 PolarHBondContact O-N 2.82Å
138	F	56.1	Low	43.6	Very low	161 Å²	161	111.1 Å²	111.1	71%	0.706	58%	0.583	S	S	*	*	H	α-helix	trans	-53.3	-36.6	179.1	179.7	-95.1	0	0	0	112	E140 L141 F142	F138-E140 PolarHBondContact O-N 3.49Å; F138-L141 PolarHBondContact O-N 2.9Å; F138-F142 HydrophobicContact CE1-CB 4.42Å; F138-F142 WeakPolarHBondContact O-CB 3.29Å; F138-F142 PolarHBondContact O-N 3.11Å
139	C	47.2	Very low	44.9	Very low	78 Å²	78	105.7 Å²	105.7	53%	0.527	56%	0.557	S	S	.	*	H	α-helix	trans	-64.1	-39.3	174.9	-73.2	0	0	0	0	112.3	S137 W143	S137-C139 PolarHBondContact O-N 2.71Å; S137-C139 VanDerWaalsContact O-N 3.13Å; S137-C139 PolarHBondContact OG-N 3.32Å; C139-W143 WeakPolarHBondContact O-CB 3.5Å; C139-W143 PolarHBondContact O-N 2.82Å
140	E	48.5	Very low	46.1	Very low	105 Å²	105	103.4 Å²	103.4	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-72	-37.6	177.5	-66.3	179.8	148.4	0	0	112.1	L136 S137 F138 K144	L136-E140 HydrophobicContact CD2-CB 4.46Å; L136-E140 VanDerWaalsContact CD2-OE2 3.28Å; L136-E140 WeakPolarHBondContact CD2-OE2 3.35Å; S137-E140 WeakPolarHBondContact O-CA 3.24Å; S137-E140 WeakPolarHBondContact O-CB 3.36Å; S137-E140 PolarHBondContact O-N 2.83Å; F138-E140 PolarHBondContact O-N 3.49Å; E140-K144 VanDerWaalsContact O-CB 3.28Å; E140-K144 WeakPolarHBondContact O-CB 3.26Å; E140-K144 WeakPolarHBondContact O-CG 3.31Å; E140-K144 PolarHBondContact O-N 3.28Å
141	L	55.1	Low	47	Very low	91 Å²	91	104 Å²	104	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-44.5	172.2	-84.5	162.7	0	0	0	111.3	L136 S137 F138 K144 W145	L136-L141 HydrophobicContact CB-CD1 4.21Å; L136-L141 HydrophobicContact CB-CG 3.89Å; L136-L141 WeakPolarHBondContact O-CD1 3.06Å; S137-L141 PolarHBondContact O-N 2.82Å; F138-L141 PolarHBondContact O-N 2.9Å; L141-K144 PolarHBondContact O-N 3.04Å; L141-W145 WeakPolarHBondContact O-CB 3.42Å; L141-W145 PolarHBondContact O-N 2.93Å
142	F	62.2	Low	47.8	Very low	87 Å²	87	104.5 Å²	104.5	38%	0.382	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-43.7	177.4	-176.2	-96.4	0	0	0	111.1	F138 W145 W146	F138-F142 HydrophobicContact CE1-CB 4.42Å; F138-F142 WeakPolarHBondContact O-CB 3.29Å; F138-F142 PolarHBondContact O-N 3.11Å; F142-W145 HydrophobicContact CD2-CE3 4.26Å; F142-W145 HydrophobicContact CE2-CE3 4.2Å; F142-W145 HydrophobicContact CE2-CZ3 4.05Å; F142-W145 PolarHBondContact O-N 2.89Å; F142-W146 HydrophobicContact CE1-CB 4.49Å; F142-W146 WeakPolarHBondContact O-CB 3.22Å; F142-W146 PolarHBondContact O-N 2.8Å
143	W	53	Low	48.6	Very low	142 Å²	142	105.6 Å²	105.6	54%	0.538	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-38.8	176.5	-80.2	117.9	0	0	0	113	C139 W146 N147	C139-W143 WeakPolarHBondContact O-CB 3.5Å; C139-W143 PolarHBondContact O-N 2.82Å; W143-W146 AromaticContact CZ3-CD1 3.8Å; W143-N147 WeakPolarHBondContact O-CB 3.15Å; W143-N147 VanDerWaalsContact O-CG 3.24Å; W143-N147 PolarHBondContact O-N 3.48Å; W143-N147 PolarHBondContact O-ND2 3.41Å; W143-N147 VanDerWaalsContact O-ND2 3.16Å
144	K	52.9	Low	48.9	Very low	90 Å²	90	100.6 Å²	100.6	39%	0.391	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-43.8	172.1	-86	180	175	170.3	0	111.3	L136 E140 L141 N148	L136-K144 HydrophobicContact CD1-CD 4.41Å; E140-K144 VanDerWaalsContact O-CB 3.28Å; E140-K144 WeakPolarHBondContact O-CB 3.26Å; E140-K144 WeakPolarHBondContact O-CG 3.31Å; E140-K144 PolarHBondContact O-N 3.28Å; L141-K144 PolarHBondContact O-N 3.04Å; K144-N148 WeakPolarHBondContact O-CB 3.33Å; K144-N148 VanDerWaalsContact O-CG 3.3Å; K144-N148 PolarHBondContact O-N 3.33Å; K144-N148 PolarHBondContact O-ND2 3.34Å
145	W	69.7	Low	49.2	Very low	142 Å²	142	99.8 Å²	99.8	54%	0.538	47%	0.47	S	S	.	.	H	α-helix	trans	-64.7	-47.1	176.8	177	82.6	0	0	0	111.4	L141 F142 N148 F149	L141-W145 WeakPolarHBondContact O-CB 3.42Å; L141-W145 PolarHBondContact O-N 2.93Å; F142-W145 HydrophobicContact CD2-CE3 4.26Å; F142-W145 HydrophobicContact CE2-CE3 4.2Å; F142-W145 HydrophobicContact CE2-CZ3 4.05Å; F142-W145 PolarHBondContact O-N 2.89Å; W145-N148 CarbonylContact O-C 3.57Å; W145-N148 WeakPolarHBondContact O-CB 3.49Å; W145-N148 PolarHBondContact O-N 3.39Å; W145-F149 VanDerWaalsContact O-CB 3.26Å; W145-F149 WeakPolarHBondContact O-CB 3.29Å; W145-F149 PolarHBondContact O-N 2.92Å
146	W	55.3	Low	48.9	Very low	79 Å²	79	103.7 Å²	103.7	30%	0.299	47%	0.469	S	S	.	.	H	α-helix	trans	-65.7	-42.1	179.9	-174.7	-109.9	0	0	0	112.3	F142 W143 F149 R150	F142-W146 HydrophobicContact CE1-CB 4.49Å; F142-W146 WeakPolarHBondContact O-CB 3.22Å; F142-W146 PolarHBondContact O-N 2.8Å; W143-W146 AromaticContact CZ3-CD1 3.8Å; W146-F149 HydrophobicContact CE3-CD1 4.25Å; W146-F149 HydrophobicContact CZ3-CD1 4.14Å; W146-F149 HydrophobicContact CZ3-CE1 4.44Å; W146-F149 PolarHBondContact O-N 3.07Å; W146-R150 WeakPolarHBondContact O-CB 3.47Å; W146-R150 PolarHBondContact O-N 3.22Å
147	N	48.9	Very low	48.9	Very low	68 Å²	68	103.4 Å²	103.4	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-67.2	-37.9	173.3	-74.1	-31.5	0	0	0	111.4	W143 R151	W143-N147 WeakPolarHBondContact O-CB 3.15Å; W143-N147 VanDerWaalsContact O-CG 3.24Å; W143-N147 PolarHBondContact O-N 3.48Å; W143-N147 PolarHBondContact O-ND2 3.41Å; W143-N147 VanDerWaalsContact O-ND2 3.16Å; N147-R151 WeakPolarHBondContact O-CB 3.41Å; N147-R151 WeakPolarHBondContact O-CD 3.35Å; N147-R151 WeakPolarHBondContact O-CG 3.23Å; N147-R151 PolarHBondContact O-N 2.91Å
148	N	52.1	Low	48.2	Very low	67 Å²	67	106.5 Å²	106.5	36%	0.358	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-37.9	171.4	-84.7	-29.7	0	0	0	112.3	K144 W145 R151 R152 Q167	K144-N148 WeakPolarHBondContact O-CB 3.33Å; K144-N148 VanDerWaalsContact O-CG 3.3Å; K144-N148 PolarHBondContact O-N 3.33Å; K144-N148 PolarHBondContact O-ND2 3.34Å; W145-N148 CarbonylContact O-C 3.57Å; W145-N148 WeakPolarHBondContact O-CB 3.49Å; W145-N148 PolarHBondContact O-N 3.39Å; N148-R151 PolarHBondContact O-N 2.87Å; N148-R152 WeakPolarHBondContact O-CB 3.2Å; N148-R152 VanDerWaalsContact O-CG 3.23Å; N148-R152 WeakPolarHBondContact O-CG 3.46Å; N148-R152 PolarHBondContact O-N 3.44Å; N148-Q167 PolarHBondContact OD1-NE2 3.03Å
149	F	53.5	Low	47.1	Very low	84 Å²	84	103.8 Å²	103.8	37%	0.368	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-47.1	178.8	-176.8	-104	0	0	0	111.2	W145 W146 R151 R152 L153	W145-F149 VanDerWaalsContact O-CB 3.26Å; W145-F149 WeakPolarHBondContact O-CB 3.29Å; W145-F149 PolarHBondContact O-N 2.92Å; W146-F149 HydrophobicContact CE3-CD1 4.25Å; W146-F149 HydrophobicContact CZ3-CD1 4.14Å; W146-F149 HydrophobicContact CZ3-CE1 4.44Å; W146-F149 PolarHBondContact O-N 3.07Å; F149-R151 PolarHBondContact O-N 3.43Å; F149-R152 WeakPolarHBondContact O-CB 3.32Å; F149-R152 PolarHBondContact O-N 3.33Å; F149-R152 VanDerWaalsContact O-N 3.16Å; F149-L153 HydrophobicContact CD1-CD1 3.86Å; F149-L153 HydrophobicContact CE1-CD1 3.43Å; F149-L153 VanDerWaalsContact CE1-CD1 3.43Å; F149-L153 HydrophobicContact CE1-CG 4.46Å; F149-L153 HydrophobicContact CZ-CD1 3.83Å; F149-L153 WeakPolarHBondContact O-CG 3.43Å; F149-L153 PolarHBondContact O-N 3.31Å
150	R	48	Very low	46.5	Very low	136 Å²	136	108.4 Å²	108.4	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-38.8	172.4	-88.1	-172.5	164.3	-167.3	-3.4	112.6	W146 R152 L153 S154	W146-R150 WeakPolarHBondContact O-CB 3.47Å; W146-R150 PolarHBondContact O-N 3.22Å; R150-R152 VanDerWaalsContact C-N 3.32Å; R150-L153 PolarHBondContact O-N 3.43Å; R150-S154 WeakPolarHBondContact O-CB 3.29Å; R150-S154 PolarHBondContact O-N 3.26Å
151	R	43.4	Very low	45.7	Very low	87 Å²	87	109 Å²	109	33%	0.328	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-30.8	173.7	-74.4	173.3	-168	-167.9	5.2	112.6	N147 N148 F149	N147-R151 WeakPolarHBondContact O-CB 3.41Å; N147-R151 WeakPolarHBondContact O-CD 3.35Å; N147-R151 WeakPolarHBondContact O-CG 3.23Å; N147-R151 PolarHBondContact O-N 2.91Å; N148-R151 PolarHBondContact O-N 2.87Å; F149-R151 PolarHBondContact O-N 3.43Å
152	R	44.2	Very low	44.5	Very low	195 Å²	195	111.7 Å²	111.7	74%	0.736	53%	0.527	S	S	*	.	H	α-helix	trans	-71.3	-31.7	172.4	-79.6	174	177.4	-172.1	-1.1	112.5	N148 F149 R150	N148-R152 WeakPolarHBondContact O-CB 3.2Å; N148-R152 VanDerWaalsContact O-CG 3.23Å; N148-R152 WeakPolarHBondContact O-CG 3.46Å; N148-R152 PolarHBondContact O-N 3.44Å; F149-R152 WeakPolarHBondContact O-CB 3.32Å; F149-R152 PolarHBondContact O-N 3.33Å; F149-R152 VanDerWaalsContact O-N 3.16Å; R150-R152 VanDerWaalsContact C-N 3.32Å
153	L	41	Very low	43.1	Very low	114 Å²	114	113.4 Å²	113.4	60%	0.597	54%	0.54	S	S	*	.	H	α-helix	trans	-79.8	-28.3	175.4	-69.2	170.3	0	0	0	112.4	F149 R150 I155	F149-L153 HydrophobicContact CD1-CD1 3.86Å; F149-L153 HydrophobicContact CE1-CD1 3.43Å; F149-L153 VanDerWaalsContact CE1-CD1 3.43Å; F149-L153 HydrophobicContact CE1-CG 4.46Å; F149-L153 HydrophobicContact CZ-CD1 3.83Å; F149-L153 WeakPolarHBondContact O-CG 3.43Å; F149-L153 PolarHBondContact O-N 3.31Å; R150-L153 PolarHBondContact O-N 3.43Å; L153-I155 PolarHBondContact O-N 3.11Å
154	S	39.3	Very low	42	Very low	29 Å²	29	114 Å²	114	20%	0.203	55%	0.552	C	S	.	*	S	Bend	trans	-87.2	92.6	173.6	-173.9	0	0	0	0	110.5	R150 C325	R150-S154 WeakPolarHBondContact O-CB 3.29Å; R150-S154 PolarHBondContact O-N 3.26Å; S154-C325 PolarHBondContact OG-O 3.13Å
155	I	42.4	Very low	41.2	Very low	73 Å²	73	114.9 Å²	114.9	37%	0.374	57%	0.569	S	S	.	*	S	Bend	trans	80.6	96.7	175.9	-46.8	167.3	0	0	0	112.4	L153 H157	L153-I155 PolarHBondContact O-N 3.11Å; I155-H157 PolarHBondContact O-N 3.47Å
156	Y	32.1	Very low	40.1	Very low	212 Å²	212	118.1 Å²	118.1	83%	0.831	58%	0.582	S	S	*	*			trans	-56.1	106.8	162.8	-103.6	-96.3	0	0	0	109.5
157	H	37.8	Very low	40.5	Very low	67 Å²	67	117.6 Å²	117.6	31%	0.31	58%	0.583	S	S	.	*			trans	-120.5	125.1	154.6	-74.8	-36.9	0	0	0	108.1	I155 S159	I155-H157 PolarHBondContact O-N 3.47Å; H157-S159 VanDerWaalsContact C-N 3.27Å; H157-S159 PolarHBondContact O-N 3.25Å
158	P	30.4	Very low	41.8	Very low	130 Å²	130	119.3 Å²	119.3	84%	0.844	58%	0.584	S	S	*	*			trans	-70	93.5	170.4	30.4	-29	0	0	0	106.7	H160	P158-H160 PolarHBondContact O-N 3.26Å
159	S	31.9	Very low	43.6	Very low	103 Å²	103	116.8 Å²	116.8	72%	0.72	57%	0.571	S	S	*	*			trans	-73.7	124.2	166.2	-45	0	0	0	0	106.3	H157	H157-S159 VanDerWaalsContact C-N 3.27Å; H157-S159 PolarHBondContact O-N 3.25Å
160	H	34	Very low	45.4	Very low	175 Å²	175	115 Å²	115	81%	0.81	56%	0.562	S	S	*	*			trans	-47.5	135.8	171.7	-100.8	-49	0	0	0	110.7	P158 N162	P158-H160 PolarHBondContact O-N 3.26Å; H160-N162 PolarHBondContact O-N 3.31Å
161	P	31.7	Very low	47.6	Very low	118 Å²	118	108.5 Å²	108.5	77%	0.766	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	9.6	-168.7	28.7	-33.8	0	0	0	115.4
162	N	30.2	Very low	49.9	Very low	147 Å²	147	104.4 Å²	104.4	79%	0.786	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	3.4	-170.8	-80	2.9	0	0	0	116.6	H160	H160-N162 PolarHBondContact O-N 3.31Å
163	D	32.3	Very low	52.2	Low	123 Å²	123	95.1 Å²	95.1	66%	0.658	49%	0.487	S	S	*	.	S	Bend	trans	-105.1	104.2	172.9	-105.8	-8.5	0	0	0	111.3	S165 R168	D163-S165 PolarHBondContact O-N 3.43Å; D163-R168 IonicContact OD2-NH2 3.54Å; D163-R168 PolarHBondContact OD2-NH2 3.1Å
164	I	31.6	Very low	54.6	Low	154 Å²	154	89.8 Å²	89.8	79%	0.79	46%	0.459	S	S	*	.			trans	-59.3	101.7	-179.4	-64	162.5	0	0	0	110.5	R166	I164-R166 PolarHBondContact O-N 3.13Å
165	S	35.1	Very low	57	Low	109 Å²	109	88.4 Å²	88.4	76%	0.762	45%	0.45	S	S	*	.	S	Bend	trans	56.8	5.2	143.2	77.8	0	0	0	0	122.3	D163 Q167	D163-S165 PolarHBondContact O-N 3.43Å; S165-Q167 PolarHBondContact O-N 2.96Å
166	R	47.8	Very low	59.2	Low	211 Å²	211	85 Å²	85	80%	0.796	43%	0.432	S	S	*	.			trans	-81.1	100.4	168.3	-84.3	-175.8	175.4	176.6	0.1	110.6	I164 R168	I164-R166 PolarHBondContact O-N 3.13Å; R166-R168 PolarHBondContact O-N 2.85Å
167	Q	61.8	Low	61.8	Low	68 Å²	68	74.9 Å²	74.9	32%	0.318	39%	0.392	S	S	.	.			trans	-51.1	103.3	173.6	-146.7	173.5	27.2	0	0	109.4	N148 S165	N148-Q167 PolarHBondContact OD1-NE2 3.03Å; S165-Q167 PolarHBondContact O-N 2.96Å
168	R	77.7	Confident	64	Low	104 Å²	104	72.3 Å²	72.3	39%	0.392	38%	0.38	S	S	.	.			trans	-64.3	140.7	-175.6	-67.8	-179.2	-176.9	171.2	0.8	110.3	D163 R166	D163-R168 IonicContact OD2-NH2 3.54Å; D163-R168 PolarHBondContact OD2-NH2 3.1Å; R166-R168 PolarHBondContact O-N 2.85Å
169	C	89.7	Confident	66.2	Low	13 Å²	13	67 Å²	67	9%	0.088	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133.9	173.6	-68.4	0	0	0	0	108.9	F171 F267 F269 D270	C169-F171 HydrophobicContact CB-CE1 4.1Å; C169-F171 HydrophobicContact CB-CE2 4.21Å; C169-F171 HydrophobicContact CB-CZ 3.74Å; C169-F267 HydrophobicContact CB-CE2 4.16Å; C169-F267 HydrophobicContact CB-CZ 4.07Å; C169-F269 HydrophobicContact CB-CB 4.21Å; C169-F269 CarbonylContact O-C 3.51Å; C169-F269 WeakPolarHBondContact O-CA 3.41Å; C169-F269 WeakPolarHBondContact O-CB 3.29Å; C169-D270 PolarHBondContact O-N 3.44Å
170	R	91.7	Very high	68	Low	47 Å²	47	66.3 Å²	66.3	18%	0.177	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.5	177.6	-49.2	-178.3	77.8	176.3	6.2	109	D270 H272 I330 C331	R170-D270 CarbonylContact C-O 3.51Å; R170-D270 WeakPolarHBondContact CA-O 3.43Å; R170-D270 HydrophobicContact CB-CB 4.23Å; R170-D270 HydrophobicContact CG-CB 4.04Å; R170-D270 IonicContact NE-OD2 3.93Å; R170-H272 PolarHBondContact NE-NE2 3.42Å; R170-H272 PolarHBondContact NH2-CE1 2.69Å; R170-H272 VanDerWaalsContact NH2-CE1 3.26Å; R170-H272 PolarHBondContact NH2-NE2 3.48Å; R170-H272 VanDerWaalsContact NH2-NE2 3.15Å; R170-I330 HydrophobicContact CB-CD1 4.09Å; R170-I330 CarbonylContact O-C 3.48Å; R170-I330 WeakPolarHBondContact O-CA 3.41Å; R170-C331 PolarHBondContact N-SG 2.8Å; R170-C331 PolarHBondContact O-N 2.93Å; R170-C331 PolarHBondContact O-SG 3.39Å
171	F	93.7	Very high	69.4	Low	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.7	178.8	-54.8	-46.6	0	0	0	110.5	C169 F267 F269 D270 L271 H272 G332 L458 L461	C169-F171 HydrophobicContact CB-CE1 4.1Å; C169-F171 HydrophobicContact CB-CE2 4.21Å; C169-F171 HydrophobicContact CB-CZ 3.74Å; F171-F267 AromaticContact CE2-CE1 3.92Å; F171-F267 HydrophobicContact CE2-CE1 3.92Å; F171-F267 AromaticContact CE2-CZ 3.72Å; F171-F267 HydrophobicContact CE2-CZ 3.72Å; F171-F267 HydrophobicContact CZ-CE1 4.43Å; F171-F267 AromaticContact CZ-CZ 3.93Å; F171-F267 HydrophobicContact CZ-CZ 3.93Å; F171-F269 HydrophobicContact CD2-CB 4.38Å; F171-F269 AromaticContact CD2-CD2 3.68Å; F171-F269 HydrophobicContact CD2-CD2 3.68Å; F171-F269 HydrophobicContact CD2-CE2 4.29Å; F171-F269 HydrophobicContact CD2-CG 4.22Å; F171-F269 HydrophobicContact CE2-CB 4.14Å; F171-F269 HydrophobicContact CE2-CD2 4.06Å; F171-F269 HydrophobicContact CE2-CG 4.15Å; F171-D270 PolarHBondContact N-O 3.24Å; F171-L271 HydrophobicContact CB-CD1 3.99Å; F171-H272 PolarHBondContact O-N 3.05Å; F171-G332 WeakPolarHBondContact CA-O 3.3Å; F171-L458 HydrophobicContact CD2-CD2 3.95Å; F171-L458 HydrophobicContact CE2-CD2 4.21Å; F171-L461 HydrophobicContact CD1-CB 4.45Å; F171-L461 HydrophobicContact CD1-CD1 4.26Å; F171-L461 HydrophobicContact CD2-CD1 4.44Å; F171-L461 HydrophobicContact CE1-CB 3.83Å; F171-L461 HydrophobicContact CE1-CD1 4.44Å; F171-L461 HydrophobicContact CE2-CB 4.28Å; F171-L461 HydrophobicContact CG-CD1 4.26Å; F171-L461 HydrophobicContact CZ-CB 3.72Å
172	A	92.4	Very high	70.6	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.2	173.9	0	0	0	0	0	110.6	H272 L274 I330 G332 I333 I334	A172-H272 CarbonylContact C-O 3.52Å; A172-H272 WeakPolarHBondContact CA-O 3.12Å; A172-L274 HydrophobicContact CB-CD1 3.7Å; A172-L274 HydrophobicContact CB-CG 4.34Å; A172-I330 HydrophobicContact CB-CD1 4.01Å; A172-I330 HydrophobicContact CB-CG1 4.09Å; A172-I330 HydrophobicContact CB-CG2 3.92Å; A172-G332 PolarHBondContact N-O 2.95Å; A172-I333 CarbonylContact O-C 3.54Å; A172-I334 PolarHBondContact O-N 3.34Å
173	V	91.7	Very high	72.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.4	173.1	170.4	0	0	0	0	109.2	F178 F187 L271 H272 Y273 L274 I334	V173-F178 HydrophobicContact CG1-CB 4.42Å; V173-F178 HydrophobicContact CG1-CD1 4.23Å; V173-F178 HydrophobicContact CG1-CD2 3.77Å; V173-F178 HydrophobicContact CG1-CE1 4.41Å; V173-F178 HydrophobicContact CG1-CE2 3.99Å; V173-F178 HydrophobicContact CG1-CG 3.89Å; V173-F178 HydrophobicContact CG1-CZ 4.31Å; V173-F187 HydrophobicContact CB-CE1 4.43Å; V173-F187 HydrophobicContact CG1-CE1 3.67Å; V173-F187 HydrophobicContact CG1-CE2 4.49Å; V173-F187 HydrophobicContact CG1-CZ 3.63Å; V173-F187 HydrophobicContact CG2-CE1 3.98Å; V173-L271 HydrophobicContact CG2-CD1 3.51Å; V173-L271 HydrophobicContact CG2-CD2 4.3Å; V173-L271 HydrophobicContact CG2-CG 4.04Å; V173-H272 PolarHBondContact N-O 3.21Å; V173-Y273 HydrophobicContact CB-CD1 4.37Å; V173-L274 PolarHBondContact O-N 3.44Å; V173-I334 VanDerWaalsContact CA-O 3.29Å; V173-I334 WeakPolarHBondContact CA-O 3.49Å; V173-I334 HydrophobicContact CG2-CB 3.73Å; V173-I334 HydrophobicContact CG2-CD1 3.9Å; V173-I334 HydrophobicContact CG2-CG1 4.32Å; V173-I334 HydrophobicContact CG2-CG2 4.09Å
174	F	91.4	Very high	73.7	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	171.9	172.2	77.8	-82	0	0	0	111.9	L274 L297 I333 I334 Y335 A336 E352 L353 V356	F174-L274 HydrophobicContact CB-CB 3.92Å; F174-L274 WeakPolarHBondContact CB-O 3.19Å; F174-L297 HydrophobicContact CD2-CD1 4.37Å; F174-I333 HydrophobicContact CD1-CG2 4.1Å; F174-I333 HydrophobicContact CE1-CG2 3.51Å; F174-I333 HydrophobicContact CZ-CG2 4.48Å; F174-I334 PolarHBondContact N-O 3.18Å; F174-I334 VanDerWaalsContact N-O 3.09Å; F174-Y335 HydrophobicContact CD1-CD2 4.44Å; F174-Y335 AromaticContact CD2-CD2 3.88Å; F174-Y335 HydrophobicContact CD2-CD2 3.88Å; F174-Y335 AromaticContact CD2-CE2 3.87Å; F174-Y335 HydrophobicContact CD2-CE2 3.87Å; F174-Y335 HydrophobicContact CE1-CD2 4.14Å; F174-Y335 AromaticContact CE2-CD2 3.51Å; F174-Y335 HydrophobicContact CE2-CD2 3.51Å; F174-Y335 AromaticContact CE2-CE2 3.5Å; F174-Y335 HydrophobicContact CE2-CE2 3.5Å; F174-Y335 VanDerWaalsContact CE2-CE2 3.5Å; F174-Y335 HydrophobicContact CG-CD2 4.32Å; F174-Y335 AromaticContact CZ-CD2 3.65Å; F174-Y335 HydrophobicContact CZ-CD2 3.65Å; F174-Y335 HydrophobicContact CZ-CE2 4.07Å; F174-Y335 CarbonylContact O-C 3.41Å; F174-Y335 WeakPolarHBondContact O-CA 3.33Å; F174-A336 PolarHBondContact O-N 2.88Å; F174-E352 HydrophobicContact CE2-CG 4.19Å; F174-L353 HydrophobicContact CE1-CD1 4.49Å; F174-L353 HydrophobicContact CZ-CD1 3.87Å; F174-V356 HydrophobicContact CE1-CB 4.36Å; F174-V356 HydrophobicContact CE1-CG1 3.86Å; F174-V356 HydrophobicContact CE1-CG2 4.35Å; F174-V356 HydrophobicContact CE2-CB 4.38Å; F174-V356 HydrophobicContact CE2-CG2 3.74Å; F174-V356 HydrophobicContact CZ-CB 3.76Å; F174-V356 HydrophobicContact CZ-CG1 3.77Å; F174-V356 HydrophobicContact CZ-CG2 3.6Å
175	G	90.6	Very high	75.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	22%	0.22	C	C	.	.	S	Bend	trans	125.2	168.5	174.2	0	0	0	0	0	113.1	G177 F178 D179 A336	G175-G177 VanDerWaalsContact C-N 3.28Å; G175-G177 PolarHBondContact O-N 3.42Å; G175-F178 WeakPolarHBondContact O-CB 3.45Å; G175-F178 PolarHBondContact O-N 3.35Å; G175-D179 PolarHBondContact O-N 3.16Å; G175-D179 VanDerWaalsContact O-N 3.15Å; G175-A336 CarbonylContact C-O 3.57Å
176	P	88.3	Confident	77.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-33.8	-172.7	24.7	-34.8	0	0	0	113.3	F178 D179 Q180 Y335 A336 L337 L349	P176-F178 PolarHBondContact O-N 3.17Å; P176-D179 PolarHBondContact O-N 2.88Å; P176-Q180 WeakPolarHBondContact O-CG 3.45Å; P176-Q180 PolarHBondContact O-N 3.02Å; P176-Q180 VanDerWaalsContact O-N 3.12Å; P176-Y335 VanDerWaalsContact CD-OH 3.28Å; P176-Y335 WeakPolarHBondContact CD-OH 3.47Å; P176-A336 WeakPolarHBondContact CD-O 3.45Å; P176-L337 HydrophobicContact CG-CD1 4.28Å; P176-L349 HydrophobicContact CG-CD1 3.82Å; P176-L349 HydrophobicContact CG-CD2 3.9Å
177	G	85.6	Confident	78.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-36.8	176.2	0	0	0	0	0	111.7	G175 T183 A336	G175-G177 VanDerWaalsContact C-N 3.28Å; G175-G177 PolarHBondContact O-N 3.42Å; G177-T183 VanDerWaalsContact C-OG1 3.28Å; G177-T183 WeakPolarHBondContact O-CB 3.38Å; G177-T183 VanDerWaalsContact O-CG2 3.23Å; G177-T183 WeakPolarHBondContact O-CG2 3.1Å; G177-T183 PolarHBondContact O-OG1 2.98Å; G177-A336 PolarHBondContact N-O 2.78Å
178	F	83.4	Confident	79.4	Confident	13 Å²	13	30.6 Å²	30.6	6%	0.057	16%	0.155	C	C	.	.	H	α-helix	trans	-73.4	-36.4	177.3	-172	-117.8	0	0	0	112.5	V173 G175 P176 F187 Y273 Y275 A336	V173-F178 HydrophobicContact CG1-CB 4.42Å; V173-F178 HydrophobicContact CG1-CD1 4.23Å; V173-F178 HydrophobicContact CG1-CD2 3.77Å; V173-F178 HydrophobicContact CG1-CE1 4.41Å; V173-F178 HydrophobicContact CG1-CE2 3.99Å; V173-F178 HydrophobicContact CG1-CG 3.89Å; V173-F178 HydrophobicContact CG1-CZ 4.31Å; G175-F178 WeakPolarHBondContact O-CB 3.45Å; G175-F178 PolarHBondContact O-N 3.35Å; P176-F178 PolarHBondContact O-N 3.17Å; F178-F187 HydrophobicContact CD2-CD1 4.39Å; F178-F187 AromaticContact CD2-CD2 3.54Å; F178-F187 HydrophobicContact CD2-CD2 3.54Å; F178-F187 HydrophobicContact CD2-CE1 4.39Å; F178-F187 AromaticContact CD2-CE2 3.52Å; F178-F187 HydrophobicContact CD2-CE2 3.52Å; F178-F187 AromaticContact CD2-CG 4Å; F178-F187 HydrophobicContact CD2-CG 4Å; F178-F187 AromaticContact CD2-CZ 3.97Å; F178-F187 HydrophobicContact CD2-CZ 3.97Å; F178-F187 HydrophobicContact CE2-CB 4.24Å; F178-F187 HydrophobicContact CE2-CD1 4.02Å; F178-F187 AromaticContact CE2-CD2 3.77Å; F178-F187 HydrophobicContact CE2-CD2 3.77Å; F178-F187 HydrophobicContact CE2-CE1 4.36Å; F178-F187 HydrophobicContact CE2-CE2 4.1Å; F178-F187 AromaticContact CE2-CG 3.73Å; F178-F187 HydrophobicContact CE2-CG 3.73Å; F178-F187 HydrophobicContact CE2-CZ 4.38Å; F178-Y273 HydrophobicContact CE1-CD1 4.31Å; F178-Y273 HydrophobicContact CE1-CG 4.43Å; F178-Y273 HydrophobicContact CE2-CD1 4.08Å; F178-Y273 AromaticContact CZ-CD1 3.48Å; F178-Y273 HydrophobicContact CZ-CD1 3.48Å; F178-Y273 VanDerWaalsContact CZ-CD1 3.48Å; F178-Y273 HydrophobicContact CZ-CE1 4.28Å; F178-Y273 AromaticContact CZ-CG 3.78Å; F178-Y273 HydrophobicContact CZ-CG 3.78Å; F178-Y275 AromaticContact CD1-CD1 3.83Å; F178-Y275 HydrophobicContact CD1-CD1 3.83Å; F178-Y275 AromaticContact CD1-CE1 3.7Å; F178-Y275 HydrophobicContact CD1-CE1 3.7Å; F178-Y275 AromaticContact CE1-CD1 3.47Å; F178-Y275 HydrophobicContact CE1-CD1 3.47Å; F178-Y275 VanDerWaalsContact CE1-CD1 3.47Å; F178-Y275 HydrophobicContact CE1-CD2 4.33Å; F178-Y275 AromaticContact CE1-CE1 3.08Å; F178-Y275 HydrophobicContact CE1-CE1 3.08Å; F178-Y275 HydrophobicContact CE1-CE2 4.01Å; F178-Y275 HydrophobicContact CE1-CG 4.1Å; F178-Y275 AromaticContact CE1-CZ 3.39Å; F178-Y275 HydrophobicContact CE2-CE1 4.33Å; F178-Y275 HydrophobicContact CZ-CD1 4.3Å; F178-Y275 AromaticContact CZ-CE1 3.45Å; F178-Y275 HydrophobicContact CZ-CE1 3.45Å; F178-Y275 VanDerWaalsContact CZ-CE1 3.45Å; F178-Y275 HydrophobicContact CZ-CE2 4.22Å; F178-Y275 AromaticContact CZ-CZ 3.41Å; F178-Y275 VanDerWaalsContact CZ-CZ 3.41Å; F178-Y275 VanDerWaalsContact CZ-OH 3.29Å; F178-Y275 WeakPolarHBondContact CZ-OH 3.3Å; F178-A336 HydrophobicContact CB-CB 3.89Å
179	D	77.6	Confident	79.3	Confident	19 Å²	19	27.5 Å²	27.5	10%	0.102	14%	0.144	C	C	.	.	H	α-helix	trans	-71.8	-38.5	-177.5	-70.6	-28.2	0	0	0	113.3	G175 P176 R181 S276 R291	G175-D179 PolarHBondContact O-N 3.16Å; G175-D179 VanDerWaalsContact O-N 3.15Å; P176-D179 PolarHBondContact O-N 2.88Å; D179-R181 VanDerWaalsContact C-N 3.27Å; D179-R181 PolarHBondContact O-N 3.4Å; D179-R181 VanDerWaalsContact O-N 3.1Å; D179-S276 PolarHBondContact OD1-N 3.5Å; D179-S276 PolarHBondContact OD1-OG 3.26Å; D179-S276 VanDerWaalsContact OD2-CB 3.25Å; D179-S276 WeakPolarHBondContact OD2-CB 3.22Å; D179-S276 PolarHBondContact OD2-OG 2.94Å; D179-R291 IonicContact OD2-CZ 3.01Å; D179-R291 IonicContact OD2-NH1 2.67Å; D179-R291 PolarHBondContact OD2-NH1 2.91Å
180	Q	68.9	Low	78.7	Confident	88 Å²	88	27 Å²	27	41%	0.411	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	12	-167.7	-71	-173.3	13.1	0	0	116.1	P176 A182 D338	P176-Q180 WeakPolarHBondContact O-CG 3.45Å; P176-Q180 PolarHBondContact O-N 3.02Å; P176-Q180 VanDerWaalsContact O-N 3.12Å; Q180-A182 PolarHBondContact O-N 3.03Å; Q180-D338 PolarHBondContact OE1-OD2 3.3Å
181	R	64.2	Low	77.9	Confident	139 Å²	139	27.6 Å²	27.6	53%	0.525	15%	0.15	S	C	.	.	S	Bend	trans	54.3	-14.7	-173.2	-64.9	-170.6	-172.2	-159.7	-3.1	116.8	D179 T183 S184 L281	D179-R181 VanDerWaalsContact C-N 3.27Å; D179-R181 PolarHBondContact O-N 3.4Å; D179-R181 VanDerWaalsContact O-N 3.1Å; R181-T183 PolarHBondContact O-N 3.33Å; R181-S184 WeakPolarHBondContact O-CB 3.46Å; R181-S184 PolarHBondContact O-N 3.26Å; R181-S184 PolarHBondContact O-OG 3.18Å; R181-L281 HydrophobicContact CG-CB 4.43Å; R181-L281 PolarHBondContact NE-O 2.98Å
182	A	56.1	Low	76.9	Confident	16 Å²	16	30.5 Å²	30.5	13%	0.132	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.1	-179.8	0	0	0	0	0	112.8	Q180 P377	Q180-A182 PolarHBondContact O-N 3.03Å; A182-P377 HydrophobicContact CB-CG 3.96Å
183	T	63.1	Low	75.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	8.7	171.3	77.8	0	0	0	0	113	G177 R181 C185 L186 I375	G177-T183 VanDerWaalsContact C-OG1 3.28Å; G177-T183 WeakPolarHBondContact O-CB 3.38Å; G177-T183 VanDerWaalsContact O-CG2 3.23Å; G177-T183 WeakPolarHBondContact O-CG2 3.1Å; G177-T183 PolarHBondContact O-OG1 2.98Å; R181-T183 PolarHBondContact O-N 3.33Å; T183-C185 PolarHBondContact O-N 3.26Å; T183-L186 VanDerWaalsContact O-CB 3.31Å; T183-L186 WeakPolarHBondContact O-CB 3.35Å; T183-L186 PolarHBondContact O-N 3.28Å; T183-I375 HydrophobicContact CG2-CB 3.74Å; T183-I375 HydrophobicContact CG2-CD1 3.96Å; T183-I375 HydrophobicContact CG2-CG1 4.46Å; T183-I375 HydrophobicContact CG2-CG2 3.38Å
184	S	65.3	Low	74.6	Confident	61 Å²	61	43.3 Å²	43.3	43%	0.427	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-32.3	-179	62.7	0	0	0	0	112.4	R181 L186 F187 S188	R181-S184 WeakPolarHBondContact O-CB 3.46Å; R181-S184 PolarHBondContact O-N 3.26Å; R181-S184 PolarHBondContact O-OG 3.18Å; S184-L186 PolarHBondContact O-N 3.35Å; S184-F187 PolarHBondContact O-N 2.97Å; S184-S188 VanDerWaalsContact O-CB 3.25Å; S184-S188 WeakPolarHBondContact O-CB 3.08Å; S184-S188 PolarHBondContact O-N 2.68Å; S184-S188 PolarHBondContact O-OG 3.44Å
185	C	69.1	Low	73.5	Confident	61 Å²	61	43.7 Å²	43.7	41%	0.412	23%	0.232	S	C	.	.	H	α-helix	trans	-57.3	-32.8	172.8	-77.5	0	0	0	0	113.2	T183 S188 K189 S448	T183-C185 PolarHBondContact O-N 3.26Å; C185-S188 WeakPolarHBondContact CA-OG 3.44Å; C185-S188 PolarHBondContact O-OG 3.24Å; C185-S188 VanDerWaalsContact O-OG 3.04Å; C185-K189 WeakPolarHBondContact O-CB 3.18Å; C185-K189 VanDerWaalsContact O-CG 3.29Å; C185-K189 WeakPolarHBondContact O-CG 3.49Å; C185-K189 PolarHBondContact O-N 2.81Å; C185-S448 CarbonylContact C-O 3.55Å
186	L	76.7	Confident	72.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-71.2	-48.8	-178.4	-169.4	69.2	0	0	0	110.5	T183 S184 K189 L190 L373 I375 S448 V454	T183-L186 VanDerWaalsContact O-CB 3.31Å; T183-L186 WeakPolarHBondContact O-CB 3.35Å; T183-L186 PolarHBondContact O-N 3.28Å; S184-L186 PolarHBondContact O-N 3.35Å; L186-K189 PolarHBondContact O-N 3.11Å; L186-L190 PolarHBondContact O-N 3.04Å; L186-L373 HydrophobicContact CD2-CD1 4.5Å; L186-I375 HydrophobicContact CD2-CD1 3.86Å; L186-I375 HydrophobicContact CD2-CG1 4.33Å; L186-S448 WeakPolarHBondContact CA-O 3.28Å; L186-S448 VanDerWaalsContact CB-O 3.26Å; L186-S448 WeakPolarHBondContact CB-O 3.3Å; L186-S448 PolarHBondContact N-O 3.43Å; L186-V454 HydrophobicContact CD1-CG2 3.72Å; L186-V454 HydrophobicContact CD2-CG2 3.77Å; L186-V454 HydrophobicContact CG-CG2 3.87Å
187	F	75.1	Confident	72.8	Confident	15 Å²	15	50.8 Å²	50.8	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-78.6	-26.2	-178	-66	-82.2	0	0	0	112.5	V173 F178 S184 K189 L190 V191 Y273 I375	V173-F187 HydrophobicContact CB-CE1 4.43Å; V173-F187 HydrophobicContact CG1-CE1 3.67Å; V173-F187 HydrophobicContact CG1-CE2 4.49Å; V173-F187 HydrophobicContact CG1-CZ 3.63Å; V173-F187 HydrophobicContact CG2-CE1 3.98Å; F178-F187 HydrophobicContact CD2-CD1 4.39Å; F178-F187 AromaticContact CD2-CD2 3.54Å; F178-F187 HydrophobicContact CD2-CD2 3.54Å; F178-F187 HydrophobicContact CD2-CE1 4.39Å; F178-F187 AromaticContact CD2-CE2 3.52Å; F178-F187 HydrophobicContact CD2-CE2 3.52Å; F178-F187 AromaticContact CD2-CG 4Å; F178-F187 HydrophobicContact CD2-CG 4Å; F178-F187 AromaticContact CD2-CZ 3.97Å; F178-F187 HydrophobicContact CD2-CZ 3.97Å; F178-F187 HydrophobicContact CE2-CB 4.24Å; F178-F187 HydrophobicContact CE2-CD1 4.02Å; F178-F187 AromaticContact CE2-CD2 3.77Å; F178-F187 HydrophobicContact CE2-CD2 3.77Å; F178-F187 HydrophobicContact CE2-CE1 4.36Å; F178-F187 HydrophobicContact CE2-CE2 4.1Å; F178-F187 AromaticContact CE2-CG 3.73Å; F178-F187 HydrophobicContact CE2-CG 3.73Å; F178-F187 HydrophobicContact CE2-CZ 4.38Å; S184-F187 PolarHBondContact O-N 2.97Å; F187-K189 VanDerWaalsContact C-N 3.32Å; F187-L190 HydrophobicContact CD1-CD1 3.72Å; F187-L190 HydrophobicContact CE1-CD1 4.3Å; F187-L190 WeakPolarHBondContact O-CB 3.38Å; F187-L190 PolarHBondContact O-N 3.3Å; F187-V191 VanDerWaalsContact O-CG2 3.29Å; F187-V191 WeakPolarHBondContact O-CG2 3.27Å; F187-Y273 HydrophobicContact CD1-CE1 4.43Å; F187-I375 HydrophobicContact CE2-CD1 4.5Å
188	S	75.1	Confident	73	Confident	64 Å²	64	50.9 Å²	50.9	45%	0.448	26%	0.263	S	S	.	.	H	α-helix	trans	-66.1	-36.8	170.5	69	0	0	0	0	111.5	S184 C185 L190 V191 D192	S184-S188 VanDerWaalsContact O-CB 3.25Å; S184-S188 WeakPolarHBondContact O-CB 3.08Å; S184-S188 PolarHBondContact O-N 2.68Å; S184-S188 PolarHBondContact O-OG 3.44Å; C185-S188 WeakPolarHBondContact CA-OG 3.44Å; C185-S188 PolarHBondContact O-OG 3.24Å; C185-S188 VanDerWaalsContact O-OG 3.04Å; S188-L190 VanDerWaalsContact C-N 3.28Å; S188-L190 PolarHBondContact O-N 3.28Å; S188-V191 CarbonylContact O-C 3.56Å; S188-V191 PolarHBondContact O-N 3.08Å; S188-D192 PolarHBondContact O-N 3.01Å
189	K	76.3	Confident	73.3	Confident	38 Å²	38	53.8 Å²	53.8	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-27.7	173.6	-81.1	-175.6	174.3	-154.5	0	113.8	C185 L186 F187 V191 D192 T195 S413 N449 I451	C185-K189 WeakPolarHBondContact O-CB 3.18Å; C185-K189 VanDerWaalsContact O-CG 3.29Å; C185-K189 WeakPolarHBondContact O-CG 3.49Å; C185-K189 PolarHBondContact O-N 2.81Å; L186-K189 PolarHBondContact O-N 3.11Å; F187-K189 VanDerWaalsContact C-N 3.32Å; K189-V191 PolarHBondContact O-N 2.93Å; K189-D192 PolarHBondContact O-N 3.47Å; K189-T195 HydrophobicContact CB-CG2 4.35Å; K189-S413 PolarHBondContact NZ-OG 3.12Å; K189-N449 PolarHBondContact NZ-O 3.37Å; K189-I451 HydrophobicContact CB-CD1 3.64Å; K189-I451 HydrophobicContact CB-CG1 4.03Å; K189-I451 HydrophobicContact CD-CD1 4.27Å; K189-I451 HydrophobicContact CD-CG1 3.83Å
190	L	76.8	Confident	73.8	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.3	172.5	-65	-180	0	0	0	112.6	L186 F187 S188 F198 L271 I451 V454	L186-L190 PolarHBondContact O-N 3.04Å; F187-L190 HydrophobicContact CD1-CD1 3.72Å; F187-L190 HydrophobicContact CE1-CD1 4.3Å; F187-L190 WeakPolarHBondContact O-CB 3.38Å; F187-L190 PolarHBondContact O-N 3.3Å; S188-L190 VanDerWaalsContact C-N 3.28Å; S188-L190 PolarHBondContact O-N 3.28Å; L190-F198 HydrophobicContact CD2-CD1 4.23Å; L190-F198 HydrophobicContact CD2-CD2 3.61Å; L190-F198 HydrophobicContact CD2-CE1 3.92Å; L190-F198 HydrophobicContact CD2-CE2 3.26Å; L190-F198 HydrophobicContact CD2-CG 4.08Å; L190-F198 HydrophobicContact CD2-CZ 3.42Å; L190-F198 VanDerWaalsContact CD2-CZ 3.42Å; L190-F198 WeakPolarHBondContact O-CB 3.15Å; L190-L271 HydrophobicContact CD1-CD2 3.97Å; L190-I451 HydrophobicContact CD2-CD1 4.12Å; L190-V454 HydrophobicContact CD2-CG1 4.02Å
191	V	74.6	Confident	74.8	Confident	59 Å²	59	54 Å²	54	36%	0.358	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-8.8	178.4	-130.6	0	0	0	0	112	F187 S188 K189 V193 P200 L214	F187-V191 VanDerWaalsContact O-CG2 3.29Å; F187-V191 WeakPolarHBondContact O-CG2 3.27Å; S188-V191 CarbonylContact O-C 3.56Å; S188-V191 PolarHBondContact O-N 3.08Å; K189-V191 PolarHBondContact O-N 2.93Å; V191-V193 PolarHBondContact O-N 2.94Å; V191-P200 HydrophobicContact CG1-CB 4.15Å; V191-P200 HydrophobicContact CG1-CG 4.13Å; V191-L214 HydrophobicContact CG1-CD1 3.71Å; V191-L214 HydrophobicContact CG2-CD1 4.25Å
192	D	73.5	Confident	76	Confident	62 Å²	62	52.4 Å²	52.4	33%	0.332	29%	0.285	S	S	.	.			trans	-80.7	107.3	179.8	-170.4	-2.3	0	0	0	110.6	S188 K189 K194 T195	S188-D192 PolarHBondContact O-N 3.01Å; K189-D192 PolarHBondContact O-N 3.47Å; D192-K194 PolarHBondContact O-N 3.37Å; D192-K194 VanDerWaalsContact OD1-CB 3.28Å; D192-K194 WeakPolarHBondContact OD1-CB 3.47Å; D192-K194 VanDerWaalsContact OD1-CG 3.29Å; D192-K194 WeakPolarHBondContact OD1-CG 3.41Å; D192-K194 PolarHBondContact OD1-N 3.42Å; D192-T195 HydrophobicContact CB-CG2 4.4Å; D192-T195 PolarHBondContact O-N 2.92Å; D192-T195 VanDerWaalsContact O-N 3.08Å; D192-T195 PolarHBondContact O-OG1 2.78Å
193	V	64.1	Low	77.5	Confident	106 Å²	106	58.2 Å²	58.2	64%	0.642	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-56.2	-24.1	177.9	-168.6	0	0	0	0	111.8	V191 T195 K196	V191-V193 PolarHBondContact O-N 2.94Å; V193-T195 PolarHBondContact O-N 3.49Å; V193-K196 PolarHBondContact O-N 3.18Å
194	K	69.9	Low	78.5	Confident	163 Å²	163	58.7 Å²	58.7	71%	0.709	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-63.2	-29.1	178.4	-66.1	177.4	-179.9	179.8	0	113.3	D192 K196	D192-K194 PolarHBondContact O-N 3.37Å; D192-K194 VanDerWaalsContact OD1-CB 3.28Å; D192-K194 WeakPolarHBondContact OD1-CB 3.47Å; D192-K194 VanDerWaalsContact OD1-CG 3.29Å; D192-K194 WeakPolarHBondContact OD1-CG 3.41Å; D192-K194 PolarHBondContact OD1-N 3.42Å; K194-K196 PolarHBondContact O-N 3.48Å
195	T	69	Low	79	Confident	10 Å²	10	60 Å²	60	6%	0.061	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-68.5	-19.6	-179.1	63.9	0	0	0	0	112.6	K189 D192 V193 S197 S411	K189-T195 HydrophobicContact CB-CG2 4.35Å; D192-T195 HydrophobicContact CB-CG2 4.4Å; D192-T195 PolarHBondContact O-N 2.92Å; D192-T195 VanDerWaalsContact O-N 3.08Å; D192-T195 PolarHBondContact O-OG1 2.78Å; V193-T195 PolarHBondContact O-N 3.49Å; T195-S197 PolarHBondContact O-N 3.47Å; T195-S197 PolarHBondContact O-OG 3.4Å; T195-S411 WeakPolarHBondContact O-CB 3.03Å; T195-S411 PolarHBondContact O-OG 2.87Å
196	K	79	Confident	79.1	Confident	148 Å²	148	58.7 Å²	58.7	64%	0.643	32%	0.317	S	S	*	.	S	Bend	trans	51.6	12.2	-173.7	-60.8	-175.5	179.1	-179.1	0	114.6	V193 K194 H219	V193-K196 PolarHBondContact O-N 3.18Å; K194-K196 PolarHBondContact O-N 3.48Å; K196-H219 PolarHBondContact O-CD2 3.39Å
197	S	86	Confident	78.6	Confident	1 Å²	1	69 Å²	69	1%	0.007	36%	0.356	C	S	.	.	S	Bend	trans	-92.3	-41	-178.8	-62.9	0	0	0	0	110.6	T195 L218 H219	T195-S197 PolarHBondContact O-N 3.47Å; T195-S197 PolarHBondContact O-OG 3.4Å; S197-L218 WeakPolarHBondContact O-CD1 3.43Å; S197-H219 PolarHBondContact O-N 3.05Å; S197-H219 VanDerWaalsContact O-N 3.1Å
198	F	88.6	Confident	77.8	Confident	3 Å²	3	76.1 Å²	76.1	1%	0.013	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.7	-178.5	-59.9	-85.2	0	0	0	111	L190 R217 L218 F269 I451 I455 L458	L190-F198 HydrophobicContact CD2-CD1 4.23Å; L190-F198 HydrophobicContact CD2-CD2 3.61Å; L190-F198 HydrophobicContact CD2-CE1 3.92Å; L190-F198 HydrophobicContact CD2-CE2 3.26Å; L190-F198 HydrophobicContact CD2-CG 4.08Å; L190-F198 HydrophobicContact CD2-CZ 3.42Å; L190-F198 VanDerWaalsContact CD2-CZ 3.42Å; L190-F198 WeakPolarHBondContact O-CB 3.15Å; F198-R217 CarbonylContact C-O 3.58Å; F198-R217 VanDerWaalsContact CA-O 3.29Å; F198-R217 WeakPolarHBondContact CA-O 3.48Å; F198-L218 HydrophobicContact CD1-CB 4.09Å; F198-L218 HydrophobicContact CD1-CD1 4.15Å; F198-L218 HydrophobicContact CE1-CB 3.99Å; F198-L218 HydrophobicContact CE1-CD1 3.71Å; F198-L218 HydrophobicContact CE1-CD2 4.42Å; F198-L218 HydrophobicContact CE1-CG 4.23Å; F198-L218 HydrophobicContact CZ-CD1 3.94Å; F198-F269 HydrophobicContact CE1-CZ 4.33Å; F198-I451 HydrophobicContact CE2-CD1 4.41Å; F198-I451 HydrophobicContact CE2-CG2 3.88Å; F198-I455 HydrophobicContact CE2-CD1 4.35Å; F198-I455 HydrophobicContact CE2-CG1 3.94Å; F198-I455 HydrophobicContact CZ-CD1 4.44Å; F198-I455 HydrophobicContact CZ-CG1 3.61Å; F198-L458 HydrophobicContact CE1-CD1 3.71Å; F198-L458 HydrophobicContact CZ-CD1 3.94Å
199	E	89.4	Confident	77	Confident	73 Å²	73	75 Å²	75	34%	0.341	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	116	170.6	-179.1	-169.3	176.6	0	0	108.4	L201 R217 H219	E199-L201 HydrophobicContact CG-CD2 4.04Å; E199-L201 PolarHBondContact O-N 2.86Å; E199-R217 HydrophobicContact CB-CB 4.23Å; E199-R217 PolarHBondContact N-O 2.86Å; E199-R217 PolarHBondContact O-N 2.84Å; E199-R217 IonicContact OE1-NH1 3.28Å; E199-R217 WeakPolarHBondContact OE2-CD 3.49Å; E199-R217 IonicContact OE2-CZ 3.29Å; E199-R217 IonicContact OE2-NE 3.64Å; E199-R217 IonicContact OE2-NH1 3.52Å; E199-R217 PolarHBondContact OE2-NH1 3.16Å; E199-H219 IonicContact OE2-CE1 3.75Å; E199-H219 IonicContact OE2-NE2 2.67Å
200	P	89.9	Confident	76.5	Confident	49 Å²	49	74.2 Å²	74.2	32%	0.318	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	117.4	172.7	28.6	-31.7	0	0	0	110.2	V191 L216	V191-P200 HydrophobicContact CG1-CB 4.15Å; V191-P200 HydrophobicContact CG1-CG 4.13Å; P200-L216 HydrophobicContact CB-CD2 4.14Å
201	L	89.8	Confident	75.8	Confident	63 Å²	63	74.2 Å²	74.2	33%	0.33	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-38.3	-177	-61.8	-175.6	0	0	0	113	E199 T215 R217 I268	E199-L201 HydrophobicContact CG-CD2 4.04Å; E199-L201 PolarHBondContact O-N 2.86Å; L201-T215 HydrophobicContact CB-CG2 4.24Å; L201-T215 HydrophobicContact CD1-CG2 4.36Å; L201-T215 PolarHBondContact N-O 3.41Å; L201-R217 HydrophobicContact CD1-CB 3.92Å; L201-R217 HydrophobicContact CD2-CB 4.18Å; L201-R217 HydrophobicContact CG-CB 3.96Å; L201-I268 HydrophobicContact CD1-CD1 4.02Å; L201-I268 HydrophobicContact CD1-CG1 4.15Å; L201-I268 HydrophobicContact CD1-CG2 3.93Å
202	N	89.7	Confident	76	Confident	105 Å²	105	73.2 Å²	73.2	56%	0.561	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.4	156	-177.7	-157.3	1	0	0	0	111.3	L214 T215	N202-L214 CarbonylContact O-C 3.59Å; N202-L214 WeakPolarHBondContact O-CA 3.48Å; N202-T215 PolarHBondContact N-O 2.96Å; N202-T215 PolarHBondContact O-N 3.41Å
203	M	86.1	Confident	76.7	Confident	138 Å²	138	70.5 Å²	70.5	68%	0.68	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.9	168.3	-75.7	-173.8	59.5	0	0	110.4	P205 L214	M203-P205 WeakPolarHBondContact O-CD 3.35Å; M203-L214 HydrophobicContact CG-CD2 3.82Å
204	I	84.9	Confident	78	Confident	11 Å²	11	66.4 Å²	66.4	6%	0.056	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.2	170.7	-55.2	171.3	0	0	0	106.3	G206 A212 G213 D270	I204-G206 PolarHBondContact O-N 2.89Å; I204-A212 WeakPolarHBondContact O-CA 3.46Å; I204-G213 PolarHBondContact N-O 3.44Å; I204-G213 PolarHBondContact O-N 2.79Å; I204-G213 VanDerWaalsContact O-N 3.12Å; I204-D270 HydrophobicContact CD1-CB 3.68Å
205	P	75.8	Confident	79	Confident	88 Å²	88	59 Å²	59	57%	0.571	32%	0.315	S	S	*	.			trans	-68.8	118.6	179.8	23.8	-27.1	0	0	0	108.9	M203	M203-P205 WeakPolarHBondContact O-CD 3.35Å
206	G	71.4	Confident	80.1	Confident	33 Å²	33	58.5 Å²	58.5	34%	0.34	31%	0.312	S	S	.	.			trans	-68.7	154.6	174.3	0	0	0	0	0	111.4	I204 F210	I204-G206 PolarHBondContact O-N 2.89Å; G206-F210 CarbonylContact C-O 3.34Å; G206-F210 WeakPolarHBondContact CA-O 3.45Å
207	R	66.1	Low	80.7	Confident	216 Å²	216	55 Å²	55	82%	0.815	29%	0.294	S	S	*	.	B	Isolated β-bridge	trans	-111.7	125.3	175.1	-139.3	-178.6	-174.5	-171.2	1.1	109	G209 F210	R207-G209 PolarHBondContact O-N 3.4Å; R207-G209 VanDerWaalsContact O-N 3.15Å; R207-F210 PolarHBondContact N-O 2.85Å; R207-F210 PolarHBondContact O-N 3.07Å
208	M	57.1	Low	81	Confident	165 Å²	165	54.9 Å²	54.9	81%	0.813	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	34.3	-175.1	-65	177.5	158.3	0	0	112.9	F210	M208-F210 WeakPolarHBondContact O-CD2 3.35Å; M208-F210 PolarHBondContact O-N 3.22Å
209	G	58.1	Low	81	Confident	40 Å²	40	57.2 Å²	57.2	41%	0.412	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-1.2	-176.8	0	0	0	0	0	115.2	R207 R296	R207-G209 PolarHBondContact O-N 3.4Å; R207-G209 VanDerWaalsContact O-N 3.15Å; G209-R296 PolarHBondContact O-NH1 2.73Å; G209-R296 PolarHBondContact O-NH2 3.22Å
210	F	65.9	Low	80.9	Confident	22 Å²	22	57.5 Å²	57.5	10%	0.096	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-91.5	142.8	174.4	-73.9	-97.7	0	0	0	111.9	G206 R207 M208 A212 R296 L297 E322	G206-F210 CarbonylContact C-O 3.34Å; G206-F210 WeakPolarHBondContact CA-O 3.45Å; R207-F210 PolarHBondContact N-O 2.85Å; R207-F210 PolarHBondContact O-N 3.07Å; M208-F210 WeakPolarHBondContact O-CD2 3.35Å; M208-F210 PolarHBondContact O-N 3.22Å; F210-A212 PolarHBondContact O-N 3.31Å; F210-R296 HydrophobicContact CE1-CB 4.4Å; F210-R296 HydrophobicContact CE1-CG 3.72Å; F210-R296 HydrophobicContact CE2-CB 4.17Å; F210-R296 HydrophobicContact CE2-CG 3.9Å; F210-R296 HydrophobicContact CZ-CB 3.57Å; F210-R296 HydrophobicContact CZ-CG 3.26Å; F210-R296 WeakPolarHBondContact CZ-O 3.09Å; F210-L297 HydrophobicContact CD1-CD2 4.29Å; F210-L297 HydrophobicContact CE1-CD2 3.92Å; F210-E322 HydrophobicContact CD1-CB 4.45Å; F210-E322 HydrophobicContact CD2-CB 4.16Å; F210-E322 HydrophobicContact CD2-CG 4.46Å; F210-E322 HydrophobicContact CE2-CB 4.3Å; F210-E322 HydrophobicContact CE2-CG 4.49Å; F210-E322 HydrophobicContact CG-CB 4.21Å; F210-E322 HydrophobicContact CZ-CB 4.45Å
211	G	62.1	Low	80.7	Confident	4 Å²	4	60.1 Å²	60.1	4%	0.041	32%	0.317	C	S	.	.	S	Bend	trans	72.2	13.1	167.6	0	0	0	0	0	115.4	H272	G211-H272 PolarHBondContact O-ND1 3.39Å
212	A	80.1	Confident	80.6	Confident	37 Å²	37	57.2 Å²	57.2	31%	0.306	30%	0.302	S	S	.	.			trans	-56.9	140.9	165.3	0	0	0	0	0	108.7	I204 F210 Y273	I204-A212 WeakPolarHBondContact O-CA 3.46Å; F210-A212 PolarHBondContact O-N 3.31Å; A212-Y273 WeakPolarHBondContact O-CB 3.44Å; A212-Y273 PolarHBondContact O-N 2.85Å
213	G	87.7	Confident	80.5	Confident	5 Å²	5	52.2 Å²	52.2	5%	0.052	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	-174.6	-171.5	0	0	0	0	0	112.6	I204 L271	I204-G213 PolarHBondContact N-O 3.44Å; I204-G213 PolarHBondContact O-N 2.79Å; I204-G213 VanDerWaalsContact O-N 3.12Å; G213-L271 CarbonylContact C-O 3.54Å; G213-L271 WeakPolarHBondContact CA-O 3.41Å
214	L	90.5	Very high	80.4	Confident	21 Å²	21	47.9 Å²	47.9	11%	0.11	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.3	178.2	-63.9	173.6	0	0	0	109.4	V191 N202 M203 L216 L271 Y273	V191-L214 HydrophobicContact CG1-CD1 3.71Å; V191-L214 HydrophobicContact CG2-CD1 4.25Å; N202-L214 CarbonylContact O-C 3.59Å; N202-L214 WeakPolarHBondContact O-CA 3.48Å; M203-L214 HydrophobicContact CG-CD2 3.82Å; L214-L216 HydrophobicContact CB-CD2 4.06Å; L214-L216 HydrophobicContact CB-CG 4.01Å; L214-L216 HydrophobicContact CD1-CD2 4.17Å; L214-L271 PolarHBondContact N-O 2.73Å; L214-L271 PolarHBondContact O-N 3.44Å; L214-Y273 HydrophobicContact CD1-CE2 4.18Å; L214-Y273 WeakPolarHBondContact CD1-OH 3.45Å; L214-Y273 HydrophobicContact CG-CE2 4.1Å
215	T	92	Very high	80.3	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117	156.5	-58.2	0	0	0	0	107.1	L201 N202 I268 F269 D270	L201-T215 HydrophobicContact CB-CG2 4.24Å; L201-T215 HydrophobicContact CD1-CG2 4.36Å; L201-T215 PolarHBondContact N-O 3.41Å; N202-T215 PolarHBondContact N-O 2.96Å; N202-T215 PolarHBondContact O-N 3.41Å; T215-I268 HydrophobicContact CG2-CG2 3.76Å; T215-F269 CarbonylContact C-O 3.58Å; T215-F269 WeakPolarHBondContact CA-O 3.4Å; T215-D270 WeakPolarHBondContact CB-OD1 3.44Å; T215-D270 WeakPolarHBondContact CG2-OD1 3.36Å; T215-D270 PolarHBondContact OG1-OD1 3.17Å
216	L	92.3	Very high	80.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.5	-179	-65.9	170.6	0	0	0	109.8	P200 L214 I268 F269 L271	P200-L216 HydrophobicContact CB-CD2 4.14Å; L214-L216 HydrophobicContact CB-CD2 4.06Å; L214-L216 HydrophobicContact CB-CG 4.01Å; L214-L216 HydrophobicContact CD1-CD2 4.17Å; L216-I268 WeakPolarHBondContact O-CA 3.27Å; L216-F269 HydrophobicContact CB-CE1 4.05Å; L216-F269 HydrophobicContact CB-CE2 4.19Å; L216-F269 HydrophobicContact CB-CZ 3.81Å; L216-F269 HydrophobicContact CD1-CE2 4.02Å; L216-F269 HydrophobicContact CD1-CZ 3.92Å; L216-F269 PolarHBondContact N-O 2.87Å; L216-F269 PolarHBondContact O-N 3.43Å; L216-L271 HydrophobicContact CD1-CB 4.17Å; L216-L271 HydrophobicContact CD1-CD2 3.88Å
217	R	92	Very high	81.2	Confident	73 Å²	73	45 Å²	45	28%	0.275	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.2	164.3	179.1	-173.6	-74.8	163.4	-6.3	108.5	F198 E199 L201 D266 F267 I268	F198-R217 CarbonylContact C-O 3.58Å; F198-R217 VanDerWaalsContact CA-O 3.29Å; F198-R217 WeakPolarHBondContact CA-O 3.48Å; E199-R217 HydrophobicContact CB-CB 4.23Å; E199-R217 PolarHBondContact N-O 2.86Å; E199-R217 PolarHBondContact O-N 2.84Å; E199-R217 IonicContact OE1-NH1 3.28Å; E199-R217 WeakPolarHBondContact OE2-CD 3.49Å; E199-R217 IonicContact OE2-CZ 3.29Å; E199-R217 IonicContact OE2-NE 3.64Å; E199-R217 IonicContact OE2-NH1 3.52Å; E199-R217 PolarHBondContact OE2-NH1 3.16Å; L201-R217 HydrophobicContact CD1-CB 3.92Å; L201-R217 HydrophobicContact CD2-CB 4.18Å; L201-R217 HydrophobicContact CG-CB 3.96Å; R217-D266 WeakPolarHBondContact CD-OD2 3.42Å; R217-D266 HydrophobicContact CG-CB 3.75Å; R217-F267 WeakPolarHBondContact CA-O 3.45Å; R217-I268 HydrophobicContact CB-CG1 4.23Å; R217-I268 HydrophobicContact CG-CG1 4.16Å
218	L	91.1	Very high	81.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.1	170	167.6	63.1	0	0	0	108.3	S197 F198 A222 Q223 D266 F267 F269 I455 M459	S197-L218 WeakPolarHBondContact O-CD1 3.43Å; F198-L218 HydrophobicContact CD1-CB 4.09Å; F198-L218 HydrophobicContact CD1-CD1 4.15Å; F198-L218 HydrophobicContact CE1-CB 3.99Å; F198-L218 HydrophobicContact CE1-CD1 3.71Å; F198-L218 HydrophobicContact CE1-CD2 4.42Å; F198-L218 HydrophobicContact CE1-CG 4.23Å; F198-L218 HydrophobicContact CZ-CD1 3.94Å; L218-A222 HydrophobicContact CD1-CB 3.77Å; L218-Q223 HydrophobicContact CD1-CG 4.34Å; L218-Q223 HydrophobicContact CD2-CG 3.64Å; L218-Q223 HydrophobicContact CG-CG 3.61Å; L218-Q223 PolarHBondContact O-NE2 3.43Å; L218-D266 WeakPolarHBondContact O-CA 3.49Å; L218-F267 HydrophobicContact CB-CB 4.27Å; L218-F267 HydrophobicContact CD2-CD1 4.29Å; L218-F267 PolarHBondContact N-O 2.8Å; L218-F267 PolarHBondContact O-N 2.92Å; L218-F269 HydrophobicContact CB-CE1 4.08Å; L218-I455 HydrophobicContact CD1-CD1 4.24Å; L218-I455 HydrophobicContact CD1-CG1 3.97Å; L218-I455 HydrophobicContact CD1-CG2 4.23Å; L218-I455 HydrophobicContact CD2-CG2 4.07Å; L218-M459 HydrophobicContact CD2-CG 4.41Å; L218-M459 HydrophobicContact CD2-SD 4.24Å
219	H	89.9	Confident	82.8	Confident	52 Å²	52	29.1 Å²	29.1	24%	0.241	17%	0.168	C	C	.	.			trans	-66.1	147.6	-175.5	-68.8	-60.9	0	0	0	112.2	K196 S197 E199 Q221 A222 Q223 D266	K196-H219 PolarHBondContact O-CD2 3.39Å; S197-H219 PolarHBondContact O-N 3.05Å; S197-H219 VanDerWaalsContact O-N 3.1Å; E199-H219 IonicContact OE2-CE1 3.75Å; E199-H219 IonicContact OE2-NE2 2.67Å; H219-Q221 PolarHBondContact O-N 3.26Å; H219-A222 WeakPolarHBondContact O-CB 3.4Å; H219-A222 PolarHBondContact O-N 3.27Å; H219-Q223 WeakPolarHBondContact O-CG 3.48Å; H219-Q223 PolarHBondContact O-N 3.09Å; H219-D266 WeakPolarHBondContact CA-OD1 3.23Å; H219-D266 IonicContact CE1-OD2 2.72Å; H219-D266 IonicContact ND1-OD2 3.65Å; H219-D266 PolarHBondContact ND1-OD2 3.46Å
220	N	86.7	Confident	83.8	Confident	78 Å²	78	27.2 Å²	27.2	42%	0.417	15%	0.148	S	C	.	.	H	α-helix	trans	-59.7	-36.7	-179	88.5	-7.7	0	0	0	112.6	A222 Q223 M224 L264 D266	N220-A222 PolarHBondContact O-N 3.15Å; N220-Q223 CarbonylContact O-C 3.58Å; N220-Q223 WeakPolarHBondContact O-CA 3.43Å; N220-Q223 WeakPolarHBondContact O-CB 3.28Å; N220-Q223 PolarHBondContact O-N 2.93Å; N220-M224 VanDerWaalsContact O-CG 3.27Å; N220-M224 WeakPolarHBondContact O-CG 3.48Å; N220-M224 PolarHBondContact O-N 3.41Å; N220-L264 WeakPolarHBondContact CB-O 3.44Å; N220-L264 PolarHBondContact ND2-O 3.46Å; N220-D266 PolarHBondContact N-OD1 2.92Å
221	Q	86.2	Confident	84.3	Confident	104 Å²	104	26.2 Å²	26.2	49%	0.486	14%	0.143	S	C	.	.	H	α-helix	trans	-62.9	-39.7	-178.1	-172.8	179.9	4.5	0	0	110	H219 M224 A225	H219-Q221 PolarHBondContact O-N 3.26Å; Q221-M224 PolarHBondContact O-N 2.49Å; Q221-A225 PolarHBondContact O-N 3.37Å; Q221-A225 VanDerWaalsContact O-N 3.07Å
222	A	87.1	Confident	84.5	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-65.5	-41.3	174	0	0	0	0	0	113	L218 H219 N220 A226 Y412 I455	L218-A222 HydrophobicContact CD1-CB 3.77Å; H219-A222 WeakPolarHBondContact O-CB 3.4Å; H219-A222 PolarHBondContact O-N 3.27Å; N220-A222 PolarHBondContact O-N 3.15Å; A222-A226 WeakPolarHBondContact O-CB 3.36Å; A222-A226 PolarHBondContact O-N 3.08Å; A222-Y412 VanDerWaalsContact CA-OH 3.26Å; A222-Y412 WeakPolarHBondContact CA-OH 3.37Å; A222-I455 HydrophobicContact CB-CD1 4.16Å
223	Q	88.2	Confident	82.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-51.4	172.7	-62.1	173.2	67.6	0	0	110	L218 H219 N220 A225 A226 L227 N265 M459	L218-Q223 HydrophobicContact CD1-CG 4.34Å; L218-Q223 HydrophobicContact CD2-CG 3.64Å; L218-Q223 HydrophobicContact CG-CG 3.61Å; L218-Q223 PolarHBondContact O-NE2 3.43Å; H219-Q223 WeakPolarHBondContact O-CG 3.48Å; H219-Q223 PolarHBondContact O-N 3.09Å; N220-Q223 CarbonylContact O-C 3.58Å; N220-Q223 WeakPolarHBondContact O-CA 3.43Å; N220-Q223 WeakPolarHBondContact O-CB 3.28Å; N220-Q223 PolarHBondContact O-N 2.93Å; Q223-A225 PolarHBondContact O-N 3.26Å; Q223-A226 PolarHBondContact O-N 3.11Å; Q223-L227 WeakPolarHBondContact O-CG 3.19Å; Q223-L227 PolarHBondContact O-N 3.35Å; Q223-L227 VanDerWaalsContact O-N 3.08Å; Q223-N265 PolarHBondContact NE2-O 3.31Å; Q223-M459 HydrophobicContact CB-CE 4.02Å; Q223-M459 HydrophobicContact CB-SD 4.02Å; Q223-M459 HydrophobicContact CG-CE 4.16Å; Q223-M459 HydrophobicContact CG-CG 4.41Å; Q223-M459 HydrophobicContact CG-SD 3.57Å; Q223-M459 VanDerWaalsContact CG-SD 3.57Å; Q223-M459 PolarHBondContact OE1-SD 2.97Å
224	M	82.9	Confident	80.8	Confident	48 Å²	48	35 Å²	35	24%	0.236	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-42.6	-174.1	-64.4	-54.8	-106.2	0	0	112.9	I118 N220 Q221 A226 L227 L264	I118-M224 HydrophobicContact CG2-CE 3.33Å; N220-M224 VanDerWaalsContact O-CG 3.27Å; N220-M224 WeakPolarHBondContact O-CG 3.48Å; N220-M224 PolarHBondContact O-N 3.41Å; Q221-M224 PolarHBondContact O-N 2.49Å; M224-A226 VanDerWaalsContact C-N 3.26Å; M224-A226 PolarHBondContact O-N 2.79Å; M224-L227 PolarHBondContact O-N 2.86Å; M224-L227 HydrophobicContact SD-CD1 3.58Å; M224-L227 VanDerWaalsContact SD-CD1 3.58Å; M224-L264 HydrophobicContact SD-CB 4.48Å; M224-L264 HydrophobicContact SD-CD1 3.62Å
225	A	83.4	Confident	78.2	Confident	39 Å²	39	38.4 Å²	38.4	32%	0.322	20%	0.195	S	C	.	.	H	α-helix	trans	-73.7	-19.7	-179.8	0	0	0	0	0	113.3	Q221 Q223 L407 Y412	Q221-A225 PolarHBondContact O-N 3.37Å; Q221-A225 VanDerWaalsContact O-N 3.07Å; Q223-A225 PolarHBondContact O-N 3.26Å; A225-L407 HydrophobicContact CB-CD2 4.28Å; A225-Y412 HydrophobicContact CB-CE1 4.02Å; A225-Y412 HydrophobicContact CB-CE2 3.85Å; A225-Y412 VanDerWaalsContact CB-CZ 3.43Å; A225-Y412 WeakPolarHBondContact CB-OH 2.89Å
226	A	85.3	Confident	75.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-90.8	-13.5	176.4	0	0	0	0	0	113.5	A222 Q223 M224 D228 K452 I455 Q456	A222-A226 WeakPolarHBondContact O-CB 3.36Å; A222-A226 PolarHBondContact O-N 3.08Å; Q223-A226 PolarHBondContact O-N 3.11Å; M224-A226 VanDerWaalsContact C-N 3.26Å; M224-A226 PolarHBondContact O-N 2.79Å; A226-D228 PolarHBondContact O-N 2.81Å; A226-K452 HydrophobicContact CB-CG 4.1Å; A226-I455 HydrophobicContact CB-CB 3.82Å; A226-I455 HydrophobicContact CB-CD1 4.46Å; A226-I455 HydrophobicContact CB-CG2 3.35Å; A226-Q456 HydrophobicContact CB-CG 4.27Å; A226-Q456 WeakPolarHBondContact O-CG 3.37Å; A226-Q456 PolarHBondContact O-NE2 3.39Å
227	L	81	Confident	72.5	Confident	32 Å²	32	53.2 Å²	53.2	17%	0.168	27%	0.268	C	S	.	.			trans	-59.6	133.9	-177.1	-82.6	173.7	0	0	0	112	Q223 M224 V231 Y232 L264 M459	Q223-L227 WeakPolarHBondContact O-CG 3.19Å; Q223-L227 PolarHBondContact O-N 3.35Å; Q223-L227 VanDerWaalsContact O-N 3.08Å; M224-L227 PolarHBondContact O-N 2.86Å; M224-L227 HydrophobicContact SD-CD1 3.58Å; M224-L227 VanDerWaalsContact SD-CD1 3.58Å; L227-V231 HydrophobicContact CD2-CB 4.17Å; L227-V231 HydrophobicContact CD2-CG1 3.96Å; L227-V231 HydrophobicContact CD2-CG2 4.29Å; L227-Y232 HydrophobicContact CD2-CD2 4.33Å; L227-Y232 HydrophobicContact CD2-CE2 3.63Å; L227-L264 HydrophobicContact CD1-CD1 4.24Å; L227-M459 HydrophobicContact CD2-CE 4.35Å
228	D	80.1	Confident	69.6	Low	24 Å²	24	57.6 Å²	57.6	13%	0.128	29%	0.289	C	S	.	.			trans	-145.6	179.5	168.9	66.8	21.2	0	0	0	110.2	H100 A226 S230 V231 Q456	H100-D228 VanDerWaalsContact CE1-CG 3.49Å; H100-D228 IonicContact CE1-OD1 3.83Å; H100-D228 IonicContact CE1-OD2 2.67Å; H100-D228 PolarHBondContact CE1-OD2 2.94Å; H100-D228 VanDerWaalsContact CE1-OD2 3.29Å; H100-D228 IonicContact NE2-OD2 3.96Å; A226-D228 PolarHBondContact O-N 2.81Å; D228-S230 VanDerWaalsContact CG-OG 3.3Å; D228-S230 PolarHBondContact O-N 2.84Å; D228-S230 VanDerWaalsContact O-N 3.11Å; D228-S230 WeakPolarHBondContact OD1-CA 3.18Å; D228-S230 WeakPolarHBondContact OD1-CB 3.48Å; D228-S230 PolarHBondContact OD1-N 2.86Å; D228-S230 PolarHBondContact OD1-OG 3.37Å; D228-S230 PolarHBondContact OD2-OG 3.18Å; D228-V231 PolarHBondContact O-N 3.29Å; D228-V231 PolarHBondContact OD1-N 3.44Å; D228-Q456 PolarHBondContact OD2-NE2 2.87Å
229	S	75.5	Confident	66.5	Low	23 Å²	23	67.1 Å²	67.1	16%	0.161	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.3	179.6	60.1	0	0	0	0	114.4	H100	H100-S229 WeakPolarHBondContact CB-OG 3.46Å; H100-S229 PolarHBondContact N-OG 3.4Å; H100-S229 PolarHBondContact ND1-OG 2.91Å
230	S	79.2	Confident	63.5	Low	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-20.3	177.7	82.2	0	0	0	0	113	I67 D228 R442	I67-S230 WeakPolarHBondContact CD1-O 3.37Å; D228-S230 VanDerWaalsContact CG-OG 3.3Å; D228-S230 PolarHBondContact O-N 2.84Å; D228-S230 VanDerWaalsContact O-N 3.11Å; D228-S230 WeakPolarHBondContact OD1-CA 3.18Å; D228-S230 WeakPolarHBondContact OD1-CB 3.48Å; D228-S230 PolarHBondContact OD1-N 2.86Å; D228-S230 PolarHBondContact OD1-OG 3.37Å; D228-S230 PolarHBondContact OD2-OG 3.18Å; S230-R442 PolarHBondContact O-NH1 2.97Å; S230-R442 VanDerWaalsContact O-NH1 3.08Å; S230-R442 VanDerWaalsContact OG-CZ 3.28Å; S230-R442 PolarHBondContact OG-NH1 2.96Å; S230-R442 PolarHBondContact OG-NH2 3.44Å
231	V	77.8	Confident	60.7	Low	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-39.1	-178.9	176.2	0	0	0	0	111.4	L227 D228 Q456 M459 S463	L227-V231 HydrophobicContact CD2-CB 4.17Å; L227-V231 HydrophobicContact CD2-CG1 3.96Å; L227-V231 HydrophobicContact CD2-CG2 4.29Å; D228-V231 PolarHBondContact O-N 3.29Å; D228-V231 PolarHBondContact OD1-N 3.44Å; V231-Q456 HydrophobicContact CG2-CB 4.45Å; V231-Q456 HydrophobicContact CG2-CG 4.48Å; V231-M459 HydrophobicContact CG1-CB 3.55Å; V231-M459 HydrophobicContact CG2-CB 4.27Å; V231-S463 PolarHBondContact O-OG 3.26Å; V231-S463 VanDerWaalsContact O-OG 3.09Å
232	Y	66.2	Low	58	Low	118 Å²	118	76.7 Å²	76.7	46%	0.463	37%	0.374	S	S	.	.	S	Bend	trans	-115.8	76.1	177.1	-59.7	-79.5	0	0	0	108.7	L227 P234	L227-Y232 HydrophobicContact CD2-CD2 4.33Å; L227-Y232 HydrophobicContact CD2-CE2 3.63Å; Y232-P234 WeakPolarHBondContact O-CD 3.28Å
233	F	46.2	Very low	55.3	Low	22 Å²	22	83.7 Å²	83.7	10%	0.096	41%	0.411	C	S	.	.			trans	-98.4	92.6	169.1	-146.5	-102.2	0	0	0	108.8	I67 Q99 E235	I67-F233 HydrophobicContact CD1-CB 4.37Å; Q99-F233 HydrophobicContact CG-CE2 4.39Å; F233-E235 HydrophobicContact CD1-CB 3.84Å; F233-E235 HydrophobicContact CD1-CG 4.25Å; F233-E235 HydrophobicContact CE1-CB 3.55Å; F233-E235 HydrophobicContact CE1-CG 3.52Å; F233-E235 HydrophobicContact CZ-CB 4.39Å; F233-E235 HydrophobicContact CZ-CG 3.9Å; F233-E235 WeakPolarHBondContact CZ-OE1 3.1Å
234	P	42.9	Very low	52.6	Low	91 Å²	91	88.9 Å²	88.9	59%	0.591	44%	0.439	S	S	*	.			trans	-102.5	84.3	162.6	35.6	-28.7	0	0	0	108.4	Y232 K236	Y232-P234 WeakPolarHBondContact O-CD 3.28Å; P234-K236 PolarHBondContact O-N 2.98Å
235	E	37.1	Very low	50	Low	93 Å²	93	93.9 Å²	93.9	44%	0.435	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-80.1	23.3	178.3	-130	-171.3	-161.8	0	0	113.6	F233 T237	F233-E235 HydrophobicContact CD1-CB 3.84Å; F233-E235 HydrophobicContact CD1-CG 4.25Å; F233-E235 HydrophobicContact CE1-CB 3.55Å; F233-E235 HydrophobicContact CE1-CG 3.52Å; F233-E235 HydrophobicContact CZ-CB 4.39Å; F233-E235 HydrophobicContact CZ-CG 3.9Å; F233-E235 WeakPolarHBondContact CZ-OE1 3.1Å; E235-T237 PolarHBondContact O-N 2.79Å
236	K	34.3	Very low	47.5	Very low	210 Å²	210	101.7 Å²	101.7	91%	0.913	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-79.4	5.6	174.8	-93.3	-174.8	177.4	178.2	0	114.5	P234	P234-K236 PolarHBondContact O-N 2.98Å
237	T	30.5	Very low	44.8	Very low	108 Å²	108	110.5 Å²	110.5	66%	0.663	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-119.9	16.5	-175.4	-2.1	0	0	0	0	116.1	E235	E235-T237 PolarHBondContact O-N 2.79Å
238	F	29.7	Very low	42.3	Very low	164 Å²	164	112.1 Å²	112.1	72%	0.719	54%	0.535	S	S	*	.	S	Bend	trans	-104.6	12.7	177.7	-112.6	-83.8	0	0	0	116.4
239	K	27	Very low	39.9	Very low	200 Å²	200	117.5 Å²	117.5	87%	0.87	56%	0.562	S	S	*	*	S	Bend	trans	-123.9	7.1	177.6	-77.3	-169.9	177.4	-178.8	0	117.4
240	H	27.3	Very low	37.8	Very low	184 Å²	184	124.2 Å²	124.2	85%	0.852	60%	0.596	S	S	*	*	S	Bend	trans	-127.1	0.4	173.5	-93.2	20.5	0	0	0	116.6
241	S	27.7	Very low	35.2	Very low	46 Å²	46	132.7 Å²	132.7	32%	0.322	63%	0.632	S	S	.	*			trans	-113.1	10.4	-176.4	82.8	0	0	0	0	117.3	N243 Y245	S241-N243 PolarHBondContact O-N 2.74Å; S241-Y245 PolarHBondContact O-N 2.89Å
242	K	29.4	Very low	32.7	Very low	205 Å²	205	139.7 Å²	139.7	89%	0.891	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-16.4	172.8	-117.2	-178.4	-177.9	-178.5	0	113.6
243	N	29.7	Very low	30.8	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-17.5	177.8	-77.9	-5.4	0	0	0	114.7	S241	S241-N243 PolarHBondContact O-N 2.74Å
244	D	30.5	Very low	29.8	Very low	109 Å²	109	149.7 Å²	149.7	58%	0.583	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-18.2	179.2	-74.9	-32	0	0	0	114.3	K246 K247 S248	D244-K246 PolarHBondContact O-N 2.85Å; D244-K246 VanDerWaalsContact O-N 3.16Å; D244-K247 PolarHBondContact O-N 3.44Å; D244-K247 VanDerWaalsContact O-N 3.11Å; D244-S248 PolarHBondContact O-N 3.06Å; D244-S248 PolarHBondContact O-OG 3.47Å
245	Y	29.8	Very low	28.9	Very low	154 Å²	154	151.2 Å²	151.2	60%	0.604	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-17.7	-178.9	-116.7	-89.3	0	0	0	114.7	S241 I249	S241-Y245 PolarHBondContact O-N 2.89Å; Y245-I249 HydrophobicContact CD1-CD1 4.2Å; Y245-I249 WeakPolarHBondContact O-CD1 3.43Å
246	K	29.7	Very low	28.6	Very low	202 Å²	202	152.3 Å²	152.3	88%	0.878	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-11.3	177	-131	179.2	-176.5	-178.1	0	113.2	D244	D244-K246 PolarHBondContact O-N 2.85Å; D244-K246 VanDerWaalsContact O-N 3.16Å
247	K	29.4	Very low	28.3	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-19	179.4	-88.1	-176.7	174.1	180	0	114.1	D244	D244-K247 PolarHBondContact O-N 3.44Å; D244-K247 VanDerWaalsContact O-N 3.11Å
248	S	27.9	Very low	28.4	Very low	66 Å²	66	146.7 Å²	146.7	46%	0.462	73%	0.725	S	S	.	*	S	Bend	trans	-93.6	-11	-178.4	61.4	0	0	0	0	115.7	D244 L250 K251	D244-S248 PolarHBondContact O-N 3.06Å; D244-S248 PolarHBondContact O-OG 3.47Å; S248-L250 PolarHBondContact O-N 3.27Å; S248-L250 VanDerWaalsContact O-N 3.14Å; S248-K251 PolarHBondContact O-N 3.02Å
249	I	30.8	Very low	28.5	Very low	137 Å²	137	146.3 Å²	146.3	70%	0.703	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-3.1	179.9	-66.6	176.5	0	0	0	113	Y245	Y245-I249 HydrophobicContact CD1-CD1 4.2Å; Y245-I249 WeakPolarHBondContact O-CD1 3.43Å
250	L	30.9	Very low	28.9	Very low	164 Å²	164	140.6 Å²	140.6	86%	0.859	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-5.7	176.8	-96.7	155.8	0	0	0	115.5	S248	S248-L250 PolarHBondContact O-N 3.27Å; S248-L250 VanDerWaalsContact O-N 3.14Å
251	K	24.7	Very low	29.4	Very low	178 Å²	178	134.7 Å²	134.7	77%	0.774	69%	0.69	S	S	*	*	S	Bend	trans	-149	127.1	174.6	-74.7	-172.1	176.7	178.2	0	111	S248	S248-K251 PolarHBondContact O-N 3.02Å
252	E	26	Very low	29.7	Very low	147 Å²	147	135.4 Å²	135.4	69%	0.687	69%	0.69	S	S	*	*			trans	83.1	104.5	164.4	-62.2	175.4	175.4	0	0	118	Y254	E252-Y254 HydrophobicContact CB-CD2 4.3Å; E252-Y254 HydrophobicContact CB-CE2 4.32Å; E252-Y254 PolarHBondContact O-N 2.66Å
253	T	24.6	Very low	30.5	Very low	149 Å²	149	132.6 Å²	132.6	91%	0.914	68%	0.675	S	S	*	*			trans	-47.2	93.5	152.7	31.7	0	0	0	0	111.6
254	Y	25.2	Very low	32	Very low	202 Å²	202	126.4 Å²	126.4	79%	0.792	64%	0.642	S	S	*	*			trans	-85	107.4	164.8	-95.3	-96.3	0	0	0	110	E252	E252-Y254 HydrophobicContact CB-CD2 4.3Å; E252-Y254 HydrophobicContact CB-CE2 4.32Å; E252-Y254 PolarHBondContact O-N 2.66Å
255	T	25.2	Very low	34.5	Very low	123 Å²	123	125.9 Å²	125.9	76%	0.755	64%	0.639	S	S	*	*			trans	-71.1	124.5	159.7	33.8	0	0	0	0	108.7	N257	T255-N257 PolarHBondContact O-N 2.71Å
256	P	30.2	Very low	37.3	Very low	116 Å²	116	121.3 Å²	121.3	75%	0.753	63%	0.625	S	S	*	*			trans	-70.1	132.8	172.3	29	-29.8	0	0	0	108.3	S258	P256-S258 PolarHBondContact O-N 2.84Å
257	N	28.6	Very low	40.2	Very low	115 Å²	115	112.3 Å²	112.3	62%	0.615	59%	0.586	S	S	*	*			trans	-41.2	105.7	179.9	-89	-21.5	0	0	0	112.1	T255 Q259	T255-N257 PolarHBondContact O-N 2.71Å; N257-Q259 VanDerWaalsContact C-N 3.29Å; N257-Q259 PolarHBondContact O-N 3.11Å
258	S	32.9	Very low	43.2	Very low	84 Å²	84	105.8 Å²	105.8	59%	0.587	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	5.2	-174.3	51.4	0	0	0	0	114.4	P256	P256-S258 PolarHBondContact O-N 2.84Å
259	Q	30.1	Very low	46.3	Very low	156 Å²	156	102.6 Å²	102.6	73%	0.729	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.2	-171.5	-72	-176.9	-21.4	0	0	115	N257	N257-Q259 VanDerWaalsContact C-N 3.29Å; N257-Q259 PolarHBondContact O-N 3.11Å
260	A	36.1	Very low	49.2	Very low	80 Å²	80	97 Å²	97	66%	0.661	51%	0.509	S	S	*	.	S	Bend	trans	-87.3	-21.2	-172.3	0	0	0	0	0	115.2
261	I	38.4	Very low	52.1	Low	61 Å²	61	89.3 Å²	89.3	31%	0.313	47%	0.468	S	S	.	.	S	Bend	trans	-104.4	-23.7	-168.9	-55.3	176.6	0	0	0	112.5	I118 Y263	I118-I261 HydrophobicContact CD1-CG2 3.76Å; I118-I261 HydrophobicContact CG1-CG2 4.09Å; I261-Y263 PolarHBondContact O-N 2.88Å; I261-Y263 VanDerWaalsContact O-N 3.16Å
262	N	33	Very low	55.3	Low	61 Å²	61	81 Å²	81	33%	0.326	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	5.5	-177.4	-76.9	-0.7	0	0	0	115.3
263	Y	47.3	Very low	58.2	Low	145 Å²	145	75.2 Å²	75.2	57%	0.569	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	49.1	172.7	-64.2	-77.1	0	0	0	111.2	I261 N265	I261-Y263 PolarHBondContact O-N 2.88Å; I261-Y263 VanDerWaalsContact O-N 3.16Å; Y263-N265 PolarHBondContact O-N 3.47Å
264	L	61.5	Low	61.1	Low	20 Å²	20	68.2 Å²	68.2	11%	0.105	36%	0.361	C	S	.	.			trans	-68.4	85.6	162.1	-93.5	160	0	0	0	107.5	N220 M224 L227 M459	N220-L264 WeakPolarHBondContact CB-O 3.44Å; N220-L264 PolarHBondContact ND2-O 3.46Å; M224-L264 HydrophobicContact SD-CB 4.48Å; M224-L264 HydrophobicContact SD-CD1 3.62Å; L227-L264 HydrophobicContact CD1-CD1 4.24Å; L264-M459 HydrophobicContact CD2-CE 3.94Å
265	N	82.3	Confident	63.8	Low	97 Å²	97	61.7 Å²	61.7	52%	0.519	34%	0.336	S	S	.	.			trans	-63.2	156.5	165.6	-68.2	-4.2	0	0	0	108.4	Q223 Y263 F267	Q223-N265 PolarHBondContact NE2-O 3.31Å; Y263-N265 PolarHBondContact O-N 3.47Å; N265-F267 PolarHBondContact O-N 3.28Å
266	D	87.9	Confident	66.4	Low	58 Å²	58	56 Å²	56	31%	0.31	30%	0.301	S	S	.	.			trans	-48.9	134.7	171.2	-73.4	1.6	0	0	0	110.5	R217 L218 H219 N220 I268	R217-D266 WeakPolarHBondContact CD-OD2 3.42Å; R217-D266 HydrophobicContact CG-CB 3.75Å; L218-D266 WeakPolarHBondContact O-CA 3.49Å; H219-D266 WeakPolarHBondContact CA-OD1 3.23Å; H219-D266 IonicContact CE1-OD2 2.72Å; H219-D266 IonicContact ND1-OD2 3.65Å; H219-D266 PolarHBondContact ND1-OD2 3.46Å; N220-D266 PolarHBondContact N-OD1 2.92Å; D266-I268 PolarHBondContact O-N 3.28Å
267	F	90.4	Very high	68.6	Low	13 Å²	13	52.9 Å²	52.9	6%	0.057	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.6	-177.8	178.4	-144.3	0	0	0	109.4	C169 F171 R217 L218 N265 F269 K462	C169-F267 HydrophobicContact CB-CE2 4.16Å; C169-F267 HydrophobicContact CB-CZ 4.07Å; F171-F267 AromaticContact CE2-CE1 3.92Å; F171-F267 HydrophobicContact CE2-CE1 3.92Å; F171-F267 AromaticContact CE2-CZ 3.72Å; F171-F267 HydrophobicContact CE2-CZ 3.72Å; F171-F267 HydrophobicContact CZ-CE1 4.43Å; F171-F267 AromaticContact CZ-CZ 3.93Å; F171-F267 HydrophobicContact CZ-CZ 3.93Å; R217-F267 WeakPolarHBondContact CA-O 3.45Å; L218-F267 HydrophobicContact CB-CB 4.27Å; L218-F267 HydrophobicContact CD2-CD1 4.29Å; L218-F267 PolarHBondContact N-O 2.8Å; L218-F267 PolarHBondContact O-N 2.92Å; N265-F267 PolarHBondContact O-N 3.28Å; F267-F269 AromaticContact CD1-CD1 3.61Å; F267-F269 HydrophobicContact CD1-CD1 3.61Å; F267-F269 HydrophobicContact CD1-CE1 4.08Å; F267-F269 HydrophobicContact CD1-CG 4.44Å; F267-F269 HydrophobicContact CD2-CD1 4.49Å; F267-F269 HydrophobicContact CE1-CB 4.14Å; F267-F269 AromaticContact CE1-CD1 3.58Å; F267-F269 HydrophobicContact CE1-CD1 3.58Å; F267-F269 HydrophobicContact CE1-CE1 4.23Å; F267-F269 AromaticContact CE1-CG 3.98Å; F267-F269 HydrophobicContact CE1-CG 3.98Å; F267-F269 HydrophobicContact CE2-CB 3.96Å; F267-F269 HydrophobicContact CE2-CD1 4.45Å; F267-F269 HydrophobicContact CG-CD1 4.09Å; F267-F269 HydrophobicContact CZ-CB 3.71Å; F267-F269 HydrophobicContact CZ-CD1 4.03Å; F267-F269 HydrophobicContact CZ-CG 4.07Å; F267-K462 HydrophobicContact CB-CD 4.34Å; F267-K462 HydrophobicContact CD1-CB 4.43Å; F267-K462 HydrophobicContact CD1-CD 3.84Å; F267-K462 HydrophobicContact CD1-CG 4.48Å; F267-K462 HydrophobicContact CD2-CD 3.8Å; F267-K462 HydrophobicContact CD2-CG 4.27Å; F267-K462 HydrophobicContact CE1-CB 3.82Å; F267-K462 HydrophobicContact CE1-CD 4.02Å; F267-K462 HydrophobicContact CE1-CG 4.17Å; F267-K462 HydrophobicContact CE2-CB 4.36Å; F267-K462 HydrophobicContact CE2-CD 4Å; F267-K462 HydrophobicContact CE2-CG 3.96Å; F267-K462 HydrophobicContact CG-CD 3.72Å; F267-K462 HydrophobicContact CZ-CB 3.78Å; F267-K462 HydrophobicContact CZ-CD 4.1Å; F267-K462 HydrophobicContact CZ-CG 3.89Å
268	I	92.4	Very high	70.2	Confident	49 Å²	49	51.3 Å²	51.3	25%	0.251	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.9	175.3	-57.1	174.3	0	0	0	109.1	L201 T215 L216 R217 D266	L201-I268 HydrophobicContact CD1-CD1 4.02Å; L201-I268 HydrophobicContact CD1-CG1 4.15Å; L201-I268 HydrophobicContact CD1-CG2 3.93Å; T215-I268 HydrophobicContact CG2-CG2 3.76Å; L216-I268 WeakPolarHBondContact O-CA 3.27Å; R217-I268 HydrophobicContact CB-CG1 4.23Å; R217-I268 HydrophobicContact CG-CG1 4.16Å; D266-I268 PolarHBondContact O-N 3.28Å
269	F	93	Very high	71.3	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159	-179.6	65	-83.4	0	0	0	111.4	C169 F171 F198 T215 L216 L218 F267 L271 L458	C169-F269 HydrophobicContact CB-CB 4.21Å; C169-F269 CarbonylContact O-C 3.51Å; C169-F269 WeakPolarHBondContact O-CA 3.41Å; C169-F269 WeakPolarHBondContact O-CB 3.29Å; F171-F269 HydrophobicContact CD2-CB 4.38Å; F171-F269 AromaticContact CD2-CD2 3.68Å; F171-F269 HydrophobicContact CD2-CD2 3.68Å; F171-F269 HydrophobicContact CD2-CE2 4.29Å; F171-F269 HydrophobicContact CD2-CG 4.22Å; F171-F269 HydrophobicContact CE2-CB 4.14Å; F171-F269 HydrophobicContact CE2-CD2 4.06Å; F171-F269 HydrophobicContact CE2-CG 4.15Å; F198-F269 HydrophobicContact CE1-CZ 4.33Å; T215-F269 CarbonylContact C-O 3.58Å; T215-F269 WeakPolarHBondContact CA-O 3.4Å; L216-F269 HydrophobicContact CB-CE1 4.05Å; L216-F269 HydrophobicContact CB-CE2 4.19Å; L216-F269 HydrophobicContact CB-CZ 3.81Å; L216-F269 HydrophobicContact CD1-CE2 4.02Å; L216-F269 HydrophobicContact CD1-CZ 3.92Å; L216-F269 PolarHBondContact N-O 2.87Å; L216-F269 PolarHBondContact O-N 3.43Å; L218-F269 HydrophobicContact CB-CE1 4.08Å; F267-F269 AromaticContact CD1-CD1 3.61Å; F267-F269 HydrophobicContact CD1-CD1 3.61Å; F267-F269 HydrophobicContact CD1-CE1 4.08Å; F267-F269 HydrophobicContact CD1-CG 4.44Å; F267-F269 HydrophobicContact CD2-CD1 4.49Å; F267-F269 HydrophobicContact CE1-CB 4.14Å; F267-F269 AromaticContact CE1-CD1 3.58Å; F267-F269 HydrophobicContact CE1-CD1 3.58Å; F267-F269 HydrophobicContact CE1-CE1 4.23Å; F267-F269 AromaticContact CE1-CG 3.98Å; F267-F269 HydrophobicContact CE1-CG 3.98Å; F267-F269 HydrophobicContact CE2-CB 3.96Å; F267-F269 HydrophobicContact CE2-CD1 4.45Å; F267-F269 HydrophobicContact CG-CD1 4.09Å; F267-F269 HydrophobicContact CZ-CB 3.71Å; F267-F269 HydrophobicContact CZ-CD1 4.03Å; F267-F269 HydrophobicContact CZ-CG 4.07Å; F269-L271 HydrophobicContact CD2-CB 4.41Å; F269-L271 HydrophobicContact CE2-CB 4.08Å; F269-L271 HydrophobicContact CE2-CD1 4.39Å; F269-L458 HydrophobicContact CD2-CD2 4.46Å; F269-L458 HydrophobicContact CE1-CD1 4.3Å; F269-L458 HydrophobicContact CE2-CD1 4.33Å; F269-L458 HydrophobicContact CE2-CD2 3.78Å; F269-L458 HydrophobicContact CZ-CD1 3.66Å; F269-L458 HydrophobicContact CZ-CD2 3.91Å; F269-L458 HydrophobicContact CZ-CG 4.39Å
270	D	92.7	Very high	72.3	Confident	20 Å²	20	49.9 Å²	49.9	11%	0.107	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132	173.4	-65.9	-19.1	0	0	0	109.3	C169 R170 F171 I204 T215	C169-D270 PolarHBondContact O-N 3.44Å; R170-D270 CarbonylContact C-O 3.51Å; R170-D270 WeakPolarHBondContact CA-O 3.43Å; R170-D270 HydrophobicContact CB-CB 4.23Å; R170-D270 HydrophobicContact CG-CB 4.04Å; R170-D270 IonicContact NE-OD2 3.93Å; F171-D270 PolarHBondContact N-O 3.24Å; I204-D270 HydrophobicContact CD1-CB 3.68Å; T215-D270 WeakPolarHBondContact CB-OD1 3.44Å; T215-D270 WeakPolarHBondContact CG2-OD1 3.36Å; T215-D270 PolarHBondContact OG1-OD1 3.17Å
271	L	92	Very high	73.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.2	176.1	-167.5	64.1	0	0	0	109.3	F171 V173 L190 G213 L214 L216 F269 Y273 I334	F171-L271 HydrophobicContact CB-CD1 3.99Å; V173-L271 HydrophobicContact CG2-CD1 3.51Å; V173-L271 HydrophobicContact CG2-CD2 4.3Å; V173-L271 HydrophobicContact CG2-CG 4.04Å; L190-L271 HydrophobicContact CD1-CD2 3.97Å; G213-L271 CarbonylContact C-O 3.54Å; G213-L271 WeakPolarHBondContact CA-O 3.41Å; L214-L271 PolarHBondContact N-O 2.73Å; L214-L271 PolarHBondContact O-N 3.44Å; L216-L271 HydrophobicContact CD1-CB 4.17Å; L216-L271 HydrophobicContact CD1-CD2 3.88Å; F269-L271 HydrophobicContact CD2-CB 4.41Å; F269-L271 HydrophobicContact CE2-CB 4.08Å; F269-L271 HydrophobicContact CE2-CD1 4.39Å; L271-Y273 HydrophobicContact CD2-CE1 3.65Å; L271-Y273 HydrophobicContact CG-CE1 3.9Å; L271-I334 HydrophobicContact CD1-CD1 4.16Å
272	H	90.7	Very high	74.1	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.3	178.1	-70.1	-91.1	0	0	0	110.7	R170 F171 A172 V173 G211 I330	R170-H272 PolarHBondContact NE-NE2 3.42Å; R170-H272 PolarHBondContact NH2-CE1 2.69Å; R170-H272 VanDerWaalsContact NH2-CE1 3.26Å; R170-H272 PolarHBondContact NH2-NE2 3.48Å; R170-H272 VanDerWaalsContact NH2-NE2 3.15Å; F171-H272 PolarHBondContact O-N 3.05Å; A172-H272 CarbonylContact C-O 3.52Å; A172-H272 WeakPolarHBondContact CA-O 3.12Å; V173-H272 PolarHBondContact N-O 3.21Å; G211-H272 PolarHBondContact O-ND1 3.39Å; H272-I330 HydrophobicContact CB-CD1 4.33Å
273	Y	87.5	Confident	75.9	Confident	25 Å²	25	52.8 Å²	52.8	10%	0.098	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.5	175.8	-55.9	-48.6	0	0	0	110.3	V173 F178 F187 A212 L214 L271	V173-Y273 HydrophobicContact CB-CD1 4.37Å; F178-Y273 HydrophobicContact CE1-CD1 4.31Å; F178-Y273 HydrophobicContact CE1-CG 4.43Å; F178-Y273 HydrophobicContact CE2-CD1 4.08Å; F178-Y273 AromaticContact CZ-CD1 3.48Å; F178-Y273 HydrophobicContact CZ-CD1 3.48Å; F178-Y273 VanDerWaalsContact CZ-CD1 3.48Å; F178-Y273 HydrophobicContact CZ-CE1 4.28Å; F178-Y273 AromaticContact CZ-CG 3.78Å; F178-Y273 HydrophobicContact CZ-CG 3.78Å; F187-Y273 HydrophobicContact CD1-CE1 4.43Å; A212-Y273 WeakPolarHBondContact O-CB 3.44Å; A212-Y273 PolarHBondContact O-N 2.85Å; L214-Y273 HydrophobicContact CD1-CE2 4.18Å; L214-Y273 WeakPolarHBondContact CD1-OH 3.45Å; L214-Y273 HydrophobicContact CG-CE2 4.1Å; L271-Y273 HydrophobicContact CD2-CE1 3.65Å; L271-Y273 HydrophobicContact CG-CE1 3.9Å
274	L	86.6	Confident	77.2	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	30%	0.299	C	S	.	.			trans	-114.7	82.1	-178.3	-50	176.7	0	0	0	109.7	A172 V173 F174 L297 M323 L326	A172-L274 HydrophobicContact CB-CD1 3.7Å; A172-L274 HydrophobicContact CB-CG 4.34Å; V173-L274 PolarHBondContact O-N 3.44Å; F174-L274 HydrophobicContact CB-CB 3.92Å; F174-L274 WeakPolarHBondContact CB-O 3.19Å; L274-L297 HydrophobicContact CB-CD2 3.96Å; L274-M323 HydrophobicContact CD1-CE 3.47Å; L274-M323 VanDerWaalsContact CD1-CE 3.47Å; L274-M323 HydrophobicContact CD1-SD 3.74Å; L274-M323 HydrophobicContact CD2-SD 4.44Å; L274-L326 HydrophobicContact CD1-CD2 4.16Å; L274-L326 HydrophobicContact CD2-CD1 3.71Å; L274-L326 HydrophobicContact CD2-CD2 3.76Å; L274-L326 HydrophobicContact CD2-CG 4.39Å
275	Y	81.3	Confident	78	Confident	66 Å²	66	55.9 Å²	55.9	26%	0.259	30%	0.303	S	S	.	.			trans	-70.2	140.4	174.3	-60.9	-76	0	0	0	111.4	F178 L277 L281 R296	F178-Y275 AromaticContact CD1-CD1 3.83Å; F178-Y275 HydrophobicContact CD1-CD1 3.83Å; F178-Y275 AromaticContact CD1-CE1 3.7Å; F178-Y275 HydrophobicContact CD1-CE1 3.7Å; F178-Y275 AromaticContact CE1-CD1 3.47Å; F178-Y275 HydrophobicContact CE1-CD1 3.47Å; F178-Y275 VanDerWaalsContact CE1-CD1 3.47Å; F178-Y275 HydrophobicContact CE1-CD2 4.33Å; F178-Y275 AromaticContact CE1-CE1 3.08Å; F178-Y275 HydrophobicContact CE1-CE1 3.08Å; F178-Y275 HydrophobicContact CE1-CE2 4.01Å; F178-Y275 HydrophobicContact CE1-CG 4.1Å; F178-Y275 AromaticContact CE1-CZ 3.39Å; F178-Y275 HydrophobicContact CE2-CE1 4.33Å; F178-Y275 HydrophobicContact CZ-CD1 4.3Å; F178-Y275 AromaticContact CZ-CE1 3.45Å; F178-Y275 HydrophobicContact CZ-CE1 3.45Å; F178-Y275 VanDerWaalsContact CZ-CE1 3.45Å; F178-Y275 HydrophobicContact CZ-CE2 4.22Å; F178-Y275 AromaticContact CZ-CZ 3.41Å; F178-Y275 VanDerWaalsContact CZ-CZ 3.41Å; F178-Y275 VanDerWaalsContact CZ-OH 3.29Å; F178-Y275 WeakPolarHBondContact CZ-OH 3.3Å; Y275-L277 VanDerWaalsContact C-N 3.27Å; Y275-L277 PolarHBondContact O-N 3.43Å; Y275-L281 HydrophobicContact CD1-CD2 3.77Å; Y275-L281 HydrophobicContact CE1-CD2 3.75Å; Y275-R296 PolarHBondContact O-NE 2.89Å; Y275-R296 PolarHBondContact O-NH2 3.25Å; Y275-R296 VanDerWaalsContact O-NH2 3.09Å
276	S	78.6	Confident	78	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.021	32%	0.316	C	S	.	.	S	Bend	trans	-65.3	-27.5	174.5	54.2	0	0	0	0	113.4	D179 S295 R296	D179-S276 PolarHBondContact OD1-N 3.5Å; D179-S276 PolarHBondContact OD1-OG 3.26Å; D179-S276 VanDerWaalsContact OD2-CB 3.25Å; D179-S276 WeakPolarHBondContact OD2-CB 3.22Å; D179-S276 PolarHBondContact OD2-OG 2.94Å; S276-S295 WeakPolarHBondContact CB-OG 3.26Å; S276-S295 CarbonylContact O-C 3.6Å; S276-S295 VanDerWaalsContact O-CA 3.28Å; S276-S295 WeakPolarHBondContact O-CA 3.11Å; S276-R296 WeakPolarHBondContact O-CG 3.39Å; S276-R296 PolarHBondContact O-N 3.31Å
277	L	76.5	Confident	78	Confident	50 Å²	50	57.2 Å²	57.2	26%	0.262	31%	0.313	S	S	.	.	S	Bend	trans	-120	151	180	-71.2	174.9	0	0	0	112.9	Y275 H283 F285	Y275-L277 VanDerWaalsContact C-N 3.27Å; Y275-L277 PolarHBondContact O-N 3.43Å; L277-H283 HydrophobicContact CD1-CB 3.87Å; L277-F285 HydrophobicContact CD1-CE2 3.53Å; L277-F285 HydrophobicContact CD1-CZ 3.5Å; L277-F285 VanDerWaalsContact CD1-CZ 3.5Å; L277-F285 HydrophobicContact CD2-CZ 4Å; L277-F285 HydrophobicContact CG-CE2 4.08Å; L277-F285 HydrophobicContact CG-CZ 3.88Å
278	S	62.9	Low	78	Confident	83 Å²	83	56.7 Å²	56.7	58%	0.58	31%	0.311	S	S	*	.	S	Bend	trans	-83.4	120.2	168.6	51.2	0	0	0	0	110.8	H280	S278-H280 VanDerWaalsContact C-N 3.3Å; S278-H280 PolarHBondContact O-N 2.78Å
279	G	55.6	Low	77.8	Confident	78 Å²	78	55.3 Å²	55.3	80%	0.804	31%	0.305	S	S	*	.	S	Bend	trans	77.6	-15.3	158.8	0	0	0	0	0	118.3
280	H	50.9	Low	77.6	Confident	132 Å²	132	59 Å²	59	61%	0.611	32%	0.322	S	S	*	.			trans	-126.9	80.8	178.7	-73.5	-71.4	0	0	0	113	S278 S282 H283	S278-H280 VanDerWaalsContact C-N 3.3Å; S278-H280 PolarHBondContact O-N 2.78Å; H280-S282 PolarHBondContact O-N 2.9Å; H280-H283 PolarHBondContact O-N 3.26Å
281	L	55.9	Low	77.4	Confident	79 Å²	79	58.1 Å²	58.1	41%	0.414	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	10.2	165.9	-75.7	164.1	0	0	0	113.9	R181 Y275	R181-L281 HydrophobicContact CG-CB 4.43Å; R181-L281 PolarHBondContact NE-O 2.98Å; Y275-L281 HydrophobicContact CD1-CD2 3.77Å; Y275-L281 HydrophobicContact CE1-CD2 3.75Å
282	S	58.2	Low	77.3	Confident	81 Å²	81	58 Å²	58	57%	0.566	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-11.2	-178.3	56.9	0	0	0	0	113.4	H280 K284	H280-S282 PolarHBondContact O-N 2.9Å; S282-K284 PolarHBondContact O-N 3.32Å
283	H	69.2	Low	77.1	Confident	103 Å²	103	60.6 Å²	60.6	48%	0.477	33%	0.329	S	S	.	.			trans	-72.5	116.3	178	-165.8	-87.6	0	0	0	109.8	L277 H280 F285	L277-H283 HydrophobicContact CD1-CB 3.87Å; H280-H283 PolarHBondContact O-N 3.26Å; H283-F285 AromaticContact CE1-CD1 3.83Å; H283-F285 AromaticContact CE1-CE1 3.9Å; H283-F285 AromaticContact ND1-CD1 3.66Å; H283-F285 AromaticContact ND1-CE1 3.61Å; H283-F285 AromaticContact ND1-CG 3.92Å; H283-F285 AromaticContact ND1-CZ 3.84Å
284	K	74.7	Confident	77.1	Confident	187 Å²	187	61.8 Å²	61.8	81%	0.813	34%	0.344	S	S	*	.			trans	-91.4	114.5	170.5	-72.8	-173.4	177.3	-176.6	0	108	S282	S282-K284 PolarHBondContact O-N 3.32Å
285	F	79.3	Confident	77.1	Confident	43 Å²	43	61.9 Å²	61.9	19%	0.189	35%	0.345	C	S	.	.			trans	-74.5	146.3	170.8	-65.9	-78.8	0	0	0	110.3	L277 H283 S287 E290 R291 A294	L277-F285 HydrophobicContact CD1-CE2 3.53Å; L277-F285 HydrophobicContact CD1-CZ 3.5Å; L277-F285 VanDerWaalsContact CD1-CZ 3.5Å; L277-F285 HydrophobicContact CD2-CZ 4Å; L277-F285 HydrophobicContact CG-CE2 4.08Å; L277-F285 HydrophobicContact CG-CZ 3.88Å; H283-F285 AromaticContact CE1-CD1 3.83Å; H283-F285 AromaticContact CE1-CE1 3.9Å; H283-F285 AromaticContact ND1-CD1 3.66Å; H283-F285 AromaticContact ND1-CE1 3.61Å; H283-F285 AromaticContact ND1-CG 3.92Å; H283-F285 AromaticContact ND1-CZ 3.84Å; F285-S287 VanDerWaalsContact C-N 3.33Å; F285-E290 HydrophobicContact CD1-CB 4.34Å; F285-E290 HydrophobicContact CD1-CG 3.92Å; F285-R291 HydrophobicContact CB-CB 3.99Å; F285-R291 HydrophobicContact CD1-CB 4.18Å; F285-R291 HydrophobicContact CD2-CB 3.59Å; F285-R291 HydrophobicContact CD2-CG 3.54Å; F285-R291 HydrophobicContact CE2-CB 4.01Å; F285-R291 HydrophobicContact CE2-CG 3.62Å; F285-R291 HydrophobicContact CG-CB 3.64Å; F285-R291 HydrophobicContact CG-CG 4.15Å; F285-R291 HydrophobicContact CZ-CB 4.43Å; F285-R291 HydrophobicContact CZ-CG 4.29Å; F285-A294 HydrophobicContact CE1-CB 3.54Å; F285-A294 HydrophobicContact CZ-CB 3.79Å
286	N	81.9	Confident	77.4	Confident	147 Å²	147	60.8 Å²	60.8	79%	0.786	34%	0.34	S	S	*	.	S	Bend	trans	-81.7	-19.9	177.5	-61.7	-51.4	0	0	0	111.7	E290	N286-E290 PolarHBondContact N-OE2 2.77Å
287	S	88.6	Confident	77.9	Confident	35 Å²	35	60.7 Å²	60.7	25%	0.245	34%	0.339	C	S	.	.	S	Bend	trans	-151.1	157	-179.3	72.2	0	0	0	0	112.2	F285 E290 R291	F285-S287 VanDerWaalsContact C-N 3.33Å; S287-E290 PolarHBondContact O-N 3.43Å; S287-E290 WeakPolarHBondContact OG-CB 3.35Å; S287-E290 PolarHBondContact OG-N 3.5Å; S287-R291 PolarHBondContact O-N 3.22Å; S287-R291 VanDerWaalsContact O-N 3.11Å
288	Q	89.4	Confident	78.6	Confident	3 Å²	3	59 Å²	59	1%	0.014	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-39.7	175.2	-68.7	-63.6	-24.4	0	0	113.4	E290 R291 I292 E341 Q345 L349	Q288-E290 VanDerWaalsContact C-N 3.34Å; Q288-E290 PolarHBondContact O-N 2.84Å; Q288-R291 PolarHBondContact O-N 3.36Å; Q288-R291 VanDerWaalsContact OE1-CZ 3.29Å; Q288-I292 WeakPolarHBondContact O-CD1 3.48Å; Q288-I292 VanDerWaalsContact O-CG1 3.23Å; Q288-I292 WeakPolarHBondContact O-CG1 3.21Å; Q288-I292 PolarHBondContact O-N 3.27Å; Q288-E341 HydrophobicContact CG-CG 4.37Å; Q288-E341 VanDerWaalsContact CG-OE1 3.27Å; Q288-E341 WeakPolarHBondContact CG-OE1 3.21Å; Q288-E341 PolarHBondContact NE2-OE1 3.05Å; Q288-E341 PolarHBondContact NE2-OE2 2.84Å; Q288-Q345 HydrophobicContact CB-CB 4.32Å; Q288-Q345 HydrophobicContact CG-CB 3.74Å; Q288-L349 HydrophobicContact CB-CD2 4.33Å; Q288-L349 HydrophobicContact CG-CD2 4.12Å
289	P	89.1	Confident	79.9	Confident	19 Å²	19	58 Å²	58	12%	0.123	32%	0.321	C	S	.	.	H	α-helix	trans	-55	-48.6	171.4	-26.7	35	0	0	0	112.2	R291 I292 H293 Y348	P289-R291 VanDerWaalsContact C-N 3.33Å; P289-R291 PolarHBondContact O-N 3.18Å; P289-I292 PolarHBondContact O-N 2.82Å; P289-I292 VanDerWaalsContact O-N 3.14Å; P289-H293 WeakPolarHBondContact O-CB 3.26Å; P289-H293 PolarHBondContact O-CD2 3.19Å; P289-H293 PolarHBondContact O-N 2.71Å; P289-Y348 HydrophobicContact CG-CD1 3.82Å; P289-Y348 HydrophobicContact CG-CD2 3.52Å; P289-Y348 HydrophobicContact CG-CE1 3.76Å; P289-Y348 HydrophobicContact CG-CE2 3.48Å; P289-Y348 VanDerWaalsContact CG-CE2 3.48Å; P289-Y348 HydrophobicContact CG-CG 3.69Å
290	E	87.3	Confident	81.3	Confident	77 Å²	77	57 Å²	57	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-44.2	178.7	-169.8	-171	-178.1	0	0	111.5	F285 N286 S287 Q288 I292 H293 A294	F285-E290 HydrophobicContact CD1-CB 4.34Å; F285-E290 HydrophobicContact CD1-CG 3.92Å; N286-E290 PolarHBondContact N-OE2 2.77Å; S287-E290 PolarHBondContact O-N 3.43Å; S287-E290 WeakPolarHBondContact OG-CB 3.35Å; S287-E290 PolarHBondContact OG-N 3.5Å; Q288-E290 VanDerWaalsContact C-N 3.34Å; Q288-E290 PolarHBondContact O-N 2.84Å; E290-I292 PolarHBondContact O-N 2.72Å; E290-H293 PolarHBondContact O-N 3.46Å; E290-A294 WeakPolarHBondContact O-CB 3.1Å; E290-A294 PolarHBondContact O-N 2.96Å
291	R	89.3	Confident	82.7	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.011	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-46.5	174.3	-176.2	-175.2	67.3	80.6	13.3	111.9	D179 F285 S287 Q288 P289 A294 S295 E352	D179-R291 IonicContact OD2-CZ 3.01Å; D179-R291 IonicContact OD2-NH1 2.67Å; D179-R291 PolarHBondContact OD2-NH1 2.91Å; F285-R291 HydrophobicContact CB-CB 3.99Å; F285-R291 HydrophobicContact CD1-CB 4.18Å; F285-R291 HydrophobicContact CD2-CB 3.59Å; F285-R291 HydrophobicContact CD2-CG 3.54Å; F285-R291 HydrophobicContact CE2-CB 4.01Å; F285-R291 HydrophobicContact CE2-CG 3.62Å; F285-R291 HydrophobicContact CG-CB 3.64Å; F285-R291 HydrophobicContact CG-CG 4.15Å; F285-R291 HydrophobicContact CZ-CB 4.43Å; F285-R291 HydrophobicContact CZ-CG 4.29Å; S287-R291 PolarHBondContact O-N 3.22Å; S287-R291 VanDerWaalsContact O-N 3.11Å; Q288-R291 PolarHBondContact O-N 3.36Å; Q288-R291 VanDerWaalsContact OE1-CZ 3.29Å; P289-R291 VanDerWaalsContact C-N 3.33Å; P289-R291 PolarHBondContact O-N 3.18Å; R291-A294 PolarHBondContact O-N 3.21Å; R291-S295 WeakPolarHBondContact O-CB 3.46Å; R291-S295 PolarHBondContact O-N 3.24Å; R291-E352 IonicContact CZ-OE1 3.44Å; R291-E352 IonicContact CZ-OE2 2.94Å; R291-E352 IonicContact NH1-OE1 3.38Å; R291-E352 PolarHBondContact NH1-OE1 2.72Å; R291-E352 IonicContact NH1-OE2 2.71Å; R291-E352 VanDerWaalsContact NH2-CD 3.26Å; R291-E352 IonicContact NH2-OE1 3.31Å; R291-E352 PolarHBondContact NH2-OE1 3.11Å; R291-E352 IonicContact NH2-OE2 3.63Å; R291-E352 PolarHBondContact NH2-OE2 3.34Å
292	I	90.1	Very high	83.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.2	-42.1	-177.6	-66.8	163.8	0	0	0	110.4	Q288 P289 E290 S295 F298 L314 L317 E352	Q288-I292 WeakPolarHBondContact O-CD1 3.48Å; Q288-I292 VanDerWaalsContact O-CG1 3.23Å; Q288-I292 WeakPolarHBondContact O-CG1 3.21Å; Q288-I292 PolarHBondContact O-N 3.27Å; P289-I292 PolarHBondContact O-N 2.82Å; P289-I292 VanDerWaalsContact O-N 3.14Å; E290-I292 PolarHBondContact O-N 2.72Å; I292-S295 VanDerWaalsContact O-CB 3.23Å; I292-S295 WeakPolarHBondContact O-CB 3.47Å; I292-S295 PolarHBondContact O-N 2.86Å; I292-S295 VanDerWaalsContact O-N 3.16Å; I292-F298 HydrophobicContact CG2-CD2 4.1Å; I292-F298 HydrophobicContact CG2-CE2 4.17Å; I292-L314 HydrophobicContact CB-CD2 4.28Å; I292-L314 HydrophobicContact CD1-CD1 3.93Å; I292-L314 HydrophobicContact CG2-CD1 4.33Å; I292-L314 HydrophobicContact CG2-CD2 3.83Å; I292-L317 HydrophobicContact CG2-CD1 4.08Å; I292-L317 HydrophobicContact CG2-CD2 3.56Å; I292-E352 HydrophobicContact CD1-CB 4.03Å; I292-E352 HydrophobicContact CG1-CB 4.31Å; I292-E352 HydrophobicContact CG1-CG 4.46Å
293	H	86.6	Confident	83.2	Confident	58 Å²	58	59.7 Å²	59.7	27%	0.269	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-42.7	176	-90.1	-95.6	0	0	0	112.3	P289 E290 S295 Y300 L314	P289-H293 WeakPolarHBondContact O-CB 3.26Å; P289-H293 PolarHBondContact O-CD2 3.19Å; P289-H293 PolarHBondContact O-N 2.71Å; E290-H293 PolarHBondContact O-N 3.46Å; H293-S295 PolarHBondContact O-N 3.47Å; H293-Y300 PolarHBondContact CD2-OH 2.87Å; H293-Y300 AromaticContact CE1-CZ 3.58Å; H293-Y300 PolarHBondContact CE1-OH 2.95Å; H293-Y300 AromaticContact ND1-CZ 3.49Å; H293-Y300 PolarHBondContact ND1-OH 2.74Å; H293-Y300 PolarHBondContact NE2-OH 3.45Å; H293-L314 VanDerWaalsContact CD2-CD2 3.44Å; H293-L314 WeakPolarHBondContact CD2-CD2 3.4Å; H293-L314 WeakPolarHBondContact NE2-CD2 3.28Å
294	A	86	Confident	82.7	Confident	49 Å²	49	57.4 Å²	57.4	41%	0.405	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.1	177.9	0	0	0	0	0	113.3	F285 E290 R291 R296	F285-A294 HydrophobicContact CE1-CB 3.54Å; F285-A294 HydrophobicContact CZ-CB 3.79Å; E290-A294 WeakPolarHBondContact O-CB 3.1Å; E290-A294 PolarHBondContact O-N 2.96Å; R291-A294 PolarHBondContact O-N 3.21Å; A294-R296 PolarHBondContact O-N 2.93Å
295	S	88.4	Confident	81.6	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.028	30%	0.295	C	S	.	.			trans	-73	123.7	-175.3	179	0	0	0	0	110.8	S276 R291 I292 H293 L297 F298	S276-S295 WeakPolarHBondContact CB-OG 3.26Å; S276-S295 CarbonylContact O-C 3.6Å; S276-S295 VanDerWaalsContact O-CA 3.28Å; S276-S295 WeakPolarHBondContact O-CA 3.11Å; R291-S295 WeakPolarHBondContact O-CB 3.46Å; R291-S295 PolarHBondContact O-N 3.24Å; I292-S295 VanDerWaalsContact O-CB 3.23Å; I292-S295 WeakPolarHBondContact O-CB 3.47Å; I292-S295 PolarHBondContact O-N 2.86Å; I292-S295 VanDerWaalsContact O-N 3.16Å; H293-S295 PolarHBondContact O-N 3.47Å; S295-L297 PolarHBondContact O-N 2.92Å; S295-L297 VanDerWaalsContact O-N 3.14Å; S295-L297 WeakPolarHBondContact OG-CB 3.46Å; S295-L297 WeakPolarHBondContact OG-CG 3.34Å; S295-L297 PolarHBondContact OG-N 3.45Å; S295-F298 PolarHBondContact O-N 3.35Å
296	R	86.9	Confident	80.3	Confident	42 Å²	42	59.1 Å²	59.1	16%	0.158	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.3	173.4	68.6	-174.6	177.2	160.6	5.3	113.4	G209 F210 Y275 S276 A294 F298 S320	G209-R296 PolarHBondContact O-NH1 2.73Å; G209-R296 PolarHBondContact O-NH2 3.22Å; F210-R296 HydrophobicContact CE1-CB 4.4Å; F210-R296 HydrophobicContact CE1-CG 3.72Å; F210-R296 HydrophobicContact CE2-CB 4.17Å; F210-R296 HydrophobicContact CE2-CG 3.9Å; F210-R296 HydrophobicContact CZ-CB 3.57Å; F210-R296 HydrophobicContact CZ-CG 3.26Å; F210-R296 WeakPolarHBondContact CZ-O 3.09Å; Y275-R296 PolarHBondContact O-NE 2.89Å; Y275-R296 PolarHBondContact O-NH2 3.25Å; Y275-R296 VanDerWaalsContact O-NH2 3.09Å; S276-R296 WeakPolarHBondContact O-CG 3.39Å; S276-R296 PolarHBondContact O-N 3.31Å; A294-R296 PolarHBondContact O-N 2.93Å; R296-F298 PolarHBondContact O-N 3.44Å; R296-F298 VanDerWaalsContact O-N 3.13Å; R296-S320 PolarHBondContact O-OG 2.83Å
297	L	89	Confident	78.8	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20	176.8	-58.2	177.8	0	0	0	111.7	F174 F210 L274 S295 V319 S320 M323	F174-L297 HydrophobicContact CD2-CD1 4.37Å; F210-L297 HydrophobicContact CD1-CD2 4.29Å; F210-L297 HydrophobicContact CE1-CD2 3.92Å; L274-L297 HydrophobicContact CB-CD2 3.96Å; S295-L297 PolarHBondContact O-N 2.92Å; S295-L297 VanDerWaalsContact O-N 3.14Å; S295-L297 WeakPolarHBondContact OG-CB 3.46Å; S295-L297 WeakPolarHBondContact OG-CG 3.34Å; S295-L297 PolarHBondContact OG-N 3.45Å; L297-V319 WeakPolarHBondContact O-CA 3.4Å; L297-S320 PolarHBondContact O-N 2.74Å; L297-S320 PolarHBondContact O-OG 3.05Å; L297-M323 HydrophobicContact CD2-SD 4.29Å
298	F	91.4	Very high	76.7	Confident	14 Å²	14	59.8 Å²	59.8	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	154.1	-172.1	-50.9	-64	0	0	0	112.7	I292 S295 R296 L317 I318 V319 E352 T355 V356	I292-F298 HydrophobicContact CG2-CD2 4.1Å; I292-F298 HydrophobicContact CG2-CE2 4.17Å; S295-F298 PolarHBondContact O-N 3.35Å; R296-F298 PolarHBondContact O-N 3.44Å; R296-F298 VanDerWaalsContact O-N 3.13Å; F298-L317 HydrophobicContact CB-CD2 3.72Å; F298-L317 HydrophobicContact CB-CG 3.84Å; F298-L317 HydrophobicContact CD1-CD2 3.54Å; F298-L317 HydrophobicContact CD1-CG 4.32Å; F298-L317 HydrophobicContact CD2-CD2 3.48Å; F298-L317 VanDerWaalsContact CD2-CD2 3.48Å; F298-L317 HydrophobicContact CD2-CG 4.48Å; F298-L317 HydrophobicContact CE1-CD2 3.99Å; F298-L317 HydrophobicContact CE2-CD2 3.96Å; F298-L317 HydrophobicContact CG-CD2 3.26Å; F298-L317 HydrophobicContact CG-CG 3.97Å; F298-L317 HydrophobicContact CZ-CD2 4.2Å; F298-I318 CarbonylContact C-O 3.47Å; F298-I318 WeakPolarHBondContact CA-O 3.43Å; F298-I318 WeakPolarHBondContact CB-O 3.32Å; F298-V319 HydrophobicContact CD1-CG1 4.4Å; F298-V319 HydrophobicContact CE1-CG1 4.34Å; F298-E352 HydrophobicContact CE2-CG 3.79Å; F298-E352 HydrophobicContact CZ-CB 4.49Å; F298-E352 HydrophobicContact CZ-CG 3.58Å; F298-T355 HydrophobicContact CD1-CG2 3.72Å; F298-T355 HydrophobicContact CE1-CG2 3.79Å; F298-V356 HydrophobicContact CE1-CG2 3.68Å; F298-V356 HydrophobicContact CZ-CG2 3.81Å
299	T	90.1	Very high	74.8	Confident	63 Å²	63	62.7 Å²	62.7	39%	0.387	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	168.5	163.7	55	0	0	0	0	108	I318	T299-I318 PolarHBondContact N-O 2.77Å; T299-I318 WeakPolarHBondContact O-CG1 3.45Å; T299-I318 PolarHBondContact O-N 2.84Å; T299-I318 VanDerWaalsContact O-O 3.06Å; T299-I318 WeakPolarHBondContact OG1-CG1 3.43Å
300	Y	85.8	Confident	72.8	Confident	55 Å²	55	71 Å²	71	22%	0.216	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	143.3	174.8	-73.9	-96.9	0	0	0	109.7	H293 N302 L317	H293-Y300 PolarHBondContact CD2-OH 2.87Å; H293-Y300 AromaticContact CE1-CZ 3.58Å; H293-Y300 PolarHBondContact CE1-OH 2.95Å; H293-Y300 AromaticContact ND1-CZ 3.49Å; H293-Y300 PolarHBondContact ND1-OH 2.74Å; H293-Y300 PolarHBondContact NE2-OH 3.45Å; Y300-N302 PolarHBondContact O-N 2.82Å; Y300-L317 HydrophobicContact CE1-CD1 3.75Å; Y300-L317 HydrophobicContact CE2-CD1 4.19Å; Y300-L317 VanDerWaalsContact CZ-CD1 3.45Å; Y300-L317 WeakPolarHBondContact OH-CD1 3.13Å
301	S	80.2	Confident	70.8	Confident	38 Å²	38	70.1 Å²	70.1	27%	0.266	38%	0.383	S	S	.	.			trans	-60.7	135.8	169.5	-168.3	0	0	0	0	109.7	D303 V304 G316	S301-D303 PolarHBondContact O-N 3.07Å; S301-D303 PolarHBondContact OG-OD2 3.15Å; S301-V304 PolarHBondContact O-N 3.44Å; S301-G316 PolarHBondContact N-O 3.48Å
302	N	65.5	Low	69.1	Low	161 Å²	161	74.4 Å²	74.4	86%	0.861	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.6	179.1	-68.2	-15.1	0	0	0	113.2	Y300 V304	Y300-N302 PolarHBondContact O-N 2.82Å; N302-V304 PolarHBondContact O-N 3.21Å
303	D	58.4	Low	68	Low	150 Å²	150	77.2 Å²	77.2	80%	0.802	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-3.8	179.8	-57.1	-40.4	0	0	0	113.7	S301	S301-D303 PolarHBondContact O-N 3.07Å; S301-D303 PolarHBondContact OG-OD2 3.15Å
304	V	58.4	Low	67.7	Low	56 Å²	56	74.5 Å²	74.5	34%	0.339	42%	0.421	S	S	.	.	S	Bend	trans	-94.7	115.1	177.2	-174.3	0	0	0	0	109.1	S301 N302 I306	S301-V304 PolarHBondContact O-N 3.44Å; N302-V304 PolarHBondContact O-N 3.21Å; V304-I306 PolarHBondContact O-N 3.03Å; V304-I306 VanDerWaalsContact O-N 3.11Å
305	N	52.6	Low	67.3	Low	125 Å²	125	78.8 Å²	78.8	67%	0.668	44%	0.436	S	S	*	.			trans	-53.7	119.3	172.8	-87	-26.8	0	0	0	109.8	S307 D308	N305-S307 PolarHBondContact O-N 3.26Å; N305-D308 PolarHBondContact O-N 2.82Å
306	I	51.3	Low	67	Low	141 Å²	141	79.2 Å²	79.2	72%	0.723	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-58.1	-19.2	-173.8	-65.3	170.7	0	0	0	112.3	V304 D308 I309	V304-I306 PolarHBondContact O-N 3.03Å; V304-I306 VanDerWaalsContact O-N 3.11Å; I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 PolarHBondContact O-N 2.93Å; I306-I309 HydrophobicContact CB-CD1 4.16Å; I306-I309 HydrophobicContact CG1-CD1 4.35Å; I306-I309 HydrophobicContact CG2-CD1 3.93Å; I306-I309 WeakPolarHBondContact O-CG1 3.37Å
307	S	50.4	Low	67.2	Low	94 Å²	94	77.7 Å²	77.7	66%	0.657	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-69.3	-21.9	176.4	53.6	0	0	0	0	114.9	N305	N305-S307 PolarHBondContact O-N 3.26Å
308	D	45.5	Very low	67.4	Low	102 Å²	102	81.4 Å²	81.4	55%	0.545	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-94.8	1.5	-178	-76.8	-19.5	0	0	0	114	N305 I306 H310 S311	N305-D308 PolarHBondContact O-N 2.82Å; I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 PolarHBondContact O-N 2.93Å; D308-H310 PolarHBondContact O-N 2.79Å; D308-H310 VanDerWaalsContact O-N 3.12Å; D308-S311 PolarHBondContact O-N 3.18Å; D308-S311 PolarHBondContact O-OG 3.43Å
309	I	49.3	Very low	67.4	Low	63 Å²	63	81.4 Å²	81.4	32%	0.323	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.8	-177.7	-63.9	176.6	0	0	0	112.2	I306 S311	I306-I309 HydrophobicContact CB-CD1 4.16Å; I306-I309 HydrophobicContact CG1-CD1 4.35Å; I306-I309 HydrophobicContact CG2-CD1 3.93Å; I306-I309 WeakPolarHBondContact O-CG1 3.37Å; I309-S311 VanDerWaalsContact C-N 3.27Å; I309-S311 PolarHBondContact O-N 3.11Å
310	H	45.9	Very low	67.5	Low	193 Å²	193	78.5 Å²	78.5	89%	0.894	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.7	173.7	-74.2	-67.2	0	0	0	114.2	D308	D308-H310 PolarHBondContact O-N 2.79Å; D308-H310 VanDerWaalsContact O-N 3.12Å
311	S	46	Very low	67.6	Low	59 Å²	59	81.7 Å²	81.7	41%	0.413	46%	0.46	S	S	.	.	S	Bend	trans	-96.5	140.9	169.8	74.3	0	0	0	0	109.6	D308 I309 S313	D308-S311 PolarHBondContact O-N 3.18Å; D308-S311 PolarHBondContact O-OG 3.43Å; I309-S311 VanDerWaalsContact C-N 3.27Å; I309-S311 PolarHBondContact O-N 3.11Å; S311-S313 PolarHBondContact O-N 2.99Å
312	S	54.4	Low	67.9	Low	93 Å²	93	84.2 Å²	84.2	65%	0.65	47%	0.467	S	S	*	.	S	Bend	trans	-53.4	16.5	-172	-19.3	0	0	0	0	117.7	L314	S312-L314 PolarHBondContact O-N 3.38Å
313	S	66.6	Low	69	Low	59 Å²	59	76.5 Å²	76.5	41%	0.413	43%	0.426	S	S	.	.			trans	-89.5	88	-171.4	-172	0	0	0	0	111.3	S311 N315	S311-S313 PolarHBondContact O-N 2.99Å; S313-N315 PolarHBondContact O-N 3.32Å; S313-N315 PolarHBondContact OG-ND2 3.19Å; S313-N315 VanDerWaalsContact OG-ND2 3.16Å
314	L	80.8	Confident	70.5	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.01	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-67.8	13.3	167	-63.8	174.2	0	0	0	113	I292 H293 S312 G316 L317 Y348 I351	I292-L314 HydrophobicContact CB-CD2 4.28Å; I292-L314 HydrophobicContact CD1-CD1 3.93Å; I292-L314 HydrophobicContact CG2-CD1 4.33Å; I292-L314 HydrophobicContact CG2-CD2 3.83Å; H293-L314 VanDerWaalsContact CD2-CD2 3.44Å; H293-L314 WeakPolarHBondContact CD2-CD2 3.4Å; H293-L314 WeakPolarHBondContact NE2-CD2 3.28Å; S312-L314 PolarHBondContact O-N 3.38Å; L314-G316 VanDerWaalsContact C-N 3.29Å; L314-G316 PolarHBondContact O-N 3.42Å; L314-L317 HydrophobicContact CB-CD1 4.43Å; L314-L317 HydrophobicContact CD2-CD1 3.82Å; L314-L317 PolarHBondContact O-N 2.91Å; L314-Y348 HydrophobicContact CD1-CD1 3.74Å; L314-Y348 HydrophobicContact CD1-CG 4.28Å; L314-I351 HydrophobicContact CB-CB 4.33Å; L314-I351 HydrophobicContact CB-CD1 3.87Å; L314-I351 HydrophobicContact CB-CG2 3.67Å; L314-I351 HydrophobicContact CD1-CB 4.34Å; L314-I351 HydrophobicContact CD1-CD1 4.19Å; L314-I351 HydrophobicContact CD1-CG2 4.46Å; L314-I351 WeakPolarHBondContact O-CG2 3.49Å
315	N	76.2	Confident	71.8	Confident	138 Å²	138	75 Å²	75	74%	0.738	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-71.2	-20.6	-172.8	-72	-31.9	0	0	0	113.9	S313	S313-N315 PolarHBondContact O-N 3.32Å; S313-N315 PolarHBondContact OG-ND2 3.19Å; S313-N315 VanDerWaalsContact OG-ND2 3.16Å
316	G	82.9	Confident	73.4	Confident	13 Å²	13	69.6 Å²	69.6	13%	0.134	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-91	4.6	179.4	0	0	0	0	0	115.3	S301 L314 I318	S301-G316 PolarHBondContact N-O 3.48Å; L314-G316 VanDerWaalsContact C-N 3.29Å; L314-G316 PolarHBondContact O-N 3.42Å; G316-I318 PolarHBondContact O-N 3.04Å
317	L	90.6	Very high	75.2	Confident	11 Å²	11	63 Å²	63	6%	0.058	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.5	-175.7	-125.9	90.7	0	0	0	111.5	I292 F298 Y300 L314 T355	I292-L317 HydrophobicContact CG2-CD1 4.08Å; I292-L317 HydrophobicContact CG2-CD2 3.56Å; F298-L317 HydrophobicContact CB-CD2 3.72Å; F298-L317 HydrophobicContact CB-CG 3.84Å; F298-L317 HydrophobicContact CD1-CD2 3.54Å; F298-L317 HydrophobicContact CD1-CG 4.32Å; F298-L317 HydrophobicContact CD2-CD2 3.48Å; F298-L317 VanDerWaalsContact CD2-CD2 3.48Å; F298-L317 HydrophobicContact CD2-CG 4.48Å; F298-L317 HydrophobicContact CE1-CD2 3.99Å; F298-L317 HydrophobicContact CE2-CD2 3.96Å; F298-L317 HydrophobicContact CG-CD2 3.26Å; F298-L317 HydrophobicContact CG-CG 3.97Å; F298-L317 HydrophobicContact CZ-CD2 4.2Å; Y300-L317 HydrophobicContact CE1-CD1 3.75Å; Y300-L317 HydrophobicContact CE2-CD1 4.19Å; Y300-L317 VanDerWaalsContact CZ-CD1 3.45Å; Y300-L317 WeakPolarHBondContact OH-CD1 3.13Å; L314-L317 HydrophobicContact CB-CD1 4.43Å; L314-L317 HydrophobicContact CD2-CD1 3.82Å; L314-L317 PolarHBondContact O-N 2.91Å; L317-T355 HydrophobicContact CB-CG2 3.98Å; L317-T355 HydrophobicContact CD2-CG2 4.15Å; L317-T355 HydrophobicContact CG-CG2 4.49Å; L317-T355 WeakPolarHBondContact O-CG2 3.15Å
318	I	93.5	Very high	76.8	Confident	79 Å²	79	61.7 Å²	61.7	41%	0.405	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	155	169.3	56.1	167.8	0	0	0	109.2	F298 T299 G316	F298-I318 CarbonylContact C-O 3.47Å; F298-I318 WeakPolarHBondContact CA-O 3.43Å; F298-I318 WeakPolarHBondContact CB-O 3.32Å; T299-I318 PolarHBondContact N-O 2.77Å; T299-I318 WeakPolarHBondContact O-CG1 3.45Å; T299-I318 PolarHBondContact O-N 2.84Å; T299-I318 VanDerWaalsContact O-O 3.06Å; T299-I318 WeakPolarHBondContact OG1-CG1 3.43Å; G316-I318 PolarHBondContact O-N 3.04Å
319	V	92.3	Very high	78.6	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	142.1	173.1	-68.8	0	0	0	0	110.6	L297 F298 M323 K324 L327 T355 G359	L297-V319 WeakPolarHBondContact O-CA 3.4Å; F298-V319 HydrophobicContact CD1-CG1 4.4Å; F298-V319 HydrophobicContact CE1-CG1 4.34Å; V319-M323 HydrophobicContact CB-CB 4.22Å; V319-M323 HydrophobicContact CB-CG 3.99Å; V319-M323 HydrophobicContact CG1-CG 4.06Å; V319-K324 HydrophobicContact CG2-CB 4.09Å; V319-K324 HydrophobicContact CG2-CG 4.48Å; V319-L327 HydrophobicContact CG1-CD1 4.37Å; V319-T355 HydrophobicContact CG1-CG2 4.35Å; V319-G359 VanDerWaalsContact CG2-CA 3.43Å
320	S	90.4	Very high	80.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.014	30%	0.3	C	S	.	.			trans	-61.2	159.1	172.9	63.2	0	0	0	0	111.6	R296 L297 E322 M323 K324	R296-S320 PolarHBondContact O-OG 2.83Å; L297-S320 PolarHBondContact O-N 2.74Å; L297-S320 PolarHBondContact O-OG 3.05Å; S320-E322 PolarHBondContact O-N 3.09Å; S320-M323 PolarHBondContact O-N 2.91Å; S320-M323 WeakPolarHBondContact OG-CB 3.49Å; S320-M323 PolarHBondContact OG-N 3.36Å; S320-K324 WeakPolarHBondContact O-CB 3.31Å; S320-K324 PolarHBondContact O-N 3.35Å
321	N	88.5	Confident	82.8	Confident	121 Å²	121	46.3 Å²	46.3	65%	0.647	27%	0.265	S	S	*	.	H	α-helix	trans	-62.3	-35.9	-179.6	-75.9	-34.2	0	0	0	111.8	K324 C325	N321-K324 PolarHBondContact O-N 3.26Å; N321-C325 PolarHBondContact O-N 3.25Å; N321-C325 PolarHBondContact O-SG 3.43Å
322	E	86.4	Confident	85.1	Confident	91 Å²	91	43.5 Å²	43.5	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-47.4	176	-63.2	70.4	-154.5	0	0	110.4	F210 S320 C325 L326	F210-E322 HydrophobicContact CD1-CB 4.45Å; F210-E322 HydrophobicContact CD2-CB 4.16Å; F210-E322 HydrophobicContact CD2-CG 4.46Å; F210-E322 HydrophobicContact CE2-CB 4.3Å; F210-E322 HydrophobicContact CE2-CG 4.49Å; F210-E322 HydrophobicContact CG-CB 4.21Å; F210-E322 HydrophobicContact CZ-CB 4.45Å; S320-E322 PolarHBondContact O-N 3.09Å; E322-C325 PolarHBondContact O-N 3.34Å; E322-L326 PolarHBondContact O-N 3.37Å; E322-L326 VanDerWaalsContact O-N 3.13Å
323	M	89	Confident	87.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-45.9	176.2	-178.8	56.1	172.1	0	0	110.7	L274 L297 V319 S320 C325 L326 L327 V356	L274-M323 HydrophobicContact CD1-CE 3.47Å; L274-M323 VanDerWaalsContact CD1-CE 3.47Å; L274-M323 HydrophobicContact CD1-SD 3.74Å; L274-M323 HydrophobicContact CD2-SD 4.44Å; L297-M323 HydrophobicContact CD2-SD 4.29Å; V319-M323 HydrophobicContact CB-CB 4.22Å; V319-M323 HydrophobicContact CB-CG 3.99Å; V319-M323 HydrophobicContact CG1-CG 4.06Å; S320-M323 PolarHBondContact O-N 2.91Å; S320-M323 WeakPolarHBondContact OG-CB 3.49Å; S320-M323 PolarHBondContact OG-N 3.36Å; M323-C325 VanDerWaalsContact C-N 3.31Å; M323-C325 PolarHBondContact O-N 3.2Å; M323-L326 WeakPolarHBondContact O-CB 3.41Å; M323-L326 PolarHBondContact O-N 3.47Å; M323-L327 HydrophobicContact CE-CD1 4.15Å; M323-L327 HydrophobicContact CE-CD2 3.53Å; M323-L327 HydrophobicContact CE-CG 3.97Å; M323-L327 HydrophobicContact CG-CD1 4.28Å; M323-L327 HydrophobicContact CG-CG 4.3Å; M323-L327 VanDerWaalsContact O-CG 3.31Å; M323-L327 WeakPolarHBondContact O-CG 3.45Å; M323-L327 PolarHBondContact O-N 3.16Å; M323-L327 HydrophobicContact SD-CD2 4.15Å; M323-L327 HydrophobicContact SD-CG 4.18Å; M323-V356 HydrophobicContact CE-CG1 3.71Å; M323-V356 HydrophobicContact CE-CG2 4.09Å
324	K	89.2	Confident	88.5	Confident	104 Å²	104	36.5 Å²	36.5	45%	0.452	20%	0.196	S	C	.	.	H	α-helix	trans	-58	-41.1	178	-167.6	173.8	-176.7	175.8	0	112.5	V319 S320 N321 L327 H328	V319-K324 HydrophobicContact CG2-CB 4.09Å; V319-K324 HydrophobicContact CG2-CG 4.48Å; S320-K324 WeakPolarHBondContact O-CB 3.31Å; S320-K324 PolarHBondContact O-N 3.35Å; N321-K324 PolarHBondContact O-N 3.26Å; K324-L327 PolarHBondContact O-N 3.44Å; K324-H328 PolarHBondContact O-ND1 2.84Å
325	C	85.8	Confident	89.2	Confident	69 Å²	69	36.4 Å²	36.4	47%	0.466	20%	0.195	S	C	.	.	H	α-helix	trans	-61.7	-44.5	174	-69.4	0	0	0	0	111.6	S154 N321 E322 M323 H328	S154-C325 PolarHBondContact OG-O 3.13Å; N321-C325 PolarHBondContact O-N 3.25Å; N321-C325 PolarHBondContact O-SG 3.43Å; E322-C325 PolarHBondContact O-N 3.34Å; M323-C325 VanDerWaalsContact C-N 3.31Å; M323-C325 PolarHBondContact O-N 3.2Å; C325-H328 PolarHBondContact O-N 2.94Å
326	L	86.3	Confident	90	Very high	13 Å²	13	29.9 Å²	29.9	7%	0.068	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-44	178.9	-173.2	141.9	0	0	0	111.9	L274 E322 M323 H328 G329 I330	L274-L326 HydrophobicContact CD1-CD2 4.16Å; L274-L326 HydrophobicContact CD2-CD1 3.71Å; L274-L326 HydrophobicContact CD2-CD2 3.76Å; L274-L326 HydrophobicContact CD2-CG 4.39Å; E322-L326 PolarHBondContact O-N 3.37Å; E322-L326 VanDerWaalsContact O-N 3.13Å; M323-L326 WeakPolarHBondContact O-CB 3.41Å; M323-L326 PolarHBondContact O-N 3.47Å; L326-H328 PolarHBondContact O-N 2.84Å; L326-H328 VanDerWaalsContact O-N 3.15Å; L326-G329 PolarHBondContact O-N 3.43Å; L326-I330 HydrophobicContact CD2-CD1 3.95Å; L326-I330 HydrophobicContact CD2-CG1 3.59Å
327	L	89.3	Confident	90.4	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-26.2	-178.2	-68.3	-176.3	0	0	0	113.9	V319 M323 K324 G329 I330 V356 F360	V319-L327 HydrophobicContact CG1-CD1 4.37Å; M323-L327 HydrophobicContact CE-CD1 4.15Å; M323-L327 HydrophobicContact CE-CD2 3.53Å; M323-L327 HydrophobicContact CE-CG 3.97Å; M323-L327 HydrophobicContact CG-CD1 4.28Å; M323-L327 HydrophobicContact CG-CG 4.3Å; M323-L327 VanDerWaalsContact O-CG 3.31Å; M323-L327 WeakPolarHBondContact O-CG 3.45Å; M323-L327 PolarHBondContact O-N 3.16Å; M323-L327 HydrophobicContact SD-CD2 4.15Å; M323-L327 HydrophobicContact SD-CG 4.18Å; K324-L327 PolarHBondContact O-N 3.44Å; L327-G329 PolarHBondContact O-N 2.99Å; L327-I330 PolarHBondContact O-N 2.97Å; L327-V356 HydrophobicContact CD1-CG1 4.35Å; L327-V356 WeakPolarHBondContact CD1-O 3.27Å; L327-V356 HydrophobicContact CD2-CG1 4.3Å; L327-F360 HydrophobicContact CB-CD1 4.17Å; L327-F360 HydrophobicContact CB-CD2 4.45Å; L327-F360 HydrophobicContact CB-CE1 4.16Å; L327-F360 HydrophobicContact CB-CE2 4.41Å; L327-F360 HydrophobicContact CB-CG 4.35Å; L327-F360 HydrophobicContact CB-CZ 4.3Å; L327-F360 HydrophobicContact CD1-CD2 3.95Å; L327-F360 HydrophobicContact CD1-CE2 3.98Å; L327-F360 HydrophobicContact CD2-CD2 4.31Å; L327-F360 HydrophobicContact CD2-CE1 4.16Å; L327-F360 HydrophobicContact CD2-CE2 3.56Å; L327-F360 HydrophobicContact CD2-CZ 3.51Å; L327-F360 HydrophobicContact CG-CD2 4.45Å; L327-F360 HydrophobicContact CG-CE2 4.17Å; L327-F360 HydrophobicContact CG-CZ 4.32Å; L327-F360 WeakPolarHBondContact O-CD1 3.42Å; L327-F360 WeakPolarHBondContact O-CE1 3.45Å
328	H	84.3	Confident	90.4	Very high	68 Å²	68	29 Å²	29	32%	0.315	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.2	176.6	-81	68.4	0	0	0	113.7	K324 C325 L326	K324-H328 PolarHBondContact O-ND1 2.84Å; C325-H328 PolarHBondContact O-N 2.94Å; L326-H328 PolarHBondContact O-N 2.84Å; L326-H328 VanDerWaalsContact O-N 3.15Å
329	G	83.8	Confident	90.2	Very high	8 Å²	8	25.8 Å²	25.8	8%	0.082	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-13.6	178.7	0	0	0	0	0	114.5	L326 L327	L326-G329 PolarHBondContact O-N 3.43Å; L327-G329 PolarHBondContact O-N 2.99Å
330	I	90.6	Very high	89.9	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	15%	0.152	C	C	.	.			trans	-83.3	135.2	-173.7	-63.3	-59	0	0	0	110.6	R170 A172 H272 L326 L327 G332 F360	R170-I330 HydrophobicContact CB-CD1 4.09Å; R170-I330 CarbonylContact O-C 3.48Å; R170-I330 WeakPolarHBondContact O-CA 3.41Å; A172-I330 HydrophobicContact CB-CD1 4.01Å; A172-I330 HydrophobicContact CB-CG1 4.09Å; A172-I330 HydrophobicContact CB-CG2 3.92Å; H272-I330 HydrophobicContact CB-CD1 4.33Å; L326-I330 HydrophobicContact CD2-CD1 3.95Å; L326-I330 HydrophobicContact CD2-CG1 3.59Å; L327-I330 PolarHBondContact O-N 2.97Å; I330-G332 WeakPolarHBondContact CG2-O 3.29Å; I330-F360 HydrophobicContact CB-CE1 4.07Å; I330-F360 HydrophobicContact CB-CZ 4.31Å; I330-F360 HydrophobicContact CG2-CE1 4.21Å; I330-F360 HydrophobicContact CG2-CZ 4.1Å
331	C	91.9	Very high	89.8	Confident	22 Å²	22	30.9 Å²	30.9	15%	0.149	16%	0.156	C	C	.	.			trans	-114.7	4.1	-179.9	66.7	0	0	0	0	113.9	R170 P369 H465	R170-C331 PolarHBondContact N-SG 2.8Å; R170-C331 PolarHBondContact O-N 2.93Å; R170-C331 PolarHBondContact O-SG 3.39Å; C331-P369 VanDerWaalsContact O-CD 3.27Å; C331-P369 WeakPolarHBondContact O-CD 3.35Å; C331-H465 PolarHBondContact SG-CD2 3.29Å
332	G	94.8	Very high	89.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	152.3	176.5	0	0	0	0	0	111.8	F171 A172 I330 P369	F171-G332 WeakPolarHBondContact CA-O 3.3Å; A172-G332 PolarHBondContact N-O 2.95Å; I330-G332 WeakPolarHBondContact CG2-O 3.29Å; G332-P369 WeakPolarHBondContact CA-O 3.26Å
333	I	95.7	Very high	89.7	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.5	-176.9	-63.4	174.8	0	0	0	109.3	A172 F174 V356 L357 F360 V368 P369 I370 V371	A172-I333 CarbonylContact O-C 3.54Å; F174-I333 HydrophobicContact CD1-CG2 4.1Å; F174-I333 HydrophobicContact CE1-CG2 3.51Å; F174-I333 HydrophobicContact CZ-CG2 4.48Å; I333-V356 HydrophobicContact CD1-CG1 4.3Å; I333-L357 HydrophobicContact CD1-CD2 3.63Å; I333-F360 HydrophobicContact CD1-CE2 3.54Å; I333-F360 HydrophobicContact CD1-CZ 3.74Å; I333-F360 HydrophobicContact CG1-CE2 4.32Å; I333-F360 HydrophobicContact CG1-CZ 4.02Å; I333-V368 HydrophobicContact CD1-CG1 4.11Å; I333-V368 HydrophobicContact CG1-CG1 3.97Å; I333-P369 PolarHBondContact N-O 3.22Å; I333-I370 HydrophobicContact CB-CG2 4.36Å; I333-I370 HydrophobicContact CG2-CG2 4.24Å; I333-I370 CarbonylContact O-C 3.58Å; I333-I370 WeakPolarHBondContact O-CA 3.37Å; I333-V371 PolarHBondContact O-N 2.91Å
334	I	95.7	Very high	89.6	Confident	5 Å²	5	35 Å²	35	3%	0.026	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.2	165.2	-59.9	171.5	0	0	0	106.8	A172 V173 F174 L271 V371 L373 L458 L461	A172-I334 PolarHBondContact O-N 3.34Å; V173-I334 VanDerWaalsContact CA-O 3.29Å; V173-I334 WeakPolarHBondContact CA-O 3.49Å; V173-I334 HydrophobicContact CG2-CB 3.73Å; V173-I334 HydrophobicContact CG2-CD1 3.9Å; V173-I334 HydrophobicContact CG2-CG1 4.32Å; V173-I334 HydrophobicContact CG2-CG2 4.09Å; F174-I334 PolarHBondContact N-O 3.18Å; F174-I334 VanDerWaalsContact N-O 3.09Å; L271-I334 HydrophobicContact CD1-CD1 4.16Å; I334-V371 CarbonylContact C-O 3.59Å; I334-V371 WeakPolarHBondContact CA-O 3.43Å; I334-V371 HydrophobicContact CG1-CB 4.29Å; I334-L373 HydrophobicContact CG2-CD1 3.54Å; I334-L373 HydrophobicContact CG2-CG 3.91Å; I334-L458 HydrophobicContact CD1-CD2 3.9Å; I334-L461 HydrophobicContact CD1-CD1 3.98Å; I334-L461 HydrophobicContact CG1-CD1 3.6Å
335	Y	95.7	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	110.9	175	-170.7	-106.2	0	0	0	109.5	F174 P176 L337 L349 E352 L353 V371 I372 L373 L432	F174-Y335 HydrophobicContact CD1-CD2 4.44Å; F174-Y335 AromaticContact CD2-CD2 3.88Å; F174-Y335 HydrophobicContact CD2-CD2 3.88Å; F174-Y335 AromaticContact CD2-CE2 3.87Å; F174-Y335 HydrophobicContact CD2-CE2 3.87Å; F174-Y335 HydrophobicContact CE1-CD2 4.14Å; F174-Y335 AromaticContact CE2-CD2 3.51Å; F174-Y335 HydrophobicContact CE2-CD2 3.51Å; F174-Y335 AromaticContact CE2-CE2 3.5Å; F174-Y335 HydrophobicContact CE2-CE2 3.5Å; F174-Y335 VanDerWaalsContact CE2-CE2 3.5Å; F174-Y335 HydrophobicContact CG-CD2 4.32Å; F174-Y335 AromaticContact CZ-CD2 3.65Å; F174-Y335 HydrophobicContact CZ-CD2 3.65Å; F174-Y335 HydrophobicContact CZ-CE2 4.07Å; F174-Y335 CarbonylContact O-C 3.41Å; F174-Y335 WeakPolarHBondContact O-CA 3.33Å; P176-Y335 VanDerWaalsContact CD-OH 3.28Å; P176-Y335 WeakPolarHBondContact CD-OH 3.47Å; Y335-L337 HydrophobicContact CE1-CB 4.47Å; Y335-L349 WeakPolarHBondContact OH-CB 3.47Å; Y335-L349 WeakPolarHBondContact OH-CD2 2.88Å; Y335-E352 PolarHBondContact OH-OE2 3.29Å; Y335-L353 HydrophobicContact CD2-CD1 4.26Å; Y335-L353 HydrophobicContact CG-CD1 4.4Å; Y335-V371 PolarHBondContact N-O 3.44Å; Y335-I372 HydrophobicContact CD1-CD1 3.98Å; Y335-I372 HydrophobicContact CD1-CG2 4.46Å; Y335-I372 HydrophobicContact CG-CD1 4.22Å; Y335-I372 WeakPolarHBondContact O-CA 3.31Å; Y335-L373 PolarHBondContact O-N 3.22Å; Y335-L432 HydrophobicContact CD1-CD1 4.28Å; Y335-L432 HydrophobicContact CE1-CD1 4.27Å; Y335-L432 HydrophobicContact CE1-CD2 4.08Å
336	A	93.4	Very high	89.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.3	-179.5	0	0	0	0	0	110.1	F174 G175 P176 G177 F178 I375	F174-A336 PolarHBondContact O-N 2.88Å; G175-A336 CarbonylContact C-O 3.57Å; P176-A336 WeakPolarHBondContact CD-O 3.45Å; G177-A336 PolarHBondContact N-O 2.78Å; F178-A336 HydrophobicContact CB-CB 3.89Å; A336-I375 HydrophobicContact CB-CD1 3.92Å
337	L	92.1	Very high	89.8	Confident	5 Å²	5	32 Å²	32	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.4	179.9	179.2	64.6	0	0	0	109.8	P176 Y335 L349 I372 L373 Y374 I375 P428 L432	P176-L337 HydrophobicContact CG-CD1 4.28Å; Y335-L337 HydrophobicContact CE1-CB 4.47Å; L337-L349 HydrophobicContact CD1-CD1 3.17Å; L337-I372 HydrophobicContact CB-CG2 4.42Å; L337-L373 PolarHBondContact N-O 2.79Å; L337-Y374 HydrophobicContact CB-CD2 4.32Å; L337-Y374 HydrophobicContact CD2-CD2 3.59Å; L337-Y374 HydrophobicContact CD2-CE2 3.94Å; L337-Y374 HydrophobicContact CG-CD2 3.87Å; L337-Y374 HydrophobicContact CG-CE2 4.26Å; L337-I375 PolarHBondContact O-N 3.21Å; L337-P428 HydrophobicContact CD2-CB 3.65Å; L337-L432 HydrophobicContact CD2-CD1 4.31Å
338	D	89.7	Confident	89.9	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	125.5	171.7	-162.7	-40.1	0	0	0	109.8	Q180 R340 E341	Q180-D338 PolarHBondContact OE1-OD2 3.3Å; D338-R340 PolarHBondContact O-N 3.29Å; D338-R340 VanDerWaalsContact OD1-CB 3.32Å; D338-R340 WeakPolarHBondContact OD1-CB 3.18Å; D338-R340 WeakPolarHBondContact OD1-CG 3.31Å; D338-R340 IonicContact OD1-CZ 2.97Å; D338-R340 PolarHBondContact OD1-N 3.13Å; D338-R340 IonicContact OD1-NE 3.61Å; D338-R340 PolarHBondContact OD1-NE 3.2Å; D338-R340 IonicContact OD1-NH2 3.95Å; D338-R340 IonicContact OD2-CZ 3.84Å; D338-R340 IonicContact OD2-NE 3.78Å; D338-R340 PolarHBondContact OD2-NE 2.67Å; D338-R340 IonicContact OD2-NH2 3.55Å; D338-R340 PolarHBondContact OD2-NH2 3.28Å; D338-E341 WeakPolarHBondContact O-CB 3.33Å; D338-E341 PolarHBondContact O-N 2.94Å
339	A	90.1	Very high	90.3	Very high	12 Å²	12	31.9 Å²	31.9	10%	0.099	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.1	178.8	0	0	0	0	0	115	E341 Y374 I375 M376 W421	A339-E341 VanDerWaalsContact C-N 3.3Å; A339-Y374 VanDerWaalsContact CA-CE2 3.42Å; A339-Y374 HydrophobicContact CB-CD2 4.16Å; A339-Y374 HydrophobicContact CB-CE1 4.46Å; A339-Y374 HydrophobicContact CB-CE2 3.73Å; A339-I375 WeakPolarHBondContact CB-O 3.36Å; A339-I375 PolarHBondContact N-O 2.93Å; A339-M376 HydrophobicContact CB-CB 3.98Å; A339-M376 HydrophobicContact CB-CG 4.45Å; A339-M376 HydrophobicContact CB-SD 3.64Å; A339-W421 HydrophobicContact CB-CH2 3.57Å; A339-W421 HydrophobicContact CB-CZ2 3.33Å
340	R	86.2	Confident	90.8	Very high	100 Å²	100	33.1 Å²	33.1	38%	0.377	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.6	178.2	-57.2	168.2	-56.4	166.8	12.5	112.2	D338 T342 M376 D380	D338-R340 PolarHBondContact O-N 3.29Å; D338-R340 VanDerWaalsContact OD1-CB 3.32Å; D338-R340 WeakPolarHBondContact OD1-CB 3.18Å; D338-R340 WeakPolarHBondContact OD1-CG 3.31Å; D338-R340 IonicContact OD1-CZ 2.97Å; D338-R340 PolarHBondContact OD1-N 3.13Å; D338-R340 IonicContact OD1-NE 3.61Å; D338-R340 PolarHBondContact OD1-NE 3.2Å; D338-R340 IonicContact OD1-NH2 3.95Å; D338-R340 IonicContact OD2-CZ 3.84Å; D338-R340 IonicContact OD2-NE 3.78Å; D338-R340 PolarHBondContact OD2-NE 2.67Å; D338-R340 IonicContact OD2-NH2 3.55Å; D338-R340 PolarHBondContact OD2-NH2 3.28Å; R340-T342 PolarHBondContact O-N 3.26Å; R340-M376 HydrophobicContact CG-SD 4.08Å; R340-D380 WeakPolarHBondContact CD-OD2 3.4Å; R340-D380 IonicContact NE-OD2 3.93Å; R340-D380 IonicContact NH1-OD2 2.97Å; R340-D380 PolarHBondContact NH1-OD2 3.21Å
341	E	87.5	Confident	90.9	Very high	23 Å²	23	34.9 Å²	34.9	11%	0.107	17%	0.173	C	C	.	.			trans	-59.5	135.3	177	-159.8	64	-133.8	0	0	110.2	Q288 D338 A339 Q345 A346 Q427	Q288-E341 HydrophobicContact CG-CG 4.37Å; Q288-E341 VanDerWaalsContact CG-OE1 3.27Å; Q288-E341 WeakPolarHBondContact CG-OE1 3.21Å; Q288-E341 PolarHBondContact NE2-OE1 3.05Å; Q288-E341 PolarHBondContact NE2-OE2 2.84Å; D338-E341 WeakPolarHBondContact O-CB 3.33Å; D338-E341 PolarHBondContact O-N 2.94Å; A339-E341 VanDerWaalsContact C-N 3.3Å; E341-Q345 HydrophobicContact CG-CB 3.93Å; E341-Q345 WeakPolarHBondContact OE1-CB 3.35Å; E341-Q345 WeakPolarHBondContact OE1-CG 3.38Å; E341-A346 HydrophobicContact CG-CB 4.16Å; E341-Q427 PolarHBondContact O-NE2 2.88Å
342	T	87.7	Confident	91	Very high	72 Å²	72	33.8 Å²	33.8	44%	0.442	17%	0.166	S	C	.	.			trans	-74.5	155.2	176.1	70	0	0	0	0	110.1	R340 E344 Q345 A346	R340-T342 PolarHBondContact O-N 3.26Å; T342-E344 PolarHBondContact O-N 2.94Å; T342-Q345 PolarHBondContact O-N 2.9Å; T342-Q345 WeakPolarHBondContact OG1-CG 3.46Å; T342-Q345 PolarHBondContact OG1-N 2.82Å; T342-A346 VanDerWaalsContact O-CB 3.29Å; T342-A346 WeakPolarHBondContact O-CB 3.43Å; T342-A346 PolarHBondContact O-N 3.42Å
343	T	85.9	Confident	91	Very high	79 Å²	79	33.9 Å²	33.9	49%	0.485	17%	0.166	S	C	.	.	H	α-helix	trans	-54.7	-40	176.5	-53.2	0	0	0	0	111.9	Q345 A346 I347	T343-Q345 VanDerWaalsContact C-N 3.33Å; T343-Q345 PolarHBondContact O-N 3.29Å; T343-A346 PolarHBondContact O-N 3.3Å; T343-I347 WeakPolarHBondContact O-CD1 3.23Å; T343-I347 WeakPolarHBondContact O-CG1 3.19Å; T343-I347 PolarHBondContact O-N 3.45Å
344	E	87.1	Confident	91	Very high	147 Å²	147	37.4 Å²	37.4	69%	0.687	18%	0.182	S	C	*	.	H	α-helix	trans	-60.9	-41.5	-179.9	-66	168.4	-178	0	0	112.3	T342 Y348	T342-E344 PolarHBondContact O-N 2.94Å; E344-Y348 WeakPolarHBondContact O-CE2 3.36Å
345	Q	90	Very high	90.9	Very high	43 Å²	43	37.6 Å²	37.6	20%	0.201	18%	0.183	C	C	.	.	H	α-helix	trans	-80.1	-35.4	179.1	-64.4	-60.4	-37.9	0	0	112	Q288 E341 T342 T343 I347 Y348	Q288-Q345 HydrophobicContact CB-CB 4.32Å; Q288-Q345 HydrophobicContact CG-CB 3.74Å; E341-Q345 HydrophobicContact CG-CB 3.93Å; E341-Q345 WeakPolarHBondContact OE1-CB 3.35Å; E341-Q345 WeakPolarHBondContact OE1-CG 3.38Å; T342-Q345 PolarHBondContact O-N 2.9Å; T342-Q345 WeakPolarHBondContact OG1-CG 3.46Å; T342-Q345 PolarHBondContact OG1-N 2.82Å; T343-Q345 VanDerWaalsContact C-N 3.33Å; T343-Q345 PolarHBondContact O-N 3.29Å; Q345-I347 PolarHBondContact O-N 2.97Å; Q345-Y348 WeakPolarHBondContact O-CD2 3.38Å; Q345-Y348 PolarHBondContact O-N 3.42Å
346	A	87.5	Confident	90.9	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-24.3	-178.9	0	0	0	0	0	113.4	E341 T342 T343 Y348 L349 C431	E341-A346 HydrophobicContact CG-CB 4.16Å; T342-A346 VanDerWaalsContact O-CB 3.29Å; T342-A346 WeakPolarHBondContact O-CB 3.43Å; T342-A346 PolarHBondContact O-N 3.42Å; T343-A346 PolarHBondContact O-N 3.3Å; A346-Y348 VanDerWaalsContact C-N 3.26Å; A346-Y348 PolarHBondContact O-N 3.16Å; A346-L349 HydrophobicContact CB-CD1 4.33Å; A346-L349 VanDerWaalsContact O-CB 3.23Å; A346-L349 WeakPolarHBondContact O-CB 3.32Å; A346-L349 WeakPolarHBondContact O-CG 3.34Å; A346-L349 PolarHBondContact O-N 3.01Å; A346-L349 VanDerWaalsContact O-N 3.17Å; A346-C431 HydrophobicContact CB-CB 3.7Å
347	I	87.2	Confident	90.9	Very high	78 Å²	78	38.1 Å²	38.1	40%	0.4	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-34	177.4	-71.1	159.7	0	0	0	111.8	T343 Q345 L349 Y350	T343-I347 WeakPolarHBondContact O-CD1 3.23Å; T343-I347 WeakPolarHBondContact O-CG1 3.19Å; T343-I347 PolarHBondContact O-N 3.45Å; Q345-I347 PolarHBondContact O-N 2.97Å; I347-L349 PolarHBondContact O-N 2.84Å; I347-Y350 PolarHBondContact O-N 2.9Å
348	Y	91.6	Very high	90.9	Very high	66 Å²	66	45 Å²	45	26%	0.259	22%	0.215	S	C	.	.	H	α-helix	trans	-69.3	-20.8	179.3	-61.5	-74.4	0	0	0	113.1	P289 L314 E344 Q345 A346 Y350 I351 E352	P289-Y348 HydrophobicContact CG-CD1 3.82Å; P289-Y348 HydrophobicContact CG-CD2 3.52Å; P289-Y348 HydrophobicContact CG-CE1 3.76Å; P289-Y348 HydrophobicContact CG-CE2 3.48Å; P289-Y348 VanDerWaalsContact CG-CE2 3.48Å; P289-Y348 HydrophobicContact CG-CG 3.69Å; L314-Y348 HydrophobicContact CD1-CD1 3.74Å; L314-Y348 HydrophobicContact CD1-CG 4.28Å; E344-Y348 WeakPolarHBondContact O-CE2 3.36Å; Q345-Y348 WeakPolarHBondContact O-CD2 3.38Å; Q345-Y348 PolarHBondContact O-N 3.42Å; A346-Y348 VanDerWaalsContact C-N 3.26Å; A346-Y348 PolarHBondContact O-N 3.16Å; Y348-Y350 VanDerWaalsContact C-N 3.25Å; Y348-Y350 PolarHBondContact O-N 3.47Å; Y348-I351 WeakPolarHBondContact O-CB 3.34Å; Y348-I351 PolarHBondContact O-N 3.14Å; Y348-E352 PolarHBondContact O-N 3.44Å
349	L	93.1	Very high	91.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-24	-178.5	-55.9	-175.8	0	0	0	112.7	P176 Q288 Y335 L337 A346 I347 I351 E352 L353 L432	P176-L349 HydrophobicContact CG-CD1 3.82Å; P176-L349 HydrophobicContact CG-CD2 3.9Å; Q288-L349 HydrophobicContact CB-CD2 4.33Å; Q288-L349 HydrophobicContact CG-CD2 4.12Å; Y335-L349 WeakPolarHBondContact OH-CB 3.47Å; Y335-L349 WeakPolarHBondContact OH-CD2 2.88Å; L337-L349 HydrophobicContact CD1-CD1 3.17Å; A346-L349 HydrophobicContact CB-CD1 4.33Å; A346-L349 VanDerWaalsContact O-CB 3.23Å; A346-L349 WeakPolarHBondContact O-CB 3.32Å; A346-L349 WeakPolarHBondContact O-CG 3.34Å; A346-L349 PolarHBondContact O-N 3.01Å; A346-L349 VanDerWaalsContact O-N 3.17Å; I347-L349 PolarHBondContact O-N 2.84Å; L349-I351 VanDerWaalsContact C-N 3.28Å; L349-I351 PolarHBondContact O-N 3.26Å; L349-E352 PolarHBondContact O-N 3.34Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 PolarHBondContact O-N 3.41Å; L349-L432 HydrophobicContact CB-CD2 3.61Å
350	Y	93.6	Very high	91.2	Very high	34 Å²	34	44.9 Å²	44.9	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-59	-43.2	168.8	168.2	-110.8	0	0	0	111.2	I347 Y348 K354 L432 H433 E436 F437	I347-Y350 PolarHBondContact O-N 2.9Å; Y348-Y350 VanDerWaalsContact C-N 3.25Å; Y348-Y350 PolarHBondContact O-N 3.47Å; Y350-K354 HydrophobicContact CE1-CD 3.79Å; Y350-K354 HydrophobicContact CE2-CD 4.17Å; Y350-K354 WeakPolarHBondContact O-CB 3.44Å; Y350-K354 PolarHBondContact O-N 3.21Å; Y350-K354 PolarHBondContact OH-NZ 3.28Å; Y350-L432 WeakPolarHBondContact CD2-O 3.36Å; Y350-H433 HydrophobicContact CD2-CB 3.84Å; Y350-H433 HydrophobicContact CE2-CB 3.78Å; Y350-H433 AromaticContact CG-CD2 3.96Å; Y350-E436 PolarHBondContact OH-OE2 3.14Å; Y350-F437 HydrophobicContact CD2-CE2 4.26Å; Y350-F437 AromaticContact CD2-CZ 3.82Å; Y350-F437 HydrophobicContact CD2-CZ 3.82Å; Y350-F437 HydrophobicContact CE2-CE1 4.33Å; Y350-F437 HydrophobicContact CE2-CE2 4.43Å; Y350-F437 AromaticContact CE2-CZ 3.92Å; Y350-F437 HydrophobicContact CE2-CZ 3.92Å
351	I	92.6	Very high	91.4	Very high	41 Å²	41	41.2 Å²	41.2	21%	0.21	20%	0.204	C	C	.	.	H	α-helix	trans	-68.6	-41.8	-177.9	-57.5	175.2	0	0	0	110.1	L314 Y348 L349 T355	L314-I351 HydrophobicContact CB-CB 4.33Å; L314-I351 HydrophobicContact CB-CD1 3.87Å; L314-I351 HydrophobicContact CB-CG2 3.67Å; L314-I351 HydrophobicContact CD1-CB 4.34Å; L314-I351 HydrophobicContact CD1-CD1 4.19Å; L314-I351 HydrophobicContact CD1-CG2 4.46Å; L314-I351 WeakPolarHBondContact O-CG2 3.49Å; Y348-I351 WeakPolarHBondContact O-CB 3.34Å; Y348-I351 PolarHBondContact O-N 3.14Å; L349-I351 VanDerWaalsContact C-N 3.28Å; L349-I351 PolarHBondContact O-N 3.26Å; I351-T355 VanDerWaalsContact O-CB 3.29Å; I351-T355 WeakPolarHBondContact O-CB 3.25Å; I351-T355 PolarHBondContact O-N 3.14Å; I351-T355 PolarHBondContact O-OG1 3.15Å
352	E	94.1	Very high	91.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.3	-57.3	173.9	-174	-176.4	-165.4	0	0	111.5	F174 R291 I292 F298 Y335 Y348 L349 K354 T355 V356	F174-E352 HydrophobicContact CE2-CG 4.19Å; R291-E352 IonicContact CZ-OE1 3.44Å; R291-E352 IonicContact CZ-OE2 2.94Å; R291-E352 IonicContact NH1-OE1 3.38Å; R291-E352 PolarHBondContact NH1-OE1 2.72Å; R291-E352 IonicContact NH1-OE2 2.71Å; R291-E352 VanDerWaalsContact NH2-CD 3.26Å; R291-E352 IonicContact NH2-OE1 3.31Å; R291-E352 PolarHBondContact NH2-OE1 3.11Å; R291-E352 IonicContact NH2-OE2 3.63Å; R291-E352 PolarHBondContact NH2-OE2 3.34Å; I292-E352 HydrophobicContact CD1-CB 4.03Å; I292-E352 HydrophobicContact CG1-CB 4.31Å; I292-E352 HydrophobicContact CG1-CG 4.46Å; F298-E352 HydrophobicContact CE2-CG 3.79Å; F298-E352 HydrophobicContact CZ-CB 4.49Å; F298-E352 HydrophobicContact CZ-CG 3.58Å; Y335-E352 PolarHBondContact OH-OE2 3.29Å; Y348-E352 PolarHBondContact O-N 3.44Å; L349-E352 PolarHBondContact O-N 3.34Å; E352-K354 PolarHBondContact O-N 3.16Å; E352-T355 PolarHBondContact O-N 2.78Å; E352-V356 PolarHBondContact O-N 2.96Å
353	L	95.2	Very high	91.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-43.9	-177.6	-179.7	58.4	0	0	0	111.6	F174 Y335 L349 T355 V356 L357 I370 I372 F437	F174-L353 HydrophobicContact CE1-CD1 4.49Å; F174-L353 HydrophobicContact CZ-CD1 3.87Å; Y335-L353 HydrophobicContact CD2-CD1 4.26Å; Y335-L353 HydrophobicContact CG-CD1 4.4Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 PolarHBondContact O-N 3.41Å; L353-T355 VanDerWaalsContact C-N 3.3Å; L353-T355 PolarHBondContact O-N 3.16Å; L353-V356 PolarHBondContact O-N 3.4Å; L353-L357 HydrophobicContact CD1-CD1 4.42Å; L353-L357 HydrophobicContact CD1-CG 4.4Å; L353-L357 HydrophobicContact CG-CD1 4.2Å; L353-L357 WeakPolarHBondContact O-CG 3.38Å; L353-L357 PolarHBondContact O-N 2.94Å; L353-I370 HydrophobicContact CD1-CG2 4.39Å; L353-I372 HydrophobicContact CD2-CD1 3.94Å; L353-F437 HydrophobicContact CB-CZ 4.46Å; L353-F437 HydrophobicContact CD2-CE2 3.88Å; L353-F437 HydrophobicContact CD2-CZ 3.97Å; L353-F437 HydrophobicContact CG-CE2 4.46Å; L353-F437 HydrophobicContact CG-CZ 4.05Å
354	K	94.7	Very high	91.4	Very high	75 Å²	75	48.7 Å²	48.7	33%	0.326	23%	0.234	S	C	.	.	H	α-helix	trans	-61	-38.7	177	-176.3	176.2	-173.7	172.9	0	112	Y350 E352 L357 K358 F437	Y350-K354 HydrophobicContact CE1-CD 3.79Å; Y350-K354 HydrophobicContact CE2-CD 4.17Å; Y350-K354 WeakPolarHBondContact O-CB 3.44Å; Y350-K354 PolarHBondContact O-N 3.21Å; Y350-K354 PolarHBondContact OH-NZ 3.28Å; E352-K354 PolarHBondContact O-N 3.16Å; K354-L357 PolarHBondContact O-N 3.47Å; K354-K358 WeakPolarHBondContact O-CG 3.44Å; K354-K358 PolarHBondContact O-N 3.47Å; K354-F437 HydrophobicContact CB-CE1 4.16Å; K354-F437 HydrophobicContact CB-CZ 4.45Å
355	T	94.3	Very high	91.5	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-44.6	177.4	-58.6	0	0	0	0	111	F298 L317 V319 I351 E352 L353 L357 K358 G359	F298-T355 HydrophobicContact CD1-CG2 3.72Å; F298-T355 HydrophobicContact CE1-CG2 3.79Å; L317-T355 HydrophobicContact CB-CG2 3.98Å; L317-T355 HydrophobicContact CD2-CG2 4.15Å; L317-T355 HydrophobicContact CG-CG2 4.49Å; L317-T355 WeakPolarHBondContact O-CG2 3.15Å; V319-T355 HydrophobicContact CG1-CG2 4.35Å; I351-T355 VanDerWaalsContact O-CB 3.29Å; I351-T355 WeakPolarHBondContact O-CB 3.25Å; I351-T355 PolarHBondContact O-N 3.14Å; I351-T355 PolarHBondContact O-OG1 3.15Å; E352-T355 PolarHBondContact O-N 2.78Å; L353-T355 VanDerWaalsContact C-N 3.3Å; L353-T355 PolarHBondContact O-N 3.16Å; T355-L357 VanDerWaalsContact C-N 3.35Å; T355-L357 PolarHBondContact O-N 3.08Å; T355-K358 PolarHBondContact O-N 3.15Å; T355-G359 PolarHBondContact O-N 3.08Å
356	V	94.5	Very high	91.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-44.8	175.2	171.9	0	0	0	0	111.6	F174 F298 M323 L327 I333 E352 L353 K358 G359 F360	F174-V356 HydrophobicContact CE1-CB 4.36Å; F174-V356 HydrophobicContact CE1-CG1 3.86Å; F174-V356 HydrophobicContact CE1-CG2 4.35Å; F174-V356 HydrophobicContact CE2-CB 4.38Å; F174-V356 HydrophobicContact CE2-CG2 3.74Å; F174-V356 HydrophobicContact CZ-CB 3.76Å; F174-V356 HydrophobicContact CZ-CG1 3.77Å; F174-V356 HydrophobicContact CZ-CG2 3.6Å; F298-V356 HydrophobicContact CE1-CG2 3.68Å; F298-V356 HydrophobicContact CZ-CG2 3.81Å; M323-V356 HydrophobicContact CE-CG1 3.71Å; M323-V356 HydrophobicContact CE-CG2 4.09Å; L327-V356 HydrophobicContact CD1-CG1 4.35Å; L327-V356 WeakPolarHBondContact CD1-O 3.27Å; L327-V356 HydrophobicContact CD2-CG1 4.3Å; I333-V356 HydrophobicContact CD1-CG1 4.3Å; E352-V356 PolarHBondContact O-N 2.96Å; L353-V356 PolarHBondContact O-N 3.4Å; V356-K358 VanDerWaalsContact C-N 3.33Å; V356-K358 PolarHBondContact O-N 2.82Å; V356-G359 WeakPolarHBondContact O-CA 3.23Å; V356-G359 PolarHBondContact O-N 3.19Å; V356-F360 HydrophobicContact CG1-CE2 4.3Å; V356-F360 WeakPolarHBondContact O-CD2 3.33Å
357	L	94.2	Very high	91.7	Very high	11 Å²	11	50.5 Å²	50.5	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-36.1	179	-67.9	171.3	0	0	0	113	I333 L353 K354 T355 G359 F360 I370 F437	I333-L357 HydrophobicContact CD1-CD2 3.63Å; L353-L357 HydrophobicContact CD1-CD1 4.42Å; L353-L357 HydrophobicContact CD1-CG 4.4Å; L353-L357 HydrophobicContact CG-CD1 4.2Å; L353-L357 WeakPolarHBondContact O-CG 3.38Å; L353-L357 PolarHBondContact O-N 2.94Å; K354-L357 PolarHBondContact O-N 3.47Å; T355-L357 VanDerWaalsContact C-N 3.35Å; T355-L357 PolarHBondContact O-N 3.08Å; L357-G359 PolarHBondContact O-N 3.17Å; L357-F360 PolarHBondContact O-N 2.86Å; L357-I370 HydrophobicContact CD1-CD1 3.54Å; L357-I370 HydrophobicContact CD2-CD1 3.67Å; L357-I370 HydrophobicContact CD2-CG1 4.13Å; L357-I370 HydrophobicContact CG-CD1 4.18Å; L357-F437 HydrophobicContact CD1-CD1 3.53Å; L357-F437 HydrophobicContact CD1-CE1 3.44Å; L357-F437 VanDerWaalsContact CD1-CE1 3.44Å; L357-F437 HydrophobicContact CD1-CG 4.35Å; L357-F437 HydrophobicContact CD1-CZ 4.18Å
358	K	92.9	Very high	92	Very high	148 Å²	148	47.1 Å²	47.1	64%	0.643	23%	0.226	S	C	*	.	H	α-helix	trans	-65.9	-20.9	171.6	-74.3	175.4	176.1	-176.3	0	113.1	K354 T355 V356 F360	K354-K358 WeakPolarHBondContact O-CG 3.44Å; K354-K358 PolarHBondContact O-N 3.47Å; T355-K358 PolarHBondContact O-N 3.15Å; V356-K358 VanDerWaalsContact C-N 3.33Å; V356-K358 PolarHBondContact O-N 2.82Å; K358-F360 VanDerWaalsContact C-N 3.27Å; K358-F360 PolarHBondContact O-N 3.38Å
359	G	92.6	Very high	92.2	Very high	6 Å²	6	44.1 Å²	44.1	6%	0.062	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.4	177.2	0	0	0	0	0	114.5	V319 T355 V356 L357	V319-G359 VanDerWaalsContact CG2-CA 3.43Å; T355-G359 PolarHBondContact O-N 3.08Å; V356-G359 WeakPolarHBondContact O-CA 3.23Å; V356-G359 PolarHBondContact O-N 3.19Å; L357-G359 PolarHBondContact O-N 3.17Å
360	F	93.2	Very high	92.4	Very high	5 Å²	5	44.2 Å²	44.2	2%	0.022	22%	0.215	C	C	.	.	S	Bend	trans	-73.3	155.2	176.8	-77.1	-95.4	0	0	0	112.1	L327 I330 I333 V356 L357 K358 N362 I364 A365 V368	L327-F360 HydrophobicContact CB-CD1 4.17Å; L327-F360 HydrophobicContact CB-CD2 4.45Å; L327-F360 HydrophobicContact CB-CE1 4.16Å; L327-F360 HydrophobicContact CB-CE2 4.41Å; L327-F360 HydrophobicContact CB-CG 4.35Å; L327-F360 HydrophobicContact CB-CZ 4.3Å; L327-F360 HydrophobicContact CD1-CD2 3.95Å; L327-F360 HydrophobicContact CD1-CE2 3.98Å; L327-F360 HydrophobicContact CD2-CD2 4.31Å; L327-F360 HydrophobicContact CD2-CE1 4.16Å; L327-F360 HydrophobicContact CD2-CE2 3.56Å; L327-F360 HydrophobicContact CD2-CZ 3.51Å; L327-F360 HydrophobicContact CG-CD2 4.45Å; L327-F360 HydrophobicContact CG-CE2 4.17Å; L327-F360 HydrophobicContact CG-CZ 4.32Å; L327-F360 WeakPolarHBondContact O-CD1 3.42Å; L327-F360 WeakPolarHBondContact O-CE1 3.45Å; I330-F360 HydrophobicContact CB-CE1 4.07Å; I330-F360 HydrophobicContact CB-CZ 4.31Å; I330-F360 HydrophobicContact CG2-CE1 4.21Å; I330-F360 HydrophobicContact CG2-CZ 4.1Å; I333-F360 HydrophobicContact CD1-CE2 3.54Å; I333-F360 HydrophobicContact CD1-CZ 3.74Å; I333-F360 HydrophobicContact CG1-CE2 4.32Å; I333-F360 HydrophobicContact CG1-CZ 4.02Å; V356-F360 HydrophobicContact CG1-CE2 4.3Å; V356-F360 WeakPolarHBondContact O-CD2 3.33Å; L357-F360 PolarHBondContact O-N 2.86Å; K358-F360 VanDerWaalsContact C-N 3.27Å; K358-F360 PolarHBondContact O-N 3.38Å; F360-N362 PolarHBondContact O-N 3.07Å; F360-I364 HydrophobicContact CD1-CD1 4.39Å; F360-A365 HydrophobicContact CB-CB 3.83Å; F360-V368 HydrophobicContact CD1-CG2 3.65Å; F360-V368 HydrophobicContact CE1-CG1 4.1Å; F360-V368 HydrophobicContact CE1-CG2 3.73Å; F360-V368 HydrophobicContact CG-CG2 4.1Å; F360-V368 HydrophobicContact CZ-CG1 3.94Å; F360-V368 HydrophobicContact CZ-CG2 4.25Å
361	P	89.3	Confident	92.6	Very high	24 Å²	24	42.6 Å²	42.6	16%	0.156	21%	0.209	C	C	.	.			trans	-56	134.9	170.1	-19.6	30.1	0	0	0	111.3	E363 I364 A365	P361-E363 WeakPolarHBondContact CB-OE2 3.44Å; P361-E363 PolarHBondContact O-N 3.37Å; P361-I364 HydrophobicContact CB-CG1 4.13Å; P361-I364 HydrophobicContact CG-CD1 4.17Å; P361-I364 HydrophobicContact CG-CG1 4.19Å; P361-I364 PolarHBondContact O-N 3.38Å; P361-A365 WeakPolarHBondContact O-CB 3.44Å; P361-A365 PolarHBondContact O-N 3.44Å
362	N	87.6	Confident	92.8	Very high	138 Å²	138	40.6 Å²	40.6	74%	0.738	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-31.4	-173.7	-70.7	-23.9	0	0	0	113	F360 I364	F360-N362 PolarHBondContact O-N 3.07Å; N362-I364 VanDerWaalsContact C-N 3.31Å; N362-I364 PolarHBondContact O-N 2.99Å
363	E	86.1	Confident	92.8	Very high	129 Å²	129	40.7 Å²	40.7	60%	0.603	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-30	-177.1	-52.9	78.7	-168.3	0	0	112.7	P361 H366	P361-E363 WeakPolarHBondContact CB-OE2 3.44Å; P361-E363 PolarHBondContact O-N 3.37Å; E363-H366 PolarHBondContact O-CE1 3.26Å
364	I	87.8	Confident	92.8	Very high	63 Å²	63	40.9 Å²	40.9	32%	0.323	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-15.9	-176.2	65.9	170.2	0	0	0	113.4	F360 P361 N362 H366 K367 V368	F360-I364 HydrophobicContact CD1-CD1 4.39Å; P361-I364 HydrophobicContact CB-CG1 4.13Å; P361-I364 HydrophobicContact CG-CD1 4.17Å; P361-I364 HydrophobicContact CG-CG1 4.19Å; P361-I364 PolarHBondContact O-N 3.38Å; N362-I364 VanDerWaalsContact C-N 3.31Å; N362-I364 PolarHBondContact O-N 2.99Å; I364-H366 VanDerWaalsContact C-N 3.26Å; I364-H366 PolarHBondContact O-N 2.9Å; I364-H366 VanDerWaalsContact O-N 3.11Å; I364-K367 WeakPolarHBondContact O-CA 3.43Å; I364-K367 WeakPolarHBondContact O-CB 3.47Å; I364-K367 PolarHBondContact O-N 3.24Å; I364-V368 PolarHBondContact O-N 3.16Å
365	A	89	Confident	92.7	Very high	19 Å²	19	37.3 Å²	37.3	16%	0.157	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-50.4	-43.7	-170.9	0	0	0	0	0	113.1	F360 P361 K367 N439	F360-A365 HydrophobicContact CB-CB 3.83Å; P361-A365 WeakPolarHBondContact O-CB 3.44Å; P361-A365 PolarHBondContact O-N 3.44Å; A365-K367 VanDerWaalsContact C-N 3.3Å; A365-K367 PolarHBondContact O-N 2.83Å; A365-N439 PolarHBondContact O-ND2 3.46Å
366	H	91	Very high	92.5	Very high	76 Å²	76	38.1 Å²	38.1	35%	0.352	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-76.6	-10.4	179.9	64.9	-82.5	0	0	0	114.6	E363 I364 Q438 N439	E363-H366 PolarHBondContact O-CE1 3.26Å; I364-H366 VanDerWaalsContact C-N 3.26Å; I364-H366 PolarHBondContact O-N 2.9Å; I364-H366 VanDerWaalsContact O-N 3.11Å; H366-Q438 HydrophobicContact CB-CB 4.07Å; H366-N439 WeakPolarHBondContact O-CA 3.48Å
367	K	90.9	Very high	92.1	Very high	136 Å²	136	38.1 Å²	38.1	59%	0.591	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-99.9	-13.9	-178.7	-60.3	-176.5	-179.4	173	0	113.1	I364 A365 P369	I364-K367 WeakPolarHBondContact O-CA 3.43Å; I364-K367 WeakPolarHBondContact O-CB 3.47Å; I364-K367 PolarHBondContact O-N 3.24Å; A365-K367 VanDerWaalsContact C-N 3.3Å; A365-K367 PolarHBondContact O-N 2.83Å; K367-P369 VanDerWaalsContact O-CD 3.27Å; K367-P369 WeakPolarHBondContact O-CD 3.39Å
368	V	93.3	Very high	91.7	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.042	20%	0.198	C	C	.	.			trans	-65.2	117.9	-178	-179	0	0	0	0	109.2	I333 F360 I364 N439	I333-V368 HydrophobicContact CD1-CG1 4.11Å; I333-V368 HydrophobicContact CG1-CG1 3.97Å; F360-V368 HydrophobicContact CD1-CG2 3.65Å; F360-V368 HydrophobicContact CE1-CG1 4.1Å; F360-V368 HydrophobicContact CE1-CG2 3.73Å; F360-V368 HydrophobicContact CG-CG2 4.1Å; F360-V368 HydrophobicContact CZ-CG1 3.94Å; F360-V368 HydrophobicContact CZ-CG2 4.25Å; I364-V368 PolarHBondContact O-N 3.16Å; V368-N439 WeakPolarHBondContact O-CB 3.26Å; V368-N439 PolarHBondContact O-ND2 3.23Å
369	P	95.8	Very high	91.3	Very high	4 Å²	4	39 Å²	39	3%	0.026	20%	0.195	C	C	.	.			trans	-73.3	143.3	177.3	31.4	-35.5	0	0	0	111.6	C331 G332 I333 K367 P440 W460 L461 K464	C331-P369 VanDerWaalsContact O-CD 3.27Å; C331-P369 WeakPolarHBondContact O-CD 3.35Å; G332-P369 WeakPolarHBondContact CA-O 3.26Å; I333-P369 PolarHBondContact N-O 3.22Å; K367-P369 VanDerWaalsContact O-CD 3.27Å; K367-P369 WeakPolarHBondContact O-CD 3.39Å; P369-P440 CarbonylContact C-O 3.47Å; P369-P440 WeakPolarHBondContact CA-O 3.05Å; P369-P440 HydrophobicContact CB-CG 4.06Å; P369-W460 HydrophobicContact CB-CH2 3.95Å; P369-W460 HydrophobicContact CB-CZ3 3.83Å; P369-L461 HydrophobicContact CB-CD2 3.85Å; P369-L461 HydrophobicContact CG-CD2 3.75Å; P369-K464 HydrophobicContact CB-CB 3.91Å; P369-K464 HydrophobicContact CB-CG 4.23Å; P369-K464 HydrophobicContact CG-CB 3.98Å
370	I	97.1	Very high	90.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.8	-175.7	-46.8	169.5	0	0	0	109.6	I333 L353 L357 I372 N439 P440 W441 R442	I333-I370 HydrophobicContact CB-CG2 4.36Å; I333-I370 HydrophobicContact CG2-CG2 4.24Å; I333-I370 CarbonylContact O-C 3.58Å; I333-I370 WeakPolarHBondContact O-CA 3.37Å; L353-I370 HydrophobicContact CD1-CG2 4.39Å; L357-I370 HydrophobicContact CD1-CD1 3.54Å; L357-I370 HydrophobicContact CD2-CD1 3.67Å; L357-I370 HydrophobicContact CD2-CG1 4.13Å; L357-I370 HydrophobicContact CG-CD1 4.18Å; I370-I372 HydrophobicContact CG2-CD1 3.7Å; I370-N439 HydrophobicContact CD1-CB 3.54Å; I370-N439 HydrophobicContact CG1-CB 4.04Å; I370-P440 PolarHBondContact N-O 2.88Å; I370-W441 HydrophobicContact CB-CB 4.26Å; I370-W441 CarbonylContact O-C 3.57Å; I370-W441 WeakPolarHBondContact O-CA 3.44Å; I370-W441 WeakPolarHBondContact O-CB 3.43Å; I370-R442 PolarHBondContact O-N 3.34Å
371	V	97.6	Very high	90.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	126.9	164.7	171	0	0	0	0	108	I333 I334 Y335 L373 R442 W460 L461	I333-V371 PolarHBondContact O-N 2.91Å; I334-V371 CarbonylContact C-O 3.59Å; I334-V371 WeakPolarHBondContact CA-O 3.43Å; I334-V371 HydrophobicContact CG1-CB 4.29Å; Y335-V371 PolarHBondContact N-O 3.44Å; V371-L373 HydrophobicContact CG1-CD2 3.81Å; V371-L373 HydrophobicContact CG1-CG 3.81Å; V371-R442 CarbonylContact C-O 3.58Å; V371-R442 WeakPolarHBondContact CA-O 3.37Å; V371-R442 HydrophobicContact CG2-CB 4.37Å; V371-W460 HydrophobicContact CG2-CE3 3.71Å; V371-W460 HydrophobicContact CG2-CZ3 3.92Å; V371-L461 HydrophobicContact CG2-CD1 3.82Å; V371-L461 HydrophobicContact CG2-CD2 3.88Å; V371-L461 HydrophobicContact CG2-CG 3.58Å
372	I	97.5	Very high	89.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	106.2	164.5	-48.5	-57.6	0	0	0	107.1	Y335 L337 L353 I370 Y374 L432 L434 R442 L443 Q444	Y335-I372 HydrophobicContact CD1-CD1 3.98Å; Y335-I372 HydrophobicContact CD1-CG2 4.46Å; Y335-I372 HydrophobicContact CG-CD1 4.22Å; Y335-I372 WeakPolarHBondContact O-CA 3.31Å; L337-I372 HydrophobicContact CB-CG2 4.42Å; L353-I372 HydrophobicContact CD2-CD1 3.94Å; I370-I372 HydrophobicContact CG2-CD1 3.7Å; I372-Y374 PolarHBondContact O-N 3.31Å; I372-L432 HydrophobicContact CD1-CD1 4.09Å; I372-L432 HydrophobicContact CG1-CD1 4.27Å; I372-L432 HydrophobicContact CG2-CD1 3.82Å; I372-L434 HydrophobicContact CD1-CD2 4.26Å; I372-L434 HydrophobicContact CG1-CD1 4.24Å; I372-L434 HydrophobicContact CG1-CD2 3.96Å; I372-R442 PolarHBondContact N-O 3.43Å; I372-L443 HydrophobicContact CB-CD1 3.78Å; I372-L443 HydrophobicContact CG2-CD1 3.65Å; I372-Q444 PolarHBondContact O-N 3.3Å
373	L	95.2	Very high	88	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108	169.3	-69.3	179.1	0	0	0	107.5	L186 I334 Y335 L337 V371 I375 Q444 V454	L186-L373 HydrophobicContact CD2-CD1 4.5Å; I334-L373 HydrophobicContact CG2-CD1 3.54Å; I334-L373 HydrophobicContact CG2-CG 3.91Å; Y335-L373 PolarHBondContact O-N 3.22Å; L337-L373 PolarHBondContact N-O 2.79Å; V371-L373 HydrophobicContact CG1-CD2 3.81Å; V371-L373 HydrophobicContact CG1-CG 3.81Å; L373-I375 HydrophobicContact CB-CD1 3.94Å; L373-I375 HydrophobicContact CB-CG1 3.81Å; L373-I375 PolarHBondContact O-N 2.8Å; L373-Q444 HydrophobicContact CD2-CB 4.13Å; L373-Q444 HydrophobicContact CD2-CG 4.09Å; L373-V454 HydrophobicContact CD1-CG2 4.45Å
374	Y	94.5	Very high	86.2	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	98.7	174.4	-173	-139.5	0	0	0	108.5	L337 A339 I372 W421 S424 L425 P428 Q444 K445 C446	L337-Y374 HydrophobicContact CB-CD2 4.32Å; L337-Y374 HydrophobicContact CD2-CD2 3.59Å; L337-Y374 HydrophobicContact CD2-CE2 3.94Å; L337-Y374 HydrophobicContact CG-CD2 3.87Å; L337-Y374 HydrophobicContact CG-CE2 4.26Å; A339-Y374 VanDerWaalsContact CA-CE2 3.42Å; A339-Y374 HydrophobicContact CB-CD2 4.16Å; A339-Y374 HydrophobicContact CB-CE1 4.46Å; A339-Y374 HydrophobicContact CB-CE2 3.73Å; I372-Y374 PolarHBondContact O-N 3.31Å; Y374-W421 AromaticContact CD1-CH2 3.27Å; Y374-W421 HydrophobicContact CD1-CH2 3.27Å; Y374-W421 AromaticContact CD1-CZ2 3.95Å; Y374-W421 HydrophobicContact CD1-CZ2 3.95Å; Y374-W421 HydrophobicContact CD1-CZ3 4.12Å; Y374-W421 HydrophobicContact CD2-CH2 4.41Å; Y374-W421 AromaticContact CE1-CH2 3.39Å; Y374-W421 HydrophobicContact CE1-CH2 3.39Å; Y374-W421 AromaticContact CE1-CZ2 3.54Å; Y374-W421 HydrophobicContact CE1-CZ2 3.54Å; Y374-W421 AromaticContact CG-CH2 3.81Å; Y374-W421 HydrophobicContact CG-CH2 3.81Å; Y374-W421 VanDerWaalsContact O-CZ3 3.31Å; Y374-W421 WeakPolarHBondContact O-CZ3 3.45Å; Y374-S424 WeakPolarHBondContact CE1-O 3.47Å; Y374-L425 HydrophobicContact CD1-CD2 4.14Å; Y374-P428 HydrophobicContact CD1-CG 3.9Å; Y374-P428 HydrophobicContact CD2-CB 4.47Å; Y374-P428 HydrophobicContact CD2-CG 4.16Å; Y374-P428 HydrophobicContact CE1-CG 4.07Å; Y374-P428 HydrophobicContact CE2-CG 4.26Å; Y374-P428 HydrophobicContact CG-CG 3.98Å; Y374-Q444 PolarHBondContact N-O 3.13Å; Y374-K445 HydrophobicContact CD1-CG 4.34Å; Y374-C446 PolarHBondContact O-N 2.91Å
375	I	92.1	Very high	83.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.7	-162.7	-53.7	165.3	0	0	0	111.3	T183 L186 F187 A336 L337 A339 L373 C446	T183-I375 HydrophobicContact CG2-CB 3.74Å; T183-I375 HydrophobicContact CG2-CD1 3.96Å; T183-I375 HydrophobicContact CG2-CG1 4.46Å; T183-I375 HydrophobicContact CG2-CG2 3.38Å; L186-I375 HydrophobicContact CD2-CD1 3.86Å; L186-I375 HydrophobicContact CD2-CG1 4.33Å; F187-I375 HydrophobicContact CE2-CD1 4.5Å; A336-I375 HydrophobicContact CB-CD1 3.92Å; L337-I375 PolarHBondContact O-N 3.21Å; A339-I375 WeakPolarHBondContact CB-O 3.36Å; A339-I375 PolarHBondContact N-O 2.93Å; L373-I375 HydrophobicContact CB-CD1 3.94Å; L373-I375 HydrophobicContact CB-CG1 3.81Å; L373-I375 PolarHBondContact O-N 2.8Å; I375-C446 CarbonylContact C-O 3.59Å; I375-C446 WeakPolarHBondContact CA-O 3.03Å; I375-C446 HydrophobicContact CG1-CB 4.23Å
376	M	90.1	Very high	81.3	Confident	27 Å²	27	53.7 Å²	53.7	13%	0.133	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.6	170.7	-170.4	66.5	156.5	0	0	110.4	A339 R340 D380 I381 W421 C446 A447 S448	A339-M376 HydrophobicContact CB-CB 3.98Å; A339-M376 HydrophobicContact CB-CG 4.45Å; A339-M376 HydrophobicContact CB-SD 3.64Å; R340-M376 HydrophobicContact CG-SD 4.08Å; M376-D380 HydrophobicContact CE-CB 3.89Å; M376-D380 HydrophobicContact SD-CB 4.46Å; M376-I381 HydrophobicContact CB-CD1 4.21Å; M376-I381 HydrophobicContact CB-CG1 4.26Å; M376-I381 HydrophobicContact CG-CD1 4.11Å; M376-I381 HydrophobicContact CG-CG1 3.61Å; M376-W421 HydrophobicContact CB-CD2 3.59Å; M376-W421 HydrophobicContact CB-CE3 3.76Å; M376-W421 HydrophobicContact CB-CG 4.17Å; M376-W421 HydrophobicContact CB-CH2 3.89Å; M376-W421 HydrophobicContact CB-CZ2 3.79Å; M376-W421 HydrophobicContact CB-CZ3 3.88Å; M376-W421 HydrophobicContact CG-CD2 4.02Å; M376-W421 HydrophobicContact CG-CG 4.15Å; M376-W421 HydrophobicContact CG-CZ2 4.33Å; M376-W421 HydrophobicContact SD-CZ2 4.42Å; M376-C446 PolarHBondContact N-O 3.32Å; M376-A447 CarbonylContact O-C 3.52Å; M376-A447 WeakPolarHBondContact O-CA 3.46Å; M376-S448 PolarHBondContact O-N 2.72Å
377	P	87.4	Confident	78.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.			trans	-59.7	136.7	171.5	-21.7	34	0	0	0	111.6	A182 E379 D380 S448	A182-P377 HydrophobicContact CB-CG 3.96Å; P377-E379 HydrophobicContact CB-CG 3.92Å; P377-E379 WeakPolarHBondContact CB-OE1 3.49Å; P377-E379 PolarHBondContact O-N 3.29Å; P377-D380 PolarHBondContact O-N 3.21Å; P377-D380 VanDerWaalsContact O-N 3.07Å; P377-S448 WeakPolarHBondContact CA-OG 3.31Å
378	I	86	Confident	76.1	Confident	55 Å²	55	51.3 Å²	51.3	28%	0.282	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-59.6	-34.4	-177.3	55.8	171.7	0	0	0	113	D380 I381 Y417 A447 S448 N449	I378-D380 PolarHBondContact O-N 3.5Å; I378-I381 PolarHBondContact O-N 3.43Å; I378-I381 VanDerWaalsContact O-N 3.16Å; I378-Y417 HydrophobicContact CG2-CG 4.49Å; I378-A447 HydrophobicContact CG2-CB 4.25Å; I378-S448 PolarHBondContact N-OG 2.88Å; I378-N449 HydrophobicContact CG2-CB 3.74Å; I378-N449 WeakPolarHBondContact CG2-OD1 3.16Å
379	E	83.5	Confident	73.1	Confident	124 Å²	124	56.9 Å²	56.9	58%	0.579	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-62	-24.7	178.5	54	-93	-145.3	0	0	112.9	P377	P377-E379 HydrophobicContact CB-CG 3.92Å; P377-E379 WeakPolarHBondContact CB-OE1 3.49Å; P377-E379 PolarHBondContact O-N 3.29Å
380	D	84.3	Confident	70.1	Confident	70 Å²	70	66.1 Å²	66.1	37%	0.374	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-99.4	0.2	-178.6	-62.9	-36	0	0	0	112.4	R340 M376 P377 I378 L382	R340-D380 WeakPolarHBondContact CD-OD2 3.4Å; R340-D380 IonicContact NE-OD2 3.93Å; R340-D380 IonicContact NH1-OD2 2.97Å; R340-D380 PolarHBondContact NH1-OD2 3.21Å; M376-D380 HydrophobicContact CE-CB 3.89Å; M376-D380 HydrophobicContact SD-CB 4.46Å; P377-D380 PolarHBondContact O-N 3.21Å; P377-D380 VanDerWaalsContact O-N 3.07Å; I378-D380 PolarHBondContact O-N 3.5Å; D380-L382 PolarHBondContact O-N 3.45Å
381	I	82.3	Confident	67.1	Low	13 Å²	13	69.9 Å²	69.9	7%	0.067	35%	0.348	C	S	.	.			trans	-88.7	102.2	177.2	-61.2	171.4	0	0	0	108.7	M376 I378 Q383 Y417 W421 A447	M376-I381 HydrophobicContact CB-CD1 4.21Å; M376-I381 HydrophobicContact CB-CG1 4.26Å; M376-I381 HydrophobicContact CG-CD1 4.11Å; M376-I381 HydrophobicContact CG-CG1 3.61Å; I378-I381 PolarHBondContact O-N 3.43Å; I378-I381 VanDerWaalsContact O-N 3.16Å; I381-Q383 PolarHBondContact O-N 3.06Å; I381-Y417 HydrophobicContact CB-CD1 4.48Å; I381-Y417 HydrophobicContact CG2-CD1 4.39Å; I381-W421 HydrophobicContact CD1-CB 4.14Å; I381-W421 HydrophobicContact CG1-CB 4.16Å; I381-W421 HydrophobicContact CG1-CG 4.4Å; I381-W421 HydrophobicContact CG2-CB 4.12Å; I381-A447 HydrophobicContact CD1-CB 3.67Å
382	L	68.7	Low	64	Low	155 Å²	155	75.8 Å²	75.8	81%	0.812	38%	0.375	S	S	*	.			trans	-62.3	104.6	172.1	-65.1	172.4	0	0	0	109.6	D380 N384	D380-L382 PolarHBondContact O-N 3.45Å; L382-N384 PolarHBondContact O-N 2.57Å
383	Q	57.9	Low	60.8	Low	101 Å²	101	79.5 Å²	79.5	47%	0.472	40%	0.401	S	S	.	.			trans	-68.1	104.2	167.2	-77.3	-175.9	-20.6	0	0	108	I381 N385 Y417	I381-Q383 PolarHBondContact O-N 3.06Å; Q383-N385 PolarHBondContact O-N 3.13Å; Q383-N385 VanDerWaalsContact O-N 3.11Å; Q383-N385 PolarHBondContact O-OD1 2.83Å; Q383-Y417 HydrophobicContact CG-CE1 4.25Å; Q383-Y417 VanDerWaalsContact NE2-CZ 3.31Å; Q383-Y417 PolarHBondContact NE2-OH 3.39Å
384	N	47.6	Very low	57.7	Low	107 Å²	107	87.1 Å²	87.1	57%	0.572	44%	0.442	S	S	*	.			trans	-68.4	107.1	163.8	-101.1	-15.7	0	0	0	107.2	L382 N386 T387	L382-N384 PolarHBondContact O-N 2.57Å; N384-N386 PolarHBondContact O-N 2.86Å; N384-T387 PolarHBondContact O-N 3.15Å; N384-T387 PolarHBondContact O-OG1 3.16Å
385	N	38	Very low	54.5	Low	118 Å²	118	90.8 Å²	90.8	63%	0.631	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-54.2	-14.1	174.6	-65.1	-9.2	0	0	0	113.1	Q383 T387	Q383-N385 PolarHBondContact O-N 3.13Å; Q383-N385 VanDerWaalsContact O-N 3.11Å; Q383-N385 PolarHBondContact O-OD1 2.83Å; N385-T387 VanDerWaalsContact C-N 3.34Å
386	N	37.3	Very low	51.6	Low	127 Å²	127	98 Å²	98	68%	0.679	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-78.7	-13.3	176.3	-63.8	-12.5	0	0	0	114	N384	N384-N386 PolarHBondContact O-N 2.86Å
387	T	39.1	Very low	48.7	Very low	46 Å²	46	105.5 Å²	105.5	28%	0.282	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-81.1	-17.7	179.4	-17.2	0	0	0	0	112.6	N384 N385 N389 Y390 I391	N384-T387 PolarHBondContact O-N 3.15Å; N384-T387 PolarHBondContact O-OG1 3.16Å; N385-T387 VanDerWaalsContact C-N 3.34Å; T387-N389 PolarHBondContact O-N 2.92Å; T387-Y390 PolarHBondContact O-N 3.44Å; T387-I391 PolarHBondContact O-N 3.14Å
388	E	32.8	Very low	46.1	Very low	116 Å²	116	111.6 Å²	111.6	54%	0.542	57%	0.573	S	S	.	*	H	α-helix	trans	-61.5	-30	172.7	-68.5	-169.8	157.6	0	0	111.2	Y390 I391 H392	E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 3.29Å; E388-I391 PolarHBondContact O-N 3.11Å; E388-H392 WeakPolarHBondContact O-CB 3.4Å; E388-H392 PolarHBondContact O-CD2 2.81Å; E388-H392 PolarHBondContact O-N 2.55Å; E388-H392 VanDerWaalsContact O-N 3.11Å
389	N	29.6	Very low	43.3	Very low	125 Å²	125	114.8 Å²	114.8	67%	0.668	60%	0.601	S	S	*	*	H	α-helix	trans	-76.1	-12.4	-179.8	-70.5	-18.4	0	0	0	115	T387	T387-N389 PolarHBondContact O-N 2.92Å
390	Y	32.9	Very low	40.7	Very low	197 Å²	197	114.6 Å²	114.6	77%	0.773	61%	0.608	S	S	*	*	H	α-helix	trans	-101.2	-16.5	174.1	-102.7	-86.9	0	0	0	113.4	T387 E388 S393	T387-Y390 PolarHBondContact O-N 3.44Å; E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 3.29Å; Y390-S393 PolarHBondContact O-OG 2.94Å
391	I	35.1	Very low	38.1	Very low	81 Å²	81	121 Å²	121	42%	0.415	63%	0.627	S	S	.	*	H	α-helix	trans	-94.5	-25.7	177.9	-60.6	175.3	0	0	0	110.7	T387 E388 S393	T387-I391 PolarHBondContact O-N 3.14Å; E388-I391 PolarHBondContact O-N 3.11Å; I391-S393 VanDerWaalsContact C-N 3.33Å; I391-S393 PolarHBondContact O-N 2.93Å
392	H	31.9	Very low	35.5	Very low	124 Å²	124	126.3 Å²	126.3	57%	0.574	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-5.4	178	-78.4	-53.9	0	0	0	115.7	E388	E388-H392 WeakPolarHBondContact O-CB 3.4Å; E388-H392 PolarHBondContact O-CD2 2.81Å; E388-H392 PolarHBondContact O-N 2.55Å; E388-H392 VanDerWaalsContact O-N 3.11Å
393	S	30.1	Very low	33.5	Very low	77 Å²	77	126.4 Å²	126.4	54%	0.538	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-20	178.3	26.1	0	0	0	0	114.6	Y390 I391	Y390-S393 PolarHBondContact O-OG 2.94Å; I391-S393 VanDerWaalsContact C-N 3.33Å; I391-S393 PolarHBondContact O-N 2.93Å
394	D	30.1	Very low	32.2	Very low	162 Å²	162	130 Å²	130	87%	0.866	68%	0.678	S	S	*	*	S	Bend	trans	-99.7	0.1	178	-87.6	-11.9	0	0	0	113.6
395	S	28.2	Very low	31.6	Very low	81 Å²	81	131.5 Å²	131.5	57%	0.566	69%	0.685	S	S	*	*	S	Bend	trans	-106.6	18.5	-178.9	73.2	0	0	0	0	114.6
396	L	30.1	Very low	31.5	Very low	152 Å²	152	136.4 Å²	136.4	80%	0.796	70%	0.696	S	S	*	*	S	Bend	trans	-119.4	34.8	-175.8	-151.4	83.6	0	0	0	113.8
397	E	30.7	Very low	31.7	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	69%	0.686	S	S	*	*	S	Bend	trans	-140.4	3.9	171	-83.5	-163.3	164.2	0	0	116.8
398	D	31.8	Very low	32.1	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	69%	0.69	S	S	*	*			trans	-124.3	33	-173.6	-107.9	-18.2	0	0	0	115.4	T400	D398-T400 PolarHBondContact O-N 3.05Å
399	S	27.3	Very low	32.6	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	17	174.3	56.8	0	0	0	0	114.9
400	T	29.6	Very low	33.6	Very low	120 Å²	120	140.8 Å²	140.8	74%	0.736	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	25.8	-178.1	55.8	0	0	0	0	115.8	D398	D398-T400 PolarHBondContact O-N 3.05Å
401	R	28	Very low	34.7	Very low	204 Å²	204	131.9 Å²	131.9	77%	0.77	67%	0.669	S	S	*	*			trans	-120.6	90.9	169.3	-84.4	-179.4	168.1	170.6	-0.4	113.4
402	T	28.5	Very low	36	Very low	125 Å²	125	130.1 Å²	130.1	77%	0.767	66%	0.658	S	S	*	*			trans	0.6	126.6	144.2	43.9	0	0	0	0	118
403	N	27.1	Very low	37.7	Very low	156 Å²	156	126.1 Å²	126.1	83%	0.834	64%	0.644	S	S	*	*			trans	76.6	48.7	162.8	-62.6	-12.4	0	0	0	118.9	I405	N403-I405 PolarHBondContact O-N 3.14Å
404	E	30.3	Very low	39.8	Very low	176 Å²	176	122.8 Å²	122.8	82%	0.822	62%	0.622	S	S	*	*			trans	-78.4	99.4	153.1	-77.2	-166.5	155.6	0	0	110.1	Y406	E404-Y406 PolarHBondContact O-N 3.38Å
405	I	35.6	Very low	42.2	Very low	139 Å²	139	116.6 Å²	116.6	71%	0.713	59%	0.593	S	S	*	*			trans	-57.3	104.7	164	-64.6	168.1	0	0	0	106.9	N403 L407	N403-I405 PolarHBondContact O-N 3.14Å; I405-L407 PolarHBondContact O-N 3.42Å
406	Y	35	Very low	44.7	Very low	222 Å²	222	118.1 Å²	118.1	87%	0.871	60%	0.595	S	S	*	*			trans	-12.2	81.9	172.2	-72.9	-90.7	0	0	0	114.7	E404 N408	E404-Y406 PolarHBondContact O-N 3.38Å; Y406-N408 PolarHBondContact O-N 2.92Å; Y406-N408 VanDerWaalsContact O-N 3.14Å
407	L	41.1	Very low	47.2	Very low	88 Å²	88	114.4 Å²	114.4	46%	0.461	57%	0.571	S	S	.	*			trans	-72.4	104.2	159.1	-80.8	159.4	0	0	0	104.9	A225 I405 R409 Y412	A225-L407 HydrophobicContact CB-CD2 4.28Å; I405-L407 PolarHBondContact O-N 3.42Å; L407-R409 PolarHBondContact O-N 3.27Å; L407-Y412 HydrophobicContact CD2-CE2 3.93Å
408	N	47.5	Very low	49.6	Very low	69 Å²	69	106.1 Å²	106.1	37%	0.369	53%	0.533	S	S	.	.			trans	-53.7	115.3	179.8	-158.9	17.2	0	0	0	107.8	Y406 D410 S411	Y406-N408 PolarHBondContact O-N 2.92Å; Y406-N408 VanDerWaalsContact O-N 3.14Å; N408-D410 PolarHBondContact O-N 3.09Å; N408-S411 WeakPolarHBondContact O-CB 3.47Å; N408-S411 PolarHBondContact O-N 2.86Å
409	R	44.5	Very low	51.9	Low	239 Å²	239	106 Å²	106	90%	0.902	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-23.9	-172	-149.7	178.3	179.8	-170	-0.3	112.2	L407	L407-R409 PolarHBondContact O-N 3.27Å
410	D	50.5	Low	54.4	Low	109 Å²	109	101.4 Å²	101.4	58%	0.583	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.2	177.5	-64.8	-23.2	0	0	0	114.8	N408 Y412 S413	N408-D410 PolarHBondContact O-N 3.09Å; D410-Y412 VanDerWaalsContact C-N 3.25Å; D410-Y412 PolarHBondContact O-N 3.23Å; D410-S413 WeakPolarHBondContact O-CB 3.4Å; D410-S413 PolarHBondContact O-N 3.24Å; D410-S413 VanDerWaalsContact O-N 3.14Å; D410-S413 PolarHBondContact O-OG 2.64Å
411	S	55.6	Low	56.9	Low	10 Å²	10	96.5 Å²	96.5	7%	0.07	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.1	-172	-71	0	0	0	0	113.6	T195 N408	T195-S411 WeakPolarHBondContact O-CB 3.03Å; T195-S411 PolarHBondContact O-OG 2.87Å; N408-S411 WeakPolarHBondContact O-CB 3.47Å; N408-S411 PolarHBondContact O-N 2.86Å
412	Y	62.8	Low	59.4	Low	45 Å²	45	90 Å²	90	18%	0.176	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	25.7	176.5	-49.7	-81.5	0	0	0	112.1	A222 A225 L407 D410 G414 K452 I455	A222-Y412 VanDerWaalsContact CA-OH 3.26Å; A222-Y412 WeakPolarHBondContact CA-OH 3.37Å; A225-Y412 HydrophobicContact CB-CE1 4.02Å; A225-Y412 HydrophobicContact CB-CE2 3.85Å; A225-Y412 VanDerWaalsContact CB-CZ 3.43Å; A225-Y412 WeakPolarHBondContact CB-OH 2.89Å; L407-Y412 HydrophobicContact CD2-CE2 3.93Å; D410-Y412 VanDerWaalsContact C-N 3.25Å; D410-Y412 PolarHBondContact O-N 3.23Å; Y412-G414 PolarHBondContact O-N 3.12Å; Y412-K452 HydrophobicContact CD1-CB 4.35Å; Y412-I455 HydrophobicContact CE1-CD1 4.14Å
413	S	66.9	Low	61.8	Low	40 Å²	40	84.7 Å²	84.7	28%	0.28	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	135.8	172.6	56.9	0	0	0	0	110	K189 D410 N449	K189-S413 PolarHBondContact NZ-OG 3.12Å; D410-S413 WeakPolarHBondContact O-CB 3.4Å; D410-S413 PolarHBondContact O-N 3.24Å; D410-S413 VanDerWaalsContact O-N 3.14Å; D410-S413 PolarHBondContact O-OG 2.64Å; S413-N449 CarbonylContact O-C 3.55Å
414	G	75.1	Confident	64.6	Low	7 Å²	7	78.6 Å²	78.6	7%	0.072	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	115.7	-26.4	175.7	0	0	0	0	0	116.4	Y412 N416 Y417 T418 N449	Y412-G414 PolarHBondContact O-N 3.12Å; G414-N416 PolarHBondContact O-N 3.15Å; G414-N416 VanDerWaalsContact O-N 3.16Å; G414-Y417 WeakPolarHBondContact O-CA 3.33Å; G414-Y417 WeakPolarHBondContact O-CB 3.19Å; G414-Y417 PolarHBondContact O-N 3.36Å; G414-T418 PolarHBondContact O-N 3.02Å; G414-T418 VanDerWaalsContact O-N 3.15Å; G414-N449 VanDerWaalsContact CA-CG 3.42Å; G414-N449 WeakPolarHBondContact CA-OD1 3.39Å
415	A	79.3	Confident	67.4	Low	31 Å²	31	70.2 Å²	70.2	26%	0.256	35%	0.347	S	S	.	.	H	α-helix	trans	-56.3	-37.5	-179.1	0	0	0	0	0	112.9	Y417 T418 F419	A415-Y417 VanDerWaalsContact C-N 3.33Å; A415-Y417 PolarHBondContact O-N 3.16Å; A415-T418 WeakPolarHBondContact O-CB 3.28Å; A415-T418 PolarHBondContact O-N 3.27Å; A415-F419 PolarHBondContact O-N 3.06Å
416	N	81.3	Confident	69.9	Low	114 Å²	114	64.9 Å²	64.9	61%	0.61	32%	0.32	S	S	*	.	H	α-helix	trans	-63.4	-37.9	176.2	-62.8	-7	0	0	0	111.9	G414 F419 S420	G414-N416 PolarHBondContact O-N 3.15Å; G414-N416 VanDerWaalsContact O-N 3.16Å; N416-F419 PolarHBondContact O-N 3.49Å; N416-S420 PolarHBondContact O-N 2.91Å; N416-S420 PolarHBondContact O-OG 3.07Å; N416-S420 VanDerWaalsContact O-OG 3.05Å
417	Y	82.9	Confident	72.5	Confident	73 Å²	73	56.7 Å²	56.7	29%	0.286	29%	0.29	S	S	.	.	H	α-helix	trans	-66.6	-41.9	176.7	-70	-89.5	0	0	0	111.3	I378 I381 Q383 G414 A415 F419 S420 W421 N449	I378-Y417 HydrophobicContact CG2-CG 4.49Å; I381-Y417 HydrophobicContact CB-CD1 4.48Å; I381-Y417 HydrophobicContact CG2-CD1 4.39Å; Q383-Y417 HydrophobicContact CG-CE1 4.25Å; Q383-Y417 VanDerWaalsContact NE2-CZ 3.31Å; Q383-Y417 PolarHBondContact NE2-OH 3.39Å; G414-Y417 WeakPolarHBondContact O-CA 3.33Å; G414-Y417 WeakPolarHBondContact O-CB 3.19Å; G414-Y417 PolarHBondContact O-N 3.36Å; A415-Y417 VanDerWaalsContact C-N 3.33Å; A415-Y417 PolarHBondContact O-N 3.16Å; Y417-F419 PolarHBondContact O-N 3.11Å; Y417-S420 PolarHBondContact O-N 2.71Å; Y417-W421 WeakPolarHBondContact O-CB 3.23Å; Y417-W421 PolarHBondContact O-N 3.31Å; Y417-N449 WeakPolarHBondContact CD2-ND2 3.26Å
418	T	81.5	Confident	75	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-39.9	174	-57.7	0	0	0	0	111.4	G414 A415 K445 A447 D450	G414-T418 PolarHBondContact O-N 3.02Å; G414-T418 VanDerWaalsContact O-N 3.15Å; A415-T418 WeakPolarHBondContact O-CB 3.28Å; A415-T418 PolarHBondContact O-N 3.27Å; T418-K445 HydrophobicContact CG2-CB 3.79Å; T418-A447 WeakPolarHBondContact OG1-CB 3.46Å; T418-A447 PolarHBondContact OG1-N 2.99Å; T418-D450 VanDerWaalsContact CB-OD2 3.3Å; T418-D450 WeakPolarHBondContact CB-OD2 3.25Å; T418-D450 VanDerWaalsContact OG1-CB 3.31Å; T418-D450 WeakPolarHBondContact OG1-CB 3.45Å; T418-D450 PolarHBondContact OG1-OD2 3.28Å
419	F	80.7	Confident	77.1	Confident	125 Å²	125	49.3 Å²	49.3	55%	0.548	25%	0.251	S	S	.	.	H	α-helix	trans	-70.8	-40.5	177.6	-173	-99.1	0	0	0	112.9	A415 N416 Y417 W421	A415-F419 PolarHBondContact O-N 3.06Å; N416-F419 PolarHBondContact O-N 3.49Å; Y417-F419 PolarHBondContact O-N 3.11Å; F419-W421 PolarHBondContact O-N 3.38Å
420	S	78.7	Confident	79.3	Confident	27 Å²	27	39.1 Å²	39.1	19%	0.189	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-22.9	176.2	-60.4	0	0	0	0	113.1	N416 Y417 C422	N416-S420 PolarHBondContact O-N 2.91Å; N416-S420 PolarHBondContact O-OG 3.07Å; N416-S420 VanDerWaalsContact O-OG 3.05Å; Y417-S420 PolarHBondContact O-N 2.71Å; S420-C422 PolarHBondContact O-N 3.41Å
421	W	81.6	Confident	81.3	Confident	17 Å²	17	34.1 Å²	34.1	6%	0.064	19%	0.189	C	C	.	.			trans	-73.3	109.5	-177.9	172.5	41.4	0	0	0	112.7	A339 Y374 M376 I381 Y417 F419 G423 K445	A339-W421 HydrophobicContact CB-CH2 3.57Å; A339-W421 HydrophobicContact CB-CZ2 3.33Å; Y374-W421 AromaticContact CD1-CH2 3.27Å; Y374-W421 HydrophobicContact CD1-CH2 3.27Å; Y374-W421 AromaticContact CD1-CZ2 3.95Å; Y374-W421 HydrophobicContact CD1-CZ2 3.95Å; Y374-W421 HydrophobicContact CD1-CZ3 4.12Å; Y374-W421 HydrophobicContact CD2-CH2 4.41Å; Y374-W421 AromaticContact CE1-CH2 3.39Å; Y374-W421 HydrophobicContact CE1-CH2 3.39Å; Y374-W421 AromaticContact CE1-CZ2 3.54Å; Y374-W421 HydrophobicContact CE1-CZ2 3.54Å; Y374-W421 AromaticContact CG-CH2 3.81Å; Y374-W421 HydrophobicContact CG-CH2 3.81Å; Y374-W421 VanDerWaalsContact O-CZ3 3.31Å; Y374-W421 WeakPolarHBondContact O-CZ3 3.45Å; M376-W421 HydrophobicContact CB-CD2 3.59Å; M376-W421 HydrophobicContact CB-CE3 3.76Å; M376-W421 HydrophobicContact CB-CG 4.17Å; M376-W421 HydrophobicContact CB-CH2 3.89Å; M376-W421 HydrophobicContact CB-CZ2 3.79Å; M376-W421 HydrophobicContact CB-CZ3 3.88Å; M376-W421 HydrophobicContact CG-CD2 4.02Å; M376-W421 HydrophobicContact CG-CG 4.15Å; M376-W421 HydrophobicContact CG-CZ2 4.33Å; M376-W421 HydrophobicContact SD-CZ2 4.42Å; I381-W421 HydrophobicContact CD1-CB 4.14Å; I381-W421 HydrophobicContact CG1-CB 4.16Å; I381-W421 HydrophobicContact CG1-CG 4.4Å; I381-W421 HydrophobicContact CG2-CB 4.12Å; Y417-W421 WeakPolarHBondContact O-CB 3.23Å; Y417-W421 PolarHBondContact O-N 3.31Å; F419-W421 PolarHBondContact O-N 3.38Å; W421-G423 VanDerWaalsContact CD1-N 3.31Å; W421-G423 VanDerWaalsContact NE1-CA 3.32Å; W421-G423 PolarHBondContact O-N 3.06Å; W421-G423 VanDerWaalsContact O-N 3.11Å; W421-K445 HydrophobicContact CE3-CB 4.29Å; W421-K445 HydrophobicContact CE3-CD 4.09Å; W421-K445 HydrophobicContact CE3-CG 4.18Å; W421-K445 HydrophobicContact CH2-CG 4.35Å; W421-K445 HydrophobicContact CZ3-CB 3.92Å; W421-K445 HydrophobicContact CZ3-CD 4.13Å; W421-K445 HydrophobicContact CZ3-CG 3.74Å
422	C	80.6	Confident	83.1	Confident	68 Å²	68	33.7 Å²	33.7	46%	0.459	19%	0.186	S	C	.	.			trans	-80.9	24.1	-179.5	-62.6	0	0	0	0	114.7	K60 S420	K60-C422 VanDerWaalsContact CD-O 3.29Å; K60-C422 WeakPolarHBondContact CD-O 3.46Å; K60-C422 WeakPolarHBondContact CG-O 3.42Å; S420-C422 PolarHBondContact O-N 3.41Å
423	G	79.5	Confident	84.6	Confident	12 Å²	12	33 Å²	33	12%	0.124	18%	0.184	C	C	.	.			trans	-68.1	144.1	175.5	0	0	0	0	0	111.4	K60 W421 K445	K60-G423 WeakPolarHBondContact CA-O 3.5Å; W421-G423 VanDerWaalsContact CD1-N 3.31Å; W421-G423 VanDerWaalsContact NE1-CA 3.32Å; W421-G423 PolarHBondContact O-N 3.06Å; W421-G423 VanDerWaalsContact O-N 3.11Å; G423-K445 WeakPolarHBondContact O-CE 3.43Å; G423-K445 PolarHBondContact O-NZ 2.95Å
424	S	85.3	Confident	85.9	Confident	28 Å²	28	31.1 Å²	31.1	20%	0.196	17%	0.171	C	C	.	.			trans	-88	133.3	-179.9	-176.3	0	0	0	0	111.6	Y374 L426	Y374-S424 WeakPolarHBondContact CE1-O 3.47Å; S424-L426 PolarHBondContact O-N 2.97Å; S424-L426 VanDerWaalsContact OG-CB 3.25Å; S424-L426 WeakPolarHBondContact OG-CB 3.47Å; S424-L426 PolarHBondContact OG-N 3.39Å; S424-L426 VanDerWaalsContact OG-N 3.13Å
425	L	90.6	Very high	86.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.9	167.9	-75.2	-178	0	0	0	113.4	L59 W63 L66 Y374 Q427 P428 L429 L443 K445	L59-L425 HydrophobicContact CD2-CB 4.2Å; L59-L425 PolarHBondContact O-N 2.89Å; W63-L425 HydrophobicContact CB-CD1 4.31Å; W63-L425 VanDerWaalsContact O-CD1 3.24Å; W63-L425 WeakPolarHBondContact O-CD1 3.35Å; L66-L425 HydrophobicContact CD1-CB 4.41Å; L66-L425 HydrophobicContact CD1-CD1 4.03Å; L66-L425 HydrophobicContact CG-CD1 4.33Å; Y374-L425 HydrophobicContact CD1-CD2 4.14Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 2.93Å; L425-P428 WeakPolarHBondContact O-CD 2.96Å; L425-P428 VanDerWaalsContact O-CG 3.31Å; L425-P428 WeakPolarHBondContact O-CG 3.06Å; L425-L429 WeakPolarHBondContact O-CD1 3.47Å; L425-L429 VanDerWaalsContact O-CG 3.26Å; L425-L429 WeakPolarHBondContact O-CG 3.39Å; L425-L429 PolarHBondContact O-N 3.47Å; L425-L443 HydrophobicContact CB-CD2 4.35Å; L425-L443 HydrophobicContact CD2-CD1 4.32Å; L425-L443 HydrophobicContact CD2-CD2 3.92Å; L425-L443 HydrophobicContact CD2-CG 3.86Å; L425-K445 HydrophobicContact CD2-CD 4.4Å; L425-K445 HydrophobicContact CD2-CG 3.6Å; L425-K445 HydrophobicContact CG-CD 4.48Å; L425-K445 HydrophobicContact CG-CG 4.17Å
426	L	88	Confident	87.6	Confident	28 Å²	28	34 Å²	34	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-38.8	-179	-164	54.9	0	0	0	112.5	L59 L81 S424 L429 T430	L59-L426 HydrophobicContact CD1-CB 4.07Å; L59-L426 HydrophobicContact CD1-CD1 4.18Å; L59-L426 HydrophobicContact CD1-CD2 4.39Å; L59-L426 HydrophobicContact CD1-CG 4.46Å; L81-L426 HydrophobicContact CD1-CD2 3.53Å; L81-L426 HydrophobicContact CD1-CG 4.25Å; L81-L426 HydrophobicContact CD2-CD1 4.3Å; L81-L426 HydrophobicContact CD2-CD2 4.41Å; S424-L426 PolarHBondContact O-N 2.97Å; S424-L426 VanDerWaalsContact OG-CB 3.25Å; S424-L426 WeakPolarHBondContact OG-CB 3.47Å; S424-L426 PolarHBondContact OG-N 3.39Å; S424-L426 VanDerWaalsContact OG-N 3.13Å; L426-L429 PolarHBondContact O-N 2.83Å; L426-T430 WeakPolarHBondContact O-CB 3.46Å; L426-T430 PolarHBondContact O-N 2.8Å; L426-T430 PolarHBondContact O-OG1 3.05Å; L426-T430 VanDerWaalsContact O-OG1 3.07Å
427	Q	89.1	Confident	88.2	Confident	49 Å²	49	29.3 Å²	29.3	23%	0.229	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-54.4	-178.7	-179.1	178.2	-14.8	0	0	112.3	E341 L425 L429 T430 C431	E341-Q427 PolarHBondContact O-NE2 2.88Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 2.93Å; Q427-L429 VanDerWaalsContact C-N 3.34Å; Q427-L429 PolarHBondContact O-N 2.9Å; Q427-T430 PolarHBondContact O-N 2.89Å; Q427-C431 WeakPolarHBondContact O-CB 3.16Å; Q427-C431 PolarHBondContact O-N 3.05Å; Q427-C431 PolarHBondContact O-SG 3.31Å
428	P	92.8	Very high	88.7	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-62.8	-37.4	175.9	19.3	-30.3	0	0	0	113.4	L337 Y374 L425 T430 L432 L443	L337-P428 HydrophobicContact CD2-CB 3.65Å; Y374-P428 HydrophobicContact CD1-CG 3.9Å; Y374-P428 HydrophobicContact CD2-CB 4.47Å; Y374-P428 HydrophobicContact CD2-CG 4.16Å; Y374-P428 HydrophobicContact CE1-CG 4.07Å; Y374-P428 HydrophobicContact CE2-CG 4.26Å; Y374-P428 HydrophobicContact CG-CG 3.98Å; L425-P428 WeakPolarHBondContact O-CD 2.96Å; L425-P428 VanDerWaalsContact O-CG 3.31Å; L425-P428 WeakPolarHBondContact O-CG 3.06Å; P428-T430 VanDerWaalsContact C-N 3.33Å; P428-T430 PolarHBondContact O-N 3.33Å; P428-L432 VanDerWaalsContact O-CB 3.29Å; P428-L432 WeakPolarHBondContact O-CB 3.48Å; P428-L432 PolarHBondContact O-N 3.25Å; P428-L432 VanDerWaalsContact O-N 3.11Å; P428-L443 HydrophobicContact CB-CD1 3.87Å; P428-L443 HydrophobicContact CB-CD2 4.28Å; P428-L443 HydrophobicContact CG-CD1 3.93Å; P428-L443 HydrophobicContact CG-CD2 3.99Å
429	L	92.4	Very high	89.3	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-58.3	-46	176.4	-74.9	164.6	0	0	0	111.9	L66 L78 L93 L425 L426 Q427 H433 L434 F435 W441 L443	L66-L429 HydrophobicContact CD1-CD1 3.56Å; L66-L429 HydrophobicContact CD1-CD2 4.03Å; L66-L429 HydrophobicContact CD1-CG 4.17Å; L78-L429 HydrophobicContact CD1-CB 4.25Å; L93-L429 HydrophobicContact CD1-CD1 4.44Å; L93-L429 HydrophobicContact CD2-CD1 4.24Å; L425-L429 WeakPolarHBondContact O-CD1 3.47Å; L425-L429 VanDerWaalsContact O-CG 3.26Å; L425-L429 WeakPolarHBondContact O-CG 3.39Å; L425-L429 PolarHBondContact O-N 3.47Å; L426-L429 PolarHBondContact O-N 2.83Å; Q427-L429 VanDerWaalsContact C-N 3.34Å; Q427-L429 PolarHBondContact O-N 2.9Å; L429-H433 PolarHBondContact O-N 3.17Å; L429-L434 HydrophobicContact CD2-CD1 4.1Å; L429-L434 PolarHBondContact O-N 2.98Å; L429-F435 HydrophobicContact CD2-CE2 3.87Å; L429-F435 HydrophobicContact CD2-CZ 4.35Å; L429-W441 HydrophobicContact CD2-CH2 3.91Å; L429-W441 HydrophobicContact CD2-CZ3 4.41Å; L429-L443 HydrophobicContact CD2-CD2 3.87Å; L429-L443 HydrophobicContact CG-CD2 3.68Å
430	T	91.1	Very high	90	Very high	24 Å²	24	26.6 Å²	26.6	15%	0.147	14%	0.144	C	C	.	.	H	α-helix	trans	-76.8	-47.9	-176.3	-59.7	0	0	0	0	111.7	L78 Q79 L426 Q427 P428 L432 H433	L78-T430 VanDerWaalsContact O-CG2 3.24Å; L78-T430 WeakPolarHBondContact O-CG2 3.27Å; L78-T430 PolarHBondContact O-OG1 3.44Å; Q79-T430 HydrophobicContact CB-CG2 4.25Å; Q79-T430 HydrophobicContact CG-CG2 3.93Å; L426-T430 WeakPolarHBondContact O-CB 3.46Å; L426-T430 PolarHBondContact O-N 2.8Å; L426-T430 PolarHBondContact O-OG1 3.05Å; L426-T430 VanDerWaalsContact O-OG1 3.07Å; Q427-T430 PolarHBondContact O-N 2.89Å; P428-T430 VanDerWaalsContact C-N 3.33Å; P428-T430 PolarHBondContact O-N 3.33Å; T430-L432 PolarHBondContact O-N 3.1Å; T430-H433 PolarHBondContact O-CD2 3.17Å; T430-H433 PolarHBondContact O-N 3.27Å
431	C	91.8	Very high	90.9	Very high	4 Å²	4	25.4 Å²	25.4	3%	0.027	14%	0.135	C	C	.	.	H	α-helix	trans	-70.3	-34.4	-174.6	-60.3	0	0	0	0	112.7	A346 Q427 H433	A346-C431 HydrophobicContact CB-CB 3.7Å; Q427-C431 WeakPolarHBondContact O-CB 3.16Å; Q427-C431 PolarHBondContact O-N 3.05Å; Q427-C431 PolarHBondContact O-SG 3.31Å; C431-H433 PolarHBondContact O-CD2 3.03Å
432	L	93.8	Very high	91.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-1	177.2	-62.3	175.3	0	0	0	113.2	Y335 L337 L349 Y350 I372 P428 T430 L434 F437	Y335-L432 HydrophobicContact CD1-CD1 4.28Å; Y335-L432 HydrophobicContact CE1-CD1 4.27Å; Y335-L432 HydrophobicContact CE1-CD2 4.08Å; L337-L432 HydrophobicContact CD2-CD1 4.31Å; L349-L432 HydrophobicContact CB-CD2 3.61Å; Y350-L432 WeakPolarHBondContact CD2-O 3.36Å; I372-L432 HydrophobicContact CD1-CD1 4.09Å; I372-L432 HydrophobicContact CG1-CD1 4.27Å; I372-L432 HydrophobicContact CG2-CD1 3.82Å; P428-L432 VanDerWaalsContact O-CB 3.29Å; P428-L432 WeakPolarHBondContact O-CB 3.48Å; P428-L432 PolarHBondContact O-N 3.25Å; P428-L432 VanDerWaalsContact O-N 3.11Å; T430-L432 PolarHBondContact O-N 3.1Å; L432-L434 HydrophobicContact CB-CD2 3.6Å; L432-L434 HydrophobicContact CB-CG 3.95Å; L432-L434 HydrophobicContact CD1-CD2 4.11Å; L432-L434 PolarHBondContact O-N 3.22Å; L432-F437 VanDerWaalsContact O-CE2 3.24Å; L432-F437 WeakPolarHBondContact O-CE2 3.4Å
433	H	93.6	Very high	92.4	Very high	30 Å²	30	21.4 Å²	21.4	14%	0.139	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	45.6	-178.3	-65.3	-110.5	0	0	0	112.9	Q79 Y350 L429 T430 C431 F435 E436	Q79-H433 PolarHBondContact NE2-CE1 2.68Å; Q79-H433 PolarHBondContact NE2-NE2 2.84Å; Y350-H433 HydrophobicContact CD2-CB 3.84Å; Y350-H433 HydrophobicContact CE2-CB 3.78Å; Y350-H433 AromaticContact CG-CD2 3.96Å; L429-H433 PolarHBondContact O-N 3.17Å; T430-H433 PolarHBondContact O-CD2 3.17Å; T430-H433 PolarHBondContact O-N 3.27Å; C431-H433 PolarHBondContact O-CD2 3.03Å; H433-F435 PolarHBondContact O-N 3.26Å; H433-E436 HydrophobicContact CB-CB 4.25Å; H433-E436 HydrophobicContact CB-CG 3.97Å; H433-E436 IonicContact CE1-OE1 2.88Å; H433-E436 IonicContact CG-OE1 3.05Å; H433-E436 IonicContact ND1-OE1 3.89Å; H433-E436 PolarHBondContact ND1-OE1 2.8Å; H433-E436 IonicContact ND1-OE2 3.84Å; H433-E436 VanDerWaalsContact O-CB 3.32Å; H433-E436 WeakPolarHBondContact O-CB 3.44Å; H433-E436 PolarHBondContact O-N 2.99Å
434	L	95.1	Very high	93.1	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-57.8	-33.6	-164.7	-67.3	-178	0	0	0	113.5	I372 L429 L432 E436 F437 W441 L443	I372-L434 HydrophobicContact CD1-CD2 4.26Å; I372-L434 HydrophobicContact CG1-CD1 4.24Å; I372-L434 HydrophobicContact CG1-CD2 3.96Å; L429-L434 HydrophobicContact CD2-CD1 4.1Å; L429-L434 PolarHBondContact O-N 2.98Å; L432-L434 HydrophobicContact CB-CD2 3.6Å; L432-L434 HydrophobicContact CB-CG 3.95Å; L432-L434 HydrophobicContact CD1-CD2 4.11Å; L432-L434 PolarHBondContact O-N 3.22Å; L434-E436 PolarHBondContact O-N 2.95Å; L434-F437 HydrophobicContact CD2-CD2 4.27Å; L434-F437 HydrophobicContact CD2-CE2 4.28Å; L434-F437 PolarHBondContact O-N 3.4Å; L434-W441 HydrophobicContact CB-CD2 4.13Å; L434-W441 HydrophobicContact CB-CH2 4.27Å; L434-W441 HydrophobicContact CB-CZ2 3.75Å; L434-W441 HydrophobicContact CD1-CD2 4.43Å; L434-W441 HydrophobicContact CD1-CE3 4.15Å; L434-W441 HydrophobicContact CD1-CZ3 4.22Å; L434-W441 PolarHBondContact O-NE1 3.15Å; L434-L443 HydrophobicContact CD1-CB 4.11Å; L434-L443 HydrophobicContact CD1-CD2 4.04Å; L434-L443 HydrophobicContact CD1-CG 4.47Å
435	F	94.8	Very high	93.5	Very high	14 Å²	14	19.9 Å²	19.9	6%	0.061	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-72.4	-6.5	177	-66.2	-70.9	0	0	0	114.8	P72 A75 L78 F92 L93 Y96 L429 H433 W441	P72-F435 HydrophobicContact CG-CB 4.27Å; P72-F435 HydrophobicContact CG-CD1 3.84Å; P72-F435 HydrophobicContact CG-CG 4.45Å; A75-F435 HydrophobicContact CB-CB 3.8Å; A75-F435 HydrophobicContact CB-CG 4.28Å; L78-F435 HydrophobicContact CD1-CD2 3.77Å; L78-F435 HydrophobicContact CD1-CE2 3.74Å; F92-F435 HydrophobicContact CD1-CZ 4.45Å; F92-F435 HydrophobicContact CE1-CD1 4.04Å; F92-F435 AromaticContact CE1-CD2 3.97Å; F92-F435 HydrophobicContact CE1-CD2 3.97Å; F92-F435 AromaticContact CE1-CE1 3.72Å; F92-F435 HydrophobicContact CE1-CE1 3.72Å; F92-F435 AromaticContact CE1-CE2 3.65Å; F92-F435 HydrophobicContact CE1-CE2 3.65Å; F92-F435 HydrophobicContact CE1-CG 4.16Å; F92-F435 AromaticContact CE1-CZ 3.51Å; F92-F435 HydrophobicContact CE1-CZ 3.51Å; F92-F435 AromaticContact CZ-CD1 3.84Å; F92-F435 HydrophobicContact CZ-CD1 3.84Å; F92-F435 HydrophobicContact CZ-CD2 4.44Å; F92-F435 AromaticContact CZ-CE1 3.79Å; F92-F435 HydrophobicContact CZ-CE1 3.79Å; F92-F435 HydrophobicContact CZ-CE2 4.4Å; F92-F435 HydrophobicContact CZ-CG 4.17Å; F92-F435 HydrophobicContact CZ-CZ 4.09Å; L93-F435 HydrophobicContact CD2-CE2 3.73Å; L93-F435 HydrophobicContact CD2-CZ 3.74Å; Y96-F435 HydrophobicContact CD1-CE1 4.28Å; Y96-F435 AromaticContact CD2-CE1 3.73Å; Y96-F435 HydrophobicContact CD2-CE1 3.73Å; Y96-F435 AromaticContact CD2-CZ 3.88Å; Y96-F435 HydrophobicContact CD2-CZ 3.88Å; Y96-F435 HydrophobicContact CE1-CE1 4.13Å; Y96-F435 HydrophobicContact CE2-CD1 4.49Å; Y96-F435 AromaticContact CE2-CE1 3.54Å; Y96-F435 HydrophobicContact CE2-CE1 3.54Å; Y96-F435 HydrophobicContact CE2-CZ 4Å; Y96-F435 HydrophobicContact CG-CE1 4.09Å; Y96-F435 HydrophobicContact CG-CZ 4.4Å; Y96-F435 AromaticContact CZ-CE1 3.75Å; L429-F435 HydrophobicContact CD2-CE2 3.87Å; L429-F435 HydrophobicContact CD2-CZ 4.35Å; H433-F435 PolarHBondContact O-N 3.26Å; F435-W441 AromaticContact CD1-CZ2 3.75Å; F435-W441 HydrophobicContact CD1-CZ2 3.75Å; F435-W441 AromaticContact CE1-CH2 3.91Å; F435-W441 HydrophobicContact CE1-CH2 3.91Å; F435-W441 AromaticContact CE1-CZ2 3.55Å; F435-W441 HydrophobicContact CE1-CZ2 3.55Å; F435-W441 HydrophobicContact CE2-CH2 4.41Å; F435-W441 HydrophobicContact CE2-CZ2 4.35Å; F435-W441 HydrophobicContact CG-CZ2 4.26Å; F435-W441 AromaticContact CZ-CH2 3.84Å; F435-W441 HydrophobicContact CZ-CH2 3.84Å; F435-W441 AromaticContact CZ-CZ2 3.87Å; F435-W441 HydrophobicContact CZ-CZ2 3.87Å
436	E	93.8	Very high	93.5	Very high	85 Å²	85	19.9 Å²	19.9	40%	0.397	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-83.6	-25.5	173.4	-67.8	-176.3	-166.4	0	0	113.2	K71 Y350 H433 L434	K71-E436 WeakPolarHBondContact CD-O 3.28Å; K71-E436 WeakPolarHBondContact CE-O 3.17Å; K71-E436 PolarHBondContact NZ-O 3.21Å; Y350-E436 PolarHBondContact OH-OE2 3.14Å; H433-E436 HydrophobicContact CB-CB 4.25Å; H433-E436 HydrophobicContact CB-CG 3.97Å; H433-E436 IonicContact CE1-OE1 2.88Å; H433-E436 IonicContact CG-OE1 3.05Å; H433-E436 IonicContact ND1-OE1 3.89Å; H433-E436 PolarHBondContact ND1-OE1 2.8Å; H433-E436 IonicContact ND1-OE2 3.84Å; H433-E436 VanDerWaalsContact O-CB 3.32Å; H433-E436 WeakPolarHBondContact O-CB 3.44Å; H433-E436 PolarHBondContact O-N 2.99Å; L434-E436 PolarHBondContact O-N 2.95Å
437	F	94.1	Very high	93.5	Very high	16 Å²	16	18.5 Å²	18.5	7%	0.07	9%	0.09	C	C	.	.			trans	-69	141.4	-179.7	-70.4	-63.4	0	0	0	111.7	K71 Y350 L353 K354 L357 L432 L434 N439	K71-F437 WeakPolarHBondContact CB-O 3.4Å; Y350-F437 HydrophobicContact CD2-CE2 4.26Å; Y350-F437 AromaticContact CD2-CZ 3.82Å; Y350-F437 HydrophobicContact CD2-CZ 3.82Å; Y350-F437 HydrophobicContact CE2-CE1 4.33Å; Y350-F437 HydrophobicContact CE2-CE2 4.43Å; Y350-F437 AromaticContact CE2-CZ 3.92Å; Y350-F437 HydrophobicContact CE2-CZ 3.92Å; L353-F437 HydrophobicContact CB-CZ 4.46Å; L353-F437 HydrophobicContact CD2-CE2 3.88Å; L353-F437 HydrophobicContact CD2-CZ 3.97Å; L353-F437 HydrophobicContact CG-CE2 4.46Å; L353-F437 HydrophobicContact CG-CZ 4.05Å; K354-F437 HydrophobicContact CB-CE1 4.16Å; K354-F437 HydrophobicContact CB-CZ 4.45Å; L357-F437 HydrophobicContact CD1-CD1 3.53Å; L357-F437 HydrophobicContact CD1-CE1 3.44Å; L357-F437 VanDerWaalsContact CD1-CE1 3.44Å; L357-F437 HydrophobicContact CD1-CG 4.35Å; L357-F437 HydrophobicContact CD1-CZ 4.18Å; L432-F437 VanDerWaalsContact O-CE2 3.24Å; L432-F437 WeakPolarHBondContact O-CE2 3.4Å; L434-F437 HydrophobicContact CD2-CD2 4.27Å; L434-F437 HydrophobicContact CD2-CE2 4.28Å; L434-F437 PolarHBondContact O-N 3.4Å; F437-N439 VanDerWaalsContact C-N 3.31Å; F437-N439 HydrophobicContact CB-CB 4.47Å
438	Q	93.7	Very high	93.5	Very high	126 Å²	126	16.2 Å²	16.2	59%	0.589	8%	0.079	S	C	*	.	S	Bend	trans	-77.6	-23.5	171.4	-64.8	-174.4	2.3	0	0	112.2	K71 H366	K71-Q438 HydrophobicContact CD-CG 4.42Å; H366-Q438 HydrophobicContact CB-CB 4.07Å
439	N	94.8	Very high	93.2	Very high	10 Å²	10	16.9 Å²	16.9	5%	0.053	8%	0.083	C	C	.	.	S	Bend	trans	-64.7	143.8	-178.3	-63.9	76.8	0	0	0	112.5	A365 H366 V368 I370 F437 W441	A365-N439 PolarHBondContact O-ND2 3.46Å; H366-N439 WeakPolarHBondContact O-CA 3.48Å; V368-N439 WeakPolarHBondContact O-CB 3.26Å; V368-N439 PolarHBondContact O-ND2 3.23Å; I370-N439 HydrophobicContact CD1-CB 3.54Å; I370-N439 HydrophobicContact CG1-CB 4.04Å; F437-N439 VanDerWaalsContact C-N 3.31Å; F437-N439 HydrophobicContact CB-CB 4.47Å; N439-W441 PolarHBondContact O-N 2.81Å
440	P	95.3	Very high	93	Very high	16 Å²	16	17.1 Å²	17.1	10%	0.104	8%	0.084	C	C	.	.			trans	-64.1	135.6	164.5	21.9	-23.4	0	0	0	109.2	C68 P369 I370 W460	C68-P440 CarbonylContact O-C 3.59Å; C68-P440 VanDerWaalsContact O-CA 3.27Å; C68-P440 WeakPolarHBondContact O-CA 2.99Å; P369-P440 CarbonylContact C-O 3.47Å; P369-P440 WeakPolarHBondContact CA-O 3.05Å; P369-P440 HydrophobicContact CB-CG 4.06Å; I370-P440 PolarHBondContact N-O 2.88Å; P440-W460 HydrophobicContact CB-CH2 4.32Å; P440-W460 HydrophobicContact CB-CZ2 4.45Å
441	W	96.6	Very high	92.8	Very high	2 Å²	2	16 Å²	16	1%	0.008	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.5	178.5	58.4	-101.9	0	0	0	113.6	L66 I67 C68 I370 L429 L434 F435 N439 L443 W460	L66-W441 HydrophobicContact CB-CH2 4.47Å; L66-W441 HydrophobicContact CB-CZ3 4.02Å; I67-W441 WeakPolarHBondContact CA-O 3.36Å; C68-W441 HydrophobicContact CB-CD2 3.69Å; C68-W441 HydrophobicContact CB-CE3 4.17Å; C68-W441 HydrophobicContact CB-CG 4.28Å; C68-W441 HydrophobicContact CB-CH2 3.8Å; C68-W441 HydrophobicContact CB-CZ2 3.27Å; C68-W441 HydrophobicContact CB-CZ3 4.21Å; C68-W441 PolarHBondContact N-O 3.48Å; C68-W441 PolarHBondContact O-N 3.24Å; I370-W441 HydrophobicContact CB-CB 4.26Å; I370-W441 CarbonylContact O-C 3.57Å; I370-W441 WeakPolarHBondContact O-CA 3.44Å; I370-W441 WeakPolarHBondContact O-CB 3.43Å; L429-W441 HydrophobicContact CD2-CH2 3.91Å; L429-W441 HydrophobicContact CD2-CZ3 4.41Å; L434-W441 HydrophobicContact CB-CD2 4.13Å; L434-W441 HydrophobicContact CB-CH2 4.27Å; L434-W441 HydrophobicContact CB-CZ2 3.75Å; L434-W441 HydrophobicContact CD1-CD2 4.43Å; L434-W441 HydrophobicContact CD1-CE3 4.15Å; L434-W441 HydrophobicContact CD1-CZ3 4.22Å; L434-W441 PolarHBondContact O-NE1 3.15Å; F435-W441 AromaticContact CD1-CZ2 3.75Å; F435-W441 HydrophobicContact CD1-CZ2 3.75Å; F435-W441 AromaticContact CE1-CH2 3.91Å; F435-W441 HydrophobicContact CE1-CH2 3.91Å; F435-W441 AromaticContact CE1-CZ2 3.55Å; F435-W441 HydrophobicContact CE1-CZ2 3.55Å; F435-W441 HydrophobicContact CE2-CH2 4.41Å; F435-W441 HydrophobicContact CE2-CZ2 4.35Å; F435-W441 HydrophobicContact CG-CZ2 4.26Å; F435-W441 AromaticContact CZ-CH2 3.84Å; F435-W441 HydrophobicContact CZ-CH2 3.84Å; F435-W441 AromaticContact CZ-CZ2 3.87Å; F435-W441 HydrophobicContact CZ-CZ2 3.87Å; N439-W441 PolarHBondContact O-N 2.81Å; W441-L443 HydrophobicContact CE3-CB 4.29Å; W441-L443 HydrophobicContact CZ3-CB 4.09Å; W441-W460 VanDerWaalsContact C-CH2 3.49Å
442	R	96.7	Very high	92.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.4	170.9	173.6	-174.9	-174.1	103.5	0.5	108.3	T65 L66 I67 S230 I370 V371 I372 Q444 W460	T65-R442 HydrophobicContact CG2-CG 4.19Å; L66-R442 CarbonylContact O-C 3.59Å; L66-R442 WeakPolarHBondContact O-CA 3.48Å; I67-R442 HydrophobicContact CG1-CB 4.42Å; I67-R442 HydrophobicContact CG1-CG 4.17Å; S230-R442 PolarHBondContact O-NH1 2.97Å; S230-R442 VanDerWaalsContact O-NH1 3.08Å; S230-R442 VanDerWaalsContact OG-CZ 3.28Å; S230-R442 PolarHBondContact OG-NH1 2.96Å; S230-R442 PolarHBondContact OG-NH2 3.44Å; I370-R442 PolarHBondContact O-N 3.34Å; V371-R442 CarbonylContact C-O 3.58Å; V371-R442 WeakPolarHBondContact CA-O 3.37Å; V371-R442 HydrophobicContact CG2-CB 4.37Å; I372-R442 PolarHBondContact N-O 3.43Å; R442-Q444 VanDerWaalsContact CZ-OE1 3.32Å; R442-Q444 VanDerWaalsContact NE-OE1 3.17Å; R442-W460 HydrophobicContact CB-CD2 3.81Å; R442-W460 HydrophobicContact CB-CE3 3.75Å; R442-W460 HydrophobicContact CB-CG 4.48Å; R442-W460 HydrophobicContact CB-CH2 4Å; R442-W460 HydrophobicContact CB-CZ2 4.04Å; R442-W460 HydrophobicContact CB-CZ3 3.84Å
443	L	97.1	Very high	92.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.6	168.7	172.9	62.3	0	0	0	108.6	T65 L66 I372 L425 P428 L429 L434 W441	T65-L443 CarbonylContact C-O 3.58Å; T65-L443 VanDerWaalsContact CA-O 3.28Å; T65-L443 WeakPolarHBondContact CA-O 3.47Å; L66-L443 HydrophobicContact CB-CB 4.41Å; L66-L443 HydrophobicContact CD1-CD2 4.38Å; L66-L443 PolarHBondContact N-O 3.47Å; L66-L443 PolarHBondContact O-N 3.12Å; I372-L443 HydrophobicContact CB-CD1 3.78Å; I372-L443 HydrophobicContact CG2-CD1 3.65Å; L425-L443 HydrophobicContact CB-CD2 4.35Å; L425-L443 HydrophobicContact CD2-CD1 4.32Å; L425-L443 HydrophobicContact CD2-CD2 3.92Å; L425-L443 HydrophobicContact CD2-CG 3.86Å; P428-L443 HydrophobicContact CB-CD1 3.87Å; P428-L443 HydrophobicContact CB-CD2 4.28Å; P428-L443 HydrophobicContact CG-CD1 3.93Å; P428-L443 HydrophobicContact CG-CD2 3.99Å; L429-L443 HydrophobicContact CD2-CD2 3.87Å; L429-L443 HydrophobicContact CG-CD2 3.68Å; L434-L443 HydrophobicContact CD1-CB 4.11Å; L434-L443 HydrophobicContact CD1-CD2 4.04Å; L434-L443 HydrophobicContact CD1-CG 4.47Å; W441-L443 HydrophobicContact CE3-CB 4.29Å; W441-L443 HydrophobicContact CZ3-CB 4.09Å
444	Q	94.8	Very high	92.4	Very high	4 Å²	4	18 Å²	18	2%	0.019	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.7	-172.6	176.5	66.8	58.3	0	0	110	T65 I372 L373 Y374 R442 A453	T65-Q444 PolarHBondContact OG1-NE2 3.07Å; T65-Q444 PolarHBondContact OG1-OE1 2.86Å; I372-Q444 PolarHBondContact O-N 3.3Å; L373-Q444 HydrophobicContact CD2-CB 4.13Å; L373-Q444 HydrophobicContact CD2-CG 4.09Å; Y374-Q444 PolarHBondContact N-O 3.13Å; R442-Q444 VanDerWaalsContact CZ-OE1 3.32Å; R442-Q444 VanDerWaalsContact NE-OE1 3.17Å; Q444-A453 HydrophobicContact CG-CB 3.97Å
445	K	92.8	Very high	92.3	Very high	4 Å²	4	18 Å²	18	2%	0.017	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	140	163.2	-81.1	-173.8	172.5	162.2	0	110.6	L59 K60 S64 Y374 T418 W421 G423 L425	L59-K445 PolarHBondContact O-NZ 3.41Å; K60-K445 PolarHBondContact O-NZ 2.87Å; S64-K445 PolarHBondContact O-N 2.97Å; Y374-K445 HydrophobicContact CD1-CG 4.34Å; T418-K445 HydrophobicContact CG2-CB 3.79Å; W421-K445 HydrophobicContact CE3-CB 4.29Å; W421-K445 HydrophobicContact CE3-CD 4.09Å; W421-K445 HydrophobicContact CE3-CG 4.18Å; W421-K445 HydrophobicContact CH2-CG 4.35Å; W421-K445 HydrophobicContact CZ3-CB 3.92Å; W421-K445 HydrophobicContact CZ3-CD 4.13Å; W421-K445 HydrophobicContact CZ3-CG 3.74Å; G423-K445 WeakPolarHBondContact O-CE 3.43Å; G423-K445 PolarHBondContact O-NZ 2.95Å; L425-K445 HydrophobicContact CD2-CD 4.4Å; L425-K445 HydrophobicContact CD2-CG 3.6Å; L425-K445 HydrophobicContact CG-CD 4.48Å; L425-K445 HydrophobicContact CG-CG 4.17Å
446	C	91.2	Very high	92.2	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	121.4	-179.9	-169.8	0	0	0	0	109.5	Y374 I375 M376 A453	Y374-C446 PolarHBondContact O-N 2.91Å; I375-C446 CarbonylContact C-O 3.59Å; I375-C446 WeakPolarHBondContact CA-O 3.03Å; I375-C446 HydrophobicContact CG1-CB 4.23Å; M376-C446 PolarHBondContact N-O 3.32Å; C446-A453 HydrophobicContact CB-CB 4.15Å
447	A	89.1	Confident	92.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	153.5	160.6	0	0	0	0	0	109.3	M376 I378 I381 T418 N449 D450	M376-A447 CarbonylContact O-C 3.52Å; M376-A447 WeakPolarHBondContact O-CA 3.46Å; I378-A447 HydrophobicContact CG2-CB 4.25Å; I381-A447 HydrophobicContact CD1-CB 3.67Å; T418-A447 WeakPolarHBondContact OG1-CB 3.46Å; T418-A447 PolarHBondContact OG1-N 2.99Å; A447-N449 WeakPolarHBondContact CB-OD1 3.29Å; A447-N449 PolarHBondContact O-N 3.15Å; A447-D450 HydrophobicContact CB-CB 4.14Å; A447-D450 PolarHBondContact O-N 2.9Å
448	S	87.8	Confident	92.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-5.6	-177.8	67.6	0	0	0	0	114.2	C185 L186 M376 P377 I378	C185-S448 CarbonylContact C-O 3.55Å; L186-S448 WeakPolarHBondContact CA-O 3.28Å; L186-S448 VanDerWaalsContact CB-O 3.26Å; L186-S448 WeakPolarHBondContact CB-O 3.3Å; L186-S448 PolarHBondContact N-O 3.43Å; M376-S448 PolarHBondContact O-N 2.72Å; P377-S448 WeakPolarHBondContact CA-OG 3.31Å; I378-S448 PolarHBondContact N-OG 2.88Å
449	N	86	Confident	92	Very high	16 Å²	16	7.4 Å²	7.4	9%	0.086	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-4.8	174	71.9	-18.2	0	0	0	113.7	K189 I378 S413 G414 Y417 A447 I451	K189-N449 PolarHBondContact NZ-O 3.37Å; I378-N449 HydrophobicContact CG2-CB 3.74Å; I378-N449 WeakPolarHBondContact CG2-OD1 3.16Å; S413-N449 CarbonylContact O-C 3.55Å; G414-N449 VanDerWaalsContact CA-CG 3.42Å; G414-N449 WeakPolarHBondContact CA-OD1 3.39Å; Y417-N449 WeakPolarHBondContact CD2-ND2 3.26Å; A447-N449 WeakPolarHBondContact CB-OD1 3.29Å; A447-N449 PolarHBondContact O-N 3.15Å; N449-I451 PolarHBondContact O-N 3.06Å; N449-I451 VanDerWaalsContact O-N 3.13Å
450	D	88.1	Confident	92	Very high	7 Å²	7	7 Å²	7	4%	0.037	3%	0.034	C	C	.	.			trans	-80.6	89.8	-172.4	-175.2	0.5	0	0	0	112.6	T418 A447 K452 A453	T418-D450 VanDerWaalsContact CB-OD2 3.3Å; T418-D450 WeakPolarHBondContact CB-OD2 3.25Å; T418-D450 VanDerWaalsContact OG1-CB 3.31Å; T418-D450 WeakPolarHBondContact OG1-CB 3.45Å; T418-D450 PolarHBondContact OG1-OD2 3.28Å; A447-D450 HydrophobicContact CB-CB 4.14Å; A447-D450 PolarHBondContact O-N 2.9Å; D450-K452 VanDerWaalsContact C-N 3.28Å; D450-K452 PolarHBondContact O-N 3.19Å; D450-K452 WeakPolarHBondContact OD1-CB 3.2Å; D450-K452 PolarHBondContact OD1-N 3.07Å; D450-A453 HydrophobicContact CB-CB 4.43Å; D450-A453 PolarHBondContact OD1-N 3.04Å
451	I	88.7	Confident	91.9	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.005	3%	0.029	C	C	.	.	H	α-helix	trans	-69.4	-26.4	178.6	-73.3	-69.3	0	0	0	112.5	K189 L190 F198 N449 A453 V454 I455	K189-I451 HydrophobicContact CB-CD1 3.64Å; K189-I451 HydrophobicContact CB-CG1 4.03Å; K189-I451 HydrophobicContact CD-CD1 4.27Å; K189-I451 HydrophobicContact CD-CG1 3.83Å; L190-I451 HydrophobicContact CD2-CD1 4.12Å; F198-I451 HydrophobicContact CE2-CD1 4.41Å; F198-I451 HydrophobicContact CE2-CG2 3.88Å; N449-I451 PolarHBondContact O-N 3.06Å; N449-I451 VanDerWaalsContact O-N 3.13Å; I451-A453 PolarHBondContact O-N 3.38Å; I451-V454 PolarHBondContact O-N 3.1Å; I451-I455 HydrophobicContact CG2-CD1 3.63Å; I451-I455 HydrophobicContact CG2-CG1 4.06Å; I451-I455 WeakPolarHBondContact O-CG1 3.5Å; I451-I455 PolarHBondContact O-N 3.2Å
452	K	88.5	Confident	91.6	Very high	72 Å²	72	7.6 Å²	7.6	31%	0.313	4%	0.035	S	C	.	.	H	α-helix	trans	-63.5	-46.6	179.7	-174.1	179.8	178.4	178	0	110.5	A226 Y412 D450 V454 I455 Q456	A226-K452 HydrophobicContact CB-CG 4.1Å; Y412-K452 HydrophobicContact CD1-CB 4.35Å; D450-K452 VanDerWaalsContact C-N 3.28Å; D450-K452 PolarHBondContact O-N 3.19Å; D450-K452 WeakPolarHBondContact OD1-CB 3.2Å; D450-K452 PolarHBondContact OD1-N 3.07Å; K452-V454 PolarHBondContact O-N 2.89Å; K452-I455 PolarHBondContact O-N 2.74Å; K452-Q456 HydrophobicContact CG-CG 4.49Å; K452-Q456 WeakPolarHBondContact O-CB 3.07Å; K452-Q456 VanDerWaalsContact O-CG 3.28Å; K452-Q456 WeakPolarHBondContact O-CG 3.35Å; K452-Q456 PolarHBondContact O-N 3.04Å
453	A	90.9	Very high	91.1	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.008	4%	0.042	C	C	.	.	H	α-helix	trans	-58.7	-35.8	176.8	0	0	0	0	0	112.6	Q444 C446 D450 I451 S457	Q444-A453 HydrophobicContact CG-CB 3.97Å; C446-A453 HydrophobicContact CB-CB 4.15Å; D450-A453 HydrophobicContact CB-CB 4.43Å; D450-A453 PolarHBondContact OD1-N 3.04Å; I451-A453 PolarHBondContact O-N 3.38Å; A453-S457 WeakPolarHBondContact O-CB 3.29Å; A453-S457 PolarHBondContact O-N 3.25Å; A453-S457 VanDerWaalsContact O-N 3.11Å; A453-S457 PolarHBondContact O-OG 2.97Å
454	V	91.6	Very high	90.6	Very high	4 Å²	4	10.7 Å²	10.7	2%	0.024	5%	0.051	C	C	.	.	H	α-helix	trans	-70.1	-46.5	176.1	-177.7	0	0	0	0	111.4	L186 L190 L373 I451 K452 Q456 S457 L458	L186-V454 HydrophobicContact CD1-CG2 3.72Å; L186-V454 HydrophobicContact CD2-CG2 3.77Å; L186-V454 HydrophobicContact CG-CG2 3.87Å; L190-V454 HydrophobicContact CD2-CG1 4.02Å; L373-V454 HydrophobicContact CD1-CG2 4.45Å; I451-V454 PolarHBondContact O-N 3.1Å; K452-V454 PolarHBondContact O-N 2.89Å; V454-Q456 VanDerWaalsContact C-N 3.33Å; V454-Q456 PolarHBondContact O-N 2.88Å; V454-S457 WeakPolarHBondContact O-CB 3.39Å; V454-S457 PolarHBondContact O-N 2.99Å; V454-L458 HydrophobicContact CG1-CD1 4.07Å; V454-L458 HydrophobicContact CG1-CG 4.47Å; V454-L458 WeakPolarHBondContact O-CG 3.35Å; V454-L458 PolarHBondContact O-N 3.25Å
455	I	92	Very high	89.7	Confident	0 Å²	0	11 Å²	11	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-58.8	-46.8	176.8	-67.6	167.6	0	0	0	110.3	F198 L218 A222 A226 Y412 I451 K452 S457 L458 M459	F198-I455 HydrophobicContact CE2-CD1 4.35Å; F198-I455 HydrophobicContact CE2-CG1 3.94Å; F198-I455 HydrophobicContact CZ-CD1 4.44Å; F198-I455 HydrophobicContact CZ-CG1 3.61Å; L218-I455 HydrophobicContact CD1-CD1 4.24Å; L218-I455 HydrophobicContact CD1-CG1 3.97Å; L218-I455 HydrophobicContact CD1-CG2 4.23Å; L218-I455 HydrophobicContact CD2-CG2 4.07Å; A222-I455 HydrophobicContact CB-CD1 4.16Å; A226-I455 HydrophobicContact CB-CB 3.82Å; A226-I455 HydrophobicContact CB-CD1 4.46Å; A226-I455 HydrophobicContact CB-CG2 3.35Å; Y412-I455 HydrophobicContact CE1-CD1 4.14Å; I451-I455 HydrophobicContact CG2-CD1 3.63Å; I451-I455 HydrophobicContact CG2-CG1 4.06Å; I451-I455 WeakPolarHBondContact O-CG1 3.5Å; I451-I455 PolarHBondContact O-N 3.2Å; K452-I455 PolarHBondContact O-N 2.74Å; I455-S457 VanDerWaalsContact C-N 3.27Å; I455-S457 PolarHBondContact O-N 2.64Å; I455-L458 PolarHBondContact O-N 3.25Å; I455-M459 HydrophobicContact CG2-CG 4.19Å; I455-M459 WeakPolarHBondContact O-CB 3.38Å; I455-M459 VanDerWaalsContact O-CG 3.26Å; I455-M459 WeakPolarHBondContact O-CG 3.4Å; I455-M459 PolarHBondContact O-N 3.49Å
456	Q	92.2	Very high	87.9	Confident	13 Å²	13	15 Å²	15	6%	0.061	8%	0.079	C	C	.	.	H	α-helix	trans	-57.7	-41.9	177.3	-73.1	176.5	-20.7	0	0	112	A226 D228 V231 K452 V454 M459 W460	A226-Q456 HydrophobicContact CB-CG 4.27Å; A226-Q456 WeakPolarHBondContact O-CG 3.37Å; A226-Q456 PolarHBondContact O-NE2 3.39Å; D228-Q456 PolarHBondContact OD2-NE2 2.87Å; V231-Q456 HydrophobicContact CG2-CB 4.45Å; V231-Q456 HydrophobicContact CG2-CG 4.48Å; K452-Q456 HydrophobicContact CG-CG 4.49Å; K452-Q456 WeakPolarHBondContact O-CB 3.07Å; K452-Q456 VanDerWaalsContact O-CG 3.28Å; K452-Q456 WeakPolarHBondContact O-CG 3.35Å; K452-Q456 PolarHBondContact O-N 3.04Å; V454-Q456 VanDerWaalsContact C-N 3.33Å; V454-Q456 PolarHBondContact O-N 2.88Å; Q456-M459 PolarHBondContact O-N 2.88Å; Q456-W460 WeakPolarHBondContact O-CB 3.22Å; Q456-W460 PolarHBondContact O-N 3.37Å
457	S	94.3	Very high	85.8	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.007	10%	0.098	C	C	.	.	H	α-helix	trans	-66	-42.9	177.7	-63.1	0	0	0	0	112.7	A453 V454 I455 W460 L461	A453-S457 WeakPolarHBondContact O-CB 3.29Å; A453-S457 PolarHBondContact O-N 3.25Å; A453-S457 VanDerWaalsContact O-N 3.11Å; A453-S457 PolarHBondContact O-OG 2.97Å; V454-S457 WeakPolarHBondContact O-CB 3.39Å; V454-S457 PolarHBondContact O-N 2.99Å; I455-S457 VanDerWaalsContact C-N 3.27Å; I455-S457 PolarHBondContact O-N 2.64Å; S457-W460 PolarHBondContact O-N 2.78Å; S457-L461 WeakPolarHBondContact O-CG 3.35Å; S457-L461 PolarHBondContact O-N 2.97Å
458	L	93.1	Very high	83.4	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-40.1	175.7	-72.3	168.3	0	0	0	112	F171 F198 F269 I334 V454 I455 W460 L461 K462	F171-L458 HydrophobicContact CD2-CD2 3.95Å; F171-L458 HydrophobicContact CE2-CD2 4.21Å; F198-L458 HydrophobicContact CE1-CD1 3.71Å; F198-L458 HydrophobicContact CZ-CD1 3.94Å; F269-L458 HydrophobicContact CD2-CD2 4.46Å; F269-L458 HydrophobicContact CE1-CD1 4.3Å; F269-L458 HydrophobicContact CE2-CD1 4.33Å; F269-L458 HydrophobicContact CE2-CD2 3.78Å; F269-L458 HydrophobicContact CZ-CD1 3.66Å; F269-L458 HydrophobicContact CZ-CD2 3.91Å; F269-L458 HydrophobicContact CZ-CG 4.39Å; I334-L458 HydrophobicContact CD1-CD2 3.9Å; V454-L458 HydrophobicContact CG1-CD1 4.07Å; V454-L458 HydrophobicContact CG1-CG 4.47Å; V454-L458 WeakPolarHBondContact O-CG 3.35Å; V454-L458 PolarHBondContact O-N 3.25Å; I455-L458 PolarHBondContact O-N 3.25Å; L458-W460 VanDerWaalsContact C-N 3.34Å; L458-L461 PolarHBondContact O-N 3.4Å; L458-K462 WeakPolarHBondContact O-CB 3.29Å; L458-K462 PolarHBondContact O-N 2.83Å
459	M	91.6	Very high	80.8	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.015	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-36.8	176.4	-72.1	-62	-70	0	0	112	L218 Q223 L227 V231 L264 I455 Q456 K462 S463	L218-M459 HydrophobicContact CD2-CG 4.41Å; L218-M459 HydrophobicContact CD2-SD 4.24Å; Q223-M459 HydrophobicContact CB-CE 4.02Å; Q223-M459 HydrophobicContact CB-SD 4.02Å; Q223-M459 HydrophobicContact CG-CE 4.16Å; Q223-M459 HydrophobicContact CG-CG 4.41Å; Q223-M459 HydrophobicContact CG-SD 3.57Å; Q223-M459 VanDerWaalsContact CG-SD 3.57Å; Q223-M459 PolarHBondContact OE1-SD 2.97Å; L227-M459 HydrophobicContact CD2-CE 4.35Å; V231-M459 HydrophobicContact CG1-CB 3.55Å; V231-M459 HydrophobicContact CG2-CB 4.27Å; L264-M459 HydrophobicContact CD2-CE 3.94Å; I455-M459 HydrophobicContact CG2-CG 4.19Å; I455-M459 WeakPolarHBondContact O-CB 3.38Å; I455-M459 VanDerWaalsContact O-CG 3.26Å; I455-M459 WeakPolarHBondContact O-CG 3.4Å; I455-M459 PolarHBondContact O-N 3.49Å; Q456-M459 PolarHBondContact O-N 2.88Å; M459-K462 HydrophobicContact CE-CD 4.44Å; M459-K462 WeakPolarHBondContact O-CB 3.29Å; M459-K462 PolarHBondContact O-N 2.85Å; M459-K462 HydrophobicContact SD-CD 4.02Å; M459-S463 PolarHBondContact O-N 3.34Å
460	W	93.4	Very high	78	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-43	171.7	-179.1	87.7	0	0	0	111.8	I67 P369 V371 P440 W441 R442 Q456 S457 L458 K462 S463 K464	I67-W460 HydrophobicContact CG2-CZ2 4.08Å; P369-W460 HydrophobicContact CB-CH2 3.95Å; P369-W460 HydrophobicContact CB-CZ3 3.83Å; V371-W460 HydrophobicContact CG2-CE3 3.71Å; V371-W460 HydrophobicContact CG2-CZ3 3.92Å; P440-W460 HydrophobicContact CB-CH2 4.32Å; P440-W460 HydrophobicContact CB-CZ2 4.45Å; W441-W460 VanDerWaalsContact C-CH2 3.49Å; R442-W460 HydrophobicContact CB-CD2 3.81Å; R442-W460 HydrophobicContact CB-CE3 3.75Å; R442-W460 HydrophobicContact CB-CG 4.48Å; R442-W460 HydrophobicContact CB-CH2 4Å; R442-W460 HydrophobicContact CB-CZ2 4.04Å; R442-W460 HydrophobicContact CB-CZ3 3.84Å; Q456-W460 WeakPolarHBondContact O-CB 3.22Å; Q456-W460 PolarHBondContact O-N 3.37Å; S457-W460 PolarHBondContact O-N 2.78Å; L458-W460 VanDerWaalsContact C-N 3.34Å; W460-K462 VanDerWaalsContact C-N 3.33Å; W460-K462 PolarHBondContact O-N 3.14Å; W460-S463 PolarHBondContact O-N 2.87Å; W460-S463 PolarHBondContact O-OG 3.22Å; W460-K464 HydrophobicContact CD2-CG 4.34Å; W460-K464 HydrophobicContact CH2-CG 4.31Å; W460-K464 HydrophobicContact CZ2-CG 4.03Å; W460-K464 WeakPolarHBondContact O-CG 3.48Å; W460-K464 PolarHBondContact O-N 2.81Å; W460-K464 VanDerWaalsContact O-N 3.15Å
461	L	93	Very high	75.2	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-43.6	173.6	-75.6	171.8	0	0	0	112	F171 I334 P369 V371 S457 L458 S463 K464 H465	F171-L461 HydrophobicContact CD1-CB 4.45Å; F171-L461 HydrophobicContact CD1-CD1 4.26Å; F171-L461 HydrophobicContact CD2-CD1 4.44Å; F171-L461 HydrophobicContact CE1-CB 3.83Å; F171-L461 HydrophobicContact CE1-CD1 4.44Å; F171-L461 HydrophobicContact CE2-CB 4.28Å; F171-L461 HydrophobicContact CG-CD1 4.26Å; F171-L461 HydrophobicContact CZ-CB 3.72Å; I334-L461 HydrophobicContact CD1-CD1 3.98Å; I334-L461 HydrophobicContact CG1-CD1 3.6Å; P369-L461 HydrophobicContact CB-CD2 3.85Å; P369-L461 HydrophobicContact CG-CD2 3.75Å; V371-L461 HydrophobicContact CG2-CD1 3.82Å; V371-L461 HydrophobicContact CG2-CD2 3.88Å; V371-L461 HydrophobicContact CG2-CG 3.58Å; S457-L461 WeakPolarHBondContact O-CG 3.35Å; S457-L461 PolarHBondContact O-N 2.97Å; L458-L461 PolarHBondContact O-N 3.4Å; L461-S463 VanDerWaalsContact C-N 3.34Å; L461-S463 PolarHBondContact O-N 2.91Å; L461-K464 PolarHBondContact O-N 2.92Å; L461-H465 PolarHBondContact O-N 2.84Å
462	K	90.3	Very high	72.5	Confident	31 Å²	31	36 Å²	36	14%	0.135	20%	0.198	C	C	.	.	H	α-helix	trans	-55.8	-49.1	173.9	-179.7	-175.1	-179.6	-178.6	0	110.4	F267 L458 M459 W460 K464 H465 I468	F267-K462 HydrophobicContact CB-CD 4.34Å; F267-K462 HydrophobicContact CD1-CB 4.43Å; F267-K462 HydrophobicContact CD1-CD 3.84Å; F267-K462 HydrophobicContact CD1-CG 4.48Å; F267-K462 HydrophobicContact CD2-CD 3.8Å; F267-K462 HydrophobicContact CD2-CG 4.27Å; F267-K462 HydrophobicContact CE1-CB 3.82Å; F267-K462 HydrophobicContact CE1-CD 4.02Å; F267-K462 HydrophobicContact CE1-CG 4.17Å; F267-K462 HydrophobicContact CE2-CB 4.36Å; F267-K462 HydrophobicContact CE2-CD 4Å; F267-K462 HydrophobicContact CE2-CG 3.96Å; F267-K462 HydrophobicContact CG-CD 3.72Å; F267-K462 HydrophobicContact CZ-CB 3.78Å; F267-K462 HydrophobicContact CZ-CD 4.1Å; F267-K462 HydrophobicContact CZ-CG 3.89Å; L458-K462 WeakPolarHBondContact O-CB 3.29Å; L458-K462 PolarHBondContact O-N 2.83Å; M459-K462 HydrophobicContact CE-CD 4.44Å; M459-K462 WeakPolarHBondContact O-CB 3.29Å; M459-K462 PolarHBondContact O-N 2.85Å; M459-K462 HydrophobicContact SD-CD 4.02Å; W460-K462 VanDerWaalsContact C-N 3.33Å; W460-K462 PolarHBondContact O-N 3.14Å; K462-K464 PolarHBondContact O-N 2.85Å; K462-H465 WeakPolarHBondContact O-CB 3.25Å; K462-H465 PolarHBondContact O-N 3.23Å; K462-I468 HydrophobicContact CG-CD1 3.74Å; K462-I468 WeakPolarHBondContact O-CD1 3.29Å
463	S	86.9	Confident	69.7	Low	20 Å²	20	37.3 Å²	37.3	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-25.3	-177.5	79	0	0	0	0	113.8	V231 M459 W460 L461	V231-S463 PolarHBondContact O-OG 3.26Å; V231-S463 VanDerWaalsContact O-OG 3.09Å; M459-S463 PolarHBondContact O-N 3.34Å; W460-S463 PolarHBondContact O-N 2.87Å; W460-S463 PolarHBondContact O-OG 3.22Å; L461-S463 VanDerWaalsContact C-N 3.34Å; L461-S463 PolarHBondContact O-N 2.91Å
464	K	86.9	Confident	66.8	Low	44 Å²	44	40.4 Å²	40.4	19%	0.191	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-7.6	174.5	-62.2	-51.6	-174.5	-175.2	0	114.5	D69 P369 W460 L461 K462	D69-K464 WeakPolarHBondContact OD1-CE 3.33Å; D69-K464 IonicContact OD1-NZ 3.62Å; D69-K464 PolarHBondContact OD1-NZ 2.99Å; D69-K464 IonicContact OD2-NZ 2.8Å; D69-K464 PolarHBondContact OD2-NZ 2.84Å; P369-K464 HydrophobicContact CB-CB 3.91Å; P369-K464 HydrophobicContact CB-CG 4.23Å; P369-K464 HydrophobicContact CG-CB 3.98Å; W460-K464 HydrophobicContact CD2-CG 4.34Å; W460-K464 HydrophobicContact CH2-CG 4.31Å; W460-K464 HydrophobicContact CZ2-CG 4.03Å; W460-K464 WeakPolarHBondContact O-CG 3.48Å; W460-K464 PolarHBondContact O-N 2.81Å; W460-K464 VanDerWaalsContact O-N 3.15Å; L461-K464 PolarHBondContact O-N 2.92Å; K462-K464 PolarHBondContact O-N 2.85Å
465	H	75.4	Confident	64	Low	11 Å²	11	44 Å²	44	5%	0.051	25%	0.251	C	S	.	.	S	Bend	trans	-69.7	129.5	-179	-166.6	-89.9	0	0	0	111.4	C331 L461 K462 T467 I468	C331-H465 PolarHBondContact SG-CD2 3.29Å; L461-H465 PolarHBondContact O-N 2.84Å; K462-H465 WeakPolarHBondContact O-CB 3.25Å; K462-H465 PolarHBondContact O-N 3.23Å; H465-T467 PolarHBondContact CE1-OG1 3.12Å; H465-T467 PolarHBondContact ND1-OG1 3.18Å; H465-T467 PolarHBondContact O-N 2.89Å; H465-I468 PolarHBondContact O-N 3.04Å
466	P	55	Low	61.1	Low	89 Å²	89	49 Å²	49	58%	0.578	28%	0.278	S	S	*	.	H	α-helix	trans	-58.5	-29.3	-169.5	10.5	-22.1	0	0	0	114.7	I468 H469	P466-I468 PolarHBondContact O-N 2.86Å; P466-H469 PolarHBondContact O-N 3.04Å
467	T	47.3	Very low	58.2	Low	64 Å²	64	55.9 Å²	55.9	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-67.2	-16.8	177.6	50.5	0	0	0	0	114.4	H465	H465-T467 PolarHBondContact CE1-OG1 3.12Å; H465-T467 PolarHBondContact ND1-OG1 3.18Å; H465-T467 PolarHBondContact O-N 2.89Å
468	I	38.7	Very low	55.2	Low	59 Å²	59	62.7 Å²	62.7	30%	0.303	34%	0.342	S	S	.	.	H	α-helix	trans	-81.1	-31.5	175.9	-56.2	-165.5	0	0	0	111	K462 H465 P466 A471 I472	K462-I468 HydrophobicContact CG-CD1 3.74Å; K462-I468 WeakPolarHBondContact O-CD1 3.29Å; H465-I468 PolarHBondContact O-N 3.04Å; P466-I468 PolarHBondContact O-N 2.86Å; I468-A471 PolarHBondContact O-N 3.29Å; I468-I472 HydrophobicContact CG2-CD1 4.28Å
469	H	32.3	Very low	52.1	Low	100 Å²	100	73.8 Å²	73.8	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-71	-31.5	179.7	-97.5	-63.5	0	0	0	113.4	P466 I472 N473	P466-H469 PolarHBondContact O-N 3.04Å; H469-I472 PolarHBondContact O-N 3.21Å; H469-N473 PolarHBondContact O-N 3.15Å
470	D	28.1	Very low	49.2	Very low	99 Å²	99	77.8 Å²	77.8	53%	0.529	42%	0.417	S	S	.	.	H	α-helix	trans	-70	-33.1	178.3	-65.5	-20.2	0	0	0	112.3	I472 S474	D470-I472 VanDerWaalsContact C-N 3.34Å; D470-I472 PolarHBondContact O-N 3.37Å; D470-S474 WeakPolarHBondContact O-CB 3.28Å; D470-S474 PolarHBondContact O-N 3.28Å; D470-S474 PolarHBondContact O-OG 3.29Å
471	A	29.3	Very low	46.1	Very low	60 Å²	60	84.1 Å²	84.1	50%	0.496	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-34.1	177.1	0	0	0	0	0	112.4	I468 S474	I468-A471 PolarHBondContact O-N 3.29Å; A471-S474 PolarHBondContact O-OG 3.08Å; A471-S474 VanDerWaalsContact O-OG 3.08Å
472	I	31.6	Very low	42.9	Very low	83 Å²	83	89 Å²	89	43%	0.426	49%	0.49	S	S	.	.	H	α-helix	trans	-81	-30.2	-178.3	-62.3	171.4	0	0	0	111.9	I468 H469 D470 T475	I468-I472 HydrophobicContact CG2-CD1 4.28Å; H469-I472 PolarHBondContact O-N 3.21Å; D470-I472 VanDerWaalsContact C-N 3.34Å; D470-I472 PolarHBondContact O-N 3.37Å; I472-T475 PolarHBondContact O-OG1 3.06Å
473	N	30.2	Very low	39.9	Very low	98 Å²	98	94 Å²	94	52%	0.524	52%	0.523	S	S	.	.	H	α-helix	trans	-81.6	-27.9	178.7	-71	-20.5	0	0	0	112.7	H469 T475 N476	H469-N473 PolarHBondContact O-N 3.15Å; N473-T475 VanDerWaalsContact C-N 3.28Å; N473-T475 PolarHBondContact O-N 2.82Å; N473-N476 PolarHBondContact O-N 2.72Å
474	S	30.6	Very low	37.2	Very low	66 Å²	66	99.8 Å²	99.8	46%	0.462	56%	0.558	S	S	.	*	H	α-helix	trans	-69.1	-21.5	178.1	67.3	0	0	0	0	114.4	D470 A471	D470-S474 WeakPolarHBondContact O-CB 3.28Å; D470-S474 PolarHBondContact O-N 3.28Å; D470-S474 PolarHBondContact O-OG 3.29Å; A471-S474 PolarHBondContact O-OG 3.08Å; A471-S474 VanDerWaalsContact O-OG 3.08Å
475	T	31.9	Very low	35	Very low	79 Å²	79	112.5 Å²	112.5	49%	0.485	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-20.9	177.3	41.4	0	0	0	0	113.4	I472 N473	I472-T475 PolarHBondContact O-OG1 3.06Å; N473-T475 VanDerWaalsContact C-N 3.28Å; N473-T475 PolarHBondContact O-N 2.82Å
476	N	30.9	Very low	33	Very low	107 Å²	107	117.6 Å²	117.6	57%	0.572	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-13.1	-178.4	-73.3	-28.8	0	0	0	114.6	N473	N473-N476 PolarHBondContact O-N 2.72Å
477	M	31.1	Very low	31.8	Very low	157 Å²	157	119.1 Å²	119.1	77%	0.773	64%	0.638	S	S	*	*	S	Bend	trans	-89.8	-6.5	175.1	-78.4	-149.1	84.4	0	0	114.8	R479	M477-R479 VanDerWaalsContact C-N 3.3Å; M477-R479 PolarHBondContact O-N 2.98Å
478	K	31	Very low	31	Very low	143 Å²	143	122.2 Å²	122.2	62%	0.622	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	11.9	-177	-74.5	-170.4	176.8	-175.7	0	115.5
479	R	29.4	Very low	30.5	Very low	235 Å²	235	125.9 Å²	125.9	89%	0.887	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	7.9	-178.5	-102.8	-177	-176.2	169.4	1.9	116.5	M477	M477-R479 VanDerWaalsContact C-N 3.3Å; M477-R479 PolarHBondContact O-N 2.98Å
480	A	29.2	Very low	30.4	Very low	88 Å²	88	127.5 Å²	127.5	73%	0.727	69%	0.685	S	S	*	*	S	Bend	trans	-111	8.1	-177.4	0	0	0	0	0	115.4
481	T	28.2	Very low	30.5	Very low	132 Å²	132	129.4 Å²	129.4	81%	0.81	70%	0.696	S	S	*	*			trans	-134	70.2	-179.1	48.5	0	0	0	0	112.1
482	S	26.3	Very low	30.6	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	71%	0.71	S	S	*	*			trans	-155.5	73.3	163.3	53.5	0	0	0	0	109.6
483	T	27.5	Very low	30.6	Very low	137 Å²	137	138.3 Å²	138.3	84%	0.84	73%	0.732	S	S	*	*			trans	-174.9	96.3	156.2	10.7	0	0	0	0	108.8
484	T	30.1	Very low	30.6	Very low	142 Å²	142	141.7 Å²	141.7	87%	0.871	75%	0.749	S	S	*	*			trans	-179.6	93	146.4	20.1	0	0	0	0	107.7
485	Y	40.9	Very low	30.6	Very low	311 Å²	311	148.5 Å²	148.5	100%	1.22	78%	0.775	S	S	*	*			trans	-132.4	0	148.1	-89.1	-73.1	0	0	0	106.7

Retrieved 485 of 485 residues in 216.3 ms (Link to these results)

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