A0A087XTQ2_POEFO Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A087XTQ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 495 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	E	51.3	Low	55.8	Low	204 Å²	204	134 Å²	134	95%	0.953	65%	0.645	S	S	*	*				0	-27.2	0	-109.2	178.1	150.5	0	0	115.2
2	S	56.7	Low	55.9	Low	87 Å²	87	129.7 Å²	129.7	61%	0.608	63%	0.627	S	S	*	*	H	α-helix	trans	-75.4	-36.1	-178	178.4	0	0	0	0	114.9
3	D	52.6	Low	55.6	Low	112 Å²	112	129.4 Å²	129.4	60%	0.599	62%	0.624	S	S	*	*	H	α-helix	trans	-82	-26.3	-174.1	-66.8	-42.7	0	0	0	114.1	K5 K6 W7	D3-K5 VanDerWaalsContact C-N 3.31Å; D3-K5 PolarHBondContact O-N 2.92Å; D3-K6 PolarHBondContact O-N 3.08Å; D3-W7 VanDerWaalsContact O-CD1 3.31Å; D3-W7 PolarHBondContact O-N 3.43Å
4	M	49.3	Very low	55.3	Low	155 Å²	155	125.9 Å²	125.9	76%	0.764	62%	0.619	S	S	*	*	H	α-helix	trans	-68.7	-32.2	177.9	-151.6	-172.9	-54.1	0	0	111.9	F8	M4-F8 WeakPolarHBondContact O-CB 2.96Å; M4-F8 PolarHBondContact O-N 3.18Å
5	K	53.8	Low	54.8	Low	142 Å²	142	124.6 Å²	124.6	62%	0.617	62%	0.615	S	S	*	*	H	α-helix	trans	-71	-35.1	175	-75.1	-179.7	176.1	177.3	0	112.5	D3 F8 F9	D3-K5 VanDerWaalsContact C-N 3.31Å; D3-K5 PolarHBondContact O-N 2.92Å; K5-F8 PolarHBondContact O-N 2.79Å; K5-F9 WeakPolarHBondContact O-CD2 3.41Å; K5-F9 PolarHBondContact O-N 2.9Å; K5-F9 VanDerWaalsContact O-N 3.07Å
6	K	58.3	Low	54.1	Low	136 Å²	136	125.9 Å²	125.9	59%	0.591	62%	0.616	S	S	*	*	H	α-helix	trans	-66.3	-43.1	176.3	-87.9	-178.7	174.1	177.6	0	112.3	D3 F8 F9 L10	D3-K6 PolarHBondContact O-N 3.08Å; K6-F8 VanDerWaalsContact C-N 3.33Å; K6-F8 PolarHBondContact O-N 3.46Å; K6-F9 PolarHBondContact O-N 2.86Å; K6-L10 PolarHBondContact O-N 2.85Å
7	W	58.4	Low	53.5	Low	198 Å²	198	127.4 Å²	127.4	75%	0.75	62%	0.624	S	S	*	*	H	α-helix	trans	-66.9	-34.2	176.3	-80	100.8	0	0	0	112.8	D3 A11	D3-W7 VanDerWaalsContact O-CD1 3.31Å; D3-W7 PolarHBondContact O-N 3.43Å; W7-A11 VanDerWaalsContact O-CB 3.32Å; W7-A11 WeakPolarHBondContact O-CB 3.49Å; W7-A11 PolarHBondContact O-N 3.46Å
8	F	59.2	Low	53	Low	145 Å²	145	129.4 Å²	129.4	64%	0.636	63%	0.632	S	S	*	*	H	α-helix	trans	-68	-40.2	175.6	-157.3	-92.4	0	0	0	112.4	M4 K5 K6 L12	M4-F8 WeakPolarHBondContact O-CB 2.96Å; M4-F8 PolarHBondContact O-N 3.18Å; K5-F8 PolarHBondContact O-N 2.79Å; K6-F8 VanDerWaalsContact C-N 3.33Å; K6-F8 PolarHBondContact O-N 3.46Å; F8-L12 HydrophobicContact CE1-CD1 4.19Å; F8-L12 WeakPolarHBondContact O-CB 3.17Å; F8-L12 PolarHBondContact O-N 2.87Å
9	F	59.2	Low	52.3	Low	143 Å²	143	129.4 Å²	129.4	63%	0.627	63%	0.633	S	S	*	*	H	α-helix	trans	-69.7	-40	176.1	-95.6	-86.4	0	0	0	113	K5 K6 A11 L12 E13	K5-F9 WeakPolarHBondContact O-CD2 3.41Å; K5-F9 PolarHBondContact O-N 2.9Å; K5-F9 VanDerWaalsContact O-N 3.07Å; K6-F9 PolarHBondContact O-N 2.86Å; F9-A11 VanDerWaalsContact C-N 3.35Å; F9-L12 PolarHBondContact O-N 2.84Å; F9-E13 PolarHBondContact O-N 3.02Å
10	L	57.2	Low	51.5	Low	100 Å²	100	127.8 Å²	127.8	52%	0.524	63%	0.634	S	S	.	*	H	α-helix	trans	-65.5	-36.5	174.5	-88.3	151.9	0	0	0	112.4	K6 C14	K6-L10 PolarHBondContact O-N 2.85Å; L10-C14 PolarHBondContact O-N 2.86Å
11	A	58.2	Low	50.7	Low	52 Å²	52	129.5 Å²	129.5	43%	0.43	64%	0.64	S	S	.	*	H	α-helix	trans	-67.2	-37.2	173.1	0	0	0	0	0	111.9	W7 F9 L15	W7-A11 VanDerWaalsContact O-CB 3.32Å; W7-A11 WeakPolarHBondContact O-CB 3.49Å; W7-A11 PolarHBondContact O-N 3.46Å; F9-A11 VanDerWaalsContact C-N 3.35Å; A11-L15 WeakPolarHBondContact O-CB 3.49Å; A11-L15 PolarHBondContact O-N 2.65Å
12	L	56.1	Low	50.2	Low	82 Å²	82	128.2 Å²	128.2	43%	0.429	63%	0.634	S	S	.	*	H	α-helix	trans	-69.3	-38.2	176.7	-137.6	88.6	0	0	0	112.3	F8 F9 L15 F16	F8-L12 HydrophobicContact CE1-CD1 4.19Å; F8-L12 WeakPolarHBondContact O-CB 3.17Å; F8-L12 PolarHBondContact O-N 2.87Å; F9-L12 PolarHBondContact O-N 2.84Å; L12-L15 PolarHBondContact O-N 3.34Å; L12-F16 WeakPolarHBondContact O-CB 3.49Å; L12-F16 PolarHBondContact O-N 2.63Å
13	E	52.8	Low	49.3	Very low	126 Å²	126	127.8 Å²	127.8	59%	0.589	63%	0.631	S	S	*	*	H	α-helix	trans	-69.6	-37.6	174.9	-77.3	-169.8	168.8	0	0	112.2	F9 F16 M17	F9-E13 PolarHBondContact O-N 3.02Å; E13-F16 PolarHBondContact O-N 2.79Å; E13-M17 WeakPolarHBondContact O-CB 3.46Å; E13-M17 VanDerWaalsContact O-CG 3.23Å; E13-M17 WeakPolarHBondContact O-CG 3.36Å; E13-M17 PolarHBondContact O-N 2.81Å
14	C	50.4	Low	48.9	Very low	81 Å²	81	130.5 Å²	130.5	55%	0.547	65%	0.645	S	S	.	*	H	α-helix	trans	-64.9	-40.3	170.8	-84.1	0	0	0	0	112	L10 M17 Q18	L10-C14 PolarHBondContact O-N 2.86Å; C14-M17 PolarHBondContact O-N 3.06Å; C14-Q18 WeakPolarHBondContact O-CB 3.31Å; C14-Q18 PolarHBondContact O-N 2.9Å
15	L	48.4	Very low	49	Very low	106 Å²	106	129.3 Å²	129.3	56%	0.555	64%	0.641	S	S	*	*	H	α-helix	trans	-64.7	-39.5	173.3	-99.7	139.1	0	0	0	112	A11 L12 Q18 I19	A11-L15 WeakPolarHBondContact O-CB 3.49Å; A11-L15 PolarHBondContact O-N 2.65Å; L12-L15 PolarHBondContact O-N 3.34Å; L15-Q18 PolarHBondContact O-N 2.81Å; L15-I19 HydrophobicContact CD2-CD1 4.47Å; L15-I19 WeakPolarHBondContact O-CB 3.38Å; L15-I19 VanDerWaalsContact O-CD1 3.31Å; L15-I19 WeakPolarHBondContact O-CD1 3.38Å; L15-I19 WeakPolarHBondContact O-CG1 3.49Å; L15-I19 PolarHBondContact O-N 2.78Å
16	F	43.9	Very low	49.5	Very low	146 Å²	146	130.6 Å²	130.6	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-68.5	-37.9	176.1	-113.4	-94.9	0	0	0	112.7	L12 E13 Q18 I19 C20	L12-F16 WeakPolarHBondContact O-CB 3.49Å; L12-F16 PolarHBondContact O-N 2.63Å; E13-F16 PolarHBondContact O-N 2.79Å; F16-Q18 VanDerWaalsContact C-N 3.3Å; F16-Q18 PolarHBondContact O-N 2.88Å; F16-I19 PolarHBondContact O-N 3.42Å; F16-C20 WeakPolarHBondContact O-CB 3.33Å; F16-C20 PolarHBondContact O-N 3.26Å
17	M	43.7	Very low	50.4	Low	151 Å²	151	129.1 Å²	129.1	74%	0.744	64%	0.643	S	S	*	*	H	α-helix	trans	-73.2	-22.9	176.5	-71.4	-68.1	-78.2	0	0	112.8	E13 C14	E13-M17 WeakPolarHBondContact O-CB 3.46Å; E13-M17 VanDerWaalsContact O-CG 3.23Å; E13-M17 WeakPolarHBondContact O-CG 3.36Å; E13-M17 PolarHBondContact O-N 2.81Å; C14-M17 PolarHBondContact O-N 3.06Å
18	Q	43.6	Very low	51.9	Low	164 Å²	164	122 Å²	122	77%	0.766	62%	0.616	S	S	*	*	H	α-helix	trans	-84.8	-21.8	174	-148	145.9	-17.4	0	0	112.6	C14 L15 F16	C14-Q18 WeakPolarHBondContact O-CB 3.31Å; C14-Q18 PolarHBondContact O-N 2.9Å; L15-Q18 PolarHBondContact O-N 2.81Å; F16-Q18 VanDerWaalsContact C-N 3.3Å; F16-Q18 PolarHBondContact O-N 2.88Å
19	I	41.4	Very low	53.5	Low	129 Å²	129	120.5 Å²	120.5	66%	0.662	61%	0.606	S	S	*	*	H	α-helix	trans	-87.5	-19	173	-64.9	164.1	0	0	0	111.7	L15 F16	L15-I19 HydrophobicContact CD2-CD1 4.47Å; L15-I19 WeakPolarHBondContact O-CB 3.38Å; L15-I19 VanDerWaalsContact O-CD1 3.31Å; L15-I19 WeakPolarHBondContact O-CD1 3.38Å; L15-I19 WeakPolarHBondContact O-CG1 3.49Å; L15-I19 PolarHBondContact O-N 2.78Å; F16-I19 PolarHBondContact O-N 3.42Å
20	C	35.7	Very low	55.1	Low	97 Å²	97	113.7 Å²	113.7	66%	0.655	58%	0.576	S	S	*	*			trans	-97.8	31.7	176.5	-134.5	0	0	0	0	113.9	F16 Q22	F16-C20 WeakPolarHBondContact O-CB 3.33Å; F16-C20 PolarHBondContact O-N 3.26Å; C20-Q22 PolarHBondContact O-N 3.13Å
21	H	34.2	Very low	56.8	Low	164 Å²	164	109.3 Å²	109.3	76%	0.759	55%	0.554	S	S	*	*			trans	-84.7	92.1	150.6	-135	57.3	0	0	0	106.2	S23	H21-S23 PolarHBondContact O-N 3.37Å
22	Q	40.3	Very low	58.4	Low	176 Å²	176	108.3 Å²	108.3	82%	0.822	54%	0.54	S	S	*	.			trans	-53.5	95	152.5	-88.7	179.6	-27.3	0	0	105.8	C20 L24	C20-Q22 PolarHBondContact O-N 3.13Å; Q22-L24 PolarHBondContact O-N 2.82Å; Q22-L24 VanDerWaalsContact O-N 3.15Å
23	S	38.6	Very low	60	Low	79 Å²	79	109 Å²	109	55%	0.552	54%	0.541	S	S	*	.			trans	-51.9	122.7	150.1	50.4	0	0	0	0	104.4	H21 L25	H21-S23 PolarHBondContact O-N 3.37Å; S23-L25 PolarHBondContact O-N 3.34Å
24	L	44.5	Very low	61.3	Low	168 Å²	168	104.9 Å²	104.9	88%	0.88	52%	0.524	S	S	*	.			trans	-51	98.6	155.4	-99.6	85.3	0	0	0	104.9	Q22 Q26	Q22-L24 PolarHBondContact O-N 2.82Å; Q22-L24 VanDerWaalsContact O-N 3.15Å; L24-Q26 VanDerWaalsContact C-N 3.3Å; L24-Q26 PolarHBondContact O-N 3.46Å
25	L	52	Low	62.2	Low	131 Å²	131	104.8 Å²	104.8	69%	0.686	52%	0.521	S	S	*	.			trans	-62.7	100.9	177.8	-104.1	127.1	0	0	0	105.8	S23 K27	S23-L25 PolarHBondContact O-N 3.34Å; L25-K27 PolarHBondContact O-N 3.36Å
26	Q	63.2	Low	62.7	Low	168 Å²	168	103.6 Å²	103.6	79%	0.785	52%	0.516	S	S	*	.			trans	-64.1	108.5	176.8	-164.2	171.6	4.8	0	0	106.1	L24 R28	L24-Q26 VanDerWaalsContact C-N 3.3Å; L24-Q26 PolarHBondContact O-N 3.46Å; Q26-R28 PolarHBondContact O-N 2.9Å
27	K	78.2	Confident	62.8	Low	105 Å²	105	103.6 Å²	103.6	46%	0.457	52%	0.521	S	S	.	.			trans	-55.3	134.5	-177.7	-69	-174.5	174.9	-170.7	0	110.2	L25 L54	L25-K27 PolarHBondContact O-N 3.36Å; K27-L54 HydrophobicContact CB-CD1 3.79Å; K27-L54 HydrophobicContact CB-CD2 4.05Å; K27-L54 HydrophobicContact CB-CG 3.69Å; K27-L54 HydrophobicContact CD-CD2 3.87Å; K27-L54 HydrophobicContact CD-CG 4.19Å; K27-L54 WeakPolarHBondContact O-CD1 3.31Å
28	R	89.1	Confident	62.9	Low	48 Å²	48	106.7 Å²	106.7	18%	0.181	52%	0.524	C	S	.	.			trans	-56.3	135.9	179.9	175.1	62.7	60.9	-154.5	0.7	111.4	Q26 L54 C55 D59 S107 T108 D109	Q26-R28 PolarHBondContact O-N 2.9Å; R28-L54 CarbonylContact O-C 3.51Å; R28-L54 WeakPolarHBondContact O-CA 3.44Å; R28-C55 HydrophobicContact CB-CB 4.08Å; R28-C55 PolarHBondContact O-N 3.31Å; R28-D59 PolarHBondContact NE-O 2.85Å; R28-S107 PolarHBondContact NH1-O 2.91Å; R28-S107 PolarHBondContact NH2-O 3.14Å; R28-T108 VanDerWaalsContact NH1-C 3.35Å; R28-D109 WeakPolarHBondContact CD-OD1 3.46Å; R28-D109 IonicContact CZ-OD1 3.1Å; R28-D109 IonicContact NE-OD1 2.79Å; R28-D109 VanDerWaalsContact NH1-N 3.19Å; R28-D109 IonicContact NH1-OD1 2.83Å; R28-D109 PolarHBondContact NH1-OD1 2.9Å
29	R	92.9	Very high	63.4	Low	115 Å²	115	101.5 Å²	101.5	43%	0.434	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.4	173.9	-61.3	172.2	69.3	-169.6	2.2	109.7	V52 Q53 L54 D109 L110	R29-V52 HydrophobicContact CB-CG1 4.16Å; R29-Q53 WeakPolarHBondContact CA-O 3.45Å; R29-L54 HydrophobicContact CG-CD1 3.6Å; R29-D109 HydrophobicContact CB-CB 4.4Å; R29-D109 PolarHBondContact N-OD1 2.89Å; R29-D109 CarbonylContact O-C 3.49Å; R29-D109 WeakPolarHBondContact O-CA 3.45Å; R29-L110 HydrophobicContact CB-CD2 4.42Å; R29-L110 PolarHBondContact O-N 2.88Å
30	C	92.8	Very high	64.2	Low	0 Å²	0	102 Å²	102	0%	0	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.4	176.2	-60.3	0	0	0	0	111.1	V52 Q53 C55 C61	C30-V52 CarbonylContact O-C 3.53Å; C30-V52 WeakPolarHBondContact O-CA 3.37Å; C30-Q53 PolarHBondContact N-O 3.44Å; C30-Q53 PolarHBondContact O-N 3.47Å; C30-C55 PolarHBondContact SG-SG 2.91Å; C30-C61 WeakPolarHBondContact CA-SG 3.38Å; C30-C61 HydrophobicContact CB-CB 3.69Å; C30-C61 WeakPolarHBondContact CB-SG 3.35Å; C30-C61 WeakPolarHBondContact SG-CA 3.35Å; C30-C61 WeakPolarHBondContact SG-CB 3.33Å; C30-C61 CovalentContact SG-SG 2.03Å; C30-C61 PolarHBondContact SG-SG 3.33Å
31	A	93.3	Very high	65.5	Low	7 Å²	7	98.3 Å²	98.3	6%	0.058	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	141.6	167.6	0	0	0	0	0	108.9	S51 L77 A78 N112 R113	A31-S51 CarbonylContact C-O 3.53Å; A31-S51 WeakPolarHBondContact CA-O 3.3Å; A31-L77 HydrophobicContact CB-CB 4.41Å; A31-L77 HydrophobicContact CB-CD1 3.93Å; A31-L77 CarbonylContact O-C 3.51Å; A31-L77 VanDerWaalsContact O-C 3.3Å; A31-L77 VanDerWaalsContact O-CB 3.31Å; A31-L77 WeakPolarHBondContact O-CB 3.5Å; A31-A78 PolarHBondContact O-N 2.72Å; A31-N112 VanDerWaalsContact CB-OD1 3.27Å; A31-N112 WeakPolarHBondContact CB-OD1 3.38Å; A31-N112 PolarHBondContact N-OD1 2.96Å; A31-N112 PolarHBondContact O-ND2 3.1Å; A31-R113 HydrophobicContact CB-CB 4.32Å
32	F	91.5	Very high	67.3	Low	31 Å²	31	92.6 Å²	92.6	14%	0.136	45%	0.451	C	S	.	.			trans	-127	121.1	-177.2	-173.5	-96.9	0	0	0	111.1	V34 V48 S51 Q53 L77 A78	F32-V34 HydrophobicContact CD2-CG2 4.43Å; F32-V34 HydrophobicContact CE1-CG2 4.25Å; F32-V34 HydrophobicContact CE2-CG2 3.71Å; F32-V34 HydrophobicContact CZ-CG2 3.6Å; F32-V48 HydrophobicContact CB-CG1 4.41Å; F32-V48 HydrophobicContact CD1-CB 4.46Å; F32-V48 HydrophobicContact CD1-CG1 3.34Å; F32-V48 HydrophobicContact CD1-CG2 4.23Å; F32-V48 HydrophobicContact CD2-CG2 4.08Å; F32-V48 HydrophobicContact CE1-CB 4.49Å; F32-V48 HydrophobicContact CE1-CG1 3.61Å; F32-V48 HydrophobicContact CE1-CG2 4.08Å; F32-V48 HydrophobicContact CE2-CG2 3.92Å; F32-V48 HydrophobicContact CG-CG1 3.84Å; F32-V48 HydrophobicContact CG-CG2 4.22Å; F32-V48 HydrophobicContact CZ-CG1 4.31Å; F32-V48 HydrophobicContact CZ-CG2 3.91Å; F32-S51 PolarHBondContact N-O 3.37Å; F32-S51 WeakPolarHBondContact O-CA 3.43Å; F32-Q53 HydrophobicContact CB-CB 3.83Å; F32-Q53 HydrophobicContact CD2-CB 3.9Å; F32-Q53 HydrophobicContact CD2-CG 4.37Å; F32-Q53 HydrophobicContact CG-CB 4.13Å; F32-L77 VanDerWaalsContact CA-O 3.31Å; F32-L77 WeakPolarHBondContact CA-O 3.35Å; F32-A78 HydrophobicContact CD2-CB 4.29Å; F32-A78 HydrophobicContact CE2-CB 4.46Å
33	Q	89.3	Confident	68.7	Low	96 Å²	96	86.9 Å²	86.9	45%	0.449	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	117.9	174	179.1	174.1	-38.9	0	0	107.4	V74 T76 L77	Q33-V74 HydrophobicContact CB-CG1 4.4Å; Q33-V74 HydrophobicContact CG-CG1 4.29Å; Q33-T76 CarbonylContact O-C 3.59Å; Q33-T76 VanDerWaalsContact O-CA 3.31Å; Q33-T76 WeakPolarHBondContact O-CA 3.42Å; Q33-L77 HydrophobicContact CB-CB 4.34Å; Q33-L77 HydrophobicContact CB-CD1 4.16Å; Q33-L77 HydrophobicContact CB-CG 4.26Å; Q33-L77 PolarHBondContact N-O 3.3Å; Q33-L77 PolarHBondContact O-N 2.66Å
34	V	81.2	Confident	70.5	Confident	40 Å²	40	86.9 Å²	86.9	24%	0.242	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113	178.9	-175.9	0	0	0	0	107.5	F32 N39 T76	F32-V34 HydrophobicContact CD2-CG2 4.43Å; F32-V34 HydrophobicContact CE1-CG2 4.25Å; F32-V34 HydrophobicContact CE2-CG2 3.71Å; F32-V34 HydrophobicContact CZ-CG2 3.6Å; V34-N39 HydrophobicContact CG1-CB 3.48Å; V34-N39 VanDerWaalsContact CG1-CB 3.48Å; V34-T76 HydrophobicContact CG2-CG2 4.36Å
35	T	67.8	Low	72	Confident	79 Å²	79	79.6 Å²	79.6	49%	0.485	40%	0.4	S	S	.	.			trans	-82.2	-21.6	-173.8	54.1	0	0	0	0	113.6	V74 D75	T35-V74 WeakPolarHBondContact CG2-O 3.16Å; T35-D75 WeakPolarHBondContact CB-O 3.49Å; T35-D75 WeakPolarHBondContact CG2-O 3.27Å; T35-D75 PolarHBondContact N-O 2.91Å; T35-D75 VanDerWaalsContact N-O 3.15Å; T35-D75 PolarHBondContact OG1-O 3.3Å
36	N	58.6	Low	73.4	Confident	82 Å²	82	73.6 Å²	73.6	44%	0.439	37%	0.369	S	S	.	.	S	Bend	trans	-108.8	125.9	-179	-160.9	-21	0	0	0	112.3	R38 N39	N36-R38 PolarHBondContact O-N 2.76Å; N36-R38 PolarHBondContact OD1-N 2.73Å; N36-N39 PolarHBondContact O-N 2.7Å
37	I	47.3	Very low	74.5	Confident	146 Å²	146	70.9 Å²	70.9	75%	0.749	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.2	-175.9	-63.1	166.4	0	0	0	112.5	N39 H40	I37-N39 PolarHBondContact O-N 2.69Å; I37-H40 PolarHBondContact O-NE2 3.24Å
38	R	45.6	Very low	75	Confident	216 Å²	216	68.2 Å²	68.2	82%	0.815	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-2	179.6	-65.2	-175.1	-173.8	-178.7	1.7	115.6	N36 H40	N36-R38 PolarHBondContact O-N 2.76Å; N36-R38 PolarHBondContact OD1-N 2.73Å; R38-H40 PolarHBondContact O-N 3.15Å
39	N	53.8	Low	74.9	Confident	55 Å²	55	70.5 Å²	70.5	29%	0.294	38%	0.376	S	S	.	.			trans	-97.4	38.7	-174.2	-91.5	-1.5	0	0	0	114	V34 N36 I37 G41 Y42	V34-N39 HydrophobicContact CG1-CB 3.48Å; V34-N39 VanDerWaalsContact CG1-CB 3.48Å; N36-N39 PolarHBondContact O-N 2.7Å; I37-N39 PolarHBondContact O-N 2.69Å; N39-G41 PolarHBondContact O-N 2.83Å; N39-Y42 HydrophobicContact CB-CD2 3.95Å; N39-Y42 HydrophobicContact CB-CE2 4.42Å; N39-Y42 PolarHBondContact O-N 2.95Å; N39-Y42 VanDerWaalsContact O-N 3.17Å
40	H	57.8	Low	74.6	Confident	138 Å²	138	68.2 Å²	68.2	64%	0.639	39%	0.389	S	S	*	.	H	α-helix	trans	-54.8	-26.9	-178.3	-73.3	-61.9	0	0	0	114.5	I37 R38 Y42 S43	I37-H40 PolarHBondContact O-NE2 3.24Å; R38-H40 PolarHBondContact O-N 3.15Å; H40-Y42 VanDerWaalsContact C-N 3.26Å; H40-Y42 PolarHBondContact O-N 2.97Å; H40-S43 PolarHBondContact O-N 2.79Å; H40-S43 VanDerWaalsContact O-N 3.16Å
41	G	62.6	Low	74.4	Confident	20 Å²	20	72 Å²	72	21%	0.206	42%	0.415	C	S	.	.	H	α-helix	trans	-61.3	-29.6	179.9	0	0	0	0	0	114.5	N39 A44 R81	N39-G41 PolarHBondContact O-N 2.83Å; G41-A44 PolarHBondContact O-N 2.83Å; G41-R81 VanDerWaalsContact C-CZ 3.49Å; G41-R81 VanDerWaalsContact CA-CZ 3.4Å; G41-R81 WeakPolarHBondContact O-CD 3.23Å; G41-R81 PolarHBondContact O-NE 3.07Å
42	Y	72.4	Confident	74.3	Confident	44 Å²	44	73.1 Å²	73.1	17%	0.173	42%	0.421	C	S	.	.	H	α-helix	trans	-75.7	-29.2	177.7	-68.4	-71.9	0	0	0	112.6	N39 H40 A44 A45 Q53 M62 T76 A78 R81	N39-Y42 HydrophobicContact CB-CD2 3.95Å; N39-Y42 HydrophobicContact CB-CE2 4.42Å; N39-Y42 PolarHBondContact O-N 2.95Å; N39-Y42 VanDerWaalsContact O-N 3.17Å; H40-Y42 VanDerWaalsContact C-N 3.26Å; H40-Y42 PolarHBondContact O-N 2.97Å; Y42-A44 PolarHBondContact O-N 3.14Å; Y42-A45 WeakPolarHBondContact O-CB 3.25Å; Y42-A45 PolarHBondContact O-N 2.92Å; Y42-Q53 PolarHBondContact O-NE2 3.04Å; Y42-M62 HydrophobicContact CD1-CE 4.24Å; Y42-M62 HydrophobicContact CE1-CE 3.29Å; Y42-M62 WeakPolarHBondContact OH-CE 3.27Å; Y42-T76 HydrophobicContact CD2-CG2 4.29Å; Y42-T76 HydrophobicContact CE2-CG2 4.41Å; Y42-T76 HydrophobicContact CG-CG2 4.5Å; Y42-A78 HydrophobicContact CD1-CB 3.71Å; Y42-A78 HydrophobicContact CG-CB 4Å; Y42-R81 HydrophobicContact CD1-CG 3.76Å; Y42-R81 HydrophobicContact CE1-CG 3.85Å
43	S	71.3	Confident	74.4	Confident	57 Å²	57	71.7 Å²	71.7	40%	0.399	42%	0.415	S	S	.	.	H	α-helix	trans	-67.8	-25.5	173.6	-56.8	0	0	0	0	112	H40 G46	H40-S43 PolarHBondContact O-N 2.79Å; H40-S43 VanDerWaalsContact O-N 3.16Å; S43-G46 VanDerWaalsContact O-O 3.05Å
44	A	75.5	Confident	74.5	Confident	78 Å²	78	70.1 Å²	70.1	65%	0.645	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.5	177.8	0	0	0	0	0	114	G41 Y42 G46	G41-A44 PolarHBondContact O-N 2.83Å; Y42-A44 PolarHBondContact O-N 3.14Å; A44-G46 PolarHBondContact O-N 2.91Å
45	A	75.3	Confident	74.8	Confident	15 Å²	15	68.3 Å²	68.3	12%	0.124	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-7	-179.8	0	0	0	0	0	113.8	Y42 E56 C79 R81	Y42-A45 WeakPolarHBondContact O-CB 3.25Å; Y42-A45 PolarHBondContact O-N 2.92Å; A45-E56 PolarHBondContact O-N 3.32Å; A45-E56 VanDerWaalsContact O-N 3.16Å; A45-C79 HydrophobicContact CB-CB 3.87Å; A45-R81 HydrophobicContact CB-CG 4.02Å
46	G	82.2	Confident	75.6	Confident	5 Å²	5	69.5 Å²	69.5	5%	0.052	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	172.6	-178.4	0	0	0	0	0	112.3	S43 A44 V48 Q53 L54	S43-G46 VanDerWaalsContact O-O 3.05Å; A44-G46 PolarHBondContact O-N 2.91Å; G46-V48 PolarHBondContact O-N 3.31Å; G46-Q53 PolarHBondContact O-NE2 3.4Å; G46-Q53 VanDerWaalsContact O-NE2 3.17Å; G46-L54 CarbonylContact C-O 3.55Å; G46-L54 WeakPolarHBondContact CA-O 3.5Å
47	N	86.8	Confident	76.5	Confident	112 Å²	112	72.2 Å²	72.2	60%	0.599	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	123.8	-176.3	-168.8	13.8	0	0	0	111.5	Q53 L54	N47-Q53 WeakPolarHBondContact O-CA 3.35Å; N47-L54 PolarHBondContact N-O 3.03Å; N47-L54 PolarHBondContact O-N 2.98Å
48	V	87.4	Confident	78.2	Confident	49 Å²	49	66 Å²	66	30%	0.297	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.1	-175.9	-176.9	0	0	0	0	110.6	F32 G46 Q53	F32-V48 HydrophobicContact CB-CG1 4.41Å; F32-V48 HydrophobicContact CD1-CB 4.46Å; F32-V48 HydrophobicContact CD1-CG1 3.34Å; F32-V48 HydrophobicContact CD1-CG2 4.23Å; F32-V48 HydrophobicContact CD2-CG2 4.08Å; F32-V48 HydrophobicContact CE1-CB 4.49Å; F32-V48 HydrophobicContact CE1-CG1 3.61Å; F32-V48 HydrophobicContact CE1-CG2 4.08Å; F32-V48 HydrophobicContact CE2-CG2 3.92Å; F32-V48 HydrophobicContact CG-CG1 3.84Å; F32-V48 HydrophobicContact CG-CG2 4.22Å; F32-V48 HydrophobicContact CZ-CG1 4.31Å; F32-V48 HydrophobicContact CZ-CG2 3.91Å; G46-V48 PolarHBondContact O-N 3.31Å; V48-Q53 HydrophobicContact CG2-CB 4.25Å; V48-Q53 HydrophobicContact CG2-CG 3.9Å
49	S	86.7	Confident	80.1	Confident	96 Å²	96	59.8 Å²	59.8	67%	0.671	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	95.1	174.2	174.7	0	0	0	0	110	S51 V52	S49-S51 PolarHBondContact O-N 2.91Å; S49-V52 PolarHBondContact N-O 3.31Å; S49-V52 PolarHBondContact O-N 3.09Å
50	G	87.5	Confident	81.8	Confident	67 Å²	67	57.5 Å²	57.5	69%	0.691	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-122.9	-176.7	0	0	0	0	0	111.5	V52	G50-V52 VanDerWaalsContact C-N 3.31Å
51	S	89.5	Confident	83.4	Confident	79 Å²	79	50.9 Å²	50.9	55%	0.552	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	14.4	179	57.6	0	0	0	0	114.1	A31 F32 S49	A31-S51 CarbonylContact C-O 3.53Å; A31-S51 WeakPolarHBondContact CA-O 3.3Å; F32-S51 PolarHBondContact N-O 3.37Å; F32-S51 WeakPolarHBondContact O-CA 3.43Å; S49-S51 PolarHBondContact O-N 2.91Å
52	V	91.1	Very high	84.7	Confident	31 Å²	31	50.9 Å²	50.9	19%	0.188	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.4	-179	-179.4	0	0	0	0	109.7	R29 C30 S49 G50 L110	R29-V52 HydrophobicContact CB-CG1 4.16Å; C30-V52 CarbonylContact O-C 3.53Å; C30-V52 WeakPolarHBondContact O-CA 3.37Å; S49-V52 PolarHBondContact N-O 3.31Å; S49-V52 PolarHBondContact O-N 3.09Å; G50-V52 VanDerWaalsContact C-N 3.31Å; V52-L110 HydrophobicContact CG1-CD2 4.06Å; V52-L110 HydrophobicContact CG2-CD2 4Å
53	Q	92.1	Very high	85.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.4	171.4	-175.1	177	29.5	0	0	110.1	R29 C30 F32 Y42 G46 N47 V48 C79	R29-Q53 WeakPolarHBondContact CA-O 3.45Å; C30-Q53 PolarHBondContact N-O 3.44Å; C30-Q53 PolarHBondContact O-N 3.47Å; F32-Q53 HydrophobicContact CB-CB 3.83Å; F32-Q53 HydrophobicContact CD2-CB 3.9Å; F32-Q53 HydrophobicContact CD2-CG 4.37Å; F32-Q53 HydrophobicContact CG-CB 4.13Å; Y42-Q53 PolarHBondContact O-NE2 3.04Å; G46-Q53 PolarHBondContact O-NE2 3.4Å; G46-Q53 VanDerWaalsContact O-NE2 3.17Å; N47-Q53 WeakPolarHBondContact O-CA 3.35Å; V48-Q53 HydrophobicContact CG2-CB 4.25Å; V48-Q53 HydrophobicContact CG2-CG 3.9Å; Q53-C79 VanDerWaalsContact CD-SG 3.57Å; Q53-C79 VanDerWaalsContact CG-SG 3.52Å
54	L	92.2	Very high	86.2	Confident	63 Å²	63	47.5 Å²	47.5	33%	0.33	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.2	174.4	-167.2	77.2	0	0	0	109	K27 R28 R29 G46 N47	K27-L54 HydrophobicContact CB-CD1 3.79Å; K27-L54 HydrophobicContact CB-CD2 4.05Å; K27-L54 HydrophobicContact CB-CG 3.69Å; K27-L54 HydrophobicContact CD-CD2 3.87Å; K27-L54 HydrophobicContact CD-CG 4.19Å; K27-L54 WeakPolarHBondContact O-CD1 3.31Å; R28-L54 CarbonylContact O-C 3.51Å; R28-L54 WeakPolarHBondContact O-CA 3.44Å; R29-L54 HydrophobicContact CG-CD1 3.6Å; G46-L54 CarbonylContact C-O 3.55Å; G46-L54 WeakPolarHBondContact CA-O 3.5Å; N47-L54 PolarHBondContact N-O 3.03Å; N47-L54 PolarHBondContact O-N 2.98Å
55	C	88.1	Confident	86.6	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.014	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	137.6	-172.1	-49.4	0	0	0	0	111.9	R28 C30 T58 C79	R28-C55 HydrophobicContact CB-CB 4.08Å; R28-C55 PolarHBondContact O-N 3.31Å; C30-C55 PolarHBondContact SG-SG 2.91Å; C55-T58 HydrophobicContact CB-CG2 3.67Å; C55-T58 WeakPolarHBondContact CB-O 3.38Å; C55-C79 WeakPolarHBondContact CA-SG 3.45Å; C55-C79 HydrophobicContact CB-CB 3.81Å; C55-C79 WeakPolarHBondContact CB-SG 3.49Å; C55-C79 PolarHBondContact N-SG 2.84Å; C55-C79 WeakPolarHBondContact SG-CB 3.34Å; C55-C79 CovalentContact SG-SG 2.03Å; C55-C79 PolarHBondContact SG-SG 3.17Å
56	E	83.2	Confident	87	Confident	104 Å²	104	48.1 Å²	48.1	49%	0.486	28%	0.28	S	S	.	.	S	Bend	trans	-91	-43.9	-179.6	-83.1	179	-177.4	0	0	113	A45	A45-E56 PolarHBondContact O-N 3.32Å; A45-E56 VanDerWaalsContact O-N 3.16Å
57	N	78	Confident	86.9	Confident	139 Å²	139	50.6 Å²	50.6	74%	0.743	29%	0.291	S	S	*	.	S	Bend	trans	-123.4	8.7	-168.6	-62.1	-42.2	0	0	0	113.7
58	T	82.8	Confident	86.5	Confident	16 Å²	16	48.1 Å²	48.1	10%	0.098	28%	0.277	C	S	.	.			trans	-139.3	149.4	-179	-173.8	0	0	0	0	111.4	C55 C60 C79 D80	C55-T58 HydrophobicContact CB-CG2 3.67Å; C55-T58 WeakPolarHBondContact CB-O 3.38Å; T58-C60 PolarHBondContact OG1-N 3.2Å; T58-C60 VanDerWaalsContact OG1-N 3.07Å; T58-C79 HydrophobicContact CG2-CB 3.86Å; T58-D80 WeakPolarHBondContact CG2-O 3.14Å
59	D	86.2	Confident	86.1	Confident	86 Å²	86	53.6 Å²	53.6	46%	0.46	31%	0.305	S	S	.	.	S	Bend	trans	-101.8	6.4	170.1	-66.1	-44.6	0	0	0	112.5	R28	R28-D59 PolarHBondContact NE-O 2.85Å
60	C	89.4	Confident	85.4	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.041	31%	0.306	C	S	.	.			trans	-107.8	135.9	-176.4	-55.1	0	0	0	0	111.9	T58 D80 M84 C86 C106	T58-C60 PolarHBondContact OG1-N 3.2Å; T58-C60 VanDerWaalsContact OG1-N 3.07Å; C60-D80 HydrophobicContact CB-CB 3.89Å; C60-D80 PolarHBondContact O-N 3.44Å; C60-M84 PolarHBondContact SG-O 3.07Å; C60-M84 VanDerWaalsContact SG-O 3.41Å; C60-C86 WeakPolarHBondContact CA-SG 3.46Å; C60-C86 HydrophobicContact CB-CB 3.71Å; C60-C86 WeakPolarHBondContact CB-SG 3.18Å; C60-C86 WeakPolarHBondContact SG-CB 3.19Å; C60-C86 CovalentContact SG-SG 2.02Å; C60-C86 PolarHBondContact SG-SG 3.46Å; C60-C106 WeakPolarHBondContact CA-O 3.35Å
61	C	90.6	Very high	85	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	150.2	165.2	-55.8	0	0	0	0	110.6	C30 T105 C106 N112	C30-C61 WeakPolarHBondContact CA-SG 3.38Å; C30-C61 HydrophobicContact CB-CB 3.69Å; C30-C61 WeakPolarHBondContact CB-SG 3.35Å; C30-C61 WeakPolarHBondContact SG-CA 3.35Å; C30-C61 WeakPolarHBondContact SG-CB 3.33Å; C30-C61 CovalentContact SG-SG 2.03Å; C30-C61 PolarHBondContact SG-SG 3.33Å; C61-T105 CarbonylContact O-C 3.58Å; C61-T105 VanDerWaalsContact O-CA 3.3Å; C61-T105 WeakPolarHBondContact O-CA 3.41Å; C61-C106 PolarHBondContact N-O 3.27Å; C61-C106 PolarHBondContact O-N 2.62Å; C61-N112 HydrophobicContact CB-CB 3.76Å
62	M	90.4	Very high	84.7	Confident	19 Å²	19	55 Å²	55	9%	0.094	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146.8	178.9	177.6	-93	-93.6	0	0	111.1	Y42 I64 A78 D80 C104 T105 N112	Y42-M62 HydrophobicContact CD1-CE 4.24Å; Y42-M62 HydrophobicContact CE1-CE 3.29Å; Y42-M62 WeakPolarHBondContact OH-CE 3.27Å; M62-I64 HydrophobicContact CE-CD1 4.17Å; M62-I64 HydrophobicContact CE-CG1 4.37Å; M62-I64 HydrophobicContact SD-CD1 4.04Å; M62-I64 HydrophobicContact SD-CG1 3.6Å; M62-I64 VanDerWaalsContact SD-CG1 3.6Å; M62-A78 PolarHBondContact N-O 3.3Å; M62-A78 PolarHBondContact O-N 2.88Å; M62-A78 VanDerWaalsContact O-N 3.15Å; M62-D80 HydrophobicContact CB-CB 4.28Å; M62-C104 WeakPolarHBondContact CA-O 3.44Å; M62-T105 HydrophobicContact CB-CG2 4.38Å; M62-T105 HydrophobicContact CG-CG2 4.37Å; M62-N112 PolarHBondContact O-ND2 2.94Å
63	A	88.4	Confident	84.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.3	168.9	0	0	0	0	0	112	Y65 T76 L77 T103 C104 N112	A63-Y65 HydrophobicContact CB-CD2 4.12Å; A63-Y65 HydrophobicContact CB-CE2 3.56Å; A63-T76 CarbonylContact C-O 3.5Å; A63-T76 WeakPolarHBondContact CA-O 3.36Å; A63-L77 HydrophobicContact CB-CD2 3.41Å; A63-L77 VanDerWaalsContact CB-CD2 3.41Å; A63-T103 VanDerWaalsContact O-CA 3.29Å; A63-T103 WeakPolarHBondContact O-CA 3.29Å; A63-C104 PolarHBondContact N-O 2.96Å; A63-C104 VanDerWaalsContact N-O 3.12Å; A63-C104 PolarHBondContact O-N 2.83Å; A63-N112 HydrophobicContact CB-CB 4.1Å
64	I	86.4	Confident	84.1	Confident	31 Å²	31	60.4 Å²	60.4	16%	0.159	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.2	170.3	-50.9	-179.1	0	0	0	107.1	M62 D75 T76 F101 T103	M62-I64 HydrophobicContact CE-CD1 4.17Å; M62-I64 HydrophobicContact CE-CG1 4.37Å; M62-I64 HydrophobicContact SD-CD1 4.04Å; M62-I64 HydrophobicContact SD-CG1 3.6Å; M62-I64 VanDerWaalsContact SD-CG1 3.6Å; I64-D75 HydrophobicContact CB-CB 4.47Å; I64-D75 HydrophobicContact CG2-CB 4.21Å; I64-D75 WeakPolarHBondContact O-CB 3.4Å; I64-D75 PolarHBondContact O-N 2.84Å; I64-T76 PolarHBondContact N-O 3.04Å; I64-T76 PolarHBondContact O-N 2.86Å; I64-F101 HydrophobicContact CG2-CD1 3.96Å; I64-T103 HydrophobicContact CB-CG2 4.44Å; I64-T103 HydrophobicContact CG1-CG2 4.07Å; I64-T103 HydrophobicContact CG2-CG2 4.19Å
65	Y	83.8	Confident	83.7	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.9	174.1	-68.5	-98.1	0	0	0	109.6	A63 L72 E73 V74 F101 V102 R113 I115	A63-Y65 HydrophobicContact CB-CD2 4.12Å; A63-Y65 HydrophobicContact CB-CE2 3.56Å; Y65-L72 HydrophobicContact CD1-CB 4.07Å; Y65-E73 CarbonylContact C-O 3.48Å; Y65-E73 VanDerWaalsContact CA-O 3.23Å; Y65-E73 WeakPolarHBondContact CA-O 3.31Å; Y65-V74 HydrophobicContact CD1-CG2 3.99Å; Y65-V74 HydrophobicContact CE1-CB 4.43Å; Y65-V74 HydrophobicContact CE1-CG2 3.44Å; Y65-V74 VanDerWaalsContact CE1-CG2 3.44Å; Y65-F101 CarbonylContact O-C 3.4Å; Y65-F101 VanDerWaalsContact O-CA 3.27Å; Y65-F101 WeakPolarHBondContact O-CA 3.47Å; Y65-F101 WeakPolarHBondContact O-CD1 3.43Å; Y65-V102 PolarHBondContact N-O 2.85Å; Y65-V102 PolarHBondContact O-N 2.87Å; Y65-R113 PolarHBondContact OH-O 3.21Å; Y65-R113 VanDerWaalsContact OH-O 3.07Å; Y65-I115 HydrophobicContact CD1-CG2 4.46Å; Y65-I115 HydrophobicContact CD2-CB 4.2Å; Y65-I115 HydrophobicContact CD2-CD1 3.86Å; Y65-I115 HydrophobicContact CD2-CG2 4.04Å; Y65-I115 HydrophobicContact CE1-CG2 4.22Å; Y65-I115 HydrophobicContact CE2-CB 3.7Å; Y65-I115 HydrophobicContact CE2-CD1 4.1Å; Y65-I115 HydrophobicContact CE2-CG2 3.79Å; Y65-I115 HydrophobicContact CG-CG2 4.37Å
66	R	84	Confident	83.7	Confident	94 Å²	94	58.2 Å²	58.2	36%	0.355	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.8	170.8	-169.3	-177.9	-58.4	-178	4.2	109.6	I68 L72 E73 D75 N100 F101	R66-I68 HydrophobicContact CG-CG1 4.06Å; R66-L72 WeakPolarHBondContact O-CA 3.41Å; R66-E73 PolarHBondContact N-O 2.86Å; R66-E73 PolarHBondContact O-N 3.49Å; R66-D75 IonicContact CZ-OD1 3.7Å; R66-D75 IonicContact NE-OD1 3.93Å; R66-D75 IonicContact NH2-OD1 3.73Å; R66-D75 PolarHBondContact NH2-OD1 2.87Å; R66-N100 CarbonylContact C-O 3.4Å; R66-N100 WeakPolarHBondContact CA-O 3.42Å; R66-F101 HydrophobicContact CB-CD1 3.92Å; R66-F101 HydrophobicContact CB-CE1 3.68Å; R66-F101 HydrophobicContact CB-CZ 4.35Å; R66-F101 HydrophobicContact CG-CD1 4.12Å; R66-F101 HydrophobicContact CG-CE1 3.69Å; R66-F101 HydrophobicContact CG-CE2 4.39Å; R66-F101 HydrophobicContact CG-CZ 3.84Å; R66-F101 VanDerWaalsContact NE-CZ 3.27Å
67	I	80.6	Confident	84.1	Confident	56 Å²	56	53.7 Å²	53.7	29%	0.287	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	112.1	173.5	-56.8	167.7	0	0	0	107.9	Q71 L72 N100 V102	I67-Q71 CarbonylContact C-O 3.49Å; I67-Q71 WeakPolarHBondContact CA-O 3.46Å; I67-L72 HydrophobicContact CG1-CD2 3.67Å; I67-N100 HydrophobicContact CB-CB 4.3Å; I67-N100 PolarHBondContact N-O 3.19Å; I67-V102 HydrophobicContact CD1-CG2 3.8Å; I67-V102 HydrophobicContact CG1-CG2 4.07Å
68	I	79.1	Confident	84.7	Confident	60 Å²	60	47 Å²	47	31%	0.308	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.6	173.6	-53.2	-172.9	0	0	0	107.5	R66 G70 Q71 E73	R66-I68 HydrophobicContact CG-CG1 4.06Å; I68-G70 PolarHBondContact O-N 3.08Å; I68-G70 VanDerWaalsContact O-N 3.13Å; I68-Q71 PolarHBondContact N-O 2.79Å; I68-Q71 PolarHBondContact O-N 3.17Å; I68-E73 HydrophobicContact CD1-CG 4.41Å; I68-E73 VanDerWaalsContact CD1-OE2 3.27Å; I68-E73 WeakPolarHBondContact CD1-OE2 3.36Å
69	N	79	Confident	85.1	Confident	165 Å²	165	46.3 Å²	46.3	88%	0.882	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	33.8	-177.9	-58.3	-33.2	0	0	0	114	Q71	N69-Q71 VanDerWaalsContact C-N 3.31Å; N69-Q71 PolarHBondContact O-N 3.34Å
70	G	71.9	Confident	85	Confident	68 Å²	68	42.9 Å²	42.9	70%	0.701	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	3.4	-177.5	0	0	0	0	0	115.3	I68	I68-G70 PolarHBondContact O-N 3.08Å; I68-G70 VanDerWaalsContact O-N 3.13Å
71	Q	78.6	Confident	84.3	Confident	143 Å²	143	48 Å²	48	67%	0.668	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.5	172.8	-63.1	-169.8	-49.8	0	0	110.9	I67 I68 N69	I67-Q71 CarbonylContact C-O 3.49Å; I67-Q71 WeakPolarHBondContact CA-O 3.46Å; I68-Q71 PolarHBondContact N-O 2.79Å; I68-Q71 PolarHBondContact O-N 3.17Å; N69-Q71 VanDerWaalsContact C-N 3.31Å; N69-Q71 PolarHBondContact O-N 3.34Å
72	L	82.9	Confident	82.9	Confident	60 Å²	60	51.6 Å²	51.6	31%	0.314	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116.5	176.7	-68.6	168.2	0	0	0	110	Y65 R66 I67 V102 I115 L117	Y65-L72 HydrophobicContact CD1-CB 4.07Å; R66-L72 WeakPolarHBondContact O-CA 3.41Å; I67-L72 HydrophobicContact CG1-CD2 3.67Å; L72-V102 HydrophobicContact CD2-CB 4.29Å; L72-V102 HydrophobicContact CD2-CG2 3.84Å; L72-I115 HydrophobicContact CD1-CG2 3.81Å; L72-L117 HydrophobicContact CD1-CD1 4.09Å; L72-L117 HydrophobicContact CD1-CD2 4.29Å; L72-L117 HydrophobicContact CD1-CG 4.35Å
73	E	85.3	Confident	81.1	Confident	105 Å²	105	59.9 Å²	59.9	49%	0.491	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.2	169.9	-68.6	-167.3	176.9	0	0	110.4	Y65 R66 I68 D75	Y65-E73 CarbonylContact C-O 3.48Å; Y65-E73 VanDerWaalsContact CA-O 3.23Å; Y65-E73 WeakPolarHBondContact CA-O 3.31Å; R66-E73 PolarHBondContact N-O 2.86Å; R66-E73 PolarHBondContact O-N 3.49Å; I68-E73 HydrophobicContact CD1-CG 4.41Å; I68-E73 VanDerWaalsContact CD1-OE2 3.27Å; I68-E73 WeakPolarHBondContact CD1-OE2 3.36Å; E73-D75 PolarHBondContact O-N 2.86Å
74	V	85.8	Confident	79.6	Confident	40 Å²	40	65.6 Å²	65.6	24%	0.242	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	115.4	177.2	174.6	0	0	0	0	109.1	Q33 T35 Y65 L77	Q33-V74 HydrophobicContact CB-CG1 4.4Å; Q33-V74 HydrophobicContact CG-CG1 4.29Å; T35-V74 WeakPolarHBondContact CG2-O 3.16Å; Y65-V74 HydrophobicContact CD1-CG2 3.99Å; Y65-V74 HydrophobicContact CE1-CB 4.43Å; Y65-V74 HydrophobicContact CE1-CG2 3.44Å; Y65-V74 VanDerWaalsContact CE1-CG2 3.44Å; V74-L77 HydrophobicContact CG1-CD1 3.88Å; V74-L77 HydrophobicContact CG1-CD2 3.91Å; V74-L77 HydrophobicContact CG1-CG 3.52Å
75	D	84.3	Confident	78.8	Confident	18 Å²	18	72 Å²	72	10%	0.096	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-54.6	171.5	-176.3	99.6	0	0	0	109.9	T35 I64 R66 E73 F101	T35-D75 WeakPolarHBondContact CB-O 3.49Å; T35-D75 WeakPolarHBondContact CG2-O 3.27Å; T35-D75 PolarHBondContact N-O 2.91Å; T35-D75 VanDerWaalsContact N-O 3.15Å; T35-D75 PolarHBondContact OG1-O 3.3Å; I64-D75 HydrophobicContact CB-CB 4.47Å; I64-D75 HydrophobicContact CG2-CB 4.21Å; I64-D75 WeakPolarHBondContact O-CB 3.4Å; I64-D75 PolarHBondContact O-N 2.84Å; R66-D75 IonicContact CZ-OD1 3.7Å; R66-D75 IonicContact NE-OD1 3.93Å; R66-D75 IonicContact NH2-OD1 3.73Å; R66-D75 PolarHBondContact NH2-OD1 2.87Å; E73-D75 PolarHBondContact O-N 2.86Å; D75-F101 HydrophobicContact CB-CE1 4.4Å
76	T	87.7	Confident	78.6	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	130	-175.1	-62.5	0	0	0	0	111.6	Q33 V34 Y42 A63 I64	Q33-T76 CarbonylContact O-C 3.59Å; Q33-T76 VanDerWaalsContact O-CA 3.31Å; Q33-T76 WeakPolarHBondContact O-CA 3.42Å; V34-T76 HydrophobicContact CG2-CG2 4.36Å; Y42-T76 HydrophobicContact CD2-CG2 4.29Å; Y42-T76 HydrophobicContact CE2-CG2 4.41Å; Y42-T76 HydrophobicContact CG-CG2 4.5Å; A63-T76 CarbonylContact C-O 3.5Å; A63-T76 WeakPolarHBondContact CA-O 3.36Å; I64-T76 PolarHBondContact N-O 3.04Å; I64-T76 PolarHBondContact O-N 2.86Å
77	L	90.6	Very high	78	Confident	9 Å²	9	71.9 Å²	71.9	5%	0.047	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.7	167.3	-52.7	178.9	0	0	0	107.8	A31 F32 Q33 A63 V74 N112	A31-L77 HydrophobicContact CB-CB 4.41Å; A31-L77 HydrophobicContact CB-CD1 3.93Å; A31-L77 CarbonylContact O-C 3.51Å; A31-L77 VanDerWaalsContact O-C 3.3Å; A31-L77 VanDerWaalsContact O-CB 3.31Å; A31-L77 WeakPolarHBondContact O-CB 3.5Å; F32-L77 VanDerWaalsContact CA-O 3.31Å; F32-L77 WeakPolarHBondContact CA-O 3.35Å; Q33-L77 HydrophobicContact CB-CB 4.34Å; Q33-L77 HydrophobicContact CB-CD1 4.16Å; Q33-L77 HydrophobicContact CB-CG 4.26Å; Q33-L77 PolarHBondContact N-O 3.3Å; Q33-L77 PolarHBondContact O-N 2.66Å; A63-L77 HydrophobicContact CB-CD2 3.41Å; A63-L77 VanDerWaalsContact CB-CD2 3.41Å; V74-L77 HydrophobicContact CG1-CD1 3.88Å; V74-L77 HydrophobicContact CG1-CD2 3.91Å; V74-L77 HydrophobicContact CG1-CG 3.52Å; L77-N112 VanDerWaalsContact CD2-O 3.26Å; L77-N112 WeakPolarHBondContact CD2-O 3.35Å
78	A	91.2	Very high	78.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	174.4	179.1	0	0	0	0	0	112.5	A31 F32 Y42 M62	A31-A78 PolarHBondContact O-N 2.72Å; F32-A78 HydrophobicContact CD2-CB 4.29Å; F32-A78 HydrophobicContact CE2-CB 4.46Å; Y42-A78 HydrophobicContact CD1-CB 3.71Å; Y42-A78 HydrophobicContact CG-CB 4Å; M62-A78 PolarHBondContact N-O 3.3Å; M62-A78 PolarHBondContact O-N 2.88Å; M62-A78 VanDerWaalsContact O-N 3.15Å
79	C	90.6	Very high	78.4	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	139.9	159	-64.8	0	0	0	0	110.2	A45 Q53 C55 T58	A45-C79 HydrophobicContact CB-CB 3.87Å; Q53-C79 VanDerWaalsContact CD-SG 3.57Å; Q53-C79 VanDerWaalsContact CG-SG 3.52Å; C55-C79 WeakPolarHBondContact CA-SG 3.45Å; C55-C79 HydrophobicContact CB-CB 3.81Å; C55-C79 WeakPolarHBondContact CB-SG 3.49Å; C55-C79 PolarHBondContact N-SG 2.84Å; C55-C79 WeakPolarHBondContact SG-CB 3.34Å; C55-C79 CovalentContact SG-SG 2.03Å; C55-C79 PolarHBondContact SG-SG 3.17Å; T58-C79 HydrophobicContact CG2-CB 3.86Å
80	D	85.1	Confident	78.9	Confident	15 Å²	15	71.7 Å²	71.7	8%	0.08	38%	0.376	C	S	.	.			trans	-63.7	139.2	175.1	-168.4	8.8	0	0	0	111.1	T58 C60 M62 V82	T58-D80 WeakPolarHBondContact CG2-O 3.14Å; C60-D80 HydrophobicContact CB-CB 3.89Å; C60-D80 PolarHBondContact O-N 3.44Å; M62-D80 HydrophobicContact CB-CB 4.28Å; D80-V82 PolarHBondContact OD1-N 3.25Å; D80-V82 VanDerWaalsContact OD1-N 3.16Å
81	R	74.8	Confident	79.6	Confident	113 Å²	113	68.5 Å²	68.5	43%	0.426	34%	0.343	S	S	.	.	S	Bend	trans	-98.7	-18.9	-179.9	-64.8	-175.8	74.4	-156.4	4.8	112.4	G41 Y42 A45	G41-R81 VanDerWaalsContact C-CZ 3.49Å; G41-R81 VanDerWaalsContact CA-CZ 3.4Å; G41-R81 WeakPolarHBondContact O-CD 3.23Å; G41-R81 PolarHBondContact O-NE 3.07Å; Y42-R81 HydrophobicContact CD1-CG 3.76Å; Y42-R81 HydrophobicContact CE1-CG 3.85Å; A45-R81 HydrophobicContact CB-CG 4.02Å
82	V	60.2	Low	80.1	Confident	75 Å²	75	65.5 Å²	65.5	46%	0.455	33%	0.327	S	S	.	.	S	Bend	trans	-99.9	135.8	178.8	-172.2	0	0	0	0	106.7	D80 M84	D80-V82 PolarHBondContact OD1-N 3.25Å; D80-V82 VanDerWaalsContact OD1-N 3.16Å; V82-M84 HydrophobicContact CB-CG 4.3Å; V82-M84 HydrophobicContact CG1-CE 4Å; V82-M84 HydrophobicContact CG1-CG 4.02Å; V82-M84 PolarHBondContact O-N 3.25Å
83	K	52.6	Low	79.9	Confident	194 Å²	194	64 Å²	64	84%	0.843	32%	0.324	S	S	*	.			trans	-78.9	72.3	179.1	-154.3	178.6	-172.8	-178.3	0	109.3
84	M	57.1	Low	79	Confident	119 Å²	119	62.2 Å²	62.2	59%	0.586	32%	0.315	S	S	*	.			trans	-85.8	150.2	172.7	-72.7	-73	177.5	0	0	110.1	C60 V82 C86	C60-M84 PolarHBondContact SG-O 3.07Å; C60-M84 VanDerWaalsContact SG-O 3.41Å; V82-M84 HydrophobicContact CB-CG 4.3Å; V82-M84 HydrophobicContact CG1-CE 4Å; V82-M84 HydrophobicContact CG1-CG 4.02Å; V82-M84 PolarHBondContact O-N 3.25Å; M84-C86 PolarHBondContact O-N 2.94Å
85	L	70.4	Confident	77.7	Confident	167 Å²	167	65.9 Å²	65.9	87%	0.874	34%	0.34	S	S	*	.			trans	-70.5	114.2	161	-81.6	98.8	0	0	0	107.6	P87	L85-P87 WeakPolarHBondContact O-CD 3.45Å
86	C	79.6	Confident	76.2	Confident	25 Å²	25	69 Å²	69	17%	0.169	36%	0.361	C	S	.	.			trans	-78	106.9	172	28.4	0	0	0	0	110	C60 M84 H88	C60-C86 WeakPolarHBondContact CA-SG 3.46Å; C60-C86 HydrophobicContact CB-CB 3.71Å; C60-C86 WeakPolarHBondContact CB-SG 3.18Å; C60-C86 WeakPolarHBondContact SG-CB 3.19Å; C60-C86 CovalentContact SG-SG 2.02Å; C60-C86 PolarHBondContact SG-SG 3.46Å; M84-C86 PolarHBondContact O-N 2.94Å; C86-H88 VanDerWaalsContact C-N 3.34Å; C86-H88 PolarHBondContact O-N 3.24Å
87	P	70.8	Confident	74.6	Confident	78 Å²	78	78.5 Å²	78.5	51%	0.506	40%	0.403	S	S	.	.			trans	-83.7	-8.8	-163.9	33.5	-34.6	0	0	0	113.8	L85	L85-P87 WeakPolarHBondContact O-CD 3.45Å
88	H	83.1	Confident	72.6	Confident	65 Å²	65	82.6 Å²	82.6	30%	0.301	42%	0.424	S	S	.	.			trans	-129.1	142.4	-173.4	-59.5	-42.1	0	0	0	111.2	C86 T90 K92 C106 S107	C86-H88 VanDerWaalsContact C-N 3.34Å; C86-H88 PolarHBondContact O-N 3.24Å; H88-T90 VanDerWaalsContact C-N 3.29Å; H88-T90 WeakPolarHBondContact CB-O 3.42Å; H88-T90 PolarHBondContact O-N 3.49Å; H88-K92 HydrophobicContact CB-CD 4.48Å; H88-C106 CarbonylContact O-C 3.55Å; H88-C106 WeakPolarHBondContact O-CA 3.42Å; H88-S107 PolarHBondContact O-N 2.71Å; H88-S107 PolarHBondContact O-OG 2.97Å
89	E	85.8	Confident	71	Confident	142 Å²	142	89.1 Å²	89.1	66%	0.664	46%	0.459	S	S	*	.	S	Bend	trans	-66.9	-33.1	175.1	-68.2	-176.6	171.7	0	0	112	T108 C111	E89-T108 HydrophobicContact CB-CG2 3.8Å; E89-T108 HydrophobicContact CG-CG2 4.23Å; E89-T108 WeakPolarHBondContact O-CB 3.24Å; E89-T108 WeakPolarHBondContact O-CG2 3.44Å; E89-T108 PolarHBondContact O-N 3.08Å; E89-T108 PolarHBondContact O-OG1 3.23Å; E89-C111 WeakPolarHBondContact O-CB 3.46Å
90	T	88.3	Confident	70.2	Confident	69 Å²	69	93.7 Å²	93.7	42%	0.423	48%	0.483	S	S	.	.	S	Bend	trans	-114.5	154.5	179.4	57.4	0	0	0	0	111.8	H88 K92	H88-T90 VanDerWaalsContact C-N 3.29Å; H88-T90 WeakPolarHBondContact CB-O 3.42Å; H88-T90 PolarHBondContact O-N 3.49Å; T90-K92 PolarHBondContact O-N 3.19Å
91	C	87.8	Confident	69.9	Low	1 Å²	1	96.7 Å²	96.7	1%	0.007	50%	0.496	C	S	.	.			trans	-68.4	99.4	176.7	168.3	0	0	0	0	110.5	C104 C106 C111 N114 S116	C91-C104 HydrophobicContact CB-CB 3.96Å; C91-C104 WeakPolarHBondContact CB-SG 3.43Å; C91-C104 WeakPolarHBondContact SG-CB 3.47Å; C91-C104 CovalentContact SG-SG 2Å; C91-C104 PolarHBondContact SG-SG 2.99Å; C91-C106 HydrophobicContact CB-CB 4.4Å; C91-C111 WeakPolarHBondContact CB-O 3.27Å; C91-N114 WeakPolarHBondContact CB-O 3.48Å; C91-S116 PolarHBondContact O-N 3.13Å
92	K	87.6	Confident	70.3	Confident	80 Å²	80	92.3 Å²	92.3	35%	0.348	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-99.8	134	171.9	-63.9	-175.8	-178.9	-179	0	108.9	H88 T90 Q94 C104	H88-K92 HydrophobicContact CB-CD 4.48Å; T90-K92 PolarHBondContact O-N 3.19Å; K92-Q94 PolarHBondContact O-N 2.84Å; K92-Q94 VanDerWaalsContact O-N 3.16Å; K92-C104 WeakPolarHBondContact O-CB 3.31Å
93	A	78.6	Confident	71.5	Confident	29 Å²	29	90.9 Å²	90.9	24%	0.24	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-56.9	120.2	177.1	0	0	0	0	0	110.4	V102 I115 S116 L117	A93-V102 HydrophobicContact CB-CG1 3.56Å; A93-I115 HydrophobicContact CB-CD1 3.9Å; A93-I115 HydrophobicContact CB-CG1 4.09Å; A93-S116 PolarHBondContact N-O 3.43Å; A93-S116 VanDerWaalsContact N-O 3.08Å; A93-L117 HydrophobicContact CB-CD2 4.12Å
94	Q	67.6	Low	73.1	Confident	67 Å²	67	81.7 Å²	81.7	31%	0.313	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-100.4	137	171.4	-70.1	177.8	-23.7	0	0	108.3	K92 T103	K92-Q94 PolarHBondContact O-N 2.84Å; K92-Q94 VanDerWaalsContact O-N 3.16Å; Q94-T103 PolarHBondContact N-O 3.14Å
95	P	57.1	Low	74.7	Confident	118 Å²	118	76.9 Å²	76.9	77%	0.766	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-65.2	136	167.2	-8.1	22.1	0	0	0	109.1
96	P	53.1	Low	75.6	Confident	83 Å²	83	69 Å²	69	54%	0.539	37%	0.369	S	S	.	.				-135.8	163.8	87	33.7	-18.4	0	0	0	115.8	I98	P96-I98 PolarHBondContact O-N 2.95Å
97	F	54.1	Low	76.1	Confident	199 Å²	199	69.4 Å²	69.4	87%	0.873	37%	0.372	S	S	*	.			trans	-75.2	90.5	179.7	-84.3	-103.4	0	0	0	112
98	I	48.1	Very low	76.9	Confident	95 Å²	95	68 Å²	68	49%	0.487	36%	0.363	S	S	.	.	S	Bend	trans	-117.7	121	145.6	-59.4	175.6	0	0	0	105.2	P96 N100 F101	P96-I98 PolarHBondContact O-N 2.95Å; I98-N100 PolarHBondContact O-N 2.88Å; I98-F101 PolarHBondContact O-N 3.36Å
99	D	58.8	Low	77.3	Confident	138 Å²	138	68.2 Å²	68.2	74%	0.738	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	113.2	-171.4	-77.7	-30.8	0	0	0	111.6
100	N	74.3	Confident	77.7	Confident	96 Å²	96	63.9 Å²	63.9	51%	0.513	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	19.1	175.6	-48.1	-52.1	0	0	0	119.4	R66 I67 I98	R66-N100 CarbonylContact C-O 3.4Å; R66-N100 WeakPolarHBondContact CA-O 3.42Å; I67-N100 HydrophobicContact CB-CB 4.3Å; I67-N100 PolarHBondContact N-O 3.19Å; I98-N100 PolarHBondContact O-N 2.88Å
101	F	78.8	Confident	77.8	Confident	77 Å²	77	61.3 Å²	61.3	34%	0.338	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.6	170.9	-68.4	-92.2	0	0	0	113.9	I64 Y65 R66 D75 I98	I64-F101 HydrophobicContact CG2-CD1 3.96Å; Y65-F101 CarbonylContact O-C 3.4Å; Y65-F101 VanDerWaalsContact O-CA 3.27Å; Y65-F101 WeakPolarHBondContact O-CA 3.47Å; Y65-F101 WeakPolarHBondContact O-CD1 3.43Å; R66-F101 HydrophobicContact CB-CD1 3.92Å; R66-F101 HydrophobicContact CB-CE1 3.68Å; R66-F101 HydrophobicContact CB-CZ 4.35Å; R66-F101 HydrophobicContact CG-CD1 4.12Å; R66-F101 HydrophobicContact CG-CE1 3.69Å; R66-F101 HydrophobicContact CG-CE2 4.39Å; R66-F101 HydrophobicContact CG-CZ 3.84Å; R66-F101 VanDerWaalsContact NE-CZ 3.27Å; D75-F101 HydrophobicContact CB-CE1 4.4Å; I98-F101 PolarHBondContact O-N 3.36Å
102	V	82.7	Confident	78	Confident	21 Å²	21	61.3 Å²	61.3	13%	0.127	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.6	176.7	-174.6	0	0	0	0	109.4	Y65 I67 L72 A93 I115	Y65-V102 PolarHBondContact N-O 2.85Å; Y65-V102 PolarHBondContact O-N 2.87Å; I67-V102 HydrophobicContact CD1-CG2 3.8Å; I67-V102 HydrophobicContact CG1-CG2 4.07Å; L72-V102 HydrophobicContact CD2-CB 4.29Å; L72-V102 HydrophobicContact CD2-CG2 3.84Å; A93-V102 HydrophobicContact CB-CG1 3.56Å; V102-I115 HydrophobicContact CB-CD1 4.4Å; V102-I115 HydrophobicContact CG1-CD1 3.52Å
103	T	85.4	Confident	78.1	Confident	45 Å²	45	64.9 Å²	64.9	28%	0.276	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	160	-179.1	62.8	0	0	0	0	112.3	A63 I64 Q94	A63-T103 VanDerWaalsContact O-CA 3.29Å; A63-T103 WeakPolarHBondContact O-CA 3.29Å; I64-T103 HydrophobicContact CB-CG2 4.44Å; I64-T103 HydrophobicContact CG1-CG2 4.07Å; I64-T103 HydrophobicContact CG2-CG2 4.19Å; Q94-T103 PolarHBondContact N-O 3.14Å
104	C	86.9	Confident	78.6	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.8	171.3	75.6	0	0	0	0	111.7	M62 A63 C91 K92 I115	M62-C104 WeakPolarHBondContact CA-O 3.44Å; A63-C104 PolarHBondContact N-O 2.96Å; A63-C104 VanDerWaalsContact N-O 3.12Å; A63-C104 PolarHBondContact O-N 2.83Å; C91-C104 HydrophobicContact CB-CB 3.96Å; C91-C104 WeakPolarHBondContact CB-SG 3.43Å; C91-C104 WeakPolarHBondContact SG-CB 3.47Å; C91-C104 CovalentContact SG-SG 2Å; C91-C104 PolarHBondContact SG-SG 2.99Å; K92-C104 WeakPolarHBondContact O-CB 3.31Å; C104-I115 HydrophobicContact CB-CD1 4.33Å
105	T	89.3	Confident	79.5	Confident	19 Å²	19	67.8 Å²	67.8	12%	0.117	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.2	167.1	54.8	0	0	0	0	110.4	C61 M62	C61-T105 CarbonylContact O-C 3.58Å; C61-T105 VanDerWaalsContact O-CA 3.3Å; C61-T105 WeakPolarHBondContact O-CA 3.41Å; M62-T105 HydrophobicContact CB-CG2 4.38Å; M62-T105 HydrophobicContact CG-CG2 4.37Å
106	C	89.5	Confident	80.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	161.9	-176.4	56.8	0	0	0	0	113.8	C60 C61 H88 C91 C111 N112	C60-C106 WeakPolarHBondContact CA-O 3.35Å; C61-C106 PolarHBondContact N-O 3.27Å; C61-C106 PolarHBondContact O-N 2.62Å; H88-C106 CarbonylContact O-C 3.55Å; H88-C106 WeakPolarHBondContact O-CA 3.42Å; C91-C106 HydrophobicContact CB-CB 4.4Å; C106-C111 HydrophobicContact CB-CB 3.78Å; C106-C111 WeakPolarHBondContact CB-SG 3.27Å; C106-C111 PolarHBondContact O-SG 3.35Å; C106-C111 WeakPolarHBondContact SG-CB 3.4Å; C106-C111 CovalentContact SG-SG 2.01Å; C106-C111 PolarHBondContact SG-SG 2.85Å; C106-N112 PolarHBondContact SG-N 3.02Å; C106-N112 VanDerWaalsContact SG-N 3.45Å
107	S	89.3	Confident	81.8	Confident	34 Å²	34	66.7 Å²	66.7	24%	0.238	34%	0.344	C	S	.	.			trans	-117.9	14.4	-164.7	64.9	0	0	0	0	115.8	R28 H88	R28-S107 PolarHBondContact NH1-O 2.91Å; R28-S107 PolarHBondContact NH2-O 3.14Å; H88-S107 PolarHBondContact O-N 2.71Å; H88-S107 PolarHBondContact O-OG 2.97Å
108	T	88.9	Confident	82.1	Confident	50 Å²	50	61.1 Å²	61.1	31%	0.307	33%	0.33	S	S	.	.	S	Bend	trans	-113.9	162	172.9	61.6	0	0	0	0	112.1	R28 E89 L110 C111	R28-T108 VanDerWaalsContact NH1-C 3.35Å; E89-T108 HydrophobicContact CB-CG2 3.8Å; E89-T108 HydrophobicContact CG-CG2 4.23Å; E89-T108 WeakPolarHBondContact O-CB 3.24Å; E89-T108 WeakPolarHBondContact O-CG2 3.44Å; E89-T108 PolarHBondContact O-N 3.08Å; E89-T108 PolarHBondContact O-OG1 3.23Å; T108-L110 PolarHBondContact O-N 3.01Å; T108-C111 VanDerWaalsContact O-CB 3.23Å; T108-C111 WeakPolarHBondContact O-CB 3.45Å; T108-C111 PolarHBondContact O-N 3.31Å; T108-C111 PolarHBondContact O-SG 3.25Å; T108-C111 VanDerWaalsContact OG1-CB 3.24Å; T108-C111 WeakPolarHBondContact OG1-CB 3.39Å
109	D	92.1	Very high	82.2	Confident	68 Å²	68	62.4 Å²	62.4	36%	0.364	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	128.8	-178.6	-85.3	7.7	0	0	0	110.9	R28 R29 C111	R28-D109 WeakPolarHBondContact CD-OD1 3.46Å; R28-D109 IonicContact CZ-OD1 3.1Å; R28-D109 IonicContact NE-OD1 2.79Å; R28-D109 VanDerWaalsContact NH1-N 3.19Å; R28-D109 IonicContact NH1-OD1 2.83Å; R28-D109 PolarHBondContact NH1-OD1 2.9Å; R29-D109 HydrophobicContact CB-CB 4.4Å; R29-D109 PolarHBondContact N-OD1 2.89Å; R29-D109 CarbonylContact O-C 3.49Å; R29-D109 WeakPolarHBondContact O-CA 3.45Å; D109-C111 PolarHBondContact O-N 2.89Å
110	L	92.6	Very high	81.2	Confident	52 Å²	52	64.4 Å²	64.4	27%	0.272	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	19.9	179.9	-49.5	174.1	0	0	0	114	R29 V52 T108 N112 R113	R29-L110 HydrophobicContact CB-CD2 4.42Å; R29-L110 PolarHBondContact O-N 2.88Å; V52-L110 HydrophobicContact CG1-CD2 4.06Å; V52-L110 HydrophobicContact CG2-CD2 4Å; T108-L110 PolarHBondContact O-N 3.01Å; L110-N112 PolarHBondContact O-N 3.35Å; L110-N112 VanDerWaalsContact O-N 3.13Å; L110-R113 WeakPolarHBondContact O-CB 3.31Å; L110-R113 PolarHBondContact O-N 3.42Å; L110-R113 VanDerWaalsContact O-N 3.16Å
111	C	91	Very high	79.7	Confident	15 Å²	15	65.9 Å²	65.9	10%	0.101	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-62.7	-21.4	-175.9	65.1	0	0	0	0	114	E89 C91 C106 T108 D109 R113	E89-C111 WeakPolarHBondContact O-CB 3.46Å; C91-C111 WeakPolarHBondContact CB-O 3.27Å; C106-C111 HydrophobicContact CB-CB 3.78Å; C106-C111 WeakPolarHBondContact CB-SG 3.27Å; C106-C111 PolarHBondContact O-SG 3.35Å; C106-C111 WeakPolarHBondContact SG-CB 3.4Å; C106-C111 CovalentContact SG-SG 2.01Å; C106-C111 PolarHBondContact SG-SG 2.85Å; T108-C111 VanDerWaalsContact O-CB 3.23Å; T108-C111 WeakPolarHBondContact O-CB 3.45Å; T108-C111 PolarHBondContact O-N 3.31Å; T108-C111 PolarHBondContact O-SG 3.25Å; T108-C111 VanDerWaalsContact OG1-CB 3.24Å; T108-C111 WeakPolarHBondContact OG1-CB 3.39Å; D109-C111 PolarHBondContact O-N 2.89Å; C111-R113 VanDerWaalsContact C-N 3.26Å; C111-R113 PolarHBondContact O-N 2.61Å
112	N	92.3	Very high	77.4	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-81.5	1.8	-179.7	67.9	-34.6	0	0	0	113.6	A31 C61 M62 A63 L77 C106 L110	A31-N112 VanDerWaalsContact CB-OD1 3.27Å; A31-N112 WeakPolarHBondContact CB-OD1 3.38Å; A31-N112 PolarHBondContact N-OD1 2.96Å; A31-N112 PolarHBondContact O-ND2 3.1Å; C61-N112 HydrophobicContact CB-CB 3.76Å; M62-N112 PolarHBondContact O-ND2 2.94Å; A63-N112 HydrophobicContact CB-CB 4.1Å; L77-N112 VanDerWaalsContact CD2-O 3.26Å; L77-N112 WeakPolarHBondContact CD2-O 3.35Å; C106-N112 PolarHBondContact SG-N 3.02Å; C106-N112 VanDerWaalsContact SG-N 3.45Å; L110-N112 PolarHBondContact O-N 3.35Å; L110-N112 VanDerWaalsContact O-N 3.13Å
113	R	89.8	Confident	75.1	Confident	156 Å²	156	79.3 Å²	79.3	59%	0.589	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-71.9	-33	-178.5	-166.5	170.3	-172.8	166.5	1.5	113.5	A31 Y65 L110 C111	A31-R113 HydrophobicContact CB-CB 4.32Å; Y65-R113 PolarHBondContact OH-O 3.21Å; Y65-R113 VanDerWaalsContact OH-O 3.07Å; L110-R113 WeakPolarHBondContact O-CB 3.31Å; L110-R113 PolarHBondContact O-N 3.42Å; L110-R113 VanDerWaalsContact O-N 3.16Å; C111-R113 VanDerWaalsContact C-N 3.26Å; C111-R113 PolarHBondContact O-N 2.61Å
114	N	87.8	Confident	72.7	Confident	126 Å²	126	82.7 Å²	82.7	67%	0.674	45%	0.449	S	S	*	.	S	Bend	trans	-131.7	137.4	-178.5	-66.5	-22	0	0	0	109.4	C91	C91-N114 WeakPolarHBondContact CB-O 3.48Å
115	I	87	Confident	70.3	Confident	30 Å²	30	88.7 Å²	88.7	15%	0.154	49%	0.488	C	S	.	.			trans	-104.1	132.6	177.1	-169.1	161.8	0	0	0	111	Y65 L72 A93 V102 C104	Y65-I115 HydrophobicContact CD1-CG2 4.46Å; Y65-I115 HydrophobicContact CD2-CB 4.2Å; Y65-I115 HydrophobicContact CD2-CD1 3.86Å; Y65-I115 HydrophobicContact CD2-CG2 4.04Å; Y65-I115 HydrophobicContact CE1-CG2 4.22Å; Y65-I115 HydrophobicContact CE2-CB 3.7Å; Y65-I115 HydrophobicContact CE2-CD1 4.1Å; Y65-I115 HydrophobicContact CE2-CG2 3.79Å; Y65-I115 HydrophobicContact CG-CG2 4.37Å; L72-I115 HydrophobicContact CD1-CG2 3.81Å; A93-I115 HydrophobicContact CB-CD1 3.9Å; A93-I115 HydrophobicContact CB-CG1 4.09Å; V102-I115 HydrophobicContact CB-CD1 4.4Å; V102-I115 HydrophobicContact CG1-CD1 3.52Å; C104-I115 HydrophobicContact CB-CD1 4.33Å
116	S	83.8	Confident	67.6	Low	65 Å²	65	95.8 Å²	95.8	46%	0.455	52%	0.519	S	S	.	.	B	Isolated β-bridge	trans	-94.6	118.5	170	-62.9	0	0	0	0	109.8	C91 A93 S118	C91-S116 PolarHBondContact O-N 3.13Å; A93-S116 PolarHBondContact N-O 3.43Å; A93-S116 VanDerWaalsContact N-O 3.08Å; S116-S118 PolarHBondContact O-N 2.86Å
117	L	75.8	Confident	65.2	Low	114 Å²	114	101.5 Å²	101.5	60%	0.597	56%	0.555	S	S	*	*			trans	-79.5	108.4	168.4	-65.9	166.5	0	0	0	107	L72 A93 P119	L72-L117 HydrophobicContact CD1-CD1 4.09Å; L72-L117 HydrophobicContact CD1-CD2 4.29Å; L72-L117 HydrophobicContact CD1-CG 4.35Å; A93-L117 HydrophobicContact CB-CD2 4.12Å; L117-P119 VanDerWaalsContact O-CD 3.29Å; L117-P119 WeakPolarHBondContact O-CD 3.47Å
118	S	60.3	Low	62.8	Low	82 Å²	82	107.9 Å²	107.9	57%	0.573	58%	0.58	S	S	*	*			trans	-71.5	123.3	176.2	-58	0	0	0	0	109.7	S116	S116-S118 PolarHBondContact O-N 2.86Å
119	P	50	Low	60.7	Low	121 Å²	121	112.5 Å²	112.5	79%	0.786	60%	0.598	S	S	*	*			trans	-70.8	152.5	152.4	-2	21.3	0	0	0	108.9	L117	L117-P119 VanDerWaalsContact O-CD 3.29Å; L117-P119 WeakPolarHBondContact O-CD 3.47Å
120	E	37.2	Very low	58.5	Low	181 Å²	181	118.3 Å²	118.3	85%	0.846	62%	0.623	S	S	*	*	S	Bend	trans	-37.1	145.3	177.8	-157.1	162.4	-171.7	0	0	114.6	E122	E120-E122 PolarHBondContact O-N 3.26Å
121	P	42.8	Very low	56.4	Low	126 Å²	126	121.9 Å²	121.9	82%	0.818	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-74.5	120.2	-166.5	28.1	-32.7	0	0	0	113.5
122	E	31.6	Very low	54.4	Low	191 Å²	191	123.2 Å²	123.2	89%	0.893	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-80.5	130.3	160.2	-79.7	-176.3	158.8	0	0	110.7	E120	E120-E122 PolarHBondContact O-N 3.26Å
123	Q	34.3	Very low	52.6	Low	190 Å²	190	127.9 Å²	127.9	89%	0.888	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-70.8	137.7	172.9	-76.7	176.6	-50.2	0	0	111.6
124	P	35.7	Very low	50.8	Low	115 Å²	115	128.2 Å²	128.2	75%	0.747	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-82.8	150	171.8	31.5	-30.4	0	0	0	112.4
125	P	34.6	Very low	49.4	Very low	127 Å²	127	127.1 Å²	127.1	83%	0.825	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-83.1	141.7	-173.8	32.6	-32.8	0	0	0	113.4
126	E	32.9	Very low	48.2	Very low	168 Å²	168	129.3 Å²	129.3	79%	0.785	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-74.8	132.9	-179.5	-63.9	-175	155	0	0	113.1
127	T	40	Very low	47.2	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	71%	0.705	S	S	*	*			trans	-150.9	71.3	161.2	32.8	0	0	0	0	112.4
128	H	38.7	Very low	46.9	Very low	169 Å²	169	130 Å²	130	78%	0.782	70%	0.7	S	S	*	*			trans	-149.9	63.4	161	-76.7	-61.7	0	0	0	112.3	H130	H128-H130 VanDerWaalsContact C-N 3.32Å; H128-H130 PolarHBondContact O-N 3.45Å
129	H	44.2	Very low	47.9	Very low	146 Å²	146	129.5 Å²	129.5	68%	0.676	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	2.4	-172.6	-114.9	-53.4	0	0	0	116.9
130	H	46.2	Very low	49.4	Very low	190 Å²	190	127.1 Å²	127.1	88%	0.88	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	-2.2	-173.9	-79.6	-76.9	0	0	0	116.8	H128	H128-H130 VanDerWaalsContact C-N 3.32Å; H128-H130 PolarHBondContact O-N 3.45Å
131	I	47.9	Very low	51.8	Low	128 Å²	128	122.3 Å²	122.3	66%	0.656	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-18.6	171.7	-59.7	174.7	0	0	0	111.7	V133 I135	I131-V133 PolarHBondContact O-N 3.01Å; I131-I135 HydrophobicContact CG2-CD1 4.28Å
132	A	50.3	Low	54	Low	43 Å²	43	120.9 Å²	120.9	36%	0.355	65%	0.648	S	S	.	*	H	α-helix	trans	-66.9	-26.9	-172	0	0	0	0	0	115	E134 T136	A132-E134 PolarHBondContact O-N 2.82Å; A132-T136 VanDerWaalsContact O-CB 3.29Å; A132-T136 WeakPolarHBondContact O-CB 3.46Å; A132-T136 PolarHBondContact O-N 2.53Å; A132-T136 PolarHBondContact O-OG1 3.38Å
133	V	53.3	Low	56.8	Low	97 Å²	97	116.2 Å²	116.2	59%	0.588	63%	0.629	S	S	*	*	H	α-helix	trans	-69.3	-35.9	-167.9	-179.7	0	0	0	0	113	I131 Q137	I131-V133 PolarHBondContact O-N 3.01Å; V133-Q137 PolarHBondContact O-N 3.21Å
134	E	52.1	Low	59.6	Low	164 Å²	164	111.6 Å²	111.6	77%	0.766	61%	0.61	S	S	*	*	H	α-helix	trans	-79.7	-36.2	179.7	-67.4	-165.2	162.2	0	0	112.8	A132 A138	A132-E134 PolarHBondContact O-N 2.82Å; E134-A138 PolarHBondContact O-N 3.15Å
135	I	58.8	Low	62.3	Low	103 Å²	103	111 Å²	111	53%	0.528	60%	0.6	S	S	.	*	H	α-helix	trans	-69.5	-37.5	176.4	-59.6	175.8	0	0	0	110.4	I131 Q137 A138 V139	I131-I135 HydrophobicContact CG2-CD1 4.28Å; I135-Q137 VanDerWaalsContact C-N 3.33Å; I135-Q137 PolarHBondContact O-N 2.78Å; I135-A138 PolarHBondContact O-N 3.49Å; I135-V139 HydrophobicContact CG2-CG2 4.1Å; I135-V139 WeakPolarHBondContact O-CB 3.2Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.5Å; I135-V139 PolarHBondContact O-N 2.78Å
136	T	61.3	Low	65	Low	76 Å²	76	110.7 Å²	110.7	47%	0.466	59%	0.586	S	S	.	*	H	α-helix	trans	-63.5	-38.7	179.5	-51.7	0	0	0	0	111.4	A132 V139 V140	A132-T136 VanDerWaalsContact O-CB 3.29Å; A132-T136 WeakPolarHBondContact O-CB 3.46Å; A132-T136 PolarHBondContact O-N 2.53Å; A132-T136 PolarHBondContact O-OG1 3.38Å; T136-V139 PolarHBondContact O-N 3.42Å; T136-V140 HydrophobicContact CG2-CG2 4.39Å; T136-V140 WeakPolarHBondContact O-CB 3.2Å; T136-V140 WeakPolarHBondContact O-CG2 3.43Å; T136-V140 PolarHBondContact O-N 3.13Å
137	Q	62.5	Low	67.9	Low	133 Å²	133	107.3 Å²	107.3	62%	0.621	57%	0.572	S	S	*	*	H	α-helix	trans	-66.4	-43.1	176.9	-72	-176.6	-8.5	0	0	112.1	V133 I135 V140 V141	V133-Q137 PolarHBondContact O-N 3.21Å; I135-Q137 VanDerWaalsContact C-N 3.33Å; I135-Q137 PolarHBondContact O-N 2.78Å; Q137-V140 PolarHBondContact O-N 3.27Å; Q137-V141 VanDerWaalsContact O-CG2 3.29Å; Q137-V141 WeakPolarHBondContact O-CG2 3.49Å; Q137-V141 PolarHBondContact O-N 3.44Å
138	A	71.1	Confident	70.3	Confident	59 Å²	59	104.8 Å²	104.8	49%	0.488	56%	0.557	S	S	.	*	H	α-helix	trans	-64.2	-42.2	177	0	0	0	0	0	112	E134 I135 V141 V142	E134-A138 PolarHBondContact O-N 3.15Å; I135-A138 PolarHBondContact O-N 3.49Å; A138-V141 PolarHBondContact O-N 3.28Å; A138-V142 VanDerWaalsContact O-CG2 3.32Å; A138-V142 WeakPolarHBondContact O-CG2 3.17Å; A138-V142 PolarHBondContact O-N 2.96Å
139	V	80.6	Confident	72.9	Confident	73 Å²	73	100.5 Å²	100.5	44%	0.442	54%	0.542	S	S	.	.	H	α-helix	trans	-65.6	-41.6	178.1	172.3	0	0	0	0	111.3	I135 T136 V141 V142 L143	I135-V139 HydrophobicContact CG2-CG2 4.1Å; I135-V139 WeakPolarHBondContact O-CB 3.2Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.5Å; I135-V139 PolarHBondContact O-N 2.78Å; T136-V139 PolarHBondContact O-N 3.42Å; V139-V141 VanDerWaalsContact C-N 3.34Å; V139-V141 PolarHBondContact O-N 3.42Å; V139-V142 PolarHBondContact O-N 3.44Å; V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.3Å; V139-L143 WeakPolarHBondContact O-CB 2.85Å; V139-L143 VanDerWaalsContact O-CG 3.28Å; V139-L143 WeakPolarHBondContact O-CG 3.21Å; V139-L143 PolarHBondContact O-N 2.75Å
140	V	82.6	Confident	75.2	Confident	70 Å²	70	97.1 Å²	97.1	42%	0.424	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-41.1	176.1	169.9	0	0	0	0	111	T136 Q137 L143 I144	T136-V140 HydrophobicContact CG2-CG2 4.39Å; T136-V140 WeakPolarHBondContact O-CB 3.2Å; T136-V140 WeakPolarHBondContact O-CG2 3.43Å; T136-V140 PolarHBondContact O-N 3.13Å; Q137-V140 PolarHBondContact O-N 3.27Å; V140-L143 PolarHBondContact O-N 2.88Å; V140-I144 HydrophobicContact CG1-CD1 3.7Å; V140-I144 HydrophobicContact CG1-CG1 4.39Å; V140-I144 WeakPolarHBondContact O-CB 3.37Å; V140-I144 WeakPolarHBondContact O-CD1 3.37Å; V140-I144 WeakPolarHBondContact O-CG1 3.24Å; V140-I144 PolarHBondContact O-N 3.37Å
141	V	86.3	Confident	77.3	Confident	81 Å²	81	93 Å²	93	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-43.1	175.8	172.2	0	0	0	0	111.2	Q137 A138 V139 I144 L145	Q137-V141 VanDerWaalsContact O-CG2 3.29Å; Q137-V141 WeakPolarHBondContact O-CG2 3.49Å; Q137-V141 PolarHBondContact O-N 3.44Å; A138-V141 PolarHBondContact O-N 3.28Å; V139-V141 VanDerWaalsContact C-N 3.34Å; V139-V141 PolarHBondContact O-N 3.42Å; V141-I144 PolarHBondContact O-N 3.3Å; V141-L145 HydrophobicContact CG1-CD1 3.95Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 WeakPolarHBondContact O-CB 3.36Å; V141-L145 VanDerWaalsContact O-CG 3.26Å; V141-L145 WeakPolarHBondContact O-CG 3.36Å; V141-L145 PolarHBondContact O-N 3.39Å
142	V	89.6	Confident	79.5	Confident	95 Å²	95	91 Å²	91	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-64.3	-40.8	176.4	172	0	0	0	0	111.5	A138 V139 L145 F146	A138-V142 VanDerWaalsContact O-CG2 3.32Å; A138-V142 WeakPolarHBondContact O-CG2 3.17Å; A138-V142 PolarHBondContact O-N 2.96Å; V139-V142 PolarHBondContact O-N 3.44Å; V142-L145 PolarHBondContact O-N 3.3Å; V142-F146 VanDerWaalsContact O-CB 3.3Å; V142-F146 WeakPolarHBondContact O-CB 3.5Å; V142-F146 PolarHBondContact O-N 3.02Å
143	L	90.3	Very high	81.3	Confident	93 Å²	93	93 Å²	93	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-39.5	176.4	-74.6	170.1	0	0	0	112	V139 V140 F146 L147	V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.3Å; V139-L143 WeakPolarHBondContact O-CB 2.85Å; V139-L143 VanDerWaalsContact O-CG 3.28Å; V139-L143 WeakPolarHBondContact O-CG 3.21Å; V139-L143 PolarHBondContact O-N 2.75Å; V140-L143 PolarHBondContact O-N 2.88Å; L143-F146 PolarHBondContact O-N 3.32Å; L143-L147 WeakPolarHBondContact O-CB 3.15Å; L143-L147 VanDerWaalsContact O-CG 3.29Å; L143-L147 WeakPolarHBondContact O-CG 3.3Å; L143-L147 PolarHBondContact O-N 3.05Å
144	I	92.1	Very high	82.7	Confident	94 Å²	94	90.6 Å²	90.6	48%	0.482	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-42.3	174.4	-69.1	166.5	0	0	0	110.4	V140 V141 F146 L147 T148	V140-I144 HydrophobicContact CG1-CD1 3.7Å; V140-I144 HydrophobicContact CG1-CG1 4.39Å; V140-I144 WeakPolarHBondContact O-CB 3.37Å; V140-I144 WeakPolarHBondContact O-CD1 3.37Å; V140-I144 WeakPolarHBondContact O-CG1 3.24Å; V140-I144 PolarHBondContact O-N 3.37Å; V141-I144 PolarHBondContact O-N 3.3Å; I144-F146 VanDerWaalsContact C-N 3.34Å; I144-F146 PolarHBondContact O-N 3.45Å; I144-L147 PolarHBondContact O-N 3.17Å; I144-T148 HydrophobicContact CG2-CG2 4.43Å; I144-T148 WeakPolarHBondContact O-CB 3.36Å; I144-T148 VanDerWaalsContact O-CG2 3.26Å; I144-T148 WeakPolarHBondContact O-CG2 3.26Å; I144-T148 PolarHBondContact O-N 3.03Å; I144-T148 PolarHBondContact O-OG1 3.12Å
145	L	92.4	Very high	84.4	Confident	102 Å²	102	86.4 Å²	86.4	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-40.9	175.1	-72.2	169.8	0	0	0	111.4	V141 V142 T148 V149	V141-L145 HydrophobicContact CG1-CD1 3.95Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 WeakPolarHBondContact O-CB 3.36Å; V141-L145 VanDerWaalsContact O-CG 3.26Å; V141-L145 WeakPolarHBondContact O-CG 3.36Å; V141-L145 PolarHBondContact O-N 3.39Å; V142-L145 PolarHBondContact O-N 3.3Å; L145-T148 WeakPolarHBondContact CA-OG1 3.4Å; L145-T148 PolarHBondContact O-N 2.89Å; L145-T148 PolarHBondContact O-OG1 3.45Å; L145-V149 VanDerWaalsContact O-CG2 3.3Å; L145-V149 WeakPolarHBondContact O-CG2 3.29Å; L145-V149 PolarHBondContact O-N 3.26Å
146	F	92.5	Very high	85.6	Confident	121 Å²	121	88.3 Å²	88.3	53%	0.531	49%	0.49	S	S	.	.	H	α-helix	trans	-65.2	-45.1	175.9	-175.4	-107.4	0	0	0	111.9	V142 L143 I144 T148 V149 L150	V142-F146 VanDerWaalsContact O-CB 3.3Å; V142-F146 WeakPolarHBondContact O-CB 3.5Å; V142-F146 PolarHBondContact O-N 3.02Å; L143-F146 PolarHBondContact O-N 3.32Å; I144-F146 VanDerWaalsContact C-N 3.34Å; I144-F146 PolarHBondContact O-N 3.45Å; F146-T148 VanDerWaalsContact C-N 3.35Å; F146-T148 PolarHBondContact O-N 3.39Å; F146-V149 PolarHBondContact O-N 3.36Å; F146-L150 HydrophobicContact CD1-CD1 3.81Å; F146-L150 HydrophobicContact CD1-CG 4.29Å; F146-L150 HydrophobicContact CE1-CD1 3.39Å; F146-L150 HydrophobicContact CE1-CG 4.02Å; F146-L150 HydrophobicContact CZ-CD1 3.95Å; F146-L150 HydrophobicContact CZ-CD2 4.27Å; F146-L150 HydrophobicContact CZ-CG 4.18Å; F146-L150 WeakPolarHBondContact O-CG 3.32Å; F146-L150 PolarHBondContact O-N 3.12Å
147	L	93.1	Very high	86.3	Confident	97 Å²	97	93 Å²	93	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-39.7	175.7	-77.5	166.4	0	0	0	112.1	L143 I144 L150 I151	L143-L147 WeakPolarHBondContact O-CB 3.15Å; L143-L147 VanDerWaalsContact O-CG 3.29Å; L143-L147 WeakPolarHBondContact O-CG 3.3Å; L143-L147 PolarHBondContact O-N 3.05Å; I144-L147 PolarHBondContact O-N 3.17Å; L147-L150 PolarHBondContact O-N 2.84Å; L147-I151 WeakPolarHBondContact O-CB 3.48Å; L147-I151 WeakPolarHBondContact O-CD1 3.42Å; L147-I151 WeakPolarHBondContact O-CG1 3.38Å; L147-I151 PolarHBondContact O-N 3.16Å
148	T	90.4	Very high	87	Confident	66 Å²	66	96.1 Å²	96.1	41%	0.405	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-38.4	175.9	53.1	0	0	0	0	111.5	I144 L145 F146 I151 V152	I144-T148 HydrophobicContact CG2-CG2 4.43Å; I144-T148 WeakPolarHBondContact O-CB 3.36Å; I144-T148 VanDerWaalsContact O-CG2 3.26Å; I144-T148 WeakPolarHBondContact O-CG2 3.26Å; I144-T148 PolarHBondContact O-N 3.03Å; I144-T148 PolarHBondContact O-OG1 3.12Å; L145-T148 WeakPolarHBondContact CA-OG1 3.4Å; L145-T148 PolarHBondContact O-N 2.89Å; L145-T148 PolarHBondContact O-OG1 3.45Å; F146-T148 VanDerWaalsContact C-N 3.35Å; F146-T148 PolarHBondContact O-N 3.39Å; T148-I151 PolarHBondContact O-N 2.79Å; T148-V152 WeakPolarHBondContact O-CB 3.44Å; T148-V152 VanDerWaalsContact O-CG2 3.23Å; T148-V152 WeakPolarHBondContact O-CG2 3.42Å; T148-V152 PolarHBondContact O-N 3Å
149	V	93.3	Very high	87.3	Confident	79 Å²	79	99.6 Å²	99.6	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-45.3	171.5	170.2	0	0	0	0	111.2	L145 F146 I151 V152 I153	L145-V149 VanDerWaalsContact O-CG2 3.3Å; L145-V149 WeakPolarHBondContact O-CG2 3.29Å; L145-V149 PolarHBondContact O-N 3.26Å; F146-V149 PolarHBondContact O-N 3.36Å; V149-I151 VanDerWaalsContact C-N 3.33Å; V149-I151 PolarHBondContact O-N 2.94Å; V149-V152 PolarHBondContact O-N 2.86Å; V149-I153 HydrophobicContact CG1-CD1 3.72Å; V149-I153 HydrophobicContact CG1-CG1 4.35Å; V149-I153 WeakPolarHBondContact O-CB 3.27Å; V149-I153 VanDerWaalsContact O-CG1 3.26Å; V149-I153 WeakPolarHBondContact O-CG1 3.49Å; V149-I153 PolarHBondContact O-N 3.34Å
150	L	91.8	Very high	87	Confident	76 Å²	76	101.3 Å²	101.3	40%	0.398	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-39.7	175.8	-72.6	-179.2	0	0	0	112.2	F146 L147 I153 A154	F146-L150 HydrophobicContact CD1-CD1 3.81Å; F146-L150 HydrophobicContact CD1-CG 4.29Å; F146-L150 HydrophobicContact CE1-CD1 3.39Å; F146-L150 HydrophobicContact CE1-CG 4.02Å; F146-L150 HydrophobicContact CZ-CD1 3.95Å; F146-L150 HydrophobicContact CZ-CD2 4.27Å; F146-L150 HydrophobicContact CZ-CG 4.18Å; F146-L150 WeakPolarHBondContact O-CG 3.32Å; F146-L150 PolarHBondContact O-N 3.12Å; L147-L150 PolarHBondContact O-N 2.84Å; L150-I153 PolarHBondContact O-N 3.15Å; L150-A154 WeakPolarHBondContact O-CB 3.48Å; L150-A154 PolarHBondContact O-N 3.35Å
151	I	92.1	Very high	86.3	Confident	102 Å²	102	101 Å²	101	52%	0.523	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-41.6	175	-70	164.3	0	0	0	110.3	L147 T148 V149 A154 V155	L147-I151 WeakPolarHBondContact O-CB 3.48Å; L147-I151 WeakPolarHBondContact O-CD1 3.42Å; L147-I151 WeakPolarHBondContact O-CG1 3.38Å; L147-I151 PolarHBondContact O-N 3.16Å; T148-I151 PolarHBondContact O-N 2.79Å; V149-I151 VanDerWaalsContact C-N 3.33Å; V149-I151 PolarHBondContact O-N 2.94Å; I151-A154 PolarHBondContact O-N 3.37Å; I151-V155 HydrophobicContact CG2-CG2 4.23Å; I151-V155 WeakPolarHBondContact O-CB 3.02Å; I151-V155 VanDerWaalsContact O-CG2 3.22Å; I151-V155 WeakPolarHBondContact O-CG2 3.38Å; I151-V155 PolarHBondContact O-N 3.19Å
152	V	92.3	Very high	85.5	Confident	87 Å²	87	103.3 Å²	103.3	53%	0.527	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-41.5	176.3	169.1	0	0	0	0	110.9	T148 V149 V155 K156	T148-V152 WeakPolarHBondContact O-CB 3.44Å; T148-V152 VanDerWaalsContact O-CG2 3.23Å; T148-V152 WeakPolarHBondContact O-CG2 3.42Å; T148-V152 PolarHBondContact O-N 3Å; V149-V152 PolarHBondContact O-N 2.86Å; V152-V155 PolarHBondContact O-N 2.69Å; V152-K156 VanDerWaalsContact O-CB 3.3Å; V152-K156 WeakPolarHBondContact O-CB 3.42Å; V152-K156 PolarHBondContact O-N 2.83Å
153	I	89.1	Confident	84.6	Confident	84 Å²	84	104.1 Å²	104.1	43%	0.431	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-46	173.1	-68.7	166.9	0	0	0	109.7	V149 L150 V155 K156 W157	V149-I153 HydrophobicContact CG1-CD1 3.72Å; V149-I153 HydrophobicContact CG1-CG1 4.35Å; V149-I153 WeakPolarHBondContact O-CB 3.27Å; V149-I153 VanDerWaalsContact O-CG1 3.26Å; V149-I153 WeakPolarHBondContact O-CG1 3.49Å; V149-I153 PolarHBondContact O-N 3.34Å; L150-I153 PolarHBondContact O-N 3.15Å; I153-V155 VanDerWaalsContact C-N 3.35Å; I153-V155 PolarHBondContact O-N 3.27Å; I153-K156 PolarHBondContact O-N 3.21Å; I153-W157 HydrophobicContact CG2-CE3 4.48Å; I153-W157 WeakPolarHBondContact O-CB 3.39Å; I153-W157 PolarHBondContact O-N 2.87Å
154	A	82.1	Confident	82.9	Confident	48 Å²	48	106.6 Å²	106.6	40%	0.397	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-35.2	178.8	0	0	0	0	0	112.4	L150 I151 R158	L150-A154 WeakPolarHBondContact O-CB 3.48Å; L150-A154 PolarHBondContact O-N 3.35Å; I151-A154 PolarHBondContact O-N 3.37Å; A154-R158 VanDerWaalsContact O-CB 3.24Å; A154-R158 WeakPolarHBondContact O-CB 3.16Å; A154-R158 VanDerWaalsContact O-CG 3.25Å; A154-R158 WeakPolarHBondContact O-CG 3.28Å; A154-R158 PolarHBondContact O-N 2.57Å
155	V	88.4	Confident	80.9	Confident	76 Å²	76	108.9 Å²	108.9	46%	0.461	53%	0.53	S	S	.	.	H	α-helix	trans	-74.8	-39.8	175.1	171.9	0	0	0	0	111	I151 V152 I153 R158 K159	I151-V155 HydrophobicContact CG2-CG2 4.23Å; I151-V155 WeakPolarHBondContact O-CB 3.02Å; I151-V155 VanDerWaalsContact O-CG2 3.22Å; I151-V155 WeakPolarHBondContact O-CG2 3.38Å; I151-V155 PolarHBondContact O-N 3.19Å; V152-V155 PolarHBondContact O-N 2.69Å; I153-V155 VanDerWaalsContact C-N 3.35Å; I153-V155 PolarHBondContact O-N 3.27Å; V155-R158 PolarHBondContact O-N 3.46Å; V155-K159 WeakPolarHBondContact O-CB 3.35Å; V155-K159 PolarHBondContact O-N 2.97Å
156	K	84.4	Confident	79	Confident	142 Å²	142	109.3 Å²	109.3	62%	0.617	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-43	171	-95.7	-172.9	167.5	-177.4	0	111	V152 I153 K159 L160	V152-K156 VanDerWaalsContact O-CB 3.3Å; V152-K156 WeakPolarHBondContact O-CB 3.42Å; V152-K156 PolarHBondContact O-N 2.83Å; I153-K156 PolarHBondContact O-N 3.21Å; K156-K159 CarbonylContact O-C 3.58Å; K156-K159 PolarHBondContact O-N 3.37Å; K156-L160 VanDerWaalsContact O-CB 3.31Å; K156-L160 WeakPolarHBondContact O-CB 3.29Å; K156-L160 VanDerWaalsContact O-CG 3.23Å; K156-L160 WeakPolarHBondContact O-CG 3.37Å; K156-L160 PolarHBondContact O-N 3.41Å
157	W	75.6	Confident	76.6	Confident	175 Å²	175	111 Å²	111	66%	0.663	53%	0.533	S	S	*	.	H	α-helix	trans	-65.2	-44.7	175.5	-162.5	-36.9	0	0	0	109.9	I153 K159 L160 C161	I153-W157 HydrophobicContact CG2-CE3 4.48Å; I153-W157 WeakPolarHBondContact O-CB 3.39Å; I153-W157 PolarHBondContact O-N 2.87Å; W157-K159 VanDerWaalsContact C-N 3.32Å; W157-K159 PolarHBondContact O-N 3.25Å; W157-L160 CarbonylContact O-C 3.48Å; W157-L160 PolarHBondContact O-N 3.11Å; W157-C161 PolarHBondContact NE1-SG 2.84Å; W157-C161 VanDerWaalsContact O-CB 3.25Å; W157-C161 WeakPolarHBondContact O-CB 3.47Å; W157-C161 PolarHBondContact O-N 2.98Å
158	R	77.1	Confident	74.3	Confident	199 Å²	199	111.3 Å²	111.3	75%	0.751	54%	0.535	S	S	*	.	H	α-helix	trans	-62.1	-38	173.7	-80.9	-177	179.7	-172.8	2	112.2	A154 V155 K162	A154-R158 VanDerWaalsContact O-CB 3.24Å; A154-R158 WeakPolarHBondContact O-CB 3.16Å; A154-R158 VanDerWaalsContact O-CG 3.25Å; A154-R158 WeakPolarHBondContact O-CG 3.28Å; A154-R158 PolarHBondContact O-N 2.57Å; V155-R158 PolarHBondContact O-N 3.46Å; R158-K162 WeakPolarHBondContact O-CB 3.32Å; R158-K162 PolarHBondContact O-N 3.33Å
159	K	76.6	Confident	71.8	Confident	131 Å²	131	114.6 Å²	114.6	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-67.1	-46	172.9	-87.8	-170	172.8	-172.4	0	111.6	V155 K156 W157 C161 K162 E163	V155-K159 WeakPolarHBondContact O-CB 3.35Å; V155-K159 PolarHBondContact O-N 2.97Å; K156-K159 CarbonylContact O-C 3.58Å; K156-K159 PolarHBondContact O-N 3.37Å; W157-K159 VanDerWaalsContact C-N 3.32Å; W157-K159 PolarHBondContact O-N 3.25Å; K159-C161 VanDerWaalsContact C-N 3.35Å; K159-C161 PolarHBondContact O-N 2.8Å; K159-K162 CarbonylContact O-C 3.59Å; K159-K162 PolarHBondContact O-N 2.93Å; K159-K162 VanDerWaalsContact O-N 3.11Å; K159-E163 VanDerWaalsContact O-CB 3.31Å; K159-E163 WeakPolarHBondContact O-CB 3.41Å; K159-E163 WeakPolarHBondContact O-CG 3.49Å; K159-E163 PolarHBondContact O-N 3.47Å
160	L	74.6	Confident	69	Low	110 Å²	110	114.5 Å²	114.5	58%	0.576	55%	0.549	S	S	*	.	H	α-helix	trans	-63.5	-38.5	175.7	-73.9	167.5	0	0	0	111.7	K156 W157 K164	K156-L160 VanDerWaalsContact O-CB 3.31Å; K156-L160 WeakPolarHBondContact O-CB 3.29Å; K156-L160 VanDerWaalsContact O-CG 3.23Å; K156-L160 WeakPolarHBondContact O-CG 3.37Å; K156-L160 PolarHBondContact O-N 3.41Å; W157-L160 CarbonylContact O-C 3.48Å; W157-L160 PolarHBondContact O-N 3.11Å; L160-K164 WeakPolarHBondContact O-CA 3.32Å; L160-K164 WeakPolarHBondContact O-CB 3.4Å; L160-K164 PolarHBondContact O-N 3.12Å
161	C	68	Low	66.3	Low	64 Å²	64	114.1 Å²	114.1	43%	0.432	55%	0.55	S	S	.	.	H	α-helix	trans	-71.1	-32.3	172.8	-83.8	0	0	0	0	111.8	W157 K159 K165	W157-C161 PolarHBondContact NE1-SG 2.84Å; W157-C161 VanDerWaalsContact O-CB 3.25Å; W157-C161 WeakPolarHBondContact O-CB 3.47Å; W157-C161 PolarHBondContact O-N 2.98Å; K159-C161 VanDerWaalsContact C-N 3.35Å; K159-C161 PolarHBondContact O-N 2.8Å; C161-K165 WeakPolarHBondContact O-CB 3.44Å; C161-K165 PolarHBondContact O-N 3.45Å
162	K	69.3	Low	63.8	Low	128 Å²	128	113.6 Å²	113.6	56%	0.557	55%	0.554	S	S	*	*	H	α-helix	trans	-75.7	-40.4	176.2	-166.7	-179.7	179.3	-168.4	0	111.4	R158 K159 K165 E166	R158-K162 WeakPolarHBondContact O-CB 3.32Å; R158-K162 PolarHBondContact O-N 3.33Å; K159-K162 CarbonylContact O-C 3.59Å; K159-K162 PolarHBondContact O-N 2.93Å; K159-K162 VanDerWaalsContact O-N 3.11Å; K162-K165 CarbonylContact O-C 3.3Å; K162-K165 PolarHBondContact O-N 3.18Å; K162-E166 WeakPolarHBondContact CE-OE1 3.22Å; K162-E166 WeakPolarHBondContact O-CB 3.31Å; K162-E166 WeakPolarHBondContact O-CG 3.38Å; K162-E166 PolarHBondContact O-N 3.23Å
163	E	70.6	Confident	61	Low	113 Å²	113	116.8 Å²	116.8	53%	0.528	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-38.9	170.9	-74.1	169.4	-175	0	0	110.6	K159 K165 E166 Y167	K159-E163 VanDerWaalsContact O-CB 3.31Å; K159-E163 WeakPolarHBondContact O-CB 3.41Å; K159-E163 WeakPolarHBondContact O-CG 3.49Å; K159-E163 PolarHBondContact O-N 3.47Å; E163-K165 VanDerWaalsContact C-N 3.34Å; E163-E166 PolarHBondContact O-N 3.08Å; E163-Y167 WeakPolarHBondContact O-CB 3.5Å; E163-Y167 PolarHBondContact O-N 3.31Å
164	K	56	Low	58.3	Low	144 Å²	144	120 Å²	120	63%	0.626	58%	0.581	S	S	*	*	H	α-helix	trans	-68.6	-32.2	171.5	-165.1	176.7	-174.1	-176.3	0	111.6	L160 L168	L160-K164 WeakPolarHBondContact O-CA 3.32Å; L160-K164 WeakPolarHBondContact O-CB 3.4Å; L160-K164 PolarHBondContact O-N 3.12Å; K164-L168 VanDerWaalsContact O-CB 3.28Å; K164-L168 WeakPolarHBondContact O-CB 3.46Å; K164-L168 PolarHBondContact O-N 3.01Å
165	K	49.3	Very low	55.8	Low	142 Å²	142	127.6 Å²	127.6	62%	0.617	60%	0.601	S	S	*	*	H	α-helix	trans	-75.4	-36.1	174.5	-169.8	175	-175.3	177	0	112.1	C161 K162 E163 Q169	C161-K165 WeakPolarHBondContact O-CB 3.44Å; C161-K165 PolarHBondContact O-N 3.45Å; K162-K165 CarbonylContact O-C 3.3Å; K162-K165 PolarHBondContact O-N 3.18Å; E163-K165 VanDerWaalsContact C-N 3.34Å; K165-Q169 WeakPolarHBondContact O-CB 3.21Å; K165-Q169 PolarHBondContact O-N 3.4Å
166	E	51.4	Low	53	Low	112 Å²	112	130.6 Å²	130.6	52%	0.523	62%	0.615	S	S	.	*	H	α-helix	trans	-75.6	-32.5	173.6	-76.7	170	-172.7	0	0	111.4	K162 E163 Q169 S170	K162-E166 WeakPolarHBondContact CE-OE1 3.22Å; K162-E166 WeakPolarHBondContact O-CB 3.31Å; K162-E166 WeakPolarHBondContact O-CG 3.38Å; K162-E166 PolarHBondContact O-N 3.23Å; E163-E166 PolarHBondContact O-N 3.08Å; E166-Q169 PolarHBondContact O-N 2.97Å; E166-S170 WeakPolarHBondContact O-CB 3.49Å; E166-S170 PolarHBondContact O-N 3.35Å
167	Y	43.8	Very low	50.9	Low	156 Å²	156	131.2 Å²	131.2	61%	0.612	62%	0.623	S	S	*	*	H	α-helix	trans	-70.4	-42.2	168.7	-179.3	-100.7	0	0	0	111.8	E163 Q169 S170 T171	E163-Y167 WeakPolarHBondContact O-CB 3.5Å; E163-Y167 PolarHBondContact O-N 3.31Å; Y167-Q169 VanDerWaalsContact C-N 3.32Å; Y167-S170 PolarHBondContact O-N 3.21Å; Y167-S170 PolarHBondContact O-OG 3Å; Y167-T171 VanDerWaalsContact O-CB 3.22Å; Y167-T171 WeakPolarHBondContact O-CB 3.32Å; Y167-T171 PolarHBondContact O-N 3.45Å; Y167-T171 PolarHBondContact O-OG1 3.31Å
168	L	43.2	Very low	48.9	Very low	103 Å²	103	130.9 Å²	130.9	54%	0.539	63%	0.629	S	S	.	*	H	α-helix	trans	-61.3	-45.3	170	-126.3	71	0	0	0	109.4	K164 S170 T171 C172	K164-L168 VanDerWaalsContact O-CB 3.28Å; K164-L168 WeakPolarHBondContact O-CB 3.46Å; K164-L168 PolarHBondContact O-N 3.01Å; L168-S170 PolarHBondContact O-N 2.89Å; L168-T171 CarbonylContact O-C 3.38Å; L168-T171 PolarHBondContact O-N 3.23Å; L168-T171 VanDerWaalsContact O-N 3.11Å; L168-C172 VanDerWaalsContact O-CB 3.26Å; L168-C172 WeakPolarHBondContact O-CB 3.2Å; L168-C172 PolarHBondContact O-N 3.05Å; L168-C172 PolarHBondContact O-SG 3.01Å
169	Q	39.2	Very low	47.4	Very low	135 Å²	135	129.1 Å²	129.1	63%	0.631	63%	0.629	S	S	*	*	H	α-helix	trans	-71.7	-26.8	-176.9	-164.1	142.3	0.1	0	0	113.6	K165 E166 Y167	K165-Q169 WeakPolarHBondContact O-CB 3.21Å; K165-Q169 PolarHBondContact O-N 3.4Å; E166-Q169 PolarHBondContact O-N 2.97Å; Y167-Q169 VanDerWaalsContact C-N 3.32Å
170	S	33.8	Very low	45.2	Very low	78 Å²	78	129.3 Å²	129.3	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-82.7	-19.3	169	87.8	0	0	0	0	113.3	E166 Y167 L168	E166-S170 WeakPolarHBondContact O-CB 3.49Å; E166-S170 PolarHBondContact O-N 3.35Å; Y167-S170 PolarHBondContact O-N 3.21Å; Y167-S170 PolarHBondContact O-OG 3Å; L168-S170 PolarHBondContact O-N 2.89Å
171	T	35.7	Very low	43.8	Very low	68 Å²	68	127.4 Å²	127.4	42%	0.417	64%	0.637	S	S	.	*	H	α-helix	trans	-94.7	-6.5	174	-42.9	0	0	0	0	111.8	Y167 L168	Y167-T171 VanDerWaalsContact O-CB 3.22Å; Y167-T171 WeakPolarHBondContact O-CB 3.32Å; Y167-T171 PolarHBondContact O-N 3.45Å; Y167-T171 PolarHBondContact O-OG1 3.31Å; L168-T171 CarbonylContact O-C 3.38Å; L168-T171 PolarHBondContact O-N 3.23Å; L168-T171 VanDerWaalsContact O-N 3.11Å
172	C	39.2	Very low	42.3	Very low	90 Å²	90	129.8 Å²	129.8	61%	0.608	65%	0.654	S	S	*	*	S	Bend	trans	-96.1	7.3	171.1	-64.9	0	0	0	0	113.2	L168	L168-C172 VanDerWaalsContact O-CB 3.26Å; L168-C172 WeakPolarHBondContact O-CB 3.2Å; L168-C172 PolarHBondContact O-N 3.05Å; L168-C172 PolarHBondContact O-SG 3.01Å
173	Q	34.4	Very low	40.7	Very low	155 Å²	155	128.6 Å²	128.6	72%	0.724	66%	0.661	S	S	*	*	S	Bend	trans	-105.9	95	159.4	-80.2	-175.2	-40.4	0	0	106.8
174	D	30.7	Very low	39	Very low	152 Å²	152	131.3 Å²	131.3	81%	0.813	67%	0.673	S	S	*	*			trans	128.6	18.6	171	-69.8	-15	0	0	0	115.9	N176	D174-N176 PolarHBondContact O-N 3.34Å
175	Y	31.4	Very low	38.4	Very low	207 Å²	207	130.7 Å²	130.7	81%	0.812	68%	0.675	S	S	*	*			trans	-76.6	80	141.3	-88.5	-86.9	0	0	0	108	I177	Y175-I177 VanDerWaalsContact C-N 3.3Å; Y175-I177 PolarHBondContact O-N 3.38Å
176	N	29.5	Very low	37.5	Very low	139 Å²	139	132.3 Å²	132.3	74%	0.743	68%	0.682	S	S	*	*			trans	-49.3	105.9	155.8	-127.8	-26.1	0	0	0	105.2	D174 Q178	D174-N176 PolarHBondContact O-N 3.34Å; N176-Q178 PolarHBondContact O-N 3.42Å
177	I	40.6	Very low	36.7	Very low	155 Å²	155	133.1 Å²	133.1	80%	0.795	70%	0.695	S	S	*	*			trans	-58.8	88.8	159.3	-65.4	171	0	0	0	102.9	Y175 Q179	Y175-I177 VanDerWaalsContact C-N 3.3Å; Y175-I177 PolarHBondContact O-N 3.38Å; I177-Q179 PolarHBondContact O-N 3.02Å
178	Q	33.3	Very low	36.2	Very low	168 Å²	168	128.6 Å²	128.6	79%	0.785	69%	0.686	S	S	*	*			trans	-67.2	96.7	171.1	-162.1	170.6	0.1	0	0	103.2	N176 T180	N176-Q178 PolarHBondContact O-N 3.42Å; Q178-T180 PolarHBondContact O-N 3.35Å
179	Q	44.9	Very low	36.2	Very low	162 Å²	162	133.3 Å²	133.3	76%	0.757	71%	0.706	S	S	*	*			trans	-49.5	88.3	168.5	-167.4	179.5	3.3	0	0	106.9	I177 C181	I177-Q179 PolarHBondContact O-N 3.02Å; Q179-C181 HydrophobicContact CG-CB 3.65Å; Q179-C181 PolarHBondContact O-N 3.35Å
180	T	30.5	Very low	36.7	Very low	134 Å²	134	130.9 Å²	130.9	82%	0.822	70%	0.697	S	S	*	*			trans	-75.2	57.3	154.2	41.2	0	0	0	0	107.6	Q178 S182	Q178-T180 PolarHBondContact O-N 3.35Å; T180-S182 PolarHBondContact O-N 3.45Å
181	C	44.3	Very low	37.8	Very low	71 Å²	71	134.4 Å²	134.4	48%	0.48	70%	0.704	S	S	.	*			trans	-64.2	94.2	145.6	161.7	0	0	0	0	106.2	Q179	Q179-C181 HydrophobicContact CG-CB 3.65Å; Q179-C181 PolarHBondContact O-N 3.35Å
182	S	36.8	Very low	39.6	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	69%	0.691	S	S	*	*			trans	-141	55.6	147.2	-161.4	0	0	0	0	110.4	T180	T180-S182 PolarHBondContact O-N 3.45Å
183	C	36.3	Very low	41.1	Very low	104 Å²	104	130 Å²	130	70%	0.703	67%	0.674	S	S	*	*			trans	-161.1	85.4	146	32	0	0	0	0	107.6	I185	C183-I185 HydrophobicContact CB-CG1 4.36Å; C183-I185 PolarHBondContact O-N 3.19Å
184	Q	34.7	Very low	43.4	Very low	170 Å²	170	128.3 Å²	128.3	79%	0.794	67%	0.67	S	S	*	*			trans	-60.8	76.9	149.3	-72.7	-176	-5.6	0	0	107.8	K186	Q184-K186 VanDerWaalsContact C-N 3.28Å; Q184-K186 PolarHBondContact O-N 3.2Å
185	I	42.8	Very low	46.1	Very low	130 Å²	130	122.7 Å²	122.7	67%	0.667	64%	0.639	S	S	*	*			trans	-74.8	101.4	150.3	-59.6	178	0	0	0	103.1	C183 T187	C183-I185 HydrophobicContact CB-CG1 4.36Å; C183-I185 PolarHBondContact O-N 3.19Å; I185-T187 PolarHBondContact O-N 3.29Å
186	K	30.3	Very low	48.9	Very low	177 Å²	177	119 Å²	119	77%	0.77	63%	0.629	S	S	*	*			trans	-42.6	108.7	160.5	-74	173.4	175.6	175.6	0	106.3	Q184 S188	Q184-K186 VanDerWaalsContact C-N 3.28Å; Q184-K186 PolarHBondContact O-N 3.2Å; K186-S188 PolarHBondContact O-N 3.2Å
187	T	35.5	Very low	51.9	Low	128 Å²	128	115.2 Å²	115.2	79%	0.785	61%	0.609	S	S	*	*			trans	-67.5	77.3	154.2	38.4	0	0	0	0	105.3	I185	I185-T187 PolarHBondContact O-N 3.29Å
188	S	34.3	Very low	54.3	Low	61 Å²	61	112.2 Å²	112.2	43%	0.427	59%	0.591	S	S	.	*			trans	-52.1	140.6	140	38.2	0	0	0	0	105.5	K186 N190	K186-S188 PolarHBondContact O-N 3.2Å; S188-N190 WeakPolarHBondContact CB-OD1 3.44Å; S188-N190 PolarHBondContact O-N 2.93Å; S188-N190 PolarHBondContact OG-ND2 3.42Å; S188-N190 PolarHBondContact OG-OD1 3.49Å
189	E	42	Very low	57	Low	203 Å²	203	105.8 Å²	105.8	95%	0.949	57%	0.571	S	S	*	*			trans	-55.6	78.1	152.7	-68.8	171.2	154.9	0	0	106.2	Q191	E189-Q191 PolarHBondContact O-N 2.89Å
190	N	49.8	Very low	59.4	Low	83 Å²	83	102.1 Å²	102.1	44%	0.444	56%	0.559	S	S	.	*			trans	-72.8	93.7	175.7	-90.5	-16.8	0	0	0	103.4	S188 I192 R215	S188-N190 WeakPolarHBondContact CB-OD1 3.44Å; S188-N190 PolarHBondContact O-N 2.93Å; S188-N190 PolarHBondContact OG-ND2 3.42Å; S188-N190 PolarHBondContact OG-OD1 3.49Å; N190-I192 PolarHBondContact O-N 3.45Å; N190-R215 PolarHBondContact OD1-NH1 2.99Å
191	Q	57.7	Low	62.3	Low	152 Å²	152	99.7 Å²	99.7	71%	0.71	54%	0.54	S	S	*	.			trans	-41.8	114.5	163.7	-142.5	170.6	13.4	0	0	106.6	E189 T193 R215	E189-Q191 PolarHBondContact O-N 2.89Å; Q191-T193 HydrophobicContact CB-CG2 3.97Å; Q191-T193 HydrophobicContact CG-CG2 3.91Å; Q191-T193 PolarHBondContact O-N 3.41Å; Q191-R215 PolarHBondContact O-NH2 3.15Å
192	I	72	Confident	64.5	Low	27 Å²	27	97.7 Å²	97.7	14%	0.138	53%	0.532	C	S	.	.			trans	-70.1	93.5	177.2	-61.1	178.1	0	0	0	104.7	N190 I195 L253 E256 V267	N190-I192 PolarHBondContact O-N 3.45Å; I192-I195 HydrophobicContact CG2-CD1 3.42Å; I192-I195 VanDerWaalsContact CG2-CD1 3.42Å; I192-I195 HydrophobicContact CG2-CG1 4.19Å; I192-L253 WeakPolarHBondContact CD1-O 3.46Å; I192-E256 HydrophobicContact CG2-CB 4.23Å; I192-E256 WeakPolarHBondContact CG2-OE2 3.37Å; I192-V267 HydrophobicContact CD1-CG2 4.48Å; I192-V267 HydrophobicContact CG2-CG2 3.87Å
193	T	71.8	Confident	66.9	Low	40 Å²	40	100.1 Å²	100.1	25%	0.245	53%	0.531	C	S	.	.			trans	-130.6	157.7	178.4	64.8	0	0	0	0	107.7	Q191	Q191-T193 HydrophobicContact CB-CG2 3.97Å; Q191-T193 HydrophobicContact CG-CG2 3.91Å; Q191-T193 PolarHBondContact O-N 3.41Å
194	D	81.6	Confident	69.2	Low	118 Å²	118	97.3 Å²	97.3	63%	0.631	52%	0.52	S	S	*	.			trans	63	50.1	172.6	-43	-51.9	0	0	0	113.2
195	I	88.6	Confident	71.4	Confident	35 Å²	35	94.5 Å²	94.5	18%	0.179	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117	170.9	-64.9	-174.3	0	0	0	109.7	I192 L197 Q214 V221 V267	I192-I195 HydrophobicContact CG2-CD1 3.42Å; I192-I195 VanDerWaalsContact CG2-CD1 3.42Å; I192-I195 HydrophobicContact CG2-CG1 4.19Å; I195-L197 HydrophobicContact CG2-CD2 4.1Å; I195-Q214 HydrophobicContact CG1-CB 4.41Å; I195-Q214 HydrophobicContact CG1-CG 4.3Å; I195-V221 HydrophobicContact CG2-CG2 3.69Å; I195-V267 HydrophobicContact CD1-CB 4.29Å; I195-V267 HydrophobicContact CD1-CG1 3.87Å; I195-V267 HydrophobicContact CD1-CG2 3.39Å
196	E	90.4	Very high	73.5	Confident	129 Å²	129	90.3 Å²	90.3	60%	0.603	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	117.4	170.4	-65.5	175.6	-177.5	0	0	109.1	G212 K213	E196-G212 CarbonylContact O-C 3.53Å; E196-G212 WeakPolarHBondContact O-CA 3.41Å; E196-K213 HydrophobicContact CB-CB 4.48Å; E196-K213 PolarHBondContact N-O 3.2Å; E196-K213 PolarHBondContact O-N 3.46Å
197	L	91.1	Very high	76.5	Confident	59 Å²	59	82.3 Å²	82.3	31%	0.309	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	136.7	172.4	-60.2	-178.1	0	0	0	110.3	I195 Y210 V221 V223	I195-L197 HydrophobicContact CG2-CD2 4.1Å; L197-Y210 HydrophobicContact CD2-CG 4.43Å; L197-V221 HydrophobicContact CD2-CB 3.64Å; L197-V221 HydrophobicContact CD2-CG1 3.72Å; L197-V221 HydrophobicContact CD2-CG2 3.84Å; L197-V223 HydrophobicContact CD1-CG2 4.4Å
198	Q	91.1	Very high	79.3	Confident	92 Å²	92	77.4 Å²	77.4	43%	0.43	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-119.7	-178.5	-59.8	-176.1	-22.9	0	0	110	E211	Q198-E211 HydrophobicContact CB-CB 4.26Å; Q198-E211 HydrophobicContact CB-CG 4.38Å; Q198-E211 PolarHBondContact N-O 2.94Å
199	G	91.7	Very high	82.2	Confident	34 Å²	34	76.4 Å²	76.4	35%	0.351	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	157.3	-179	0	0	0	0	0	113.6	Y210 E211	G199-Y210 CarbonylContact O-C 3.57Å; G199-Y210 VanDerWaalsContact O-CA 3.31Å; G199-Y210 WeakPolarHBondContact O-CA 3.43Å; G199-E211 PolarHBondContact O-N 3.4Å
200	V	94.9	Very high	84.7	Confident	85 Å²	85	69.8 Å²	69.8	52%	0.515	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.4	168.3	176.9	0	0	0	0	108.5	T208 Y210	V200-T208 HydrophobicContact CG1-CG2 3.77Å; V200-T208 HydrophobicContact CG2-CG2 4.24Å; V200-Y210 HydrophobicContact CG2-CD1 3.89Å; V200-Y210 HydrophobicContact CG2-CE1 3.54Å
201	L	91.8	Very high	86.9	Confident	82 Å²	82	68.1 Å²	68.1	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-34.6	174.4	-64.7	172.9	0	0	0	111.7	V209 E211 A220 Y270	L201-V209 HydrophobicContact CB-CB 4.49Å; L201-V209 HydrophobicContact CB-CG1 4.25Å; L201-V209 HydrophobicContact CD1-CG1 4.22Å; L201-V209 PolarHBondContact N-O 2.9Å; L201-E211 HydrophobicContact CD1-CB 4.12Å; L201-E211 HydrophobicContact CD2-CB 4.02Å; L201-E211 HydrophobicContact CG-CB 3.96Å; L201-A220 HydrophobicContact CD1-CB 4.4Å; L201-Y270 HydrophobicContact CD1-CD2 4.11Å; L201-Y270 HydrophobicContact CD1-CE2 3.72Å; L201-Y270 HydrophobicContact CD2-CE2 4.04Å
202	G	88.7	Confident	88.6	Confident	30 Å²	30	60.9 Å²	60.9	31%	0.309	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	151.1	179.1	0	0	0	0	0	111.7	V209	G202-V209 PolarHBondContact N-O 3.07Å; G202-V209 PolarHBondContact O-N 3.39Å
203	Q	88.8	Confident	89.6	Confident	163 Å²	163	63.7 Å²	63.7	76%	0.762	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	113.6	178.8	-174.5	174.1	4.9	0	0	109.3	T208	Q203-T208 HydrophobicContact CB-CG2 4.38Å; Q203-T208 HydrophobicContact CG-CG2 4.44Å
204	G	83.3	Confident	90.5	Very high	46 Å²	46	63.1 Å²	63.1	47%	0.474	34%	0.34	S	S	.	.			trans	-100.9	178.2	172.2	0	0	0	0	0	111.6	A207	G204-A207 CarbonylContact C-O 3.48Å; G204-A207 WeakPolarHBondContact CA-O 3.46Å; G204-A207 PolarHBondContact N-O 3.22Å
205	H	80.9	Confident	90.8	Very high	110 Å²	110	64.3 Å²	64.3	51%	0.509	34%	0.335	S	S	.	.	S	Bend	trans	-67.7	-40.1	-180	-179.9	-97.7	0	0	0	113.1	F370	H205-F370 AromaticContact CE1-CE1 3.65Å; H205-F370 AromaticContact ND1-CE1 3.95Å; H205-F370 AromaticContact NE2-CE1 3.79Å
206	F	87.1	Confident	90.6	Very high	43 Å²	43	65.1 Å²	65.1	19%	0.189	35%	0.352	C	S	.	.	S	Bend	trans	-97.6	-19.4	-175.5	-57.8	-68.6	0	0	0	113.6	Y224 A225 Q231 F370	F206-Y224 WeakPolarHBondContact O-CA 3.38Å; F206-A225 PolarHBondContact O-N 2.98Å; F206-Q231 HydrophobicContact CB-CB 4.41Å; F206-Q231 HydrophobicContact CB-CG 4.23Å; F206-Q231 HydrophobicContact CD1-CG 4.26Å; F206-Q231 HydrophobicContact CD2-CG 3.81Å; F206-Q231 HydrophobicContact CE2-CG 4.23Å; F206-Q231 HydrophobicContact CG-CG 3.83Å; F206-F370 HydrophobicContact CE2-CB 4.39Å; F206-F370 HydrophobicContact CE2-CG 4.43Å; F206-F370 HydrophobicContact CZ-CD1 4.41Å; F206-F370 HydrophobicContact CZ-CD2 4.29Å; F206-F370 HydrophobicContact CZ-CG 4.18Å
207	A	92.7	Very high	90.6	Very high	9 Å²	9	62.8 Å²	62.8	7%	0.074	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	153.1	-174	0	0	0	0	0	112	G204 K222 V223 Y224	G204-A207 CarbonylContact C-O 3.48Å; G204-A207 WeakPolarHBondContact CA-O 3.46Å; G204-A207 PolarHBondContact N-O 3.22Å; A207-K222 HydrophobicContact CB-CD 4.34Å; A207-K222 HydrophobicContact CB-CG 3.66Å; A207-V223 CarbonylContact C-O 3.57Å; A207-V223 WeakPolarHBondContact CA-O 3.43Å; A207-V223 WeakPolarHBondContact CB-O 3.48Å; A207-Y224 HydrophobicContact CB-CD1 3.83Å; A207-Y224 HydrophobicContact CB-CD2 4.39Å; A207-Y224 HydrophobicContact CB-CE1 4.04Å; A207-Y224 HydrophobicContact CB-CG 4.02Å
208	T	94.3	Very high	90.8	Very high	24 Å²	24	64.2 Å²	64.2	15%	0.147	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.3	168	-54.4	0	0	0	0	108.8	V200 Q203 Y210 V223	V200-T208 HydrophobicContact CG1-CG2 3.77Å; V200-T208 HydrophobicContact CG2-CG2 4.24Å; Q203-T208 HydrophobicContact CB-CG2 4.38Å; Q203-T208 HydrophobicContact CG-CG2 4.44Å; T208-Y210 HydrophobicContact CG2-CD2 4.11Å; T208-Y210 HydrophobicContact CG2-CE1 4.41Å; T208-Y210 HydrophobicContact CG2-CE2 3.47Å; T208-Y210 VanDerWaalsContact CG2-CE2 3.47Å; T208-Y210 WeakPolarHBondContact O-CD2 3.48Å; T208-V223 PolarHBondContact N-O 3.36Å; T208-V223 PolarHBondContact O-N 2.86Å
209	V	95.4	Very high	91	Very high	40 Å²	40	60 Å²	60	24%	0.242	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.3	177.9	-172.5	0	0	0	0	108.6	L201 G202 A220 K222	L201-V209 HydrophobicContact CB-CB 4.49Å; L201-V209 HydrophobicContact CB-CG1 4.25Å; L201-V209 HydrophobicContact CD1-CG1 4.22Å; L201-V209 PolarHBondContact N-O 2.9Å; G202-V209 PolarHBondContact N-O 3.07Å; G202-V209 PolarHBondContact O-N 3.39Å; V209-A220 HydrophobicContact CG1-CB 4.35Å; V209-K222 HydrophobicContact CG2-CB 4.36Å; V209-K222 HydrophobicContact CG2-CD 4.32Å; V209-K222 HydrophobicContact CG2-CG 4.04Å
210	Y	95.6	Very high	91.2	Very high	64 Å²	64	58.8 Å²	58.8	25%	0.251	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.9	177.4	-65	-98.3	0	0	0	110.1	L197 G199 V200 T208 V221 V223	L197-Y210 HydrophobicContact CD2-CG 4.43Å; G199-Y210 CarbonylContact O-C 3.57Å; G199-Y210 VanDerWaalsContact O-CA 3.31Å; G199-Y210 WeakPolarHBondContact O-CA 3.43Å; V200-Y210 HydrophobicContact CG2-CD1 3.89Å; V200-Y210 HydrophobicContact CG2-CE1 3.54Å; T208-Y210 HydrophobicContact CG2-CD2 4.11Å; T208-Y210 HydrophobicContact CG2-CE1 4.41Å; T208-Y210 HydrophobicContact CG2-CE2 3.47Å; T208-Y210 VanDerWaalsContact CG2-CE2 3.47Å; T208-Y210 WeakPolarHBondContact O-CD2 3.48Å; Y210-V221 PolarHBondContact N-O 3.01Å; Y210-V221 PolarHBondContact O-N 2.86Å; Y210-V223 HydrophobicContact CD2-CB 4.27Å; Y210-V223 HydrophobicContact CD2-CG2 3.46Å; Y210-V223 VanDerWaalsContact CD2-CG2 3.46Å; Y210-V223 HydrophobicContact CE2-CB 4Å; Y210-V223 HydrophobicContact CE2-CG2 3.55Å
211	E	95.6	Very high	91.3	Very high	48 Å²	48	54.8 Å²	54.8	22%	0.224	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134.6	156.6	-173.2	177.8	-164.8	0	0	107.4	Q198 G199 L201 M218 Y270	Q198-E211 HydrophobicContact CB-CB 4.26Å; Q198-E211 HydrophobicContact CB-CG 4.38Å; Q198-E211 PolarHBondContact N-O 2.94Å; G199-E211 PolarHBondContact O-N 3.4Å; L201-E211 HydrophobicContact CD1-CB 4.12Å; L201-E211 HydrophobicContact CD2-CB 4.02Å; L201-E211 HydrophobicContact CG-CB 3.96Å; E211-M218 HydrophobicContact CG-CE 3.97Å; E211-M218 WeakPolarHBondContact OE1-CE 3.31Å; E211-Y270 HydrophobicContact CG-CE2 4.31Å
212	G	93.9	Very high	91.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	162.4	178.3	0	0	0	0	0	111.8	E196 M218 V219	E196-G212 CarbonylContact O-C 3.53Å; E196-G212 WeakPolarHBondContact O-CA 3.41Å; G212-M218 WeakPolarHBondContact O-CA 3.31Å; G212-V219 PolarHBondContact N-O 2.98Å; G212-V219 WeakPolarHBondContact O-CG2 3.44Å; G212-V219 PolarHBondContact O-N 3.2Å
213	K	93.4	Very high	91.8	Very high	86 Å²	86	50.9 Å²	50.9	37%	0.374	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.5	173.8	-165.3	171.3	-179.8	175.3	0	109.3	E196 S217	E196-K213 HydrophobicContact CB-CB 4.48Å; E196-K213 PolarHBondContact N-O 3.2Å; E196-K213 PolarHBondContact O-N 3.46Å; K213-S217 WeakPolarHBondContact CA-O 3.25Å
214	Q	89.5	Confident	92	Very high	28 Å²	28	43.3 Å²	43.3	13%	0.131	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	113.1	175.8	-171.4	-178.1	33.2	0	0	109	I195 G216 S217 V219	I195-Q214 HydrophobicContact CG1-CB 4.41Å; I195-Q214 HydrophobicContact CG1-CG 4.3Å; Q214-G216 PolarHBondContact O-N 3.09Å; Q214-G216 VanDerWaalsContact O-N 3.08Å; Q214-S217 PolarHBondContact N-O 3.29Å; Q214-S217 PolarHBondContact O-N 3.08Å; Q214-V219 HydrophobicContact CB-CG1 4Å; Q214-V219 HydrophobicContact CB-CG2 4.22Å
215	R	87.7	Confident	92.2	Very high	143 Å²	143	43.6 Å²	43.6	54%	0.54	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	36.7	179.5	-58.3	-178.4	-177.4	172.7	3.9	114	N190 Q191	N190-R215 PolarHBondContact OD1-NH1 2.99Å; Q191-R215 PolarHBondContact O-NH2 3.15Å
216	G	84.6	Confident	92.4	Very high	52 Å²	52	47.4 Å²	47.4	54%	0.536	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	96	-20.6	-178.8	0	0	0	0	0	115.3	Q214	Q214-G216 PolarHBondContact O-N 3.09Å; Q214-G216 VanDerWaalsContact O-N 3.08Å
217	S	90.4	Very high	92.3	Very high	80 Å²	80	49.9 Å²	49.9	56%	0.559	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	141.1	-179.3	-61.4	0	0	0	0	111.7	K213 Q214	K213-S217 WeakPolarHBondContact CA-O 3.25Å; Q214-S217 PolarHBondContact N-O 3.29Å; Q214-S217 PolarHBondContact O-N 3.08Å
218	M	94.7	Very high	92.1	Very high	89 Å²	89	49.5 Å²	49.5	44%	0.438	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.8	174.2	-69.3	-173.9	64.7	0	0	111.4	E211 G212 Y270	E211-M218 HydrophobicContact CG-CE 3.97Å; E211-M218 WeakPolarHBondContact OE1-CE 3.31Å; G212-M218 WeakPolarHBondContact O-CA 3.31Å; M218-Y270 HydrophobicContact CB-CD1 4.22Å; M218-Y270 HydrophobicContact CB-CG 4.13Å; M218-Y270 HydrophobicContact CE-CD1 3.6Å; M218-Y270 HydrophobicContact CE-CD2 4.03Å; M218-Y270 HydrophobicContact CE-CE1 3.29Å; M218-Y270 HydrophobicContact CE-CE2 3.77Å; M218-Y270 HydrophobicContact CE-CG 3.95Å; M218-Y270 HydrophobicContact SD-CD1 4.33Å; M218-Y270 HydrophobicContact SD-CE1 4.26Å
219	V	96.1	Very high	92	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158.6	176.7	-63.9	0	0	0	0	109.8	G212 Q214 V221 L253 V267	G212-V219 PolarHBondContact N-O 2.98Å; G212-V219 WeakPolarHBondContact O-CG2 3.44Å; G212-V219 PolarHBondContact O-N 3.2Å; Q214-V219 HydrophobicContact CB-CG1 4Å; Q214-V219 HydrophobicContact CB-CG2 4.22Å; V219-V221 HydrophobicContact CG2-CG2 3.86Å; V219-L253 HydrophobicContact CB-CD1 4.4Å; V219-L253 HydrophobicContact CG1-CD1 3.63Å; V219-V267 HydrophobicContact CB-CG1 4.07Å; V219-V267 HydrophobicContact CG1-CG1 4.33Å; V219-V267 HydrophobicContact CG2-CG1 4.2Å
220	A	96.9	Very high	91.7	Very high	10 Å²	10	57.7 Å²	57.7	8%	0.083	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.7	166.1	0	0	0	0	0	108.9	L201 V209 L268	L201-A220 HydrophobicContact CD1-CB 4.4Å; V209-A220 HydrophobicContact CG1-CB 4.35Å; A220-L268 HydrophobicContact CB-CB 4.35Å; A220-L268 PolarHBondContact N-O 3.29Å; A220-L268 PolarHBondContact O-N 3.47Å
221	V	95.9	Very high	91.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	108	-176.3	-170.1	0	0	0	0	109.4	I195 L197 Y210 V219 V223 L265	I195-V221 HydrophobicContact CG2-CG2 3.69Å; L197-V221 HydrophobicContact CD2-CB 3.64Å; L197-V221 HydrophobicContact CD2-CG1 3.72Å; L197-V221 HydrophobicContact CD2-CG2 3.84Å; Y210-V221 PolarHBondContact N-O 3.01Å; Y210-V221 PolarHBondContact O-N 2.86Å; V219-V221 HydrophobicContact CG2-CG2 3.86Å; V221-V223 HydrophobicContact CG1-CG2 4.4Å; V221-L265 HydrophobicContact CG1-CD2 3.91Å
222	K	96.1	Very high	91.6	Very high	14 Å²	14	54.3 Å²	54.3	6%	0.061	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	111.4	178	-169.3	167.8	-178.2	-176.2	0	109.1	A207 V209 Y224 E235 L265 I266 D340	A207-K222 HydrophobicContact CB-CD 4.34Å; A207-K222 HydrophobicContact CB-CG 3.66Å; V209-K222 HydrophobicContact CG2-CB 4.36Å; V209-K222 HydrophobicContact CG2-CD 4.32Å; V209-K222 HydrophobicContact CG2-CG 4.04Å; K222-Y224 HydrophobicContact CB-CE2 4.27Å; K222-Y224 HydrophobicContact CD-CE2 4.16Å; K222-Y224 WeakPolarHBondContact CD-OH 3.22Å; K222-Y224 WeakPolarHBondContact CE-OH 3.26Å; K222-Y224 HydrophobicContact CG-CD2 4.48Å; K222-Y224 HydrophobicContact CG-CE2 3.79Å; K222-E235 IonicContact NZ-OE1 3.49Å; K222-E235 PolarHBondContact NZ-OE1 3.38Å; K222-E235 IonicContact NZ-OE2 2.78Å; K222-E235 PolarHBondContact NZ-OE2 2.89Å; K222-L265 WeakPolarHBondContact O-CA 3.47Å; K222-I266 HydrophobicContact CB-CB 4.43Å; K222-I266 PolarHBondContact N-O 3.48Å; K222-I266 PolarHBondContact O-N 2.94Å; K222-D340 IonicContact NZ-OD1 2.82Å; K222-D340 PolarHBondContact NZ-OD1 3.16Å; K222-D340 IonicContact NZ-OD2 2.78Å; K222-D340 PolarHBondContact NZ-OD2 3.39Å
223	V	94.5	Very high	91.6	Very high	17 Å²	17	59.1 Å²	59.1	10%	0.103	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	116.1	-178.7	-173.1	0	0	0	0	108.7	L197 A207 T208 Y210 V221 L265	L197-V223 HydrophobicContact CD1-CG2 4.4Å; A207-V223 CarbonylContact C-O 3.57Å; A207-V223 WeakPolarHBondContact CA-O 3.43Å; A207-V223 WeakPolarHBondContact CB-O 3.48Å; T208-V223 PolarHBondContact N-O 3.36Å; T208-V223 PolarHBondContact O-N 2.86Å; Y210-V223 HydrophobicContact CD2-CB 4.27Å; Y210-V223 HydrophobicContact CD2-CG2 3.46Å; Y210-V223 VanDerWaalsContact CD2-CG2 3.46Å; Y210-V223 HydrophobicContact CE2-CB 4Å; Y210-V223 HydrophobicContact CE2-CG2 3.55Å; V221-V223 HydrophobicContact CG1-CG2 4.4Å; V223-L265 HydrophobicContact CB-CD2 4.05Å; V223-L265 HydrophobicContact CG1-CD2 4.01Å; V223-L265 HydrophobicContact CG2-CD2 3.53Å
224	Y	93.8	Very high	91.7	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.7	-179.8	-66.8	-102.6	0	0	0	111.3	F206 A207 K222 G228 Q231 F232 E235 L264 I266	F206-Y224 WeakPolarHBondContact O-CA 3.38Å; A207-Y224 HydrophobicContact CB-CD1 3.83Å; A207-Y224 HydrophobicContact CB-CD2 4.39Å; A207-Y224 HydrophobicContact CB-CE1 4.04Å; A207-Y224 HydrophobicContact CB-CG 4.02Å; K222-Y224 HydrophobicContact CB-CE2 4.27Å; K222-Y224 HydrophobicContact CD-CE2 4.16Å; K222-Y224 WeakPolarHBondContact CD-OH 3.22Å; K222-Y224 WeakPolarHBondContact CE-OH 3.26Å; K222-Y224 HydrophobicContact CG-CD2 4.48Å; K222-Y224 HydrophobicContact CG-CE2 3.79Å; Y224-G228 WeakPolarHBondContact CD1-O 3.25Å; Y224-Q231 HydrophobicContact CD1-CB 4.42Å; Y224-Q231 HydrophobicContact CE1-CB 4.03Å; Y224-F232 HydrophobicContact CD1-CB 3.82Å; Y224-F232 HydrophobicContact CD2-CB 3.95Å; Y224-F232 AromaticContact CD2-CD2 3.66Å; Y224-F232 HydrophobicContact CD2-CD2 3.66Å; Y224-F232 HydrophobicContact CD2-CG 4.27Å; Y224-F232 HydrophobicContact CE1-CB 4.02Å; Y224-F232 HydrophobicContact CE2-CB 4.15Å; Y224-F232 AromaticContact CE2-CD2 3.73Å; Y224-F232 HydrophobicContact CE2-CD2 3.73Å; Y224-F232 HydrophobicContact CE2-CG 4.45Å; Y224-F232 HydrophobicContact CG-CB 3.78Å; Y224-F232 HydrophobicContact CG-CD2 4.32Å; Y224-E235 PolarHBondContact OH-OE2 3.39Å; Y224-L264 PolarHBondContact N-O 3.04Å; Y224-I266 HydrophobicContact CE2-CB 4.26Å; Y224-I266 HydrophobicContact CE2-CD1 3.99Å; Y224-I266 HydrophobicContact CE2-CG1 3.91Å; Y224-I266 WeakPolarHBondContact OH-CD1 3.49Å
225	A	88.1	Confident	92	Very high	51 Å²	51	55 Å²	55	42%	0.421	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-71.9	168.8	168.2	0	0	0	0	0	110.8	F206 N227 G228	F206-A225 PolarHBondContact O-N 2.98Å; A225-N227 VanDerWaalsContact C-N 3.26Å; A225-N227 WeakPolarHBondContact CB-OD1 3.47Å; A225-N227 PolarHBondContact O-N 3.26Å; A225-G228 WeakPolarHBondContact O-CA 3.35Å; A225-G228 PolarHBondContact O-N 3.44Å
226	E	84.4	Confident	92.4	Very high	191 Å²	191	50.7 Å²	50.7	89%	0.893	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-58.2	-37.5	-177.7	-169.7	176.3	-172.1	0	0	112.8	G228	E226-G228 PolarHBondContact O-N 2.69Å
227	N	85.1	Confident	93	Very high	95 Å²	95	51.8 Å²	51.8	51%	0.508	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-74.2	-10	175.4	68.3	-16.6	0	0	0	113.8	A225	A225-N227 VanDerWaalsContact C-N 3.26Å; A225-N227 WeakPolarHBondContact CB-OD1 3.47Å; A225-N227 PolarHBondContact O-N 3.26Å
228	G	88.4	Confident	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-91.9	4.4	-179.6	0	0	0	0	0	114.5	Y224 A225 E226 H230 Q231 F232	Y224-G228 WeakPolarHBondContact CD1-O 3.25Å; A225-G228 WeakPolarHBondContact O-CA 3.35Å; A225-G228 PolarHBondContact O-N 3.44Å; E226-G228 PolarHBondContact O-N 2.69Å; G228-H230 VanDerWaalsContact C-N 3.26Å; G228-H230 PolarHBondContact O-N 3.08Å; G228-Q231 PolarHBondContact O-N 3.31Å; G228-Q231 PolarHBondContact O-OE1 3.35Å; G228-F232 PolarHBondContact O-N 2.89Å
229	K	91.1	Very high	93.5	Very high	135 Å²	135	44.6 Å²	44.6	59%	0.587	22%	0.221	S	C	*	.	H	α-helix	trans	-57.7	-36.1	-176.3	-175.5	176.7	-179.6	-179.1	0	113.2	M233 L264	K229-M233 VanDerWaalsContact O-CG 3.28Å; K229-M233 WeakPolarHBondContact O-CG 3.42Å; K229-M233 PolarHBondContact O-N 3.04Å; K229-M233 VanDerWaalsContact O-N 3.08Å; K229-L264 HydrophobicContact CB-CD1 4.48Å; K229-L264 HydrophobicContact CG-CD1 4.04Å
230	H	90.4	Very high	93.6	Very high	102 Å²	102	49.7 Å²	49.7	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-67.1	-46.7	178.2	-177.6	59.3	0	0	0	111.4	G228 F232 M233 N234 H359	G228-H230 VanDerWaalsContact C-N 3.26Å; G228-H230 PolarHBondContact O-N 3.08Å; H230-F232 VanDerWaalsContact C-N 3.33Å; H230-F232 PolarHBondContact O-N 3.47Å; H230-M233 PolarHBondContact O-N 3.32Å; H230-N234 WeakPolarHBondContact O-CB 3.46Å; H230-N234 PolarHBondContact O-N 3.29Å; H230-H359 AromaticContact CE1-CE1 3.56Å; H230-H359 AromaticContact NE2-CE1 3.68Å
231	Q	92.8	Very high	93.5	Very high	30 Å²	30	50 Å²	50	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-40.6	177.8	-68.4	74.1	13.1	0	0	111.1	F206 Y224 G228 N234 E235	F206-Q231 HydrophobicContact CB-CB 4.41Å; F206-Q231 HydrophobicContact CB-CG 4.23Å; F206-Q231 HydrophobicContact CD1-CG 4.26Å; F206-Q231 HydrophobicContact CD2-CG 3.81Å; F206-Q231 HydrophobicContact CE2-CG 4.23Å; F206-Q231 HydrophobicContact CG-CG 3.83Å; Y224-Q231 HydrophobicContact CD1-CB 4.42Å; Y224-Q231 HydrophobicContact CE1-CB 4.03Å; G228-Q231 PolarHBondContact O-N 3.31Å; G228-Q231 PolarHBondContact O-OE1 3.35Å; Q231-N234 PolarHBondContact O-N 3.05Å; Q231-E235 VanDerWaalsContact O-CB 3.29Å; Q231-E235 WeakPolarHBondContact O-CB 3.18Å; Q231-E235 PolarHBondContact O-N 3.31Å
232	F	95.3	Very high	93.5	Very high	11 Å²	11	52.9 Å²	52.9	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-57	-50.9	172.2	169.9	-94.4	0	0	0	111.9	Y224 G228 H230 N234 E235 K236 T255 L264 I266	Y224-F232 HydrophobicContact CD1-CB 3.82Å; Y224-F232 HydrophobicContact CD2-CB 3.95Å; Y224-F232 AromaticContact CD2-CD2 3.66Å; Y224-F232 HydrophobicContact CD2-CD2 3.66Å; Y224-F232 HydrophobicContact CD2-CG 4.27Å; Y224-F232 HydrophobicContact CE1-CB 4.02Å; Y224-F232 HydrophobicContact CE2-CB 4.15Å; Y224-F232 AromaticContact CE2-CD2 3.73Å; Y224-F232 HydrophobicContact CE2-CD2 3.73Å; Y224-F232 HydrophobicContact CE2-CG 4.45Å; Y224-F232 HydrophobicContact CG-CB 3.78Å; Y224-F232 HydrophobicContact CG-CD2 4.32Å; G228-F232 PolarHBondContact O-N 2.89Å; H230-F232 VanDerWaalsContact C-N 3.33Å; H230-F232 PolarHBondContact O-N 3.47Å; F232-N234 VanDerWaalsContact C-N 3.32Å; F232-N234 PolarHBondContact O-N 3.41Å; F232-E235 PolarHBondContact O-N 3.27Å; F232-K236 HydrophobicContact CE1-CD 4.22Å; F232-K236 HydrophobicContact CZ-CD 4.22Å; F232-K236 WeakPolarHBondContact O-CB 3.38Å; F232-K236 PolarHBondContact O-N 3.11Å; F232-T255 HydrophobicContact CE2-CG2 4Å; F232-T255 HydrophobicContact CZ-CG2 3.92Å; F232-L264 HydrophobicContact CB-CD1 4.35Å; F232-L264 HydrophobicContact CD1-CB 4.16Å; F232-L264 HydrophobicContact CD1-CD1 3.59Å; F232-L264 HydrophobicContact CD1-CG 4.32Å; F232-L264 HydrophobicContact CD2-CB 3.7Å; F232-L264 HydrophobicContact CE1-CB 4.25Å; F232-L264 HydrophobicContact CE1-CD1 3.98Å; F232-L264 HydrophobicContact CE1-CD2 4.16Å; F232-L264 HydrophobicContact CE1-CG 4.36Å; F232-L264 HydrophobicContact CE2-CB 3.81Å; F232-L264 HydrophobicContact CG-CB 3.87Å; F232-L264 HydrophobicContact CG-CD1 3.91Å; F232-L264 HydrophobicContact CG-CG 4.47Å; F232-L264 HydrophobicContact CZ-CB 4.08Å; F232-L264 HydrophobicContact CZ-CD2 4.29Å; F232-I266 HydrophobicContact CD2-CD1 4.05Å; F232-I266 HydrophobicContact CD2-CG1 3.75Å; F232-I266 HydrophobicContact CE2-CD1 4.28Å; F232-I266 HydrophobicContact CE2-CG1 3.64Å
233	M	94.6	Very high	93.4	Very high	101 Å²	101	55.4 Å²	55.4	50%	0.498	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-40.3	-178.3	-71.1	-62.3	-58.1	0	0	111.6	K229 H230 E237	K229-M233 VanDerWaalsContact O-CG 3.28Å; K229-M233 WeakPolarHBondContact O-CG 3.42Å; K229-M233 PolarHBondContact O-N 3.04Å; K229-M233 VanDerWaalsContact O-N 3.08Å; H230-M233 PolarHBondContact O-N 3.32Å; M233-E237 WeakPolarHBondContact O-CB 3.32Å; M233-E237 PolarHBondContact O-N 3.38Å
234	N	94.4	Very high	93.5	Very high	26 Å²	26	54.9 Å²	54.9	14%	0.139	27%	0.274	C	S	.	.	H	α-helix	trans	-66.8	-49.3	178.6	-168.4	47.2	0	0	0	111.6	H230 Q231 F232 K236 E237 V238 F341 G342 S344	H230-N234 WeakPolarHBondContact O-CB 3.46Å; H230-N234 PolarHBondContact O-N 3.29Å; Q231-N234 PolarHBondContact O-N 3.05Å; F232-N234 VanDerWaalsContact C-N 3.32Å; F232-N234 PolarHBondContact O-N 3.41Å; N234-K236 VanDerWaalsContact C-N 3.32Å; N234-K236 PolarHBondContact O-N 2.94Å; N234-E237 PolarHBondContact O-N 3.29Å; N234-V238 WeakPolarHBondContact O-CG2 3.44Å; N234-V238 PolarHBondContact O-N 2.95Å; N234-F341 PolarHBondContact ND2-O 2.97Å; N234-G342 PolarHBondContact ND2-O 3.28Å; N234-S344 PolarHBondContact ND2-N 2.9Å; N234-S344 PolarHBondContact ND2-O 2.9Å; N234-S344 PolarHBondContact OD1-O 2.92Å
235	E	97	Very high	93.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-42.5	178.7	-173	159.9	175.1	0	0	111.5	K222 Y224 Q231 F232 V238 Y239 I266 F341	K222-E235 IonicContact NZ-OE1 3.49Å; K222-E235 PolarHBondContact NZ-OE1 3.38Å; K222-E235 IonicContact NZ-OE2 2.78Å; K222-E235 PolarHBondContact NZ-OE2 2.89Å; Y224-E235 PolarHBondContact OH-OE2 3.39Å; Q231-E235 VanDerWaalsContact O-CB 3.29Å; Q231-E235 WeakPolarHBondContact O-CB 3.18Å; Q231-E235 PolarHBondContact O-N 3.31Å; F232-E235 PolarHBondContact O-N 3.27Å; E235-V238 PolarHBondContact O-N 3.37Å; E235-Y239 HydrophobicContact CG-CD2 3.8Å; E235-Y239 HydrophobicContact CG-CE2 3.58Å; E235-Y239 VanDerWaalsContact O-CD2 3.24Å; E235-Y239 WeakPolarHBondContact O-CD2 3.41Å; E235-Y239 PolarHBondContact O-N 2.77Å; E235-I266 HydrophobicContact CB-CD1 3.87Å; E235-I266 HydrophobicContact CG-CD1 3.73Å; E235-F341 HydrophobicContact CG-CB 4.1Å
236	K	96.8	Very high	94	Very high	53 Å²	53	63.1 Å²	63.1	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-49.9	173.1	-179.6	-177.2	177.8	171.8	0	111.7	F232 N234 V238 Y239 E240 T255	F232-K236 HydrophobicContact CE1-CD 4.22Å; F232-K236 HydrophobicContact CZ-CD 4.22Å; F232-K236 WeakPolarHBondContact O-CB 3.38Å; F232-K236 PolarHBondContact O-N 3.11Å; N234-K236 VanDerWaalsContact C-N 3.32Å; N234-K236 PolarHBondContact O-N 2.94Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 2.69Å; K236-Y239 PolarHBondContact O-N 3.09Å; K236-E240 WeakPolarHBondContact CE-OE1 3.44Å; K236-E240 WeakPolarHBondContact CE-OE2 3.4Å; K236-E240 HydrophobicContact CG-CG 4.27Å; K236-E240 IonicContact NZ-OE1 2.69Å; K236-E240 WeakPolarHBondContact O-CB 3.08Å; K236-E240 WeakPolarHBondContact O-CG 3.5Å; K236-E240 PolarHBondContact O-N 3.23Å; K236-T255 HydrophobicContact CB-CG2 4.43Å; K236-T255 HydrophobicContact CD-CG2 3.8Å; K236-T255 HydrophobicContact CG-CG2 3.92Å
237	E	97.1	Very high	94.6	Very high	76 Å²	76	59.4 Å²	59.4	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-41.8	-179.8	-173.6	-176.7	170.9	0	0	111.2	M233 N234 E240 L241 I346 R348	M233-E237 WeakPolarHBondContact O-CB 3.32Å; M233-E237 PolarHBondContact O-N 3.38Å; N234-E237 PolarHBondContact O-N 3.29Å; E237-E240 PolarHBondContact O-N 2.86Å; E237-L241 PolarHBondContact O-N 2.83Å; E237-I346 HydrophobicContact CB-CD1 4.48Å; E237-I346 HydrophobicContact CG-CD1 3.74Å; E237-R348 IonicContact OE1-CZ 3.53Å; E237-R348 IonicContact OE1-NH1 2.9Å; E237-R348 PolarHBondContact OE1-NH1 2.94Å; E237-R348 IonicContact OE1-NH2 3.32Å; E237-R348 PolarHBondContact OE1-NH2 3.43Å
238	V	97.6	Very high	95.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-48.6	177.2	174.2	0	0	0	0	111.1	N234 E235 K236 E240 L241 M244 V318 F341 I346	N234-V238 WeakPolarHBondContact O-CG2 3.44Å; N234-V238 PolarHBondContact O-N 2.95Å; E235-V238 PolarHBondContact O-N 3.37Å; K236-V238 VanDerWaalsContact C-N 3.28Å; K236-V238 PolarHBondContact O-N 2.69Å; V238-E240 VanDerWaalsContact C-N 3.29Å; V238-E240 PolarHBondContact O-N 3.11Å; V238-L241 WeakPolarHBondContact O-CB 3.43Å; V238-L241 PolarHBondContact O-N 3.43Å; V238-M244 HydrophobicContact CG1-CE 3.68Å; V238-M244 WeakPolarHBondContact O-CG 3.5Å; V238-V318 HydrophobicContact CG1-CG1 4.13Å; V238-V318 HydrophobicContact CG2-CG1 4.41Å; V238-F341 HydrophobicContact CB-CB 3.78Å; V238-F341 HydrophobicContact CB-CG 4.28Å; V238-F341 HydrophobicContact CG1-CB 3.65Å; V238-F341 HydrophobicContact CG1-CD1 4.04Å; V238-F341 HydrophobicContact CG1-CD2 4.04Å; V238-F341 HydrophobicContact CG1-CG 3.62Å; V238-F341 HydrophobicContact CG2-CB 4.2Å; V238-I346 HydrophobicContact CG2-CD1 4.06Å; V238-I346 HydrophobicContact CG2-CG1 3.94Å
239	Y	98.1	Very high	95.7	Very high	18 Å²	18	56.3 Å²	56.3	7%	0.071	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-32.8	178.7	-81.9	-61.3	0	0	0	113.6	E235 K236 L241 I249 L250 F252 L268 F341	E235-Y239 HydrophobicContact CG-CD2 3.8Å; E235-Y239 HydrophobicContact CG-CE2 3.58Å; E235-Y239 VanDerWaalsContact O-CD2 3.24Å; E235-Y239 WeakPolarHBondContact O-CD2 3.41Å; E235-Y239 PolarHBondContact O-N 2.77Å; K236-Y239 PolarHBondContact O-N 3.09Å; Y239-L241 VanDerWaalsContact C-N 3.31Å; Y239-I249 HydrophobicContact CE1-CG2 4.43Å; Y239-L250 WeakPolarHBondContact CE1-O 3.48Å; Y239-F252 HydrophobicContact CD1-CB 3.51Å; Y239-F252 HydrophobicContact CD1-CD2 4.43Å; Y239-F252 HydrophobicContact CD1-CG 4.17Å; Y239-F252 HydrophobicContact CD2-CB 4.38Å; Y239-F252 AromaticContact CD2-CD2 3.79Å; Y239-F252 HydrophobicContact CD2-CD2 3.79Å; Y239-F252 HydrophobicContact CD2-CE2 4.32Å; Y239-F252 HydrophobicContact CD2-CG 4.3Å; Y239-F252 HydrophobicContact CE1-CB 4.02Å; Y239-F252 HydrophobicContact CE2-CD2 4.41Å; Y239-F252 HydrophobicContact CG-CB 3.71Å; Y239-F252 AromaticContact CG-CD2 3.8Å; Y239-F252 HydrophobicContact CG-CD2 3.8Å; Y239-F252 HydrophobicContact CG-CE2 4.5Å; Y239-F252 AromaticContact CG-CG 3.83Å; Y239-F252 HydrophobicContact CG-CG 3.83Å; Y239-L268 HydrophobicContact CE1-CD2 4.34Å; Y239-L268 HydrophobicContact CE2-CD2 3.82Å; Y239-F341 HydrophobicContact CD1-CD2 4.03Å; Y239-F341 AromaticContact CD1-CE2 3.97Å; Y239-F341 HydrophobicContact CD1-CE2 3.97Å; Y239-F341 HydrophobicContact CD2-CD2 4.08Å; Y239-F341 AromaticContact CE1-CD2 3.63Å; Y239-F341 HydrophobicContact CE1-CD2 3.63Å; Y239-F341 AromaticContact CE1-CE2 3.33Å; Y239-F341 HydrophobicContact CE1-CE2 3.33Å; Y239-F341 AromaticContact CE2-CD2 3.65Å; Y239-F341 HydrophobicContact CE2-CD2 3.65Å; Y239-F341 HydrophobicContact CE2-CE2 4.17Å; Y239-F341 HydrophobicContact CG-CD2 4.25Å; Y239-F341 AromaticContact CZ-CD2 3.4Å; Y239-F341 VanDerWaalsContact CZ-CD2 3.4Å; Y239-F341 AromaticContact CZ-CE2 3.42Å; Y239-F341 VanDerWaalsContact CZ-CE2 3.42Å
240	E	96.8	Very high	96.1	Very high	109 Å²	109	50.1 Å²	50.1	51%	0.509	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.1	-179.9	-70.7	-178.1	161.6	0	0	113.7	K236 E237 V238 F252	K236-E240 WeakPolarHBondContact CE-OE1 3.44Å; K236-E240 WeakPolarHBondContact CE-OE2 3.4Å; K236-E240 HydrophobicContact CG-CG 4.27Å; K236-E240 IonicContact NZ-OE1 2.69Å; K236-E240 WeakPolarHBondContact O-CB 3.08Å; K236-E240 WeakPolarHBondContact O-CG 3.5Å; K236-E240 PolarHBondContact O-N 3.23Å; E237-E240 PolarHBondContact O-N 2.86Å; V238-E240 VanDerWaalsContact C-N 3.29Å; V238-E240 PolarHBondContact O-N 3.11Å; E240-F252 HydrophobicContact CG-CE1 4.02Å; E240-F252 HydrophobicContact CG-CZ 4.41Å
241	L	96.1	Very high	96.4	Very high	18 Å²	18	48.6 Å²	48.6	9%	0.094	23%	0.231	C	C	.	.	S	Bend	trans	-58.4	143.8	174.1	-79.3	173.3	0	0	0	110.5	E237 V238 Y239 M244 P316 V318 I346	E237-L241 PolarHBondContact O-N 2.83Å; V238-L241 WeakPolarHBondContact O-CB 3.43Å; V238-L241 PolarHBondContact O-N 3.43Å; Y239-L241 VanDerWaalsContact C-N 3.31Å; L241-M244 HydrophobicContact CB-CG 3.37Å; L241-M244 HydrophobicContact CB-SD 4.23Å; L241-M244 HydrophobicContact CD1-CG 4.46Å; L241-M244 HydrophobicContact CD1-SD 4.31Å; L241-M244 WeakPolarHBondContact O-CB 3.49Å; L241-M244 VanDerWaalsContact O-CG 3.29Å; L241-M244 WeakPolarHBondContact O-CG 3.35Å; L241-M244 PolarHBondContact O-N 2.9Å; L241-P316 HydrophobicContact CD1-CG 4.31Å; L241-P316 HydrophobicContact CD2-CG 4.24Å; L241-V318 HydrophobicContact CD1-CG2 3.73Å; L241-I346 HydrophobicContact CD1-CD1 3.86Å; L241-I346 HydrophobicContact CD1-CG1 3.99Å; L241-I346 HydrophobicContact CD1-CG2 4.03Å; L241-I346 HydrophobicContact CD2-CD1 4.24Å; L241-I346 HydrophobicContact CD2-CG2 4.42Å; L241-I346 HydrophobicContact CG-CD1 4.13Å
242	P	94.8	Very high	96.5	Very high	60 Å²	60	49.4 Å²	49.4	39%	0.39	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	146	175.6	-18.6	30.1	0	0	0	111.5	M244 V313 K315	P242-M244 PolarHBondContact O-N 2.62Å; P242-V313 HydrophobicContact CB-CG1 3.15Å; P242-V313 HydrophobicContact CG-CG1 4.12Å; P242-K315 VanDerWaalsContact O-CB 3.25Å; P242-K315 WeakPolarHBondContact O-CB 3.25Å; P242-K315 WeakPolarHBondContact O-CG 3.23Å
243	L	95.3	Very high	96.5	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.346	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	33	-178.4	-46.2	169.1	0	0	0	113.5	Y303 L308 V313 K315	L243-Y303 WeakPolarHBondContact O-CE1 3.07Å; L243-Y303 VanDerWaalsContact O-CZ 3.31Å; L243-Y303 PolarHBondContact O-OH 3.15Å; L243-L308 HydrophobicContact CD1-CB 4.21Å; L243-V313 HydrophobicContact CD1-CG1 4.11Å; L243-V313 HydrophobicContact CD2-CG1 4.4Å; L243-V313 HydrophobicContact CG-CG1 3.86Å; L243-K315 HydrophobicContact CB-CB 4.12Å; L243-K315 HydrophobicContact CD1-CB 4.46Å
244	M	96.1	Very high	96.5	Very high	7 Å²	7	47.5 Å²	47.5	3%	0.034	23%	0.229	C	C	.	.			trans	-87.7	-15.9	172.7	-77.1	-64.9	-67.9	0	0	114.8	V238 L241 P242 H246 L304 K315	V238-M244 HydrophobicContact CG1-CE 3.68Å; V238-M244 WeakPolarHBondContact O-CG 3.5Å; L241-M244 HydrophobicContact CB-CG 3.37Å; L241-M244 HydrophobicContact CB-SD 4.23Å; L241-M244 HydrophobicContact CD1-CG 4.46Å; L241-M244 HydrophobicContact CD1-SD 4.31Å; L241-M244 WeakPolarHBondContact O-CB 3.49Å; L241-M244 VanDerWaalsContact O-CG 3.29Å; L241-M244 WeakPolarHBondContact O-CG 3.35Å; L241-M244 PolarHBondContact O-N 2.9Å; P242-M244 PolarHBondContact O-N 2.62Å; M244-H246 PolarHBondContact O-N 2.91Å; M244-L304 HydrophobicContact CE-CD1 3.74Å; M244-K315 HydrophobicContact SD-CD 4.07Å; M244-K315 WeakPolarHBondContact SD-CE 3.43Å; M244-K315 HydrophobicContact SD-CG 4.09Å
245	K	95.8	Very high	96.5	Very high	167 Å²	167	48.2 Å²	48.2	73%	0.726	23%	0.234	S	C	*	.			trans	-71.9	114.2	179.2	-173.3	179.4	-179.8	-179.4	0	109.8
246	H	97.1	Very high	96.1	Very high	61 Å²	61	50.7 Å²	50.7	28%	0.282	25%	0.246	S	C	.	.			trans	-146.5	154.7	-178.9	-176.8	-105	0	0	0	110.8	M244 R248 I249 Y303	M244-H246 PolarHBondContact O-N 2.91Å; H246-R248 WeakPolarHBondContact ND1-CB 3.26Å; H246-R248 PolarHBondContact ND1-N 2.82Å; H246-R248 PolarHBondContact O-N 3.48Å; H246-I249 HydrophobicContact CB-CB 4.31Å; H246-I249 HydrophobicContact CB-CG1 3.97Å; H246-I249 PolarHBondContact O-N 3.47Å; H246-I249 VanDerWaalsContact O-O 3.07Å; H246-Y303 HydrophobicContact CB-CD1 3.55Å; H246-Y303 HydrophobicContact CB-CD2 4.33Å; H246-Y303 HydrophobicContact CB-CE1 3.39Å; H246-Y303 HydrophobicContact CB-CE2 4.18Å; H246-Y303 HydrophobicContact CB-CG 4.01Å; H246-Y303 AromaticContact CD2-CD2 3.38Å; H246-Y303 WeakPolarHBondContact CD2-CD2 3.25Å; H246-Y303 AromaticContact CD2-CE2 3.48Å; H246-Y303 VanDerWaalsContact CD2-CE2 3.48Å; H246-Y303 WeakPolarHBondContact CD2-CE2 3.4Å; H246-Y303 AromaticContact CD2-CG 3.7Å; H246-Y303 AromaticContact CD2-CZ 3.9Å; H246-Y303 AromaticContact CG-CD1 3.69Å; H246-Y303 AromaticContact CG-CD2 3.77Å; H246-Y303 AromaticContact CG-CE1 3.9Å; H246-Y303 AromaticContact CG-CE2 3.97Å; H246-Y303 AromaticContact CG-CG 3.59Å; H246-Y303 AromaticContact CG-CZ 3.99Å; H246-Y303 AromaticContact ND1-CG 3.86Å; H246-Y303 AromaticContact NE2-CD2 3.75Å
247	E	96.9	Very high	95.5	Very high	112 Å²	112	55.7 Å²	55.7	52%	0.523	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.8	-177.9	-163	-175.1	144.8	0	0	112.1	R331 V337	E247-R331 PolarHBondContact O-NH1 3.39Å; E247-V337 WeakPolarHBondContact O-CG1 3.3Å
248	R	98.2	Very high	94.6	Very high	26 Å²	26	54.5 Å²	54.5	10%	0.098	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8.3	-178	-51.8	-60	177.4	-124.2	-18.6	115	H246 S296 E299 T335 C336 V337 L338	H246-R248 WeakPolarHBondContact ND1-CB 3.26Å; H246-R248 PolarHBondContact ND1-N 2.82Å; H246-R248 PolarHBondContact O-N 3.48Å; R248-S296 WeakPolarHBondContact CD-O 3.4Å; R248-S296 WeakPolarHBondContact CG-O 3.26Å; R248-E299 HydrophobicContact CG-CB 3.88Å; R248-E299 IonicContact CZ-OE2 3.82Å; R248-E299 IonicContact NE-OE2 2.97Å; R248-E299 PolarHBondContact NE-OE2 3.17Å; R248-E299 IonicContact NH2-OE2 3.79Å; R248-T335 VanDerWaalsContact NH1-CB 3.35Å; R248-T335 PolarHBondContact NH1-OG1 3.46Å; R248-C336 WeakPolarHBondContact CD-O 3.25Å; R248-V337 WeakPolarHBondContact O-CA 3.24Å; R248-L338 PolarHBondContact O-N 3.39Å
249	I	98.4	Very high	93.4	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.026	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-113.8	134.5	172.1	-58.9	-60.1	0	0	0	107.3	Y239 H246 Q251 Y303 L304 L338 F341	Y239-I249 HydrophobicContact CE1-CG2 4.43Å; H246-I249 HydrophobicContact CB-CB 4.31Å; H246-I249 HydrophobicContact CB-CG1 3.97Å; H246-I249 PolarHBondContact O-N 3.47Å; H246-I249 VanDerWaalsContact O-O 3.07Å; I249-Q251 PolarHBondContact O-N 2.93Å; I249-Y303 HydrophobicContact CG1-CD1 4.17Å; I249-L304 HydrophobicContact CD1-CB 4.43Å; I249-L304 HydrophobicContact CD1-CD1 4.49Å; I249-L338 HydrophobicContact CD1-CB 4Å; I249-L338 HydrophobicContact CD1-CD1 4.09Å; I249-L338 HydrophobicContact CD1-CG 4.38Å; I249-F341 HydrophobicContact CD1-CZ 4.36Å; I249-F341 HydrophobicContact CG2-CE2 3.97Å; I249-F341 HydrophobicContact CG2-CZ 3.88Å
250	L	97.9	Very high	92.3	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.026	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-59.3	134.6	-178.9	-173.6	65.8	0	0	0	110.2	Y239 F252 L268 Q269 L329 V337 L338 C339	Y239-L250 WeakPolarHBondContact CE1-O 3.48Å; L250-F252 PolarHBondContact O-N 3.39Å; L250-L268 HydrophobicContact CD2-CB 3.91Å; L250-L268 HydrophobicContact CD2-CD1 3.86Å; L250-L268 HydrophobicContact CD2-CG 4.29Å; L250-L268 HydrophobicContact CG-CB 4.39Å; L250-Q269 HydrophobicContact CD1-CB 4.3Å; L250-L329 HydrophobicContact CD1-CD1 4.01Å; L250-L329 HydrophobicContact CD2-CD1 3.7Å; L250-L329 HydrophobicContact CG-CD1 4.45Å; L250-V337 HydrophobicContact CB-CG2 4.2Å; L250-V337 HydrophobicContact CD1-CG2 3.84Å; L250-L338 VanDerWaalsContact CB-O 3.31Å; L250-L338 WeakPolarHBondContact CB-O 3.32Å; L250-L338 PolarHBondContact N-O 2.78Å; L250-C339 HydrophobicContact CB-CB 3.94Å; L250-C339 HydrophobicContact CD2-CB 3.58Å; L250-C339 HydrophobicContact CG-CB 4.41Å
251	Q	96.8	Very high	91.4	Very high	69 Å²	69	65 Å²	65	32%	0.322	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-73.3	117.1	-174.1	179.6	179.1	3.8	0	0	111.1	I249 L253 L268 Q269	I249-Q251 PolarHBondContact O-N 2.93Å; Q251-L253 HydrophobicContact CG-CD2 3.99Å; Q251-L268 WeakPolarHBondContact O-CA 3.29Å; Q251-Q269 HydrophobicContact CB-CB 3.81Å; Q251-Q269 PolarHBondContact O-N 3.44Å
252	F	96.4	Very high	90.6	Very high	48 Å²	48	66.7 Å²	66.7	21%	0.211	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.7	168.7	178.1	-112.4	0	0	0	110.8	Y239 E240 L250 G254 T255 I266 L268	Y239-F252 HydrophobicContact CD1-CB 3.51Å; Y239-F252 HydrophobicContact CD1-CD2 4.43Å; Y239-F252 HydrophobicContact CD1-CG 4.17Å; Y239-F252 HydrophobicContact CD2-CB 4.38Å; Y239-F252 AromaticContact CD2-CD2 3.79Å; Y239-F252 HydrophobicContact CD2-CD2 3.79Å; Y239-F252 HydrophobicContact CD2-CE2 4.32Å; Y239-F252 HydrophobicContact CD2-CG 4.3Å; Y239-F252 HydrophobicContact CE1-CB 4.02Å; Y239-F252 HydrophobicContact CE2-CD2 4.41Å; Y239-F252 HydrophobicContact CG-CB 3.71Å; Y239-F252 AromaticContact CG-CD2 3.8Å; Y239-F252 HydrophobicContact CG-CD2 3.8Å; Y239-F252 HydrophobicContact CG-CE2 4.5Å; Y239-F252 AromaticContact CG-CG 3.83Å; Y239-F252 HydrophobicContact CG-CG 3.83Å; E240-F252 HydrophobicContact CG-CE1 4.02Å; E240-F252 HydrophobicContact CG-CZ 4.41Å; L250-F252 PolarHBondContact O-N 3.39Å; F252-G254 WeakPolarHBondContact CE2-O 3.45Å; F252-G254 VanDerWaalsContact CZ-CA 3.41Å; F252-T255 HydrophobicContact CE2-CG2 3.9Å; F252-T255 HydrophobicContact CZ-CG2 3.7Å; F252-I266 HydrophobicContact CD2-CG2 3.9Å; F252-I266 HydrophobicContact CE2-CG2 3.84Å; F252-L268 HydrophobicContact CB-CD2 4.4Å; F252-L268 HydrophobicContact CD2-CD2 4.11Å
253	L	95.1	Very high	90.2	Very high	62 Å²	62	65 Å²	65	33%	0.325	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-31.4	178.2	-55.8	179.6	0	0	0	110.8	I192 V219 Q251 V267	I192-L253 WeakPolarHBondContact CD1-O 3.46Å; V219-L253 HydrophobicContact CB-CD1 4.4Å; V219-L253 HydrophobicContact CG1-CD1 3.63Å; Q251-L253 HydrophobicContact CG-CD2 3.99Å; L253-V267 WeakPolarHBondContact CA-O 3.3Å; L253-V267 HydrophobicContact CB-CB 4.29Å; L253-V267 HydrophobicContact CB-CG1 4.16Å; L253-V267 WeakPolarHBondContact CB-O 3.36Å; L253-V267 HydrophobicContact CD1-CG1 4.15Å; L253-V267 PolarHBondContact N-O 3.13Å
254	G	94.2	Very high	90.1	Very high	10 Å²	10	63.6 Å²	63.6	10%	0.103	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.5	-160.6	164	0	0	0	0	0	112.5	F252 V267	F252-G254 WeakPolarHBondContact CE2-O 3.45Å; F252-G254 VanDerWaalsContact CZ-CA 3.41Å; G254-V267 PolarHBondContact N-O 3.29Å; G254-V267 PolarHBondContact O-N 3.21Å
255	T	94.1	Very high	90.1	Very high	41 Å²	41	63.5 Å²	63.5	25%	0.252	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.5	179.1	65.1	0	0	0	0	112.3	F232 K236 F252 L265 I266	F232-T255 HydrophobicContact CE2-CG2 4Å; F232-T255 HydrophobicContact CZ-CG2 3.92Å; K236-T255 HydrophobicContact CB-CG2 4.43Å; K236-T255 HydrophobicContact CD-CG2 3.8Å; K236-T255 HydrophobicContact CG-CG2 3.92Å; F252-T255 HydrophobicContact CE2-CG2 3.9Å; F252-T255 HydrophobicContact CZ-CG2 3.7Å; T255-L265 WeakPolarHBondContact CA-O 3.08Å; T255-L265 WeakPolarHBondContact CB-O 3.37Å; T255-I266 HydrophobicContact CG2-CG1 4.08Å
256	E	88.4	Confident	90.1	Very high	51 Å²	51	55.5 Å²	55.5	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	162.7	172.8	-172.5	173.6	-175.9	0	0	110	I192 L265	I192-E256 HydrophobicContact CG2-CB 4.23Å; I192-E256 WeakPolarHBondContact CG2-OE2 3.37Å; E256-L265 HydrophobicContact CB-CB 4.14Å; E256-L265 HydrophobicContact CB-CD1 3.76Å; E256-L265 HydrophobicContact CG-CD1 3.99Å; E256-L265 PolarHBondContact N-O 3.12Å; E256-L265 WeakPolarHBondContact O-CB 3.07Å; E256-L265 PolarHBondContact O-N 3.2Å
257	R	85.5	Confident	90	Very high	158 Å²	158	52.6 Å²	52.6	60%	0.596	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.4	170.5	-177.6	174.7	177.8	170	-2.2	108.1	S262 S263 L264	R257-S262 PolarHBondContact NE-OG 3.06Å; R257-S262 VanDerWaalsContact NH2-CB 3.31Å; R257-S262 PolarHBondContact NH2-OG 2.89Å; R257-S263 WeakPolarHBondContact CA-O 3.28Å; R257-L264 HydrophobicContact CG-CD2 4.39Å
258	K	77.9	Confident	90	Very high	52 Å²	52	47.8 Å²	47.8	23%	0.226	25%	0.249	C	C	.	.			trans	-61.8	133	177.5	-76.4	-163.1	176	-179.4	0	110.5	D260 D261 S262 S263 L265	K258-D260 VanDerWaalsContact C-N 3.27Å; K258-D260 PolarHBondContact O-N 3.3Å; K258-D261 VanDerWaalsContact CB-OD1 3.25Å; K258-D261 WeakPolarHBondContact CB-OD1 3.49Å; K258-S262 VanDerWaalsContact O-CA 3.23Å; K258-S262 WeakPolarHBondContact O-CA 3.27Å; K258-S262 PolarHBondContact O-N 3.34Å; K258-S262 VanDerWaalsContact O-N 3.14Å; K258-S263 PolarHBondContact N-O 2.99Å; K258-L265 HydrophobicContact CG-CD1 3.66Å; K258-L265 HydrophobicContact CG-CD2 4.31Å; K258-L265 HydrophobicContact CG-CG 4.23Å
259	P	71.4	Confident	89.9	Confident	113 Å²	113	49.3 Å²	49.3	73%	0.734	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-35.8	175.9	-22.4	33.4	0	0	0	112.8
260	D	74.3	Confident	89.7	Confident	141 Å²	141	51.3 Å²	51.3	75%	0.754	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-50.9	-164.1	-31	-21.3	0	0	0	112.3	K258	K258-D260 VanDerWaalsContact C-N 3.27Å; K258-D260 PolarHBondContact O-N 3.3Å
261	D	79.3	Confident	89.6	Confident	92 Å²	92	51.4 Å²	51.4	49%	0.492	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	4.4	-173.5	67.9	-6.3	0	0	0	112.8	K258 S263	K258-D261 VanDerWaalsContact CB-OD1 3.25Å; K258-D261 WeakPolarHBondContact CB-OD1 3.49Å; D261-S263 PolarHBondContact O-N 3.17Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 WeakPolarHBondContact OD1-CB 3.46Å; D261-S263 PolarHBondContact OD1-N 2.99Å; D261-S263 PolarHBondContact OD1-OG 3Å; D261-S263 VanDerWaalsContact OD1-OG 3.07Å; D261-S263 PolarHBondContact OD2-OG 2.78Å
262	S	79.7	Confident	89.3	Confident	55 Å²	55	52.9 Å²	52.9	39%	0.385	27%	0.273	S	S	.	.			trans	58.8	16.8	-174.9	-77.9	0	0	0	0	115.2	R257 K258	R257-S262 PolarHBondContact NE-OG 3.06Å; R257-S262 VanDerWaalsContact NH2-CB 3.31Å; R257-S262 PolarHBondContact NH2-OG 2.89Å; K258-S262 VanDerWaalsContact O-CA 3.23Å; K258-S262 WeakPolarHBondContact O-CA 3.27Å; K258-S262 PolarHBondContact O-N 3.34Å; K258-S262 VanDerWaalsContact O-N 3.14Å
263	S	86.3	Confident	89.3	Confident	23 Å²	23	54.4 Å²	54.4	16%	0.161	28%	0.281	C	S	.	.			trans	-59.1	139.1	176.3	-72.7	0	0	0	0	111.2	R257 K258 D261	R257-S263 WeakPolarHBondContact CA-O 3.28Å; K258-S263 PolarHBondContact N-O 2.99Å; D261-S263 PolarHBondContact O-N 3.17Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 WeakPolarHBondContact OD1-CB 3.46Å; D261-S263 PolarHBondContact OD1-N 2.99Å; D261-S263 PolarHBondContact OD1-OG 3Å; D261-S263 VanDerWaalsContact OD1-OG 3.07Å; D261-S263 PolarHBondContact OD2-OG 2.78Å
264	L	93.4	Very high	89.3	Confident	37 Å²	37	52.9 Å²	52.9	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	133.6	179.8	-62.5	173.4	0	0	0	109.7	Y224 K229 F232 R257	Y224-L264 PolarHBondContact N-O 3.04Å; K229-L264 HydrophobicContact CB-CD1 4.48Å; K229-L264 HydrophobicContact CG-CD1 4.04Å; F232-L264 HydrophobicContact CB-CD1 4.35Å; F232-L264 HydrophobicContact CD1-CB 4.16Å; F232-L264 HydrophobicContact CD1-CD1 3.59Å; F232-L264 HydrophobicContact CD1-CG 4.32Å; F232-L264 HydrophobicContact CD2-CB 3.7Å; F232-L264 HydrophobicContact CE1-CB 4.25Å; F232-L264 HydrophobicContact CE1-CD1 3.98Å; F232-L264 HydrophobicContact CE1-CD2 4.16Å; F232-L264 HydrophobicContact CE1-CG 4.36Å; F232-L264 HydrophobicContact CE2-CB 3.81Å; F232-L264 HydrophobicContact CG-CB 3.87Å; F232-L264 HydrophobicContact CG-CD1 3.91Å; F232-L264 HydrophobicContact CG-CG 4.47Å; F232-L264 HydrophobicContact CZ-CB 4.08Å; F232-L264 HydrophobicContact CZ-CD2 4.29Å; R257-L264 HydrophobicContact CG-CD2 4.39Å
265	L	94.1	Very high	89.5	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.9	-173.1	-56.1	164.6	0	0	0	110.7	V221 K222 V223 T255 E256 K258	V221-L265 HydrophobicContact CG1-CD2 3.91Å; K222-L265 WeakPolarHBondContact O-CA 3.47Å; V223-L265 HydrophobicContact CB-CD2 4.05Å; V223-L265 HydrophobicContact CG1-CD2 4.01Å; V223-L265 HydrophobicContact CG2-CD2 3.53Å; T255-L265 WeakPolarHBondContact CA-O 3.08Å; T255-L265 WeakPolarHBondContact CB-O 3.37Å; E256-L265 HydrophobicContact CB-CB 4.14Å; E256-L265 HydrophobicContact CB-CD1 3.76Å; E256-L265 HydrophobicContact CG-CD1 3.99Å; E256-L265 PolarHBondContact N-O 3.12Å; E256-L265 WeakPolarHBondContact O-CB 3.07Å; E256-L265 PolarHBondContact O-N 3.2Å; K258-L265 HydrophobicContact CG-CD1 3.66Å; K258-L265 HydrophobicContact CG-CD2 4.31Å; K258-L265 HydrophobicContact CG-CG 4.23Å
266	I	96.2	Very high	89.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129	161	-67	-174.2	0	0	0	108.2	K222 Y224 F232 E235 F252 T255 L268	K222-I266 HydrophobicContact CB-CB 4.43Å; K222-I266 PolarHBondContact N-O 3.48Å; K222-I266 PolarHBondContact O-N 2.94Å; Y224-I266 HydrophobicContact CE2-CB 4.26Å; Y224-I266 HydrophobicContact CE2-CD1 3.99Å; Y224-I266 HydrophobicContact CE2-CG1 3.91Å; Y224-I266 WeakPolarHBondContact OH-CD1 3.49Å; F232-I266 HydrophobicContact CD2-CD1 4.05Å; F232-I266 HydrophobicContact CD2-CG1 3.75Å; F232-I266 HydrophobicContact CE2-CD1 4.28Å; F232-I266 HydrophobicContact CE2-CG1 3.64Å; E235-I266 HydrophobicContact CB-CD1 3.87Å; E235-I266 HydrophobicContact CG-CD1 3.73Å; F252-I266 HydrophobicContact CD2-CG2 3.9Å; F252-I266 HydrophobicContact CE2-CG2 3.84Å; T255-I266 HydrophobicContact CG2-CG1 4.08Å; I266-L268 HydrophobicContact CG2-CD1 4.22Å; I266-L268 HydrophobicContact CG2-CD2 3.6Å; I266-L268 HydrophobicContact CG2-CG 3.8Å
267	V	96.6	Very high	90.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125	-179.7	-169.4	0	0	0	0	108.4	I192 I195 V219 L253 G254	I192-V267 HydrophobicContact CD1-CG2 4.48Å; I192-V267 HydrophobicContact CG2-CG2 3.87Å; I195-V267 HydrophobicContact CD1-CB 4.29Å; I195-V267 HydrophobicContact CD1-CG1 3.87Å; I195-V267 HydrophobicContact CD1-CG2 3.39Å; V219-V267 HydrophobicContact CB-CG1 4.07Å; V219-V267 HydrophobicContact CG1-CG1 4.33Å; V219-V267 HydrophobicContact CG2-CG1 4.2Å; L253-V267 WeakPolarHBondContact CA-O 3.3Å; L253-V267 HydrophobicContact CB-CB 4.29Å; L253-V267 HydrophobicContact CB-CG1 4.16Å; L253-V267 WeakPolarHBondContact CB-O 3.36Å; L253-V267 HydrophobicContact CD1-CG1 4.15Å; L253-V267 PolarHBondContact N-O 3.13Å; G254-V267 PolarHBondContact N-O 3.29Å; G254-V267 PolarHBondContact O-N 3.21Å
268	L	96.6	Very high	90.7	Very high	10 Å²	10	46 Å²	46	5%	0.052	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156.9	-172.1	-56.7	168.3	0	0	0	109.8	A220 Y239 L250 Q251 F252 I266 Y270	A220-L268 HydrophobicContact CB-CB 4.35Å; A220-L268 PolarHBondContact N-O 3.29Å; A220-L268 PolarHBondContact O-N 3.47Å; Y239-L268 HydrophobicContact CE1-CD2 4.34Å; Y239-L268 HydrophobicContact CE2-CD2 3.82Å; L250-L268 HydrophobicContact CD2-CB 3.91Å; L250-L268 HydrophobicContact CD2-CD1 3.86Å; L250-L268 HydrophobicContact CD2-CG 4.29Å; L250-L268 HydrophobicContact CG-CB 4.39Å; Q251-L268 WeakPolarHBondContact O-CA 3.29Å; F252-L268 HydrophobicContact CB-CD2 4.4Å; F252-L268 HydrophobicContact CD2-CD2 4.11Å; I266-L268 HydrophobicContact CG2-CD1 4.22Å; I266-L268 HydrophobicContact CG2-CD2 3.6Å; I266-L268 HydrophobicContact CG2-CG 3.8Å; L268-Y270 PolarHBondContact O-N 3.14Å
269	Q	95.6	Very high	91.6	Very high	58 Å²	58	44.2 Å²	44.2	27%	0.271	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	137.4	165.6	173.8	178.4	49.3	0	0	109.9	L250 Q251	L250-Q269 HydrophobicContact CD1-CB 4.3Å; Q251-Q269 HydrophobicContact CB-CB 3.81Å; Q251-Q269 PolarHBondContact O-N 3.44Å
270	Y	95	Very high	92.9	Very high	47 Å²	47	38.8 Å²	38.8	18%	0.184	21%	0.213	C	C	.	.			trans	-76.7	136.5	172.4	-175.1	-99.5	0	0	0	110.6	L201 E211 M218 L268 E272	L201-Y270 HydrophobicContact CD1-CD2 4.11Å; L201-Y270 HydrophobicContact CD1-CE2 3.72Å; L201-Y270 HydrophobicContact CD2-CE2 4.04Å; E211-Y270 HydrophobicContact CG-CE2 4.31Å; M218-Y270 HydrophobicContact CB-CD1 4.22Å; M218-Y270 HydrophobicContact CB-CG 4.13Å; M218-Y270 HydrophobicContact CE-CD1 3.6Å; M218-Y270 HydrophobicContact CE-CD2 4.03Å; M218-Y270 HydrophobicContact CE-CE1 3.29Å; M218-Y270 HydrophobicContact CE-CE2 3.77Å; M218-Y270 HydrophobicContact CE-CG 3.95Å; M218-Y270 HydrophobicContact SD-CD1 4.33Å; M218-Y270 HydrophobicContact SD-CE1 4.26Å; L268-Y270 PolarHBondContact O-N 3.14Å; Y270-E272 HydrophobicContact CD1-CG 4.13Å; Y270-E272 HydrophobicContact CE1-CB 4.29Å; Y270-E272 HydrophobicContact CE1-CG 4.1Å
271	A	94.3	Very high	94	Very high	8 Å²	8	35.2 Å²	35.2	7%	0.066	20%	0.198	C	C	.	.			trans	-113.8	118.1	174.1	0	0	0	0	0	109.6	H273 G274 L329	A271-H273 PolarHBondContact O-N 3.05Å; A271-G274 PolarHBondContact O-N 3.34Å; A271-G274 VanDerWaalsContact O-N 3.13Å; A271-L329 HydrophobicContact CB-CB 3.75Å; A271-L329 HydrophobicContact CB-CD1 3.82Å; A271-L329 HydrophobicContact CB-CG 4.39Å
272	E	92.1	Very high	94.8	Very high	99 Å²	99	38.2 Å²	38.2	46%	0.463	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-26.7	-162.2	-57.7	84.3	166.1	0	0	114.1	Y270 G274 T332	Y270-E272 HydrophobicContact CD1-CG 4.13Å; Y270-E272 HydrophobicContact CE1-CB 4.29Å; Y270-E272 HydrophobicContact CE1-CG 4.1Å; E272-G274 VanDerWaalsContact C-N 3.32Å; E272-T332 HydrophobicContact CB-CG2 3.75Å; E272-T332 HydrophobicContact CG-CG2 3.81Å
273	H	95.6	Very high	95.5	Very high	81 Å²	81	39.3 Å²	39.3	38%	0.375	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	2.3	176.6	-69	-45.1	0	0	0	113.3	A271 F279 V330 R331	A271-H273 PolarHBondContact O-N 3.05Å; H273-F279 HydrophobicContact CB-CD2 3.89Å; H273-F279 HydrophobicContact CB-CE2 4.35Å; H273-V330 HydrophobicContact CB-CB 3.88Å; H273-V330 HydrophobicContact CB-CG1 4.05Å; H273-V330 WeakPolarHBondContact CB-O 3.44Å; H273-V330 PolarHBondContact N-O 2.75Å; H273-R331 PolarHBondContact CD2-O 3.25Å
274	G	95.8	Very high	95.9	Very high	29 Å²	29	40.7 Å²	40.7	30%	0.299	22%	0.218	S	C	.	.			trans	65	-151.8	179.1	0	0	0	0	0	112.5	A271 E272 L329 V330	A271-G274 PolarHBondContact O-N 3.34Å; A271-G274 VanDerWaalsContact O-N 3.13Å; E272-G274 VanDerWaalsContact C-N 3.32Å; G274-L329 CarbonylContact O-C 3.58Å; G274-L329 VanDerWaalsContact O-CA 3.31Å; G274-L329 WeakPolarHBondContact O-CA 3.34Å; G274-V330 PolarHBondContact O-N 3.46Å
275	S	97.5	Very high	96.1	Very high	20 Å²	20	39.1 Å²	39.1	14%	0.14	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-70.1	149.8	179.4	64.9	0	0	0	0	112.6	H277 S278 F279 S326 V328	S275-H277 PolarHBondContact O-N 3.19Å; S275-S278 PolarHBondContact O-N 3.09Å; S275-S278 VanDerWaalsContact O-N 3.07Å; S275-S278 PolarHBondContact OG-N 2.82Å; S275-S278 PolarHBondContact OG-OG 3.49Å; S275-F279 WeakPolarHBondContact O-CB 3.32Å; S275-F279 PolarHBondContact O-N 3.45Å; S275-S326 WeakPolarHBondContact CB-O 3.44Å; S275-V328 CarbonylContact C-O 3.54Å; S275-V328 VanDerWaalsContact CA-O 3.3Å; S275-V328 WeakPolarHBondContact CA-O 2.87Å
276	L	98.6	Very high	96.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-39.5	173.9	177.5	65.6	0	0	0	110.6	S278 F279 L280 L293 S325 V328 V330 I404 I408	L276-S278 PolarHBondContact O-N 3.03Å; L276-F279 WeakPolarHBondContact O-CB 3.19Å; L276-F279 PolarHBondContact O-N 2.88Å; L276-L280 HydrophobicContact CD1-CD1 4.03Å; L276-L280 HydrophobicContact CD1-CD2 4.19Å; L276-L280 HydrophobicContact CD1-CG 3.86Å; L276-L280 HydrophobicContact CD2-CD1 4.45Å; L276-L280 HydrophobicContact CG-CD1 3.86Å; L276-L280 HydrophobicContact CG-CG 4.12Å; L276-L280 WeakPolarHBondContact O-CB 3.45Å; L276-L280 VanDerWaalsContact O-CG 3.24Å; L276-L280 WeakPolarHBondContact O-CG 2.94Å; L276-L280 PolarHBondContact O-N 3.37Å; L276-L293 HydrophobicContact CD1-CD1 4.42Å; L276-S325 WeakPolarHBondContact CB-O 3.35Å; L276-S325 PolarHBondContact N-O 3.03Å; L276-V328 HydrophobicContact CB-CB 3.98Å; L276-V328 HydrophobicContact CB-CG1 4.05Å; L276-V328 HydrophobicContact CD2-CB 4.26Å; L276-V328 HydrophobicContact CD2-CG1 4.1Å; L276-V328 PolarHBondContact N-O 3.44Å; L276-V330 HydrophobicContact CB-CG2 4.07Å; L276-V330 HydrophobicContact CD1-CG2 3.8Å; L276-I404 HydrophobicContact CD2-CG2 3.52Å; L276-I408 HydrophobicContact CD1-CG1 4.28Å; L276-I408 HydrophobicContact CD2-CD1 3.9Å; L276-I408 HydrophobicContact CD2-CG1 3.93Å
277	H	97.3	Very high	96.1	Very high	51 Å²	51	43.8 Å²	43.8	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-52.5	-54.8	171.5	178	78.7	0	0	0	111.8	S275 F279 L280 C281 S325 H424	S275-H277 PolarHBondContact O-N 3.19Å; H277-F279 VanDerWaalsContact C-N 3.26Å; H277-F279 PolarHBondContact O-N 3.33Å; H277-L280 PolarHBondContact O-N 2.88Å; H277-C281 PolarHBondContact O-N 3.06Å; H277-C281 PolarHBondContact O-SG 3.41Å; H277-S325 PolarHBondContact N-O 2.79Å; H277-H424 AromaticContact CE1-CD2 3.99Å; H277-H424 AromaticContact ND1-CD2 3.95Å; H277-H424 AromaticContact ND1-NE2 3.61Å
278	S	96.6	Very high	96.1	Very high	44 Å²	44	48.2 Å²	48.2	31%	0.308	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-34.9	179.8	-61.4	0	0	0	0	112.4	S275 L276 K282	S275-S278 PolarHBondContact O-N 3.09Å; S275-S278 VanDerWaalsContact O-N 3.07Å; S275-S278 PolarHBondContact OG-N 2.82Å; S275-S278 PolarHBondContact OG-OG 3.49Å; L276-S278 PolarHBondContact O-N 3.03Å; S278-K282 WeakPolarHBondContact O-CD 3.33Å; S278-K282 WeakPolarHBondContact O-CG 3.19Å; S278-K282 PolarHBondContact O-N 3.49Å
279	F	98.1	Very high	96.2	Very high	15 Å²	15	49.8 Å²	49.8	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-49.7	177	-176.1	-92.6	0	0	0	111.4	H273 S275 L276 H277 C281 K282 H283 L289 L293 V330	H273-F279 HydrophobicContact CB-CD2 3.89Å; H273-F279 HydrophobicContact CB-CE2 4.35Å; S275-F279 WeakPolarHBondContact O-CB 3.32Å; S275-F279 PolarHBondContact O-N 3.45Å; L276-F279 WeakPolarHBondContact O-CB 3.19Å; L276-F279 PolarHBondContact O-N 2.88Å; H277-F279 VanDerWaalsContact C-N 3.26Å; H277-F279 PolarHBondContact O-N 3.33Å; F279-C281 VanDerWaalsContact C-N 3.34Å; F279-C281 PolarHBondContact O-N 3.04Å; F279-K282 PolarHBondContact O-N 3Å; F279-K282 VanDerWaalsContact O-N 3.09Å; F279-H283 AromaticContact CD2-CD2 3.51Å; F279-H283 HydrophobicContact CE1-CB 4.22Å; F279-H283 AromaticContact CE2-CD2 3.57Å; F279-H283 AromaticContact CG-CD2 3.98Å; F279-H283 HydrophobicContact CZ-CB 4.28Å; F279-H283 WeakPolarHBondContact O-CB 3.49Å; F279-H283 PolarHBondContact O-CD2 2.85Å; F279-H283 VanDerWaalsContact O-CD2 3.26Å; F279-H283 PolarHBondContact O-N 2.82Å; F279-L289 HydrophobicContact CZ-CD2 4.19Å; F279-L293 HydrophobicContact CE1-CD1 4.12Å; F279-V330 HydrophobicContact CB-CG2 4.12Å; F279-V330 HydrophobicContact CD1-CG2 4.46Å; F279-V330 HydrophobicContact CD2-CB 4.42Å; F279-V330 HydrophobicContact CD2-CG1 4.19Å; F279-V330 HydrophobicContact CE2-CG1 4.25Å; F279-V330 HydrophobicContact CG-CB 4.46Å; F279-V330 HydrophobicContact CG-CG1 4.45Å; F279-V330 HydrophobicContact CG-CG2 4.14Å
280	L	98.3	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-33.6	-179.2	-68	178.9	0	0	0	112.8	L276 H277 K282 E407 I408 R411 H424	L276-L280 HydrophobicContact CD1-CD1 4.03Å; L276-L280 HydrophobicContact CD1-CD2 4.19Å; L276-L280 HydrophobicContact CD1-CG 3.86Å; L276-L280 HydrophobicContact CD2-CD1 4.45Å; L276-L280 HydrophobicContact CG-CD1 3.86Å; L276-L280 HydrophobicContact CG-CG 4.12Å; L276-L280 WeakPolarHBondContact O-CB 3.45Å; L276-L280 VanDerWaalsContact O-CG 3.24Å; L276-L280 WeakPolarHBondContact O-CG 2.94Å; L276-L280 PolarHBondContact O-N 3.37Å; H277-L280 PolarHBondContact O-N 2.88Å; L280-K282 VanDerWaalsContact C-N 3.26Å; L280-K282 PolarHBondContact O-N 3.26Å; L280-E407 HydrophobicContact CD1-CB 3.99Å; L280-I408 HydrophobicContact CD1-CG1 4.24Å; L280-R411 HydrophobicContact CB-CG 4.14Å; L280-R411 HydrophobicContact CD2-CB 3.89Å; L280-R411 HydrophobicContact CD2-CG 4.08Å; L280-R411 PolarHBondContact O-NE 3.41Å; L280-H424 WeakPolarHBondContact CB-ND1 3.03Å
281	C	97	Very high	96.4	Very high	65 Å²	65	45.1 Å²	45.1	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-32.7	171.1	-74.4	0	0	0	0	113.2	H277 F279 H424	H277-C281 PolarHBondContact O-N 3.06Å; H277-C281 PolarHBondContact O-SG 3.41Å; F279-C281 VanDerWaalsContact C-N 3.34Å; F279-C281 PolarHBondContact O-N 3.04Å; C281-H424 PolarHBondContact SG-CD2 3.31Å
282	K	96.2	Very high	96.6	Very high	155 Å²	155	49.6 Å²	49.6	67%	0.674	27%	0.267	S	S	*	.	H	α-helix	trans	-98.8	-22.4	-174.4	-66.8	171.3	-171.8	171.2	0	113.3	S278 F279 L280	S278-K282 WeakPolarHBondContact O-CD 3.33Å; S278-K282 WeakPolarHBondContact O-CG 3.19Å; S278-K282 PolarHBondContact O-N 3.49Å; F279-K282 PolarHBondContact O-N 3Å; F279-K282 VanDerWaalsContact O-N 3.09Å; L280-K282 VanDerWaalsContact C-N 3.26Å; L280-K282 PolarHBondContact O-N 3.26Å
283	H	94.4	Very high	96.9	Very high	79 Å²	79	44.9 Å²	44.9	37%	0.366	25%	0.245	S	C	.	.			trans	-131	143.4	-167.5	-55.9	-56.3	0	0	0	111.7	F279 R411	F279-H283 AromaticContact CD2-CD2 3.51Å; F279-H283 HydrophobicContact CE1-CB 4.22Å; F279-H283 AromaticContact CE2-CD2 3.57Å; F279-H283 AromaticContact CG-CD2 3.98Å; F279-H283 HydrophobicContact CZ-CB 4.28Å; F279-H283 WeakPolarHBondContact O-CB 3.49Å; F279-H283 PolarHBondContact O-CD2 2.85Å; F279-H283 VanDerWaalsContact O-CD2 3.26Å; F279-H283 PolarHBondContact O-N 2.82Å; H283-R411 PolarHBondContact O-NE 2.73Å; H283-R411 PolarHBondContact O-NH2 3.4Å
284	A	95.6	Very high	97.1	Very high	52 Å²	52	41 Å²	41	43%	0.43	23%	0.227	S	C	.	.			trans	-106.3	140.6	157.1	0	0	0	0	0	107.1	R411 V421	A284-R411 CarbonylContact C-O 3.52Å; A284-R411 VanDerWaalsContact CA-O 3.27Å; A284-R411 WeakPolarHBondContact CA-O 3.06Å; A284-V421 HydrophobicContact CB-CB 4.28Å; A284-V421 HydrophobicContact CB-CG1 4.09Å; A284-V421 HydrophobicContact CB-CG2 4.19Å
285	S	96.1	Very high	97.2	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.021	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-107.5	153.1	-172.1	-66.1	0	0	0	0	111.2	T290 R411 C412 S413	S285-T290 WeakPolarHBondContact CB-OG1 3.35Å; S285-R411 PolarHBondContact N-O 3.15Å; S285-C412 CarbonylContact O-C 3.51Å; S285-C412 WeakPolarHBondContact O-CA 3.46Å; S285-S413 PolarHBondContact O-N 2.03Å; S285-S413 PolarHBondContact O-OG 3.25Å
286	S	96.1	Very high	97.2	Very high	57 Å²	57	41 Å²	41	40%	0.399	22%	0.217	S	C	.	.			trans	-73.3	162.8	163	64	0	0	0	0	110.1	V288 L289 T290	S286-V288 VanDerWaalsContact C-N 3.25Å; S286-V288 PolarHBondContact O-N 3.4Å; S286-L289 PolarHBondContact O-N 2.98Å; S286-T290 WeakPolarHBondContact O-CB 3.28Å; S286-T290 PolarHBondContact O-N 2.92Å; S286-T290 PolarHBondContact O-OG1 2.92Å
287	W	95.5	Very high	97.3	Very high	46 Å²	46	41 Å²	41	17%	0.174	22%	0.217	C	C	.	.	H	α-helix	trans	-50.4	-45.2	176.1	178.4	-108.4	0	0	0	112.5	L289 T290 M291 D414 L415 Q463 L467 L495	W287-L289 PolarHBondContact O-N 3.37Å; W287-T290 WeakPolarHBondContact O-CB 3.19Å; W287-T290 PolarHBondContact O-N 3.07Å; W287-M291 HydrophobicContact CD2-CG 3.88Å; W287-M291 VanDerWaalsContact CE2-CG 3.47Å; W287-M291 HydrophobicContact CE3-CG 4.31Å; W287-M291 HydrophobicContact CG-CG 4.42Å; W287-M291 HydrophobicContact CH2-CG 4.06Å; W287-M291 HydrophobicContact CH2-SD 3.59Å; W287-M291 VanDerWaalsContact CH2-SD 3.59Å; W287-M291 HydrophobicContact CZ2-CE 4.43Å; W287-M291 HydrophobicContact CZ2-CG 3.59Å; W287-M291 HydrophobicContact CZ2-SD 3.62Å; W287-M291 HydrophobicContact CZ3-CG 4.39Å; W287-M291 HydrophobicContact CZ3-SD 4.08Å; W287-M291 WeakPolarHBondContact O-CB 3.35Å; W287-M291 WeakPolarHBondContact O-CG 3.46Å; W287-M291 PolarHBondContact O-N 2.86Å; W287-D414 HydrophobicContact CB-CB 4.04Å; W287-D414 WeakPolarHBondContact CB-OD2 3.35Å; W287-D414 PolarHBondContact N-OD2 3.02Å; W287-L415 HydrophobicContact CE3-CD2 4.26Å; W287-L415 HydrophobicContact CE3-CG 4.49Å; W287-L415 HydrophobicContact CZ3-CD1 4.45Å; W287-L415 HydrophobicContact CZ3-CD2 3.91Å; W287-L415 HydrophobicContact CZ3-CG 4.35Å; W287-Q463 HydrophobicContact CH2-CB 4.28Å; W287-Q463 HydrophobicContact CH2-CG 4.35Å; W287-Q463 HydrophobicContact CZ2-CG 4.11Å; W287-L467 HydrophobicContact CH2-CD1 4.33Å; W287-L467 HydrophobicContact CH2-CD2 4.05Å; W287-L467 HydrophobicContact CZ3-CD1 4.26Å; W287-L495 HydrophobicContact CZ2-CB 4.41Å
288	V	96.3	Very high	97.3	Very high	93 Å²	93	38.6 Å²	38.6	56%	0.564	21%	0.206	S	C	*	.	H	α-helix	trans	-62.3	-44.6	-178	177.2	0	0	0	0	111.7	S286 R292	S286-V288 VanDerWaalsContact C-N 3.25Å; S286-V288 PolarHBondContact O-N 3.4Å; V288-R292 PolarHBondContact O-N 2.71Å; V288-R292 VanDerWaalsContact O-N 3.14Å
289	L	97.8	Very high	97.4	Very high	43 Å²	43	39.4 Å²	39.4	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-70.4	-42.8	177.6	179.3	58.2	0	0	0	110.8	F279 S286 W287 M291 R292 L293	F279-L289 HydrophobicContact CZ-CD2 4.19Å; S286-L289 PolarHBondContact O-N 2.98Å; W287-L289 PolarHBondContact O-N 3.37Å; L289-M291 PolarHBondContact O-N 3.49Å; L289-R292 WeakPolarHBondContact O-CB 3.46Å; L289-R292 PolarHBondContact O-N 2.97Å; L289-L293 HydrophobicContact CD1-CG 4.44Å; L289-L293 HydrophobicContact CG-CD1 4.37Å; L289-L293 WeakPolarHBondContact O-CG 3.48Å; L289-L293 PolarHBondContact O-N 2.82Å
290	T	97.9	Very high	97.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-53	-50.8	174.4	-79	0	0	0	0	111.9	S285 S286 W287 R292 L293 C294 I408 W409 C412	S285-T290 WeakPolarHBondContact CB-OG1 3.35Å; S286-T290 WeakPolarHBondContact O-CB 3.28Å; S286-T290 PolarHBondContact O-N 2.92Å; S286-T290 PolarHBondContact O-OG1 2.92Å; W287-T290 WeakPolarHBondContact O-CB 3.19Å; W287-T290 PolarHBondContact O-N 3.07Å; T290-R292 VanDerWaalsContact C-N 3.33Å; T290-R292 PolarHBondContact O-N 3.26Å; T290-L293 WeakPolarHBondContact O-CB 3.04Å; T290-L293 PolarHBondContact O-N 3.01Å; T290-C294 PolarHBondContact O-N 3.24Å; T290-C294 PolarHBondContact O-SG 3.5Å; T290-I408 HydrophobicContact CG2-CG2 3.98Å; T290-W409 VanDerWaalsContact CG2-CD1 3.44Å; T290-C412 HydrophobicContact CG2-CB 4.01Å; T290-C412 WeakPolarHBondContact OG1-CB 3.26Å; T290-C412 PolarHBondContact OG1-SG 3.04Å; T290-C412 VanDerWaalsContact OG1-SG 3.39Å
291	M	97.8	Very high	97.5	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.039	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-35.9	179.7	-70.3	-54.2	-64.7	0	0	112.1	W287 L289 L293 C294 Q295 L492 L495	W287-M291 HydrophobicContact CD2-CG 3.88Å; W287-M291 VanDerWaalsContact CE2-CG 3.47Å; W287-M291 HydrophobicContact CE3-CG 4.31Å; W287-M291 HydrophobicContact CG-CG 4.42Å; W287-M291 HydrophobicContact CH2-CG 4.06Å; W287-M291 HydrophobicContact CH2-SD 3.59Å; W287-M291 VanDerWaalsContact CH2-SD 3.59Å; W287-M291 HydrophobicContact CZ2-CE 4.43Å; W287-M291 HydrophobicContact CZ2-CG 3.59Å; W287-M291 HydrophobicContact CZ2-SD 3.62Å; W287-M291 HydrophobicContact CZ3-CG 4.39Å; W287-M291 HydrophobicContact CZ3-SD 4.08Å; W287-M291 WeakPolarHBondContact O-CB 3.35Å; W287-M291 WeakPolarHBondContact O-CG 3.46Å; W287-M291 PolarHBondContact O-N 2.86Å; L289-M291 PolarHBondContact O-N 3.49Å; M291-L293 PolarHBondContact O-N 2.82Å; M291-C294 PolarHBondContact O-N 3.11Å; M291-Q295 VanDerWaalsContact O-CB 3.3Å; M291-Q295 WeakPolarHBondContact O-CB 3.31Å; M291-Q295 WeakPolarHBondContact O-CG 3.34Å; M291-Q295 PolarHBondContact O-N 3.43Å; M291-L492 HydrophobicContact CE-CB 4.24Å; M291-L492 HydrophobicContact CE-CD2 3.86Å; M291-L492 WeakPolarHBondContact CE-O 3.45Å; M291-L495 HydrophobicContact CE-CB 3.89Å; M291-L495 HydrophobicContact CE-CD1 4.4Å
292	R	98.3	Very high	97.6	Very high	101 Å²	101	36.5 Å²	36.5	38%	0.381	19%	0.187	S	C	.	.	H	α-helix	trans	-60.6	-44.6	173	-171.7	179.7	-60.3	141.1	10.6	111.9	V288 L289 T290 S296 D333 G334 T335	V288-R292 PolarHBondContact O-N 2.71Å; V288-R292 VanDerWaalsContact O-N 3.14Å; L289-R292 WeakPolarHBondContact O-CB 3.46Å; L289-R292 PolarHBondContact O-N 2.97Å; T290-R292 VanDerWaalsContact C-N 3.33Å; T290-R292 PolarHBondContact O-N 3.26Å; R292-S296 VanDerWaalsContact O-CB 3.27Å; R292-S296 WeakPolarHBondContact O-CB 3.49Å; R292-S296 PolarHBondContact O-N 3.43Å; R292-S296 PolarHBondContact O-OG 3.48Å; R292-D333 WeakPolarHBondContact CD-O 3.34Å; R292-D333 PolarHBondContact NH1-O 3.45Å; R292-D333 VanDerWaalsContact NH1-O 3.1Å; R292-G334 WeakPolarHBondContact CD-O 3.46Å; R292-G334 WeakPolarHBondContact CG-O 3.17Å; R292-T335 HydrophobicContact CG-CG2 4.13Å
293	L	98.7	Very high	97.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-47.6	176.1	-66.3	169.3	0	0	0	110.9	L276 F279 L289 T290 M291 S296 L297 V330 G334 C336 I408	L276-L293 HydrophobicContact CD1-CD1 4.42Å; F279-L293 HydrophobicContact CE1-CD1 4.12Å; L289-L293 HydrophobicContact CD1-CG 4.44Å; L289-L293 HydrophobicContact CG-CD1 4.37Å; L289-L293 WeakPolarHBondContact O-CG 3.48Å; L289-L293 PolarHBondContact O-N 2.82Å; T290-L293 WeakPolarHBondContact O-CB 3.04Å; T290-L293 PolarHBondContact O-N 3.01Å; M291-L293 PolarHBondContact O-N 2.82Å; L293-S296 PolarHBondContact O-OG 2.97Å; L293-L297 WeakPolarHBondContact O-CB 3.25Å; L293-L297 PolarHBondContact O-N 3.45Å; L293-V330 HydrophobicContact CD2-CG1 3.89Å; L293-V330 HydrophobicContact CD2-CG2 4.1Å; L293-G334 WeakPolarHBondContact CD2-O 3.09Å; L293-C336 VanDerWaalsContact CD2-SG 3.52Å; L293-C336 PolarHBondContact O-SG 3.43Å; L293-C336 VanDerWaalsContact O-SG 3.39Å; L293-I408 HydrophobicContact CB-CD1 4.24Å; L293-I408 HydrophobicContact CB-CG2 4.24Å; L293-I408 HydrophobicContact CD1-CG2 4.26Å
294	C	98.7	Very high	97.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.2	-45.8	179.6	-65.1	0	0	0	0	112.8	T290 M291 S298 L405 W409 L492	T290-C294 PolarHBondContact O-N 3.24Å; T290-C294 PolarHBondContact O-SG 3.5Å; M291-C294 PolarHBondContact O-N 3.11Å; C294-S298 WeakPolarHBondContact O-CB 3.32Å; C294-S298 PolarHBondContact O-N 3.4Å; C294-S298 PolarHBondContact O-OG 2.95Å; C294-L405 HydrophobicContact CB-CD2 3.56Å; C294-L405 VanDerWaalsContact SG-CD2 3.54Å; C294-W409 PolarHBondContact SG-NE1 2.93Å; C294-W409 VanDerWaalsContact SG-NE1 3.45Å; C294-L492 HydrophobicContact CB-CD1 3.96Å; C294-L492 HydrophobicContact CB-CD2 3.99Å
295	Q	98.4	Very high	98	Very high	46 Å²	46	26 Å²	26	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-52.9	-178.6	-74.3	169.3	-10.3	0	0	110.6	M291 L297 S298 E299 L492 M493	M291-Q295 VanDerWaalsContact O-CB 3.3Å; M291-Q295 WeakPolarHBondContact O-CB 3.31Å; M291-Q295 WeakPolarHBondContact O-CG 3.34Å; M291-Q295 PolarHBondContact O-N 3.43Å; Q295-L297 VanDerWaalsContact C-N 3.31Å; Q295-L297 PolarHBondContact O-N 2.82Å; Q295-S298 PolarHBondContact O-N 3.48Å; Q295-S298 VanDerWaalsContact O-N 3.16Å; Q295-E299 WeakPolarHBondContact O-CB 3.43Å; Q295-E299 VanDerWaalsContact O-CG 3.26Å; Q295-E299 WeakPolarHBondContact O-CG 3.37Å; Q295-E299 PolarHBondContact O-N 2.63Å; Q295-L492 HydrophobicContact CG-CB 4.01Å; Q295-L492 PolarHBondContact NE2-O 3.33Å; Q295-M493 HydrophobicContact CG-SD 4.44Å
296	S	98.7	Very high	98	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.014	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-37.2	-179.8	57	0	0	0	0	113	R248 R292 L293 G300 C336	R248-S296 WeakPolarHBondContact CD-O 3.4Å; R248-S296 WeakPolarHBondContact CG-O 3.26Å; R292-S296 VanDerWaalsContact O-CB 3.27Å; R292-S296 WeakPolarHBondContact O-CB 3.49Å; R292-S296 PolarHBondContact O-N 3.43Å; R292-S296 PolarHBondContact O-OG 3.48Å; L293-S296 PolarHBondContact O-OG 2.97Å; S296-G300 PolarHBondContact O-N 3.23Å; S296-G300 VanDerWaalsContact O-N 3.12Å; S296-C336 WeakPolarHBondContact OG-CB 3.17Å; S296-C336 PolarHBondContact OG-N 3.22Å
297	L	98.8	Very high	97.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-49.8	172.7	174.1	57.9	0	0	0	111.8	L293 Q295 E299 G300 L301 V328 C336 L338 L401 I404 I408	L293-L297 WeakPolarHBondContact O-CB 3.25Å; L293-L297 PolarHBondContact O-N 3.45Å; Q295-L297 VanDerWaalsContact C-N 3.31Å; Q295-L297 PolarHBondContact O-N 2.82Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 3.46Å; L297-G300 PolarHBondContact O-N 2.79Å; L297-G300 VanDerWaalsContact O-N 3.15Å; L297-L301 PolarHBondContact O-N 3.25Å; L297-V328 HydrophobicContact CD1-CB 4.43Å; L297-V328 HydrophobicContact CD1-CG1 3.94Å; L297-V328 HydrophobicContact CD1-CG2 3.55Å; L297-C336 HydrophobicContact CB-CB 3.89Å; L297-L338 HydrophobicContact CD1-CD2 3.51Å; L297-L401 HydrophobicContact CD1-CD1 4.46Å; L297-L401 HydrophobicContact CD2-CD1 3.6Å; L297-L401 HydrophobicContact CG-CD1 3.61Å; L297-I404 HydrophobicContact CD2-CB 4.22Å; L297-I404 HydrophobicContact CD2-CG2 3.5Å; L297-I404 VanDerWaalsContact CD2-CG2 3.5Å; L297-I408 HydrophobicContact CD2-CD1 4.29Å
298	S	98.7	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-36.4	-177.9	-55.8	0	0	0	0	112.2	C294 Q295 G300 L301 S302 L492	C294-S298 WeakPolarHBondContact O-CB 3.32Å; C294-S298 PolarHBondContact O-N 3.4Å; C294-S298 PolarHBondContact O-OG 2.95Å; Q295-S298 PolarHBondContact O-N 3.48Å; Q295-S298 VanDerWaalsContact O-N 3.16Å; S298-G300 VanDerWaalsContact C-N 3.34Å; S298-L301 PolarHBondContact O-N 2.92Å; S298-S302 WeakPolarHBondContact O-CB 3.34Å; S298-S302 PolarHBondContact O-N 3.44Å; S298-L492 WeakPolarHBondContact OG-CD1 3.18Å
299	E	98.8	Very high	97.6	Very high	61 Å²	61	32.2 Å²	32.2	29%	0.285	15%	0.148	S	C	.	.	H	α-helix	trans	-60.1	-43	170.9	-75.9	168.8	-176.8	0	0	111.5	R248 Q295 L297 S302 Y303 V489	R248-E299 HydrophobicContact CG-CB 3.88Å; R248-E299 IonicContact CZ-OE2 3.82Å; R248-E299 IonicContact NE-OE2 2.97Å; R248-E299 PolarHBondContact NE-OE2 3.17Å; R248-E299 IonicContact NH2-OE2 3.79Å; Q295-E299 WeakPolarHBondContact O-CB 3.43Å; Q295-E299 VanDerWaalsContact O-CG 3.26Å; Q295-E299 WeakPolarHBondContact O-CG 3.37Å; Q295-E299 PolarHBondContact O-N 2.63Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 3.46Å; E299-S302 PolarHBondContact O-N 2.76Å; E299-Y303 WeakPolarHBondContact O-CB 3.45Å; E299-Y303 PolarHBondContact O-N 2.66Å; E299-V489 HydrophobicContact CG-CG1 4.29Å; E299-V489 HydrophobicContact CG-CG2 4.32Å
300	G	98.8	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-46.5	175.7	0	0	0	0	0	112.7	S296 L297 S298 Y303 L304	S296-G300 PolarHBondContact O-N 3.23Å; S296-G300 VanDerWaalsContact O-N 3.12Å; L297-G300 PolarHBondContact O-N 2.79Å; L297-G300 VanDerWaalsContact O-N 3.15Å; S298-G300 VanDerWaalsContact C-N 3.34Å; G300-Y303 PolarHBondContact O-N 2.76Å; G300-L304 WeakPolarHBondContact O-CB 3.21Å; G300-L304 PolarHBondContact O-N 2.84Å
301	L	98.8	Very high	96.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68	-42	178.8	-168.5	65	0	0	0	111.8	L297 S298 Y303 L304 H305 L323 L338 D397 I398 L401 A485	L297-L301 PolarHBondContact O-N 3.25Å; S298-L301 PolarHBondContact O-N 2.92Å; L301-Y303 VanDerWaalsContact C-N 3.3Å; L301-Y303 PolarHBondContact O-N 3.27Å; L301-L304 HydrophobicContact CD1-CD2 4.38Å; L301-L304 WeakPolarHBondContact O-CB 3.46Å; L301-L304 PolarHBondContact O-N 3.24Å; L301-L304 VanDerWaalsContact O-N 3.16Å; L301-H305 WeakPolarHBondContact CD1-NE2 3.21Å; L301-H305 WeakPolarHBondContact O-CB 3.37Å; L301-H305 PolarHBondContact O-N 3.22Å; L301-L323 HydrophobicContact CD1-CD2 4.11Å; L301-L323 HydrophobicContact CD2-CD2 3.89Å; L301-L338 HydrophobicContact CB-CD1 4.32Å; L301-L338 HydrophobicContact CD1-CD1 4.23Å; L301-D397 HydrophobicContact CD1-CB 4.07Å; L301-D397 HydrophobicContact CD2-CB 4.21Å; L301-I398 HydrophobicContact CD2-CD1 4.17Å; L301-L401 HydrophobicContact CD2-CB 3.92Å; L301-L401 HydrophobicContact CD2-CD2 3.71Å; L301-L401 HydrophobicContact CD2-CG 4.3Å; L301-A485 HydrophobicContact CB-CB 4.45Å; L301-A485 HydrophobicContact CD2-CB 4.46Å; L301-A485 HydrophobicContact CG-CB 4.31Å
302	S	98.7	Very high	96.4	Very high	20 Å²	20	48.2 Å²	48.2	14%	0.14	24%	0.238	C	C	.	.	H	α-helix	trans	-55.8	-45.4	174.3	179.6	0	0	0	0	111.5	S298 E299 H305 S306 P486	S298-S302 WeakPolarHBondContact O-CB 3.34Å; S298-S302 PolarHBondContact O-N 3.44Å; E299-S302 PolarHBondContact O-N 2.76Å; S302-H305 PolarHBondContact O-N 3.17Å; S302-S306 WeakPolarHBondContact O-CB 3.28Å; S302-S306 PolarHBondContact O-N 2.73Å; S302-S306 VanDerWaalsContact O-N 3.09Å; S302-S306 PolarHBondContact O-OG 2.77Å; S302-P486 WeakPolarHBondContact OG-CG 3.31Å
303	Y	98.6	Very high	96.1	Very high	42 Å²	42	46.3 Å²	46.3	17%	0.165	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-44.5	175.5	-170.8	-96.1	0	0	0	112.7	L243 H246 I249 E299 G300 L301 H305 S306 L308 K315	L243-Y303 WeakPolarHBondContact O-CE1 3.07Å; L243-Y303 VanDerWaalsContact O-CZ 3.31Å; L243-Y303 PolarHBondContact O-OH 3.15Å; H246-Y303 HydrophobicContact CB-CD1 3.55Å; H246-Y303 HydrophobicContact CB-CD2 4.33Å; H246-Y303 HydrophobicContact CB-CE1 3.39Å; H246-Y303 HydrophobicContact CB-CE2 4.18Å; H246-Y303 HydrophobicContact CB-CG 4.01Å; H246-Y303 AromaticContact CD2-CD2 3.38Å; H246-Y303 WeakPolarHBondContact CD2-CD2 3.25Å; H246-Y303 AromaticContact CD2-CE2 3.48Å; H246-Y303 VanDerWaalsContact CD2-CE2 3.48Å; H246-Y303 WeakPolarHBondContact CD2-CE2 3.4Å; H246-Y303 AromaticContact CD2-CG 3.7Å; H246-Y303 AromaticContact CD2-CZ 3.9Å; H246-Y303 AromaticContact CG-CD1 3.69Å; H246-Y303 AromaticContact CG-CD2 3.77Å; H246-Y303 AromaticContact CG-CE1 3.9Å; H246-Y303 AromaticContact CG-CE2 3.97Å; H246-Y303 AromaticContact CG-CG 3.59Å; H246-Y303 AromaticContact CG-CZ 3.99Å; H246-Y303 AromaticContact ND1-CG 3.86Å; H246-Y303 AromaticContact NE2-CD2 3.75Å; I249-Y303 HydrophobicContact CG1-CD1 4.17Å; E299-Y303 WeakPolarHBondContact O-CB 3.45Å; E299-Y303 PolarHBondContact O-N 2.66Å; G300-Y303 PolarHBondContact O-N 2.76Å; L301-Y303 VanDerWaalsContact C-N 3.3Å; L301-Y303 PolarHBondContact O-N 3.27Å; Y303-H305 VanDerWaalsContact C-N 3.33Å; Y303-H305 PolarHBondContact O-N 3.43Å; Y303-S306 PolarHBondContact O-N 3.13Å; Y303-L308 HydrophobicContact CD2-CD1 4.14Å; Y303-L308 HydrophobicContact CE2-CD1 3.55Å; Y303-K315 HydrophobicContact CE1-CD 4.45Å; Y303-K315 VanDerWaalsContact O-CE 3.31Å; Y303-K315 WeakPolarHBondContact O-CE 3.47Å; Y303-K315 PolarHBondContact O-NZ 3.04Å
304	L	98.4	Very high	95.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-43.3	179.1	-170.6	65.9	0	0	0	111.5	M244 I249 G300 L301 S306 K315 V318 H320 L338 F341	M244-L304 HydrophobicContact CE-CD1 3.74Å; I249-L304 HydrophobicContact CD1-CB 4.43Å; I249-L304 HydrophobicContact CD1-CD1 4.49Å; G300-L304 WeakPolarHBondContact O-CB 3.21Å; G300-L304 PolarHBondContact O-N 2.84Å; L301-L304 HydrophobicContact CD1-CD2 4.38Å; L301-L304 WeakPolarHBondContact O-CB 3.46Å; L301-L304 PolarHBondContact O-N 3.24Å; L301-L304 VanDerWaalsContact O-N 3.16Å; L304-S306 VanDerWaalsContact C-N 3.32Å; L304-S306 PolarHBondContact O-N 3.5Å; L304-K315 PolarHBondContact O-NZ 3.08Å; L304-V318 HydrophobicContact CD1-CB 3.75Å; L304-V318 HydrophobicContact CD1-CG1 3.95Å; L304-V318 HydrophobicContact CD1-CG2 4.44Å; L304-V318 HydrophobicContact CG-CB 3.97Å; L304-V318 HydrophobicContact CG-CG1 4.28Å; L304-V318 PolarHBondContact O-N 3.33Å; L304-H320 HydrophobicContact CD2-CB 4.01Å; L304-L338 HydrophobicContact CB-CD1 4.47Å; L304-L338 HydrophobicContact CD2-CD1 4.06Å; L304-F341 HydrophobicContact CD1-CE1 4.03Å; L304-F341 HydrophobicContact CD2-CE1 4Å
305	H	97.8	Very high	95.6	Very high	23 Å²	23	49.5 Å²	49.5	11%	0.106	25%	0.252	C	S	.	.	H	α-helix	trans	-74.7	-15.6	179.2	-72.9	-165.9	0	0	0	114.2	L301 S302 Y303 P317 V318 L394 D397	L301-H305 WeakPolarHBondContact CD1-NE2 3.21Å; L301-H305 WeakPolarHBondContact O-CB 3.37Å; L301-H305 PolarHBondContact O-N 3.22Å; S302-H305 PolarHBondContact O-N 3.17Å; Y303-H305 VanDerWaalsContact C-N 3.33Å; Y303-H305 PolarHBondContact O-N 3.43Å; H305-P317 VanDerWaalsContact O-CB 3.27Å; H305-P317 WeakPolarHBondContact O-CB 3.44Å; H305-V318 PolarHBondContact CD2-O 3.06Å; H305-V318 VanDerWaalsContact CD2-O 3.26Å; H305-L394 HydrophobicContact CB-CD2 4.39Å; H305-L394 PolarHBondContact CE1-O 3.39Å; H305-D397 IonicContact CD2-OD2 3.6Å; H305-D397 IonicContact CE1-OD2 2.85Å; H305-D397 IonicContact NE2-OD2 3.74Å; H305-D397 PolarHBondContact NE2-OD2 3.17Å
306	S	96	Very high	95.5	Very high	33 Å²	33	47.5 Å²	47.5	23%	0.231	24%	0.244	C	C	.	.			trans	-73.1	135.6	-175.1	-69.5	0	0	0	0	113	S302 Y303 L304 L308 K315	S302-S306 WeakPolarHBondContact O-CB 3.28Å; S302-S306 PolarHBondContact O-N 2.73Å; S302-S306 VanDerWaalsContact O-N 3.09Å; S302-S306 PolarHBondContact O-OG 2.77Å; Y303-S306 PolarHBondContact O-N 3.13Å; L304-S306 VanDerWaalsContact C-N 3.32Å; L304-S306 PolarHBondContact O-N 3.5Å; S306-L308 PolarHBondContact O-N 2.88Å; S306-K315 PolarHBondContact O-NZ 3.36Å
307	D	94.2	Very high	95.3	Very high	65 Å²	65	48.3 Å²	48.3	35%	0.348	25%	0.249	S	C	.	.			trans	-83.3	96	164.6	-175.6	2.5	0	0	0	108.8	R309 H314 P317	D307-R309 IonicContact OD1-NE 2.72Å; D307-R309 IonicContact OD2-NH2 2.77Å; D307-H314 IonicContact OD1-CD2 3.56Å; D307-H314 PolarHBondContact OD1-CD2 2.67Å; D307-H314 VanDerWaalsContact OD1-CD2 3.23Å; D307-H314 IonicContact OD1-CE1 3.72Å; D307-H314 IonicContact OD1-NE2 2.88Å; D307-H314 PolarHBondContact OD1-NE2 3.28Å; D307-H314 IonicContact OD2-NE2 3.87Å; D307-P317 HydrophobicContact CB-CG 3.8Å
308	L	93.7	Very high	95.2	Very high	51 Å²	51	48.2 Å²	48.2	27%	0.267	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.1	-175.8	-52.9	177.8	0	0	0	110.9	L243 Y303 S306 H314 K315	L243-L308 HydrophobicContact CD1-CB 4.21Å; Y303-L308 HydrophobicContact CD2-CD1 4.14Å; Y303-L308 HydrophobicContact CE2-CD1 3.55Å; S306-L308 PolarHBondContact O-N 2.88Å; L308-H314 PolarHBondContact O-CD2 2.71Å; L308-K315 HydrophobicContact CB-CB 4.08Å; L308-K315 HydrophobicContact CB-CD 4.4Å; L308-K315 HydrophobicContact CD1-CD 3.81Å; L308-K315 HydrophobicContact CG-CD 4.12Å; L308-K315 PolarHBondContact N-O 3.03Å; L308-K315 PolarHBondContact O-N 3.48Å
309	R	93	Very high	95.1	Very high	181 Å²	181	48.2 Å²	48.2	68%	0.683	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.1	173.1	-63.8	-179.6	-170.1	-177	4.7	109.2	D307	D307-R309 IonicContact OD1-NE 2.72Å; D307-R309 IonicContact OD2-NH2 2.77Å
310	S	89.5	Confident	95	Very high	58 Å²	58	45.3 Å²	45.3	41%	0.406	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	113.3	175.4	-170.9	0	0	0	0	108.8	D312 V313	S310-D312 PolarHBondContact O-N 3Å; S310-V313 PolarHBondContact N-O 3.21Å; S310-V313 WeakPolarHBondContact O-CA 3.34Å; S310-V313 VanDerWaalsContact O-CB 3.31Å; S310-V313 WeakPolarHBondContact O-CB 3.31Å; S310-V313 PolarHBondContact O-N 3.21Å
311	N	89.3	Confident	94.8	Very high	157 Å²	157	48.9 Å²	48.9	84%	0.84	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	-129.3	-171	-51.5	-42.4	0	0	0	110.9	V313	N311-V313 PolarHBondContact O-N 2.97Å
312	D	88.9	Confident	94.5	Very high	172 Å²	172	50.1 Å²	50.1	92%	0.92	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	11.7	176.3	-61.6	-48.9	0	0	0	113.6	S310	S310-D312 PolarHBondContact O-N 3Å
313	V	92.1	Very high	94.5	Very high	61 Å²	61	49.3 Å²	49.3	37%	0.37	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.7	-178.1	-174	0	0	0	0	110.1	P242 L243 S310 N311	P242-V313 HydrophobicContact CB-CG1 3.15Å; P242-V313 HydrophobicContact CG-CG1 4.12Å; L243-V313 HydrophobicContact CD1-CG1 4.11Å; L243-V313 HydrophobicContact CD2-CG1 4.4Å; L243-V313 HydrophobicContact CG-CG1 3.86Å; S310-V313 PolarHBondContact N-O 3.21Å; S310-V313 WeakPolarHBondContact O-CA 3.34Å; S310-V313 VanDerWaalsContact O-CB 3.31Å; S310-V313 WeakPolarHBondContact O-CB 3.31Å; S310-V313 PolarHBondContact O-N 3.21Å; N311-V313 PolarHBondContact O-N 2.97Å
314	H	92.4	Very high	94.4	Very high	66 Å²	66	47.4 Å²	47.4	31%	0.306	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	122.6	-178.5	179.3	-138.7	0	0	0	111.1	D307 L308	D307-H314 IonicContact OD1-CD2 3.56Å; D307-H314 PolarHBondContact OD1-CD2 2.67Å; D307-H314 VanDerWaalsContact OD1-CD2 3.23Å; D307-H314 IonicContact OD1-CE1 3.72Å; D307-H314 IonicContact OD1-NE2 2.88Å; D307-H314 PolarHBondContact OD1-NE2 3.28Å; D307-H314 IonicContact OD2-NE2 3.87Å; L308-H314 PolarHBondContact O-CD2 2.71Å
315	K	94.9	Very high	94.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	107.4	167	-176.3	-152.7	159.8	-65.6	0	108.5	P242 L243 M244 Y303 L304 S306 L308	P242-K315 VanDerWaalsContact O-CB 3.25Å; P242-K315 WeakPolarHBondContact O-CB 3.25Å; P242-K315 WeakPolarHBondContact O-CG 3.23Å; L243-K315 HydrophobicContact CB-CB 4.12Å; L243-K315 HydrophobicContact CD1-CB 4.46Å; M244-K315 HydrophobicContact SD-CD 4.07Å; M244-K315 WeakPolarHBondContact SD-CE 3.43Å; M244-K315 HydrophobicContact SD-CG 4.09Å; Y303-K315 HydrophobicContact CE1-CD 4.45Å; Y303-K315 VanDerWaalsContact O-CE 3.31Å; Y303-K315 WeakPolarHBondContact O-CE 3.47Å; Y303-K315 PolarHBondContact O-NZ 3.04Å; L304-K315 PolarHBondContact O-NZ 3.08Å; S306-K315 PolarHBondContact O-NZ 3.36Å; L308-K315 HydrophobicContact CB-CB 4.08Å; L308-K315 HydrophobicContact CB-CD 4.4Å; L308-K315 HydrophobicContact CD1-CD 3.81Å; L308-K315 HydrophobicContact CG-CD 4.12Å; L308-K315 PolarHBondContact N-O 3.03Å; L308-K315 PolarHBondContact O-N 3.48Å
316	P	94.9	Very high	94.3	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.032	26%	0.255	C	S	.	.			trans	-65.1	159.5	171.7	28.1	-35.6	0	0	0	111.9	L241 I346 L347 R348	L241-P316 HydrophobicContact CD1-CG 4.31Å; L241-P316 HydrophobicContact CD2-CG 4.24Å; P316-I346 HydrophobicContact CB-CG2 4.03Å; P316-I346 HydrophobicContact CG-CG2 3.31Å; P316-L347 WeakPolarHBondContact CB-O 3.39Å; P316-R348 HydrophobicContact CG-CG 4.49Å
317	P	95.7	Very high	94.3	Very high	18 Å²	18	48.2 Å²	48.2	12%	0.117	25%	0.248	C	C	.	.			trans	-56.5	143.5	165.2	-25.1	35.8	0	0	0	111.4	H305 D307 L347	H305-P317 VanDerWaalsContact O-CB 3.27Å; H305-P317 WeakPolarHBondContact O-CB 3.44Å; D307-P317 HydrophobicContact CB-CG 3.8Å; P317-L347 HydrophobicContact CB-CB 4.16Å; P317-L347 HydrophobicContact CB-CD1 4.27Å; P317-L347 HydrophobicContact CB-CG 4.5Å; P317-L347 WeakPolarHBondContact O-CB 3.11Å; P317-L347 PolarHBondContact O-N 3.38Å
318	V	96.6	Very high	94.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.1	174.7	179.9	0	0	0	0	108.2	V238 L241 L304 H305 T345 I346	V238-V318 HydrophobicContact CG1-CG1 4.13Å; V238-V318 HydrophobicContact CG2-CG1 4.41Å; L241-V318 HydrophobicContact CD1-CG2 3.73Å; L304-V318 HydrophobicContact CD1-CB 3.75Å; L304-V318 HydrophobicContact CD1-CG1 3.95Å; L304-V318 HydrophobicContact CD1-CG2 4.44Å; L304-V318 HydrophobicContact CG-CB 3.97Å; L304-V318 HydrophobicContact CG-CG1 4.28Å; L304-V318 PolarHBondContact O-N 3.33Å; H305-V318 PolarHBondContact CD2-O 3.06Å; H305-V318 VanDerWaalsContact CD2-O 3.26Å; V318-T345 WeakPolarHBondContact CA-O 3.26Å; V318-I346 HydrophobicContact CG2-CG1 4.35Å
319	A	96.3	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.6	167.8	0	0	0	0	0	109.2	R321 S344 T345 L393 L394 D397	A319-R321 HydrophobicContact CB-CG 4.08Å; A319-S344 CarbonylContact O-C 3.45Å; A319-S344 WeakPolarHBondContact O-CA 3.14Å; A319-S344 VanDerWaalsContact O-CB 3.26Å; A319-S344 WeakPolarHBondContact O-CB 3.32Å; A319-T345 PolarHBondContact N-O 3.39Å; A319-T345 PolarHBondContact O-N 2.88Å; A319-L393 HydrophobicContact CB-CB 3.58Å; A319-L394 HydrophobicContact CB-CD2 3.88Å; A319-D397 WeakPolarHBondContact CA-OD2 3.41Å
320	H	97.1	Very high	95	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.194	C	C	.	.			trans	-69.2	-46.1	-178.2	-166.4	-76.6	0	0	0	111.7	L304 D322 L323 C339 D340 F341 S344 D397	L304-H320 HydrophobicContact CD2-CB 4.01Å; H320-D322 PolarHBondContact CE1-O 3Å; H320-D322 PolarHBondContact ND1-N 3.31Å; H320-D322 PolarHBondContact ND1-O 3.4Å; H320-D322 PolarHBondContact O-N 2.91Å; H320-D322 VanDerWaalsContact O-N 3.09Å; H320-L323 HydrophobicContact CB-CB 4.3Å; H320-L323 PolarHBondContact ND1-N 3.37Å; H320-C339 PolarHBondContact NE2-O 3.23Å; H320-D340 PolarHBondContact CE1-O 2.86Å; H320-F341 AromaticContact CD2-CD1 3.94Å; H320-F341 AromaticContact CD2-CE1 3.75Å; H320-S344 WeakPolarHBondContact CA-OG 3.34Å; H320-S344 VanDerWaalsContact O-CA 3.32Å; H320-S344 WeakPolarHBondContact O-CA 3.39Å; H320-S344 PolarHBondContact O-N 3.04Å; H320-S344 PolarHBondContact O-OG 3.07Å; H320-D397 WeakPolarHBondContact CB-OD1 3.49Å; H320-D397 PolarHBondContact N-OD1 2.84Å; H320-D397 PolarHBondContact N-OD2 3Å
321	R	93.6	Very high	95.3	Very high	75 Å²	75	34.3 Å²	34.3	28%	0.283	18%	0.181	S	C	.	.	S	Bend	trans	67.9	-12	177.1	-60.6	178.7	57.9	-151.5	-11	117.4	A319 S343 T345 H367 L393 D397	A319-R321 HydrophobicContact CB-CG 4.08Å; R321-S343 WeakPolarHBondContact CD-O 3.4Å; R321-S343 PolarHBondContact NH1-O 3.14Å; R321-T345 WeakPolarHBondContact CD-OG1 3.24Å; R321-T345 PolarHBondContact NH1-OG1 3.44Å; R321-H367 PolarHBondContact NH2-CE1 3.23Å; R321-H367 PolarHBondContact NH2-NE2 3.15Å; R321-L393 HydrophobicContact CG-CD2 4.22Å; R321-D397 PolarHBondContact N-OD1 2.83Å
322	D	93.1	Very high	95.6	Very high	25 Å²	25	31.2 Å²	31.2	13%	0.134	17%	0.167	C	C	.	.	S	Bend	trans	-136.5	45.5	170.4	-168.7	39.1	0	0	0	110.6	H320 S324 N327 T372	H320-D322 PolarHBondContact CE1-O 3Å; H320-D322 PolarHBondContact ND1-N 3.31Å; H320-D322 PolarHBondContact ND1-O 3.4Å; H320-D322 PolarHBondContact O-N 2.91Å; H320-D322 VanDerWaalsContact O-N 3.09Å; D322-S324 PolarHBondContact O-N 3.39Å; D322-N327 PolarHBondContact O-ND2 2.85Å; D322-N327 PolarHBondContact OD2-ND2 2.77Å; D322-T372 PolarHBondContact OD1-N 2.78Å; D322-T372 VanDerWaalsContact OD1-N 3.12Å; D322-T372 PolarHBondContact OD1-OG1 3.26Å
323	L	97.4	Very high	95.9	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.143	C	C	.	.			trans	-72.1	118.9	178.1	-175.7	65.6	0	0	0	109.1	L301 H320 V328 L338 D397 A400 L401 I404	L301-L323 HydrophobicContact CD1-CD2 4.11Å; L301-L323 HydrophobicContact CD2-CD2 3.89Å; H320-L323 HydrophobicContact CB-CB 4.3Å; H320-L323 PolarHBondContact ND1-N 3.37Å; L323-V328 HydrophobicContact CD1-CG2 4.23Å; L323-L338 HydrophobicContact CD1-CD2 3.6Å; L323-D397 HydrophobicContact CD2-CB 4.37Å; L323-D397 WeakPolarHBondContact CD2-O 3.42Å; L323-A400 HydrophobicContact CB-CB 4.02Å; L323-A400 HydrophobicContact CD2-CB 4.3Å; L323-A400 HydrophobicContact CG-CB 4.37Å; L323-A400 WeakPolarHBondContact O-CB 3.45Å; L323-L401 HydrophobicContact CD2-CB 4.1Å; L323-I404 HydrophobicContact CD1-CD1 4.26Å; L323-I404 HydrophobicContact CD2-CD1 4.35Å; L323-I404 HydrophobicContact CG-CD1 3.78Å
324	S	97.1	Very high	96	Very high	1 Å²	1	24 Å²	24	1%	0.007	13%	0.129	C	C	.	.			trans	-150.5	165	179.6	69.8	0	0	0	0	110.1	D322 S326 N327 V328	D322-S324 PolarHBondContact O-N 3.39Å; S324-S326 PolarHBondContact O-N 2.69Å; S324-S326 VanDerWaalsContact O-N 3.12Å; S324-S326 PolarHBondContact OG-N 2.89Å; S324-N327 PolarHBondContact O-N 3.49Å; S324-N327 PolarHBondContact OG-N 3.05Å; S324-V328 WeakPolarHBondContact O-CG2 3.35Å; S324-V328 PolarHBondContact O-N 2.81Å
325	S	98	Very high	96.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-16	175.9	62.7	0	0	0	0	113.1	L276 H277 Y375 E407	L276-S325 WeakPolarHBondContact CB-O 3.35Å; L276-S325 PolarHBondContact N-O 3.03Å; H277-S325 PolarHBondContact N-O 2.79Å; S325-Y375 PolarHBondContact OG-OH 3.14Å; S325-E407 WeakPolarHBondContact CB-OE2 3.43Å; S325-E407 PolarHBondContact OG-OE1 3.21Å; S325-E407 PolarHBondContact OG-OE2 2.77Å
326	S	95.7	Very high	96.5	Very high	55 Å²	55	21.2 Å²	21.2	39%	0.385	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-27.8	172	-67.6	0	0	0	0	113.7	S275 S324	S275-S326 WeakPolarHBondContact CB-O 3.44Å; S324-S326 PolarHBondContact O-N 2.69Å; S324-S326 VanDerWaalsContact O-N 3.12Å; S324-S326 PolarHBondContact OG-N 2.89Å
327	N	97.3	Very high	96.6	Very high	19 Å²	19	21 Å²	21	10%	0.102	12%	0.115	C	C	.	.	S	Bend	trans	-99.5	12	-179.2	-67	-20.1	0	0	0	113.1	D322 S324 C339 D340	D322-N327 PolarHBondContact O-ND2 2.85Å; D322-N327 PolarHBondContact OD2-ND2 2.77Å; S324-N327 PolarHBondContact O-N 3.49Å; S324-N327 PolarHBondContact OG-N 3.05Å; N327-C339 PolarHBondContact O-N 3.07Å; N327-C339 VanDerWaalsContact O-N 3.12Å; N327-C339 PolarHBondContact O-SG 3.25Å; N327-D340 HydrophobicContact CB-CB 4.42Å
328	V	98.6	Very high	96.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.8	168.1	179.5	0	0	0	0	107.5	S275 L276 L297 L323 S324 C336 V337 L338 I404	S275-V328 CarbonylContact C-O 3.54Å; S275-V328 VanDerWaalsContact CA-O 3.3Å; S275-V328 WeakPolarHBondContact CA-O 2.87Å; L276-V328 HydrophobicContact CB-CB 3.98Å; L276-V328 HydrophobicContact CB-CG1 4.05Å; L276-V328 HydrophobicContact CD2-CB 4.26Å; L276-V328 HydrophobicContact CD2-CG1 4.1Å; L276-V328 PolarHBondContact N-O 3.44Å; L297-V328 HydrophobicContact CD1-CB 4.43Å; L297-V328 HydrophobicContact CD1-CG1 3.94Å; L297-V328 HydrophobicContact CD1-CG2 3.55Å; L323-V328 HydrophobicContact CD1-CG2 4.23Å; S324-V328 WeakPolarHBondContact O-CG2 3.35Å; S324-V328 PolarHBondContact O-N 2.81Å; V328-C336 HydrophobicContact CG1-CB 3.73Å; V328-V337 WeakPolarHBondContact CA-O 3.18Å; V328-L338 HydrophobicContact CG2-CD2 3.99Å; V328-I404 HydrophobicContact CG2-CD1 4.41Å
329	L	98.4	Very high	96.8	Very high	29 Å²	29	20.9 Å²	20.9	15%	0.152	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	149.9	175.3	-53.4	-178.9	0	0	0	111.2	L250 A271 G274 C336 V337 C339	L250-L329 HydrophobicContact CD1-CD1 4.01Å; L250-L329 HydrophobicContact CD2-CD1 3.7Å; L250-L329 HydrophobicContact CG-CD1 4.45Å; A271-L329 HydrophobicContact CB-CB 3.75Å; A271-L329 HydrophobicContact CB-CD1 3.82Å; A271-L329 HydrophobicContact CB-CG 4.39Å; G274-L329 CarbonylContact O-C 3.58Å; G274-L329 VanDerWaalsContact O-CA 3.31Å; G274-L329 WeakPolarHBondContact O-CA 3.34Å; L329-C336 CarbonylContact O-C 3.6Å; L329-C336 VanDerWaalsContact O-CA 3.29Å; L329-C336 WeakPolarHBondContact O-CA 3.42Å; L329-V337 HydrophobicContact CB-CG2 3.83Å; L329-V337 PolarHBondContact N-O 3.23Å; L329-V337 PolarHBondContact O-N 2.89Å; L329-C339 HydrophobicContact CD1-CB 4.36Å; L329-C339 HydrophobicContact CG-CB 4.45Å
330	V	98.4	Very high	96.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.1	177	-175.8	0	0	0	0	109.5	H273 G274 L276 F279 L293	H273-V330 HydrophobicContact CB-CB 3.88Å; H273-V330 HydrophobicContact CB-CG1 4.05Å; H273-V330 WeakPolarHBondContact CB-O 3.44Å; H273-V330 PolarHBondContact N-O 2.75Å; G274-V330 PolarHBondContact O-N 3.46Å; L276-V330 HydrophobicContact CB-CG2 4.07Å; L276-V330 HydrophobicContact CD1-CG2 3.8Å; F279-V330 HydrophobicContact CB-CG2 4.12Å; F279-V330 HydrophobicContact CD1-CG2 4.46Å; F279-V330 HydrophobicContact CD2-CB 4.42Å; F279-V330 HydrophobicContact CD2-CG1 4.19Å; F279-V330 HydrophobicContact CE2-CG1 4.25Å; F279-V330 HydrophobicContact CG-CB 4.46Å; F279-V330 HydrophobicContact CG-CG1 4.45Å; F279-V330 HydrophobicContact CG-CG2 4.14Å; L293-V330 HydrophobicContact CD2-CG1 3.89Å; L293-V330 HydrophobicContact CD2-CG2 4.1Å
331	R	96.1	Very high	96.8	Very high	33 Å²	33	22.9 Å²	22.9	13%	0.125	13%	0.125	C	C	.	.			trans	-91.1	163.5	173.7	-70.3	-163.8	179.6	117.8	-4	111.9	E247 H273 D333 G334 T335	E247-R331 PolarHBondContact O-NH1 3.39Å; H273-R331 PolarHBondContact CD2-O 3.25Å; R331-D333 WeakPolarHBondContact CB-OD1 3.49Å; R331-D333 PolarHBondContact O-N 3.41Å; R331-D333 VanDerWaalsContact O-N 3.14Å; R331-G334 PolarHBondContact O-N 2.97Å; R331-T335 PolarHBondContact N-O 2.71Å
332	T	94.6	Very high	96.8	Very high	92 Å²	92	19.6 Å²	19.6	56%	0.564	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-27.2	177.9	44.9	0	0	0	0	115.2	E272 G334	E272-T332 HydrophobicContact CB-CG2 3.75Å; E272-T332 HydrophobicContact CG-CG2 3.81Å; T332-G334 PolarHBondContact O-N 3.16Å
333	D	95.2	Very high	96.7	Very high	75 Å²	75	19.9 Å²	19.9	40%	0.401	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.2	176.4	65.7	-4.4	0	0	0	113.9	R292 R331 T335	R292-D333 WeakPolarHBondContact CD-O 3.34Å; R292-D333 PolarHBondContact NH1-O 3.45Å; R292-D333 VanDerWaalsContact NH1-O 3.1Å; R331-D333 WeakPolarHBondContact CB-OD1 3.49Å; R331-D333 PolarHBondContact O-N 3.41Å; R331-D333 VanDerWaalsContact O-N 3.14Å; D333-T335 WeakPolarHBondContact OD1-CB 3.26Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.4Å; D333-T335 PolarHBondContact OD1-N 2.88Å; D333-T335 PolarHBondContact OD1-OG1 2.81Å; D333-T335 PolarHBondContact OD2-OG1 3.32Å
334	G	95.4	Very high	96.5	Very high	7 Å²	7	19.7 Å²	19.7	7%	0.072	12%	0.117	C	C	.	.	S	Bend	trans	79.5	21	-177	0	0	0	0	0	113.6	R292 L293 R331 T332	R292-G334 WeakPolarHBondContact CD-O 3.46Å; R292-G334 WeakPolarHBondContact CG-O 3.17Å; L293-G334 WeakPolarHBondContact CD2-O 3.09Å; R331-G334 PolarHBondContact O-N 2.97Å; T332-G334 PolarHBondContact O-N 3.16Å
335	T	97.8	Very high	96.3	Very high	8 Å²	8	21.5 Å²	21.5	5%	0.049	13%	0.128	C	C	.	.			trans	-96.3	147	172.1	66.3	0	0	0	0	111.8	R248 R292 R331 D333	R248-T335 VanDerWaalsContact NH1-CB 3.35Å; R248-T335 PolarHBondContact NH1-OG1 3.46Å; R292-T335 HydrophobicContact CG-CG2 4.13Å; R331-T335 PolarHBondContact N-O 2.71Å; D333-T335 WeakPolarHBondContact OD1-CB 3.26Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.4Å; D333-T335 PolarHBondContact OD1-N 2.88Å; D333-T335 PolarHBondContact OD1-OG1 2.81Å; D333-T335 PolarHBondContact OD2-OG1 3.32Å
336	C	98.6	Very high	96	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	148.9	175.3	-70	0	0	0	0	111.4	R248 L293 S296 L297 V328 L329	R248-C336 WeakPolarHBondContact CD-O 3.25Å; L293-C336 VanDerWaalsContact CD2-SG 3.52Å; L293-C336 PolarHBondContact O-SG 3.43Å; L293-C336 VanDerWaalsContact O-SG 3.39Å; S296-C336 WeakPolarHBondContact OG-CB 3.17Å; S296-C336 PolarHBondContact OG-N 3.22Å; L297-C336 HydrophobicContact CB-CB 3.89Å; V328-C336 HydrophobicContact CG1-CB 3.73Å; L329-C336 CarbonylContact O-C 3.6Å; L329-C336 VanDerWaalsContact O-CA 3.29Å; L329-C336 WeakPolarHBondContact O-CA 3.42Å
337	V	98.6	Very high	95.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.7	166.1	-65.4	0	0	0	0	112.2	E247 R248 L250 V328 L329	E247-V337 WeakPolarHBondContact O-CG1 3.3Å; R248-V337 WeakPolarHBondContact O-CA 3.24Å; L250-V337 HydrophobicContact CB-CG2 4.2Å; L250-V337 HydrophobicContact CD1-CG2 3.84Å; V328-V337 WeakPolarHBondContact CA-O 3.18Å; L329-V337 HydrophobicContact CB-CG2 3.83Å; L329-V337 PolarHBondContact N-O 3.23Å; L329-V337 PolarHBondContact O-N 2.89Å
338	L	98.7	Very high	95.1	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	140.3	173.3	-60.7	-177.4	0	0	0	111.1	R248 I249 L250 L297 L301 L304 L323 V328 F341	R248-L338 PolarHBondContact O-N 3.39Å; I249-L338 HydrophobicContact CD1-CB 4Å; I249-L338 HydrophobicContact CD1-CD1 4.09Å; I249-L338 HydrophobicContact CD1-CG 4.38Å; L250-L338 VanDerWaalsContact CB-O 3.31Å; L250-L338 WeakPolarHBondContact CB-O 3.32Å; L250-L338 PolarHBondContact N-O 2.78Å; L297-L338 HydrophobicContact CD1-CD2 3.51Å; L301-L338 HydrophobicContact CB-CD1 4.32Å; L301-L338 HydrophobicContact CD1-CD1 4.23Å; L304-L338 HydrophobicContact CB-CD1 4.47Å; L304-L338 HydrophobicContact CD2-CD1 4.06Å; L323-L338 HydrophobicContact CD1-CD2 3.6Å; V328-L338 HydrophobicContact CG2-CD2 3.99Å; L338-F341 HydrophobicContact CB-CE1 4.45Å; L338-F341 HydrophobicContact CB-CZ 4.25Å
339	C	97.3	Very high	93.4	Very high	13 Å²	13	29.6 Å²	29.6	9%	0.088	16%	0.164	C	C	.	.			trans	-143.2	175.8	173.7	71.5	0	0	0	0	111.3	L250 H320 N327 L329	L250-C339 HydrophobicContact CB-CB 3.94Å; L250-C339 HydrophobicContact CD2-CB 3.58Å; L250-C339 HydrophobicContact CG-CB 4.41Å; H320-C339 PolarHBondContact NE2-O 3.23Å; N327-C339 PolarHBondContact O-N 3.07Å; N327-C339 VanDerWaalsContact O-N 3.12Å; N327-C339 PolarHBondContact O-SG 3.25Å; L329-C339 HydrophobicContact CD1-CB 4.36Å; L329-C339 HydrophobicContact CG-CB 4.45Å
340	D	95.3	Very high	91	Very high	43 Å²	43	33.3 Å²	33.3	23%	0.23	19%	0.191	C	C	.	.			trans	65.6	74.6	179.7	-153.8	-23.2	0	0	0	114.6	K222 H320 N327 G342	K222-D340 IonicContact NZ-OD1 2.82Å; K222-D340 PolarHBondContact NZ-OD1 3.16Å; K222-D340 IonicContact NZ-OD2 2.78Å; K222-D340 PolarHBondContact NZ-OD2 3.39Å; H320-D340 PolarHBondContact CE1-O 2.86Å; N327-D340 HydrophobicContact CB-CB 4.42Å; D340-G342 VanDerWaalsContact C-N 3.26Å; D340-G342 PolarHBondContact O-N 2.67Å; D340-G342 PolarHBondContact OD1-N 3.33Å
341	F	96.8	Very high	88.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.236	C	C	.	.			trans	-89.6	16.7	176.9	-53	-66	0	0	0	113.4	N234 E235 V238 Y239 I249 L304 H320 L338 S343 S344	N234-F341 PolarHBondContact ND2-O 2.97Å; E235-F341 HydrophobicContact CG-CB 4.1Å; V238-F341 HydrophobicContact CB-CB 3.78Å; V238-F341 HydrophobicContact CB-CG 4.28Å; V238-F341 HydrophobicContact CG1-CB 3.65Å; V238-F341 HydrophobicContact CG1-CD1 4.04Å; V238-F341 HydrophobicContact CG1-CD2 4.04Å; V238-F341 HydrophobicContact CG1-CG 3.62Å; V238-F341 HydrophobicContact CG2-CB 4.2Å; Y239-F341 HydrophobicContact CD1-CD2 4.03Å; Y239-F341 AromaticContact CD1-CE2 3.97Å; Y239-F341 HydrophobicContact CD1-CE2 3.97Å; Y239-F341 HydrophobicContact CD2-CD2 4.08Å; Y239-F341 AromaticContact CE1-CD2 3.63Å; Y239-F341 HydrophobicContact CE1-CD2 3.63Å; Y239-F341 AromaticContact CE1-CE2 3.33Å; Y239-F341 HydrophobicContact CE1-CE2 3.33Å; Y239-F341 AromaticContact CE2-CD2 3.65Å; Y239-F341 HydrophobicContact CE2-CD2 3.65Å; Y239-F341 HydrophobicContact CE2-CE2 4.17Å; Y239-F341 HydrophobicContact CG-CD2 4.25Å; Y239-F341 AromaticContact CZ-CD2 3.4Å; Y239-F341 VanDerWaalsContact CZ-CD2 3.4Å; Y239-F341 AromaticContact CZ-CE2 3.42Å; Y239-F341 VanDerWaalsContact CZ-CE2 3.42Å; I249-F341 HydrophobicContact CD1-CZ 4.36Å; I249-F341 HydrophobicContact CG2-CE2 3.97Å; I249-F341 HydrophobicContact CG2-CZ 3.88Å; L304-F341 HydrophobicContact CD1-CE1 4.03Å; L304-F341 HydrophobicContact CD2-CE1 4Å; H320-F341 AromaticContact CD2-CD1 3.94Å; H320-F341 AromaticContact CD2-CE1 3.75Å; L338-F341 HydrophobicContact CB-CE1 4.45Å; L338-F341 HydrophobicContact CB-CZ 4.25Å; F341-S343 PolarHBondContact O-N 3Å; F341-S344 WeakPolarHBondContact CA-OG 3.44Å; F341-S344 WeakPolarHBondContact O-CB 3.12Å; F341-S344 PolarHBondContact O-N 3.25Å
342	G	93.6	Very high	85.2	Confident	5 Å²	5	40.9 Å²	40.9	5%	0.052	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.9	-176.8	0	0	0	0	0	114.1	N234 D340	N234-G342 PolarHBondContact ND2-O 3.28Å; D340-G342 VanDerWaalsContact C-N 3.26Å; D340-G342 PolarHBondContact O-N 2.67Å; D340-G342 PolarHBondContact OD1-N 3.33Å
343	S	91	Very high	82.6	Confident	31 Å²	31	46.1 Å²	46.1	22%	0.217	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-2.2	179.9	-61.5	0	0	0	0	113.7	R321 F341	R321-S343 WeakPolarHBondContact CD-O 3.4Å; R321-S343 PolarHBondContact NH1-O 3.14Å; F341-S343 PolarHBondContact O-N 3Å
344	S	94	Very high	79.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	30%	0.299	C	S	.	.			trans	-67.8	162.4	-172.8	-62.5	0	0	0	0	113.2	N234 A319 H320 F341	N234-S344 PolarHBondContact ND2-N 2.9Å; N234-S344 PolarHBondContact ND2-O 2.9Å; N234-S344 PolarHBondContact OD1-O 2.92Å; A319-S344 CarbonylContact O-C 3.45Å; A319-S344 WeakPolarHBondContact O-CA 3.14Å; A319-S344 VanDerWaalsContact O-CB 3.26Å; A319-S344 WeakPolarHBondContact O-CB 3.32Å; H320-S344 WeakPolarHBondContact CA-OG 3.34Å; H320-S344 VanDerWaalsContact O-CA 3.32Å; H320-S344 WeakPolarHBondContact O-CA 3.39Å; H320-S344 PolarHBondContact O-N 3.04Å; H320-S344 PolarHBondContact O-OG 3.07Å; F341-S344 WeakPolarHBondContact CA-OG 3.44Å; F341-S344 WeakPolarHBondContact O-CB 3.12Å; F341-S344 PolarHBondContact O-N 3.25Å
345	T	92.1	Very high	76.9	Confident	39 Å²	39	60.5 Å²	60.5	24%	0.239	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125	-179.9	-62.6	0	0	0	0	111	V318 A319 R321 L347 L393	V318-T345 WeakPolarHBondContact CA-O 3.26Å; A319-T345 PolarHBondContact N-O 3.39Å; A319-T345 PolarHBondContact O-N 2.88Å; R321-T345 WeakPolarHBondContact CD-OG1 3.24Å; R321-T345 PolarHBondContact NH1-OG1 3.44Å; T345-L347 HydrophobicContact CG2-CD2 4.02Å; T345-L393 HydrophobicContact CG2-CD1 4.19Å
346	I	93.6	Very high	74.3	Confident	22 Å²	22	69.5 Å²	69.5	11%	0.113	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.1	-179.5	-54.7	171.9	0	0	0	109	E237 V238 L241 P316 V318 R348	E237-I346 HydrophobicContact CB-CD1 4.48Å; E237-I346 HydrophobicContact CG-CD1 3.74Å; V238-I346 HydrophobicContact CG2-CD1 4.06Å; V238-I346 HydrophobicContact CG2-CG1 3.94Å; L241-I346 HydrophobicContact CD1-CD1 3.86Å; L241-I346 HydrophobicContact CD1-CG1 3.99Å; L241-I346 HydrophobicContact CD1-CG2 4.03Å; L241-I346 HydrophobicContact CD2-CD1 4.24Å; L241-I346 HydrophobicContact CD2-CG2 4.42Å; L241-I346 HydrophobicContact CG-CD1 4.13Å; P316-I346 HydrophobicContact CB-CG2 4.03Å; P316-I346 HydrophobicContact CG-CG2 3.31Å; V318-I346 HydrophobicContact CG2-CG1 4.35Å; I346-R348 HydrophobicContact CG2-CG 4Å; I346-R348 PolarHBondContact O-N 2.77Å
347	L	90.5	Very high	71.3	Confident	17 Å²	17	80.2 Å²	80.2	9%	0.089	40%	0.401	C	S	.	.			trans	-91	85.2	-175.4	-52.2	-173.5	0	0	0	110.7	P316 P317 T345 L393 L394	P316-L347 WeakPolarHBondContact CB-O 3.39Å; P317-L347 HydrophobicContact CB-CB 4.16Å; P317-L347 HydrophobicContact CB-CD1 4.27Å; P317-L347 HydrophobicContact CB-CG 4.5Å; P317-L347 WeakPolarHBondContact O-CB 3.11Å; P317-L347 PolarHBondContact O-N 3.38Å; T345-L347 HydrophobicContact CG2-CD2 4.02Å; L347-L393 HydrophobicContact CD2-CD1 4.22Å; L347-L394 HydrophobicContact CD1-CD1 3.9Å; L347-L394 HydrophobicContact CD1-CD2 3.78Å; L347-L394 HydrophobicContact CD1-CG 3.72Å
348	R	83.1	Confident	68.2	Low	122 Å²	122	87.6 Å²	87.6	46%	0.46	44%	0.44	S	S	.	.			trans	-82.6	116.9	178.8	-62.8	-178.4	170.8	110.7	-3.2	110.6	E237 P316 I346 C350	E237-R348 IonicContact OE1-CZ 3.53Å; E237-R348 IonicContact OE1-NH1 2.9Å; E237-R348 PolarHBondContact OE1-NH1 2.94Å; E237-R348 IonicContact OE1-NH2 3.32Å; E237-R348 PolarHBondContact OE1-NH2 3.43Å; P316-R348 HydrophobicContact CG-CG 4.49Å; I346-R348 HydrophobicContact CG2-CG 4Å; I346-R348 PolarHBondContact O-N 2.77Å; R348-C350 PolarHBondContact O-N 3.32Å; R348-C350 VanDerWaalsContact O-N 3.14Å
349	S	62.4	Low	65.4	Low	83 Å²	83	92.3 Å²	92.3	58%	0.58	46%	0.462	S	S	*	.			trans	-76.1	11	-178.5	-50.7	0	0	0	0	115.8	S351	S349-S351 PolarHBondContact O-N 2.72Å
350	C	48	Very low	62.3	Low	106 Å²	106	96.5 Å²	96.5	72%	0.716	49%	0.491	S	S	*	.			trans	-81.3	115.6	-169	-59.8	0	0	0	0	113.1	R348 G352	R348-C350 PolarHBondContact O-N 3.32Å; R348-C350 VanDerWaalsContact O-N 3.14Å; C350-G352 VanDerWaalsContact C-N 3.33Å; C350-G352 PolarHBondContact O-N 3.02Å
351	S	38.9	Very low	59.7	Low	136 Å²	136	97.3 Å²	97.3	95%	0.951	50%	0.498	S	S	*	.			trans	-47.3	86.6	159.5	-58	0	0	0	0	112.5	S349	S349-S351 PolarHBondContact O-N 2.72Å
352	G	34.3	Very low	56.7	Low	57 Å²	57	101.5 Å²	101.5	59%	0.588	52%	0.524	S	S	*	.			trans	-169.6	103.1	175.6	0	0	0	0	0	109.6	C350 R354	C350-G352 VanDerWaalsContact C-N 3.33Å; C350-G352 PolarHBondContact O-N 3.02Å; G352-R354 VanDerWaalsContact C-N 3.31Å; G352-R354 PolarHBondContact O-N 2.62Å
353	H	38.7	Very low	54.3	Low	202 Å²	202	104 Å²	104	94%	0.935	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.1	93.5	162.5	-98.7	-85.9	0	0	0	110.1
354	R	34.3	Very low	51.7	Low	236 Å²	236	106.4 Å²	106.4	89%	0.891	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-168.9	-7.2	159.9	-111.9	-172.8	-59.6	-122	8.3	117.6	G352	G352-R354 VanDerWaalsContact C-N 3.31Å; G352-R354 PolarHBondContact O-N 2.62Å
355	F	38.2	Very low	49.1	Very low	147 Å²	147	114.9 Å²	114.9	65%	0.645	59%	0.588	S	S	*	*	S	Bend	trans	-111.1	-12.8	-175.2	-140.5	-97.7	0	0	0	116.7	R357	F355-R357 PolarHBondContact O-N 3.24Å; F355-R357 VanDerWaalsContact O-N 3.15Å
356	W	42.9	Very low	46.5	Very low	197 Å²	197	114.5 Å²	114.5	75%	0.746	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	25.4	176.8	-72.8	102.6	0	0	0	114.4
357	R	34.4	Very low	44.1	Very low	226 Å²	226	116.9 Å²	116.9	85%	0.853	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-14.4	-175.6	-139.2	172	177.8	160.2	-0.7	115.4	F355	F355-R357 PolarHBondContact O-N 3.24Å; F355-R357 VanDerWaalsContact O-N 3.15Å
358	N	34.6	Very low	42	Very low	156 Å²	156	117.3 Å²	117.3	83%	0.834	61%	0.605	S	S	*	*	S	Bend	trans	-123.3	-14.4	-177	-69.6	-8	0	0	0	115.5
359	H	39.1	Very low	40.1	Very low	99 Å²	99	119 Å²	119	46%	0.458	62%	0.618	S	S	.	*			trans	-100.3	77.7	166.7	-77	-68.5	0	0	0	108.6	H230 T361	H230-H359 AromaticContact CE1-CE1 3.56Å; H230-H359 AromaticContact NE2-CE1 3.68Å; H359-T361 VanDerWaalsContact C-N 3.25Å; H359-T361 PolarHBondContact O-N 3.1Å
360	S	32.5	Very low	39.4	Very low	102 Å²	102	119.4 Å²	119.4	71%	0.713	61%	0.609	S	S	*	*			trans	-58.9	100	157.8	-120.4	0	0	0	0	106.2	T362	S360-T362 PolarHBondContact O-N 2.9Å
361	T	40.6	Very low	39.8	Very low	60 Å²	60	115.5 Å²	115.5	37%	0.368	58%	0.583	S	S	.	*			trans	-70.8	43	163	48.8	0	0	0	0	109.6	H359 I363 L387	H359-T361 VanDerWaalsContact C-N 3.25Å; H359-T361 PolarHBondContact O-N 3.1Å; T361-I363 VanDerWaalsContact C-N 3.32Å; T361-I363 PolarHBondContact O-N 2.77Å; T361-I363 VanDerWaalsContact O-N 3.14Å; T361-L387 WeakPolarHBondContact OG1-CD2 3.18Å
362	T	33.9	Very low	41.7	Very low	88 Å²	88	111.1 Å²	111.1	54%	0.54	55%	0.55	S	S	.	*			trans	-72.2	103.7	156	-38.9	0	0	0	0	103.2	S360 T364	S360-T362 PolarHBondContact O-N 2.9Å; T362-T364 HydrophobicContact CG2-CG2 4.07Å; T362-T364 PolarHBondContact O-N 3.22Å
363	I	43.4	Very low	44.2	Very low	56 Å²	56	110.4 Å²	110.4	29%	0.287	53%	0.533	S	S	.	.			trans	-59.6	80.6	161.8	-59.3	176.9	0	0	0	104.9	T361 L368	T361-I363 VanDerWaalsContact C-N 3.32Å; T361-I363 PolarHBondContact O-N 2.77Å; T361-I363 VanDerWaalsContact O-N 3.14Å; I363-L368 HydrophobicContact CG2-CD1 3.77Å; I363-L368 HydrophobicContact CG2-CD2 3.8Å; I363-L368 HydrophobicContact CG2-CG 3.49Å; I363-L368 VanDerWaalsContact CG2-CG 3.49Å
364	T	37	Very low	46.8	Very low	83 Å²	83	101.6 Å²	101.6	51%	0.509	49%	0.493	S	S	.	.			trans	-67.4	146.7	171.3	43.6	0	0	0	0	106	T362 G366 H367	T362-T364 HydrophobicContact CG2-CG2 4.07Å; T362-T364 PolarHBondContact O-N 3.22Å; T364-G366 CarbonylContact O-C 3.57Å; T364-G366 PolarHBondContact O-N 2.77Å; T364-H367 PolarHBondContact O-N 3.15Å
365	Q	38.9	Very low	49.7	Very low	178 Å²	178	90.9 Å²	90.9	83%	0.832	45%	0.452	S	S	*	.	H	α-helix	trans	-47.6	-25.1	176.7	-82.2	175.1	-32.9	0	0	113.3
366	G	38.1	Very low	52.3	Low	31 Å²	31	84.5 Å²	84.5	32%	0.32	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-39.4	170.7	0	0	0	0	0	114.7	T364 L368 Q369 F370	T364-G366 CarbonylContact O-C 3.57Å; T364-G366 PolarHBondContact O-N 2.77Å; G366-L368 VanDerWaalsContact C-N 3.34Å; G366-L368 PolarHBondContact O-N 3.22Å; G366-Q369 WeakPolarHBondContact O-CB 3.46Å; G366-Q369 PolarHBondContact O-N 3.42Å; G366-F370 WeakPolarHBondContact O-CD2 3.21Å; G366-F370 WeakPolarHBondContact O-CE2 3.23Å
367	H	42.9	Very low	54.7	Low	72 Å²	72	75.1 Å²	75.1	33%	0.333	39%	0.389	S	S	.	.	H	α-helix	trans	-70.5	-28.1	-178.9	-164.5	-60.4	0	0	0	112.9	R321 T364 Q369	R321-H367 PolarHBondContact NH2-CE1 3.23Å; R321-H367 PolarHBondContact NH2-NE2 3.15Å; T364-H367 PolarHBondContact O-N 3.15Å; H367-Q369 VanDerWaalsContact C-N 3.28Å
368	L	45.9	Very low	57.5	Low	27 Å²	27	64.5 Å²	64.5	14%	0.141	35%	0.349	C	S	.	.	H	α-helix	trans	-73	-21.2	174.4	-70.4	166.1	0	0	0	112.6	I363 G366 F370 M376 L438	I363-L368 HydrophobicContact CG2-CD1 3.77Å; I363-L368 HydrophobicContact CG2-CD2 3.8Å; I363-L368 HydrophobicContact CG2-CG 3.49Å; I363-L368 VanDerWaalsContact CG2-CG 3.49Å; G366-L368 VanDerWaalsContact C-N 3.34Å; G366-L368 PolarHBondContact O-N 3.22Å; L368-F370 PolarHBondContact O-N 3.18Å; L368-M376 HydrophobicContact CD2-CE 3.75Å; L368-M376 HydrophobicContact CD2-SD 3.88Å; L368-L438 HydrophobicContact CD1-CD2 4.15Å
369	Q	42.3	Very low	60.1	Low	157 Å²	157	57.8 Å²	57.8	73%	0.734	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-8.2	-179	-162	162.7	9.7	0	0	113.4	G366 H367	G366-Q369 WeakPolarHBondContact O-CB 3.46Å; G366-Q369 PolarHBondContact O-N 3.42Å; H367-Q369 VanDerWaalsContact C-N 3.28Å
370	F	48.9	Very low	62.3	Low	92 Å²	92	54.9 Å²	54.9	40%	0.404	30%	0.301	S	S	.	.	S	Bend	trans	-122.8	-7.7	-170.5	-51.9	-58.2	0	0	0	115.4	H205 F206 G366 L368	H205-F370 AromaticContact CE1-CE1 3.65Å; H205-F370 AromaticContact ND1-CE1 3.95Å; H205-F370 AromaticContact NE2-CE1 3.79Å; F206-F370 HydrophobicContact CE2-CB 4.39Å; F206-F370 HydrophobicContact CE2-CG 4.43Å; F206-F370 HydrophobicContact CZ-CD1 4.41Å; F206-F370 HydrophobicContact CZ-CD2 4.29Å; F206-F370 HydrophobicContact CZ-CG 4.18Å; G366-F370 WeakPolarHBondContact O-CD2 3.21Å; G366-F370 WeakPolarHBondContact O-CE2 3.23Å; L368-F370 PolarHBondContact O-N 3.18Å
371	C	57	Low	64.8	Low	24 Å²	24	50.4 Å²	50.4	16%	0.162	27%	0.269	C	S	.	.	S	Bend	trans	-90.3	151.8	176	-80.3	0	0	0	0	110	L373 M376	C371-L373 PolarHBondContact O-N 3.34Å; C371-M376 HydrophobicContact CB-CE 3.14Å
372	T	78	Confident	66.6	Low	43 Å²	43	51.2 Å²	51.2	26%	0.264	27%	0.268	S	S	.	.			trans	-70.6	94.1	177.1	-44.7	0	0	0	0	109.7	D322 N374 Y375	D322-T372 PolarHBondContact OD1-N 2.78Å; D322-T372 VanDerWaalsContact OD1-N 3.12Å; D322-T372 PolarHBondContact OD1-OG1 3.26Å; T372-N374 PolarHBondContact O-N 2.71Å; T372-Y375 HydrophobicContact CG2-CD2 3.45Å; T372-Y375 VanDerWaalsContact CG2-CD2 3.45Å; T372-Y375 HydrophobicContact CG2-CE2 3.55Å; T372-Y375 PolarHBondContact O-N 3.11Å
373	L	86.7	Confident	68.5	Low	43 Å²	43	49.1 Å²	49.1	23%	0.225	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-48.6	-41.4	-167.4	-68.1	177.6	0	0	0	113.8	C371 Y375 M376 L438 L441	C371-L373 PolarHBondContact O-N 3.34Å; L373-Y375 PolarHBondContact O-N 2.76Å; L373-M376 HydrophobicContact CD2-CE 3.72Å; L373-M376 HydrophobicContact CD2-SD 3.94Å; L373-M376 PolarHBondContact O-N 3.31Å; L373-M376 VanDerWaalsContact O-N 3.13Å; L373-L438 HydrophobicContact CD2-CD1 4.21Å; L373-L441 HydrophobicContact CB-CD1 3.73Å; L373-L441 WeakPolarHBondContact O-CD1 3.3Å
374	N	92.8	Very high	69.3	Low	17 Å²	17	49.5 Å²	49.5	9%	0.091	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.5	-13.4	-177.2	-57.1	59.7	0	0	0	114	T372 L403 P427 Y428	T372-N374 PolarHBondContact O-N 2.71Å; N374-L403 WeakPolarHBondContact O-CD1 3.43Å; N374-P427 HydrophobicContact CB-CB 4.44Å; N374-P427 PolarHBondContact ND2-O 3.41Å; N374-Y428 WeakPolarHBondContact O-CD2 3.37Å; N374-Y428 WeakPolarHBondContact O-CE2 2.96Å
375	Y	95.9	Very high	70.6	Confident	11 Å²	11	46.8 Å²	46.8	4%	0.043	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-109	-1.2	-177.7	-60	-91.3	0	0	0	113.8	S325 T372 L373 Y399 L403 I404 E407 P427	S325-Y375 PolarHBondContact OG-OH 3.14Å; T372-Y375 HydrophobicContact CG2-CD2 3.45Å; T372-Y375 VanDerWaalsContact CG2-CD2 3.45Å; T372-Y375 HydrophobicContact CG2-CE2 3.55Å; T372-Y375 PolarHBondContact O-N 3.11Å; L373-Y375 PolarHBondContact O-N 2.76Å; Y375-Y399 WeakPolarHBondContact O-CD1 3.49Å; Y375-L403 HydrophobicContact CD1-CB 4.09Å; Y375-L403 HydrophobicContact CD1-CD1 4.32Å; Y375-L403 HydrophobicContact CE1-CB 4.34Å; Y375-I404 HydrophobicContact CD1-CG1 4.08Å; Y375-I404 HydrophobicContact CE1-CD1 4.44Å; Y375-I404 HydrophobicContact CE1-CG1 3.63Å; Y375-E407 WeakPolarHBondContact CE1-OE1 3.27Å; Y375-E407 VanDerWaalsContact CZ-OE1 3.26Å; Y375-E407 PolarHBondContact OH-OE1 2.8Å; Y375-E407 PolarHBondContact OH-OE2 3.29Å; Y375-E407 VanDerWaalsContact OH-OE2 3.11Å; Y375-P427 HydrophobicContact CD1-CG 4.4Å; Y375-P427 HydrophobicContact CE1-CG 3.82Å
376	M	92.5	Very high	71.5	Confident	13 Å²	13	43.3 Å²	43.3	6%	0.064	24%	0.242	C	C	.	.			trans	-70.8	133.1	-177.9	-68.1	-176.5	175.2	0	0	111.8	L368 C371 L373 I380 L381 Y399	L368-M376 HydrophobicContact CD2-CE 3.75Å; L368-M376 HydrophobicContact CD2-SD 3.88Å; C371-M376 HydrophobicContact CB-CE 3.14Å; L373-M376 HydrophobicContact CD2-CE 3.72Å; L373-M376 HydrophobicContact CD2-SD 3.94Å; L373-M376 PolarHBondContact O-N 3.31Å; L373-M376 VanDerWaalsContact O-N 3.13Å; M376-I380 HydrophobicContact CB-CG2 4.35Å; M376-I380 HydrophobicContact CG-CG2 4.27Å; M376-I380 HydrophobicContact SD-CG2 4.26Å; M376-L381 HydrophobicContact CB-CD1 4.46Å; M376-L381 HydrophobicContact CB-CD2 3.73Å; M376-L381 HydrophobicContact CB-CG 3.76Å; M376-L381 HydrophobicContact CG-CD2 4.4Å; M376-L381 HydrophobicContact SD-CD2 3.78Å; M376-Y399 WeakPolarHBondContact O-CE1 3.35Å
377	S	94	Very high	72.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.252	C	S	.	.			trans	-72.5	157.3	174.2	59.6	0	0	0	0	112.3	E379 I380 L381	S377-E379 VanDerWaalsContact C-N 3.31Å; S377-E379 WeakPolarHBondContact CB-OE1 3.22Å; S377-E379 WeakPolarHBondContact CB-OE2 3.49Å; S377-E379 PolarHBondContact O-N 2.86Å; S377-E379 PolarHBondContact OG-OE1 3.49Å; S377-E379 PolarHBondContact OG-OE2 3.27Å; S377-I380 PolarHBondContact O-N 2.81Å; S377-I380 VanDerWaalsContact OG-CD1 3.28Å; S377-I380 WeakPolarHBondContact OG-CD1 3.45Å; S377-I380 VanDerWaalsContact OG-CG1 3.31Å; S377-I380 WeakPolarHBondContact OG-CG1 3.43Å; S377-L381 PolarHBondContact O-N 2.75Å
378	P	92.3	Very high	73	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-52	-44.2	-177.1	-24.4	28.8	0	0	0	114.1	I380 L381 E382 Y399 V445 S446 R477	P378-I380 VanDerWaalsContact C-N 3.3Å; P378-I380 PolarHBondContact O-N 2.7Å; P378-L381 PolarHBondContact O-N 3.29Å; P378-E382 WeakPolarHBondContact O-CB 3.31Å; P378-E382 VanDerWaalsContact O-CG 3.26Å; P378-E382 WeakPolarHBondContact O-CG 3.31Å; P378-E382 PolarHBondContact O-N 3.46Å; P378-Y399 HydrophobicContact CG-CE2 4.25Å; P378-V445 HydrophobicContact CB-CG1 4.38Å; P378-V445 HydrophobicContact CG-CG1 3.81Å; P378-S446 WeakPolarHBondContact CA-OG 3.43Å; P378-S446 PolarHBondContact O-OG 2.9Å; P378-R477 HydrophobicContact CG-CG 4.5Å
379	E	88.6	Confident	74	Confident	16 Å²	16	49.2 Å²	49.2	8%	0.075	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-28.1	-179.6	69.2	-76.8	-178.8	0	0	113.1	S377 G383 S384 V385 T479 R482	S377-E379 VanDerWaalsContact C-N 3.31Å; S377-E379 WeakPolarHBondContact CB-OE1 3.22Å; S377-E379 WeakPolarHBondContact CB-OE2 3.49Å; S377-E379 PolarHBondContact O-N 2.86Å; S377-E379 PolarHBondContact OG-OE1 3.49Å; S377-E379 PolarHBondContact OG-OE2 3.27Å; E379-G383 PolarHBondContact O-N 3.5Å; E379-S384 PolarHBondContact O-N 3.4Å; E379-S384 VanDerWaalsContact O-N 3.17Å; E379-V385 HydrophobicContact CB-CG1 4.5Å; E379-V385 HydrophobicContact CG-CG1 4.34Å; E379-V385 WeakPolarHBondContact O-CG1 3.46Å; E379-T479 VanDerWaalsContact CD-CG2 3.44Å; E379-T479 HydrophobicContact CG-CG2 3.91Å; E379-T479 WeakPolarHBondContact OE1-CG2 3.32Å; E379-R482 IonicContact OE1-CZ 3.23Å; E379-R482 IonicContact OE1-NH1 3.98Å; E379-R482 PolarHBondContact OE1-NH1 3.08Å; E379-R482 IonicContact OE1-NH2 3.92Å; E379-R482 IonicContact OE2-CZ 3.86Å; E379-R482 IonicContact OE2-NH1 3.63Å; E379-R482 IonicContact OE2-NH2 2.84Å; E379-R482 PolarHBondContact OE2-NH2 3.4Å
380	I	86	Confident	75.5	Confident	38 Å²	38	43.8 Å²	43.8	20%	0.195	26%	0.26	C	S	.	.	H	α-helix	trans	-76.5	-41.7	174.4	-65.2	175.9	0	0	0	109.9	M376 S377 P378 G383	M376-I380 HydrophobicContact CB-CG2 4.35Å; M376-I380 HydrophobicContact CG-CG2 4.27Å; M376-I380 HydrophobicContact SD-CG2 4.26Å; S377-I380 PolarHBondContact O-N 2.81Å; S377-I380 VanDerWaalsContact OG-CD1 3.28Å; S377-I380 WeakPolarHBondContact OG-CD1 3.45Å; S377-I380 VanDerWaalsContact OG-CG1 3.31Å; S377-I380 WeakPolarHBondContact OG-CG1 3.43Å; P378-I380 VanDerWaalsContact C-N 3.3Å; P378-I380 PolarHBondContact O-N 2.7Å; I380-G383 PolarHBondContact O-N 3.11Å
381	L	85.4	Confident	77	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-43	177.2	-72.7	172	0	0	0	112.2	M376 S377 P378 G383 L438 L441 I442 V445	M376-L381 HydrophobicContact CB-CD1 4.46Å; M376-L381 HydrophobicContact CB-CD2 3.73Å; M376-L381 HydrophobicContact CB-CG 3.76Å; M376-L381 HydrophobicContact CG-CD2 4.4Å; M376-L381 HydrophobicContact SD-CD2 3.78Å; S377-L381 PolarHBondContact O-N 2.75Å; P378-L381 PolarHBondContact O-N 3.29Å; L381-G383 VanDerWaalsContact C-N 3.25Å; L381-G383 PolarHBondContact O-N 3.25Å; L381-L438 HydrophobicContact CD2-CD1 3.67Å; L381-L441 HydrophobicContact CD1-CB 4.22Å; L381-L441 HydrophobicContact CD2-CB 4.18Å; L381-I442 HydrophobicContact CB-CG1 4.06Å; L381-I442 HydrophobicContact CD2-CG1 4.5Å; L381-V445 HydrophobicContact CD1-CB 3.84Å; L381-V445 HydrophobicContact CD1-CG1 3.86Å; L381-V445 HydrophobicContact CD1-CG2 4.38Å
382	E	78.5	Confident	78.3	Confident	76 Å²	76	41.6 Å²	41.6	36%	0.355	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.2	177.8	-71.2	172	-162.6	0	0	112.7	P378 S384 S446 R477	P378-E382 WeakPolarHBondContact O-CB 3.31Å; P378-E382 VanDerWaalsContact O-CG 3.26Å; P378-E382 WeakPolarHBondContact O-CG 3.31Å; P378-E382 PolarHBondContact O-N 3.46Å; E382-S384 WeakPolarHBondContact CB-OG 3.48Å; E382-S384 PolarHBondContact O-N 2.79Å; E382-S384 PolarHBondContact OE2-OG 3.41Å; E382-S446 WeakPolarHBondContact OE1-CB 3.3Å; E382-R477 IonicContact OE1-CZ 2.67Å; E382-R477 IonicContact OE1-NH2 2.78Å; E382-R477 PolarHBondContact OE1-NH2 3.32Å
383	G	72.5	Confident	78.9	Confident	45 Å²	45	40.8 Å²	40.8	46%	0.464	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	11.5	-168.9	0	0	0	0	0	113.6	E379 I380 L381 V385	E379-G383 PolarHBondContact O-N 3.5Å; I380-G383 PolarHBondContact O-N 3.11Å; L381-G383 VanDerWaalsContact C-N 3.25Å; L381-G383 PolarHBondContact O-N 3.25Å; G383-V385 VanDerWaalsContact C-N 3.3Å; G383-V385 PolarHBondContact O-N 3.03Å
384	S	61.9	Low	79.2	Confident	64 Å²	64	40.1 Å²	40.1	45%	0.448	24%	0.244	S	C	.	.			trans	-89.4	50.6	-174.5	60.3	0	0	0	0	111.8	E379 E382	E379-S384 PolarHBondContact O-N 3.4Å; E379-S384 VanDerWaalsContact O-N 3.17Å; E382-S384 WeakPolarHBondContact CB-OG 3.48Å; E382-S384 PolarHBondContact O-N 2.79Å; E382-S384 PolarHBondContact OE2-OG 3.41Å
385	V	64	Low	79.4	Confident	26 Å²	26	40.7 Å²	40.7	16%	0.158	25%	0.246	C	C	.	.			trans	-87.8	131.9	-176.4	-64	0	0	0	0	112.5	E379 G383 L387 F392	E379-V385 HydrophobicContact CB-CG1 4.5Å; E379-V385 HydrophobicContact CG-CG1 4.34Å; E379-V385 WeakPolarHBondContact O-CG1 3.46Å; G383-V385 VanDerWaalsContact C-N 3.3Å; G383-V385 PolarHBondContact O-N 3.03Å; V385-L387 HydrophobicContact CG2-CD2 3.83Å; V385-L387 HydrophobicContact CG2-CG 4.41Å; V385-L387 PolarHBondContact O-N 2.96Å; V385-F392 HydrophobicContact CB-CD1 4.47Å; V385-F392 HydrophobicContact CB-CD2 3.94Å; V385-F392 HydrophobicContact CB-CE1 4.26Å; V385-F392 HydrophobicContact CB-CE2 3.67Å; V385-F392 HydrophobicContact CB-CG 4.35Å; V385-F392 HydrophobicContact CB-CZ 3.85Å; V385-F392 HydrophobicContact CG1-CD2 3.67Å; V385-F392 HydrophobicContact CG1-CE2 3.54Å; V385-F392 HydrophobicContact CG1-CG 4.45Å; V385-F392 HydrophobicContact CG1-CZ 4.24Å; V385-F392 HydrophobicContact CG2-CE2 4.16Å; V385-F392 HydrophobicContact CG2-CZ 4.06Å
386	N	57.4	Low	79.3	Confident	104 Å²	104	40.4 Å²	40.4	56%	0.556	25%	0.247	S	C	*	.			trans	-73	95.1	171.4	-175.3	-3.8	0	0	0	110.2	S388 S389	N386-S388 VanDerWaalsContact CG-OG 3.27Å; N386-S388 PolarHBondContact ND2-OG 3.38Å; N386-S388 PolarHBondContact O-N 3.16Å; N386-S388 WeakPolarHBondContact OD1-CB 3.49Å; N386-S388 PolarHBondContact OD1-N 3.09Å; N386-S388 PolarHBondContact OD1-OG 3.04Å; N386-S389 PolarHBondContact O-N 3.26Å; N386-S389 VanDerWaalsContact O-O 3.07Å
387	L	60.5	Low	79.6	Confident	102 Å²	102	40 Å²	40	53%	0.534	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.1	-179.8	-62.4	175.1	0	0	0	114.4	T361 V385	T361-L387 WeakPolarHBondContact OG1-CD2 3.18Å; V385-L387 HydrophobicContact CG2-CD2 3.83Å; V385-L387 HydrophobicContact CG2-CG 4.41Å; V385-L387 PolarHBondContact O-N 2.96Å
388	S	52.7	Low	79.8	Confident	104 Å²	104	40 Å²	40	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-20.4	179.5	70.8	0	0	0	0	113.7	N386	N386-S388 VanDerWaalsContact CG-OG 3.27Å; N386-S388 PolarHBondContact ND2-OG 3.38Å; N386-S388 PolarHBondContact O-N 3.16Å; N386-S388 WeakPolarHBondContact OD1-CB 3.49Å; N386-S388 PolarHBondContact OD1-N 3.09Å; N386-S388 PolarHBondContact OD1-OG 3.04Å
389	S	66.7	Low	80.1	Confident	48 Å²	48	39.9 Å²	39.9	34%	0.336	24%	0.244	S	C	.	.			trans	-122.7	142.1	174	-178	0	0	0	0	109.7	N386 S391 F392	N386-S389 PolarHBondContact O-N 3.26Å; N386-S389 VanDerWaalsContact O-O 3.07Å; S389-S391 VanDerWaalsContact C-N 3.3Å; S389-S391 WeakPolarHBondContact OG-CB 3.03Å; S389-S391 PolarHBondContact OG-N 2.9Å; S389-S391 VanDerWaalsContact OG-N 3.11Å; S389-S391 PolarHBondContact OG-OG 3.41Å; S389-F392 WeakPolarHBondContact O-CD1 3.26Å; S389-F392 VanDerWaalsContact O-CE1 3.25Å; S389-F392 WeakPolarHBondContact O-CE1 3.44Å
390	S	72.9	Confident	80.6	Confident	44 Å²	44	39.3 Å²	39.3	31%	0.308	24%	0.242	S	C	.	.	S	Bend	trans	-88.5	0.4	170.2	50.4	0	0	0	0	113.1	F392 L393	S390-F392 VanDerWaalsContact C-N 3.28Å; S390-F392 PolarHBondContact O-N 2.97Å; S390-L393 PolarHBondContact O-N 2.99Å
391	S	80.8	Confident	81.2	Confident	46 Å²	46	37.5 Å²	37.5	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-33	-179.7	59.1	0	0	0	0	112.9	S389 L393 L394 Q395	S389-S391 VanDerWaalsContact C-N 3.3Å; S389-S391 WeakPolarHBondContact OG-CB 3.03Å; S389-S391 PolarHBondContact OG-N 2.9Å; S389-S391 VanDerWaalsContact OG-N 3.11Å; S389-S391 PolarHBondContact OG-OG 3.41Å; S391-L393 PolarHBondContact O-N 2.65Å; S391-L393 VanDerWaalsContact O-N 3.15Å; S391-L394 WeakPolarHBondContact O-CB 3.02Å; S391-L394 PolarHBondContact O-N 2.91Å; S391-Q395 WeakPolarHBondContact O-CG 3.05Å; S391-Q395 PolarHBondContact O-N 3.28Å
392	F	84.3	Confident	81.8	Confident	24 Å²	24	37.1 Å²	37.1	11%	0.105	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-28.3	179.5	77.7	-92.5	0	0	0	112.4	V385 S389 S390 Q395 G396	V385-F392 HydrophobicContact CB-CD1 4.47Å; V385-F392 HydrophobicContact CB-CD2 3.94Å; V385-F392 HydrophobicContact CB-CE1 4.26Å; V385-F392 HydrophobicContact CB-CE2 3.67Å; V385-F392 HydrophobicContact CB-CG 4.35Å; V385-F392 HydrophobicContact CB-CZ 3.85Å; V385-F392 HydrophobicContact CG1-CD2 3.67Å; V385-F392 HydrophobicContact CG1-CE2 3.54Å; V385-F392 HydrophobicContact CG1-CG 4.45Å; V385-F392 HydrophobicContact CG1-CZ 4.24Å; V385-F392 HydrophobicContact CG2-CE2 4.16Å; V385-F392 HydrophobicContact CG2-CZ 4.06Å; S389-F392 WeakPolarHBondContact O-CD1 3.26Å; S389-F392 VanDerWaalsContact O-CE1 3.25Å; S389-F392 WeakPolarHBondContact O-CE1 3.44Å; S390-F392 VanDerWaalsContact C-N 3.28Å; S390-F392 PolarHBondContact O-N 2.97Å; F392-Q395 PolarHBondContact O-N 3.39Å; F392-G396 PolarHBondContact O-N 3.44Å
393	L	89.8	Confident	82.8	Confident	25 Å²	25	33.5 Å²	33.5	13%	0.131	21%	0.214	C	C	.	.	H	α-helix	trans	-68.1	-40.3	176.3	-65.6	173.3	0	0	0	111.5	A319 R321 T345 L347 S390 S391 G396 D397	A319-L393 HydrophobicContact CB-CB 3.58Å; R321-L393 HydrophobicContact CG-CD2 4.22Å; T345-L393 HydrophobicContact CG2-CD1 4.19Å; L347-L393 HydrophobicContact CD2-CD1 4.22Å; S390-L393 PolarHBondContact O-N 2.99Å; S391-L393 PolarHBondContact O-N 2.65Å; S391-L393 VanDerWaalsContact O-N 3.15Å; L393-G396 PolarHBondContact O-N 3.3Å; L393-D397 PolarHBondContact O-N 3.19Å
394	L	94.6	Very high	84	Confident	29 Å²	29	31.3 Å²	31.3	15%	0.152	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-42.6	174.1	-57.3	177.5	0	0	0	110.2	H305 A319 L347 S391 G396 D397 I398	H305-L394 HydrophobicContact CB-CD2 4.39Å; H305-L394 PolarHBondContact CE1-O 3.39Å; A319-L394 HydrophobicContact CB-CD2 3.88Å; L347-L394 HydrophobicContact CD1-CD1 3.9Å; L347-L394 HydrophobicContact CD1-CD2 3.78Å; L347-L394 HydrophobicContact CD1-CG 3.72Å; S391-L394 WeakPolarHBondContact O-CB 3.02Å; S391-L394 PolarHBondContact O-N 2.91Å; L394-G396 VanDerWaalsContact C-N 3.27Å; L394-G396 PolarHBondContact O-N 3.27Å; L394-D397 WeakPolarHBondContact O-CB 3.21Å; L394-D397 PolarHBondContact O-N 2.69Å; L394-D397 VanDerWaalsContact O-N 3.07Å; L394-I398 WeakPolarHBondContact O-CG1 3.04Å; L394-I398 PolarHBondContact O-N 2.85Å
395	Q	95.8	Very high	85.8	Confident	29 Å²	29	28.3 Å²	28.3	14%	0.136	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-26.9	178.3	-60	-54.4	93.3	0	0	112.9	S391 F392 I398 Y399 T479 R482	S391-Q395 WeakPolarHBondContact O-CG 3.05Å; S391-Q395 PolarHBondContact O-N 3.28Å; F392-Q395 PolarHBondContact O-N 3.39Å; Q395-I398 PolarHBondContact O-N 3.44Å; Q395-Y399 PolarHBondContact O-N 3.33Å; Q395-T479 HydrophobicContact CB-CG2 4.39Å; Q395-T479 WeakPolarHBondContact CG-O 3.38Å; Q395-T479 PolarHBondContact NE2-O 3.39Å; Q395-R482 PolarHBondContact NE2-O 3.48Å; Q395-R482 PolarHBondContact O-NH1 2.91Å
396	G	95.1	Very high	87.4	Confident	6 Å²	6	27.2 Å²	27.2	6%	0.062	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-41	168.7	0	0	0	0	0	112.1	F392 L393 L394 I398 Y399 A400	F392-G396 PolarHBondContact O-N 3.44Å; L393-G396 PolarHBondContact O-N 3.3Å; L394-G396 VanDerWaalsContact C-N 3.27Å; L394-G396 PolarHBondContact O-N 3.27Å; G396-I398 VanDerWaalsContact C-N 3.35Å; G396-Y399 WeakPolarHBondContact O-CB 3.31Å; G396-Y399 PolarHBondContact O-N 3.04Å; G396-A400 PolarHBondContact O-N 2.77Å; G396-A400 VanDerWaalsContact O-N 3.08Å
397	D	97.9	Very high	89.4	Confident	3 Å²	3	22.3 Å²	22.3	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-66.7	-36.1	173.3	-61.3	-28.7	0	0	0	112	L301 H305 A319 H320 R321 L323 L393 L394 Y399 A400 L401	L301-D397 HydrophobicContact CD1-CB 4.07Å; L301-D397 HydrophobicContact CD2-CB 4.21Å; H305-D397 IonicContact CD2-OD2 3.6Å; H305-D397 IonicContact CE1-OD2 2.85Å; H305-D397 IonicContact NE2-OD2 3.74Å; H305-D397 PolarHBondContact NE2-OD2 3.17Å; A319-D397 WeakPolarHBondContact CA-OD2 3.41Å; H320-D397 WeakPolarHBondContact CB-OD1 3.49Å; H320-D397 PolarHBondContact N-OD1 2.84Å; H320-D397 PolarHBondContact N-OD2 3Å; R321-D397 PolarHBondContact N-OD1 2.83Å; L323-D397 HydrophobicContact CD2-CB 4.37Å; L323-D397 WeakPolarHBondContact CD2-O 3.42Å; L393-D397 PolarHBondContact O-N 3.19Å; L394-D397 WeakPolarHBondContact O-CB 3.21Å; L394-D397 PolarHBondContact O-N 2.69Å; L394-D397 VanDerWaalsContact O-N 3.07Å; D397-Y399 VanDerWaalsContact C-N 3.33Å; D397-A400 PolarHBondContact O-N 3.4Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 PolarHBondContact O-N 3.44Å
398	I	98.6	Very high	91.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.2	-43.4	175.6	-62.5	-58	0	0	0	111.2	L301 L394 Q395 G396 A400 L401 G402 C474 R482 L483 A485 I488	L301-I398 HydrophobicContact CD2-CD1 4.17Å; L394-I398 WeakPolarHBondContact O-CG1 3.04Å; L394-I398 PolarHBondContact O-N 2.85Å; Q395-I398 PolarHBondContact O-N 3.44Å; G396-I398 VanDerWaalsContact C-N 3.35Å; I398-A400 VanDerWaalsContact C-N 3.35Å; I398-A400 PolarHBondContact O-N 2.71Å; I398-L401 WeakPolarHBondContact O-CB 3.49Å; I398-L401 PolarHBondContact O-N 2.76Å; I398-G402 PolarHBondContact O-N 3.33Å; I398-C474 HydrophobicContact CG2-CB 4.38Å; I398-R482 HydrophobicContact CG2-CB 4.13Å; I398-L483 WeakPolarHBondContact CG1-O 3.26Å; I398-L483 WeakPolarHBondContact CG2-O 3.49Å; I398-A485 HydrophobicContact CD1-CB 3.78Å; I398-I488 HydrophobicContact CD1-CD1 4.1Å; I398-I488 HydrophobicContact CG2-CD1 3.96Å
399	Y	98.5	Very high	93.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-58.5	-48.9	175.2	177.7	-84.7	0	0	0	111.2	Y375 M376 P378 Q395 G396 D397 L401 G402 L403 Y428 V445 C474 W475	Y375-Y399 WeakPolarHBondContact O-CD1 3.49Å; M376-Y399 WeakPolarHBondContact O-CE1 3.35Å; P378-Y399 HydrophobicContact CG-CE2 4.25Å; Q395-Y399 PolarHBondContact O-N 3.33Å; G396-Y399 WeakPolarHBondContact O-CB 3.31Å; G396-Y399 PolarHBondContact O-N 3.04Å; D397-Y399 VanDerWaalsContact C-N 3.33Å; Y399-L401 VanDerWaalsContact C-N 3.33Å; Y399-L401 PolarHBondContact O-N 3.07Å; Y399-G402 PolarHBondContact O-N 2.93Å; Y399-L403 HydrophobicContact CD1-CD1 3.92Å; Y399-L403 HydrophobicContact CE1-CD1 3.41Å; Y399-L403 VanDerWaalsContact CE1-CD1 3.41Å; Y399-L403 HydrophobicContact CE1-CG 4.2Å; Y399-L403 PolarHBondContact O-N 2.8Å; Y399-Y428 PolarHBondContact OH-OH 3.07Å; Y399-V445 WeakPolarHBondContact OH-CG1 3.32Å; Y399-C474 WeakPolarHBondContact CA-O 3.01Å; Y399-W475 HydrophobicContact CD2-CB 3.78Å; Y399-W475 HydrophobicContact CE2-CB 3.78Å
400	A	98.5	Very high	94.8	Very high	4 Å²	4	11.4 Å²	11.4	3%	0.033	7%	0.067	C	C	.	.	H	α-helix	trans	-61.3	-39.7	176.7	0	0	0	0	0	112.3	L323 G396 D397 I398 G402 L403 I404	L323-A400 HydrophobicContact CB-CB 4.02Å; L323-A400 HydrophobicContact CD2-CB 4.3Å; L323-A400 HydrophobicContact CG-CB 4.37Å; L323-A400 WeakPolarHBondContact O-CB 3.45Å; G396-A400 PolarHBondContact O-N 2.77Å; G396-A400 VanDerWaalsContact O-N 3.08Å; D397-A400 PolarHBondContact O-N 3.4Å; I398-A400 VanDerWaalsContact C-N 3.35Å; I398-A400 PolarHBondContact O-N 2.71Å; A400-G402 VanDerWaalsContact C-N 3.33Å; A400-G402 PolarHBondContact O-N 3.44Å; A400-L403 PolarHBondContact O-N 3.5Å; A400-I404 WeakPolarHBondContact O-CG1 3.3Å; A400-I404 PolarHBondContact O-N 3.49Å
401	L	98.8	Very high	96	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-58.7	-44.5	174.4	178	63.4	0	0	0	111.2	L297 L301 L323 D397 I398 Y399 L403 I404 L405 I488	L297-L401 HydrophobicContact CD1-CD1 4.46Å; L297-L401 HydrophobicContact CD2-CD1 3.6Å; L297-L401 HydrophobicContact CG-CD1 3.61Å; L301-L401 HydrophobicContact CD2-CB 3.92Å; L301-L401 HydrophobicContact CD2-CD2 3.71Å; L301-L401 HydrophobicContact CD2-CG 4.3Å; L323-L401 HydrophobicContact CD2-CB 4.1Å; D397-L401 WeakPolarHBondContact O-CB 3.39Å; D397-L401 PolarHBondContact O-N 3.44Å; I398-L401 WeakPolarHBondContact O-CB 3.49Å; I398-L401 PolarHBondContact O-N 2.76Å; Y399-L401 VanDerWaalsContact C-N 3.33Å; Y399-L401 PolarHBondContact O-N 3.07Å; L401-L403 VanDerWaalsContact C-N 3.28Å; L401-L403 PolarHBondContact O-N 2.92Å; L401-I404 PolarHBondContact O-N 3.17Å; L401-I404 VanDerWaalsContact O-N 3.14Å; L401-L405 HydrophobicContact CD1-CG 4.32Å; L401-L405 HydrophobicContact CG-CD1 4.31Å; L401-L405 HydrophobicContact CG-CG 4.35Å; L401-L405 WeakPolarHBondContact O-CG 3.19Å; L401-L405 PolarHBondContact O-N 2.73Å; L401-I488 HydrophobicContact CD2-CD1 3.72Å; L401-I488 HydrophobicContact CD2-CG2 4.16Å
402	G	98.7	Very high	96.7	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-55.1	-43.5	175.4	0	0	0	0	0	112.6	I398 Y399 A400 L405 W406 L471	I398-G402 PolarHBondContact O-N 3.33Å; Y399-G402 PolarHBondContact O-N 2.93Å; A400-G402 VanDerWaalsContact C-N 3.33Å; A400-G402 PolarHBondContact O-N 3.44Å; G402-L405 PolarHBondContact O-N 3.37Å; G402-W406 PolarHBondContact O-N 3.28Å; G402-L471 WeakPolarHBondContact O-CD2 3.23Å
403	L	98.8	Very high	97.2	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66	-38.9	177	-62.3	171.7	0	0	0	112.7	N374 Y375 Y399 A400 L401 W406 E407 P427 Y428 P452 W475	N374-L403 WeakPolarHBondContact O-CD1 3.43Å; Y375-L403 HydrophobicContact CD1-CB 4.09Å; Y375-L403 HydrophobicContact CD1-CD1 4.32Å; Y375-L403 HydrophobicContact CE1-CB 4.34Å; Y399-L403 HydrophobicContact CD1-CD1 3.92Å; Y399-L403 HydrophobicContact CE1-CD1 3.41Å; Y399-L403 VanDerWaalsContact CE1-CD1 3.41Å; Y399-L403 HydrophobicContact CE1-CG 4.2Å; Y399-L403 PolarHBondContact O-N 2.8Å; A400-L403 PolarHBondContact O-N 3.5Å; L401-L403 VanDerWaalsContact C-N 3.28Å; L401-L403 PolarHBondContact O-N 2.92Å; L403-W406 WeakPolarHBondContact O-CB 3.41Å; L403-W406 PolarHBondContact O-N 3.17Å; L403-E407 PolarHBondContact O-N 3.16Å; L403-P427 HydrophobicContact CB-CB 4.29Å; L403-P427 HydrophobicContact CB-CG 3.87Å; L403-P427 HydrophobicContact CD1-CB 4.41Å; L403-P427 HydrophobicContact CD2-CB 4.1Å; L403-Y428 HydrophobicContact CD1-CE2 4.13Å; L403-Y428 HydrophobicContact CD2-CE2 4.19Å; L403-P452 HydrophobicContact CD2-CG 3.63Å; L403-W475 HydrophobicContact CD2-CE3 3.62Å; L403-W475 HydrophobicContact CD2-CZ3 3.99Å; L403-W475 HydrophobicContact CG-CE3 4.42Å
404	I	98.8	Very high	97.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-68.9	-37.8	176.3	-61.2	166.3	0	0	0	111.2	L276 L297 L323 V328 Y375 A400 L401 W406 E407 I408	L276-I404 HydrophobicContact CD2-CG2 3.52Å; L297-I404 HydrophobicContact CD2-CB 4.22Å; L297-I404 HydrophobicContact CD2-CG2 3.5Å; L297-I404 VanDerWaalsContact CD2-CG2 3.5Å; L323-I404 HydrophobicContact CD1-CD1 4.26Å; L323-I404 HydrophobicContact CD2-CD1 4.35Å; L323-I404 HydrophobicContact CG-CD1 3.78Å; V328-I404 HydrophobicContact CG2-CD1 4.41Å; Y375-I404 HydrophobicContact CD1-CG1 4.08Å; Y375-I404 HydrophobicContact CE1-CD1 4.44Å; Y375-I404 HydrophobicContact CE1-CG1 3.63Å; A400-I404 WeakPolarHBondContact O-CG1 3.3Å; A400-I404 PolarHBondContact O-N 3.49Å; L401-I404 PolarHBondContact O-N 3.17Å; L401-I404 VanDerWaalsContact O-N 3.14Å; I404-W406 VanDerWaalsContact C-N 3.29Å; I404-W406 PolarHBondContact O-N 3.16Å; I404-E407 WeakPolarHBondContact O-CB 3.47Å; I404-E407 PolarHBondContact O-N 2.57Å; I404-I408 HydrophobicContact CG2-CD1 4.11Å; I404-I408 HydrophobicContact CG2-CG1 4.44Å; I404-I408 VanDerWaalsContact O-CG1 3.31Å; I404-I408 WeakPolarHBondContact O-CG1 3.46Å; I404-I408 PolarHBondContact O-N 3.43Å
405	L	98.8	Very high	97.3	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.3	-42.2	173.4	-68	177.6	0	0	0	110.8	C294 L401 G402 I408 W409 L470 L471 I488 L492	C294-L405 HydrophobicContact CB-CD2 3.56Å; C294-L405 VanDerWaalsContact SG-CD2 3.54Å; L401-L405 HydrophobicContact CD1-CG 4.32Å; L401-L405 HydrophobicContact CG-CD1 4.31Å; L401-L405 HydrophobicContact CG-CG 4.35Å; L401-L405 WeakPolarHBondContact O-CG 3.19Å; L401-L405 PolarHBondContact O-N 2.73Å; G402-L405 PolarHBondContact O-N 3.37Å; L405-I408 PolarHBondContact O-N 2.85Å; L405-W409 WeakPolarHBondContact O-CB 3.23Å; L405-W409 VanDerWaalsContact O-CG 3.28Å; L405-W409 PolarHBondContact O-N 2.83Å; L405-L470 HydrophobicContact CD1-CD2 4.31Å; L405-L471 HydrophobicContact CB-CD2 3.97Å; L405-I488 HydrophobicContact CD1-CG2 4.11Å; L405-L492 HydrophobicContact CD2-CD1 4.39Å
406	W	98.6	Very high	97.1	Very high	4 Å²	4	10.8 Å²	10.8	2%	0.015	6%	0.059	C	C	.	.	H	α-helix	trans	-59.6	-46.4	173	174.8	91.5	0	0	0	111.8	G402 L403 I404 I408 W409 M410 P452 S453 L471 W475	G402-W406 PolarHBondContact O-N 3.28Å; L403-W406 WeakPolarHBondContact O-CB 3.41Å; L403-W406 PolarHBondContact O-N 3.17Å; I404-W406 VanDerWaalsContact C-N 3.29Å; I404-W406 PolarHBondContact O-N 3.16Å; W406-I408 PolarHBondContact O-N 2.84Å; W406-W409 PolarHBondContact O-N 2.76Å; W406-M410 HydrophobicContact CD2-CG 3.86Å; W406-M410 HydrophobicContact CE3-CG 4.29Å; W406-M410 HydrophobicContact CG-CG 4.37Å; W406-M410 HydrophobicContact CH2-CG 4.13Å; W406-M410 HydrophobicContact CZ2-CE 4.22Å; W406-M410 HydrophobicContact CZ2-CG 3.68Å; W406-M410 HydrophobicContact CZ2-SD 4.14Å; W406-M410 HydrophobicContact CZ3-CG 4.4Å; W406-M410 WeakPolarHBondContact O-CB 3.35Å; W406-M410 VanDerWaalsContact O-CG 3.27Å; W406-M410 WeakPolarHBondContact O-CG 3.27Å; W406-M410 PolarHBondContact O-N 2.71Å; W406-P452 HydrophobicContact CD2-CB 3.82Å; W406-P452 HydrophobicContact CE3-CB 4.21Å; W406-P452 HydrophobicContact CG-CB 4.34Å; W406-P452 HydrophobicContact CH2-CB 4.14Å; W406-P452 HydrophobicContact CZ2-CB 3.71Å; W406-P452 HydrophobicContact CZ3-CB 4.37Å; W406-S453 PolarHBondContact NE1-O 2.89Å; W406-L471 HydrophobicContact CB-CD1 4.16Å; W406-L471 HydrophobicContact CB-CD2 3.97Å; W406-W475 HydrophobicContact CB-CZ3 4.05Å; W406-W475 HydrophobicContact CG-CH2 4.45Å; W406-W475 HydrophobicContact CG-CZ3 4.22Å
407	E	98.4	Very high	96.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-56	-47.3	175.5	-76.9	179.9	-89.2	0	0	112.2	L280 S325 Y375 L403 I404 W409 M410 R411 H424 P427	L280-E407 HydrophobicContact CD1-CB 3.99Å; S325-E407 WeakPolarHBondContact CB-OE2 3.43Å; S325-E407 PolarHBondContact OG-OE1 3.21Å; S325-E407 PolarHBondContact OG-OE2 2.77Å; Y375-E407 WeakPolarHBondContact CE1-OE1 3.27Å; Y375-E407 VanDerWaalsContact CZ-OE1 3.26Å; Y375-E407 PolarHBondContact OH-OE1 2.8Å; Y375-E407 PolarHBondContact OH-OE2 3.29Å; Y375-E407 VanDerWaalsContact OH-OE2 3.11Å; L403-E407 PolarHBondContact O-N 3.16Å; I404-E407 WeakPolarHBondContact O-CB 3.47Å; I404-E407 PolarHBondContact O-N 2.57Å; E407-W409 VanDerWaalsContact C-N 3.33Å; E407-W409 PolarHBondContact O-N 3.3Å; E407-M410 PolarHBondContact O-N 3.44Å; E407-R411 PolarHBondContact O-N 3.15Å; E407-H424 IonicContact OE2-CE1 3.13Å; E407-H424 PolarHBondContact OE2-CE1 2.84Å; E407-H424 IonicContact OE2-NE2 3.21Å; E407-H424 PolarHBondContact OE2-NE2 3.23Å; E407-P427 HydrophobicContact CG-CG 4.13Å
408	I	98.6	Very high	95.3	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-42.6	179.9	-63.8	165.4	0	0	0	110.6	L276 L280 T290 L293 L297 I404 L405 W406 R411 C412	L276-I408 HydrophobicContact CD1-CG1 4.28Å; L276-I408 HydrophobicContact CD2-CD1 3.9Å; L276-I408 HydrophobicContact CD2-CG1 3.93Å; L280-I408 HydrophobicContact CD1-CG1 4.24Å; T290-I408 HydrophobicContact CG2-CG2 3.98Å; L293-I408 HydrophobicContact CB-CD1 4.24Å; L293-I408 HydrophobicContact CB-CG2 4.24Å; L293-I408 HydrophobicContact CD1-CG2 4.26Å; L297-I408 HydrophobicContact CD2-CD1 4.29Å; I404-I408 HydrophobicContact CG2-CD1 4.11Å; I404-I408 HydrophobicContact CG2-CG1 4.44Å; I404-I408 VanDerWaalsContact O-CG1 3.31Å; I404-I408 WeakPolarHBondContact O-CG1 3.46Å; I404-I408 PolarHBondContact O-N 3.43Å; L405-I408 PolarHBondContact O-N 2.85Å; W406-I408 PolarHBondContact O-N 2.84Å; I408-R411 PolarHBondContact O-N 2.78Å; I408-C412 PolarHBondContact O-N 3.04Å
409	W	97.6	Very high	94.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-73.1	-33.2	-178.8	-67.5	-19.6	0	0	0	113.3	T290 C294 L405 W406 E407 R411 C412 L415 W458 L467 L470 L471 L492	T290-W409 VanDerWaalsContact CG2-CD1 3.44Å; C294-W409 PolarHBondContact SG-NE1 2.93Å; C294-W409 VanDerWaalsContact SG-NE1 3.45Å; L405-W409 WeakPolarHBondContact O-CB 3.23Å; L405-W409 VanDerWaalsContact O-CG 3.28Å; L405-W409 PolarHBondContact O-N 2.83Å; W406-W409 PolarHBondContact O-N 2.76Å; E407-W409 VanDerWaalsContact C-N 3.33Å; E407-W409 PolarHBondContact O-N 3.3Å; W409-R411 PolarHBondContact O-N 2.82Å; W409-R411 VanDerWaalsContact O-N 3.13Å; W409-C412 VanDerWaalsContact O-CB 3.27Å; W409-C412 WeakPolarHBondContact O-CB 3.48Å; W409-C412 PolarHBondContact O-N 2.99Å; W409-L415 HydrophobicContact CB-CD1 3.73Å; W409-L415 HydrophobicContact CG-CD1 4.14Å; W409-W458 HydrophobicContact CB-CH2 3.41Å; W409-W458 VanDerWaalsContact CB-CH2 3.41Å; W409-W458 HydrophobicContact CB-CZ2 4.03Å; W409-W458 HydrophobicContact CB-CZ3 4.07Å; W409-W458 HydrophobicContact CE3-CH2 4.35Å; W409-W458 AromaticContact CE3-CZ3 3.91Å; W409-W458 HydrophobicContact CE3-CZ3 3.91Å; W409-W458 HydrophobicContact CG-CH2 4.46Å; W409-L467 HydrophobicContact CD2-CD2 4.07Å; W409-L467 HydrophobicContact CE3-CB 4.09Å; W409-L467 HydrophobicContact CE3-CD2 4.1Å; W409-L467 HydrophobicContact CE3-CG 4.5Å; W409-L467 HydrophobicContact CH2-CB 3.96Å; W409-L467 HydrophobicContact CH2-CD2 3.33Å; W409-L467 HydrophobicContact CH2-CG 4.23Å; W409-L467 HydrophobicContact CZ2-CD2 3.31Å; W409-L467 HydrophobicContact CZ3-CB 3.58Å; W409-L467 HydrophobicContact CZ3-CD2 3.71Å; W409-L467 HydrophobicContact CZ3-CG 4.18Å; W409-L467 WeakPolarHBondContact CZ3-O 3.49Å; W409-L470 HydrophobicContact CH2-CB 4.32Å; W409-L470 HydrophobicContact CH2-CD2 3.84Å; W409-L470 HydrophobicContact CH2-CG 4.4Å; W409-L470 HydrophobicContact CZ2-CD2 4.21Å; W409-L471 HydrophobicContact CE3-CD1 3.82Å; W409-L471 HydrophobicContact CE3-CD2 4.18Å; W409-L471 HydrophobicContact CE3-CG 4.06Å; W409-L471 HydrophobicContact CH2-CG 4.38Å; W409-L471 HydrophobicContact CZ3-CD1 3.69Å; W409-L471 HydrophobicContact CZ3-CD2 3.81Å; W409-L471 HydrophobicContact CZ3-CG 3.49Å; W409-L471 VanDerWaalsContact CZ3-CG 3.49Å; W409-L492 HydrophobicContact CZ2-CD2 3.96Å
410	M	97.1	Very high	94.1	Very high	24 Å²	24	24.8 Å²	24.8	12%	0.118	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-20.9	171.7	-73.6	-61.1	-69.4	0	0	112.9	W406 E407 F416 V421 P422 P455 W458	W406-M410 HydrophobicContact CD2-CG 3.86Å; W406-M410 HydrophobicContact CE3-CG 4.29Å; W406-M410 HydrophobicContact CG-CG 4.37Å; W406-M410 HydrophobicContact CH2-CG 4.13Å; W406-M410 HydrophobicContact CZ2-CE 4.22Å; W406-M410 HydrophobicContact CZ2-CG 3.68Å; W406-M410 HydrophobicContact CZ2-SD 4.14Å; W406-M410 HydrophobicContact CZ3-CG 4.4Å; W406-M410 WeakPolarHBondContact O-CB 3.35Å; W406-M410 VanDerWaalsContact O-CG 3.27Å; W406-M410 WeakPolarHBondContact O-CG 3.27Å; W406-M410 PolarHBondContact O-N 2.71Å; E407-M410 PolarHBondContact O-N 3.44Å; M410-F416 HydrophobicContact CE-CZ 4.45Å; M410-F416 VanDerWaalsContact O-CE2 3.31Å; M410-F416 WeakPolarHBondContact O-CE2 3.31Å; M410-F416 HydrophobicContact SD-CZ 4.28Å; M410-V421 WeakPolarHBondContact O-CG1 3.39Å; M410-P422 HydrophobicContact CE-CB 4.3Å; M410-P422 HydrophobicContact CE-CG 4.07Å; M410-P455 HydrophobicContact CE-CG 4.19Å; M410-P455 HydrophobicContact SD-CG 3.61Å; M410-W458 HydrophobicContact SD-CH2 4.26Å; M410-W458 HydrophobicContact SD-CZ2 3.9Å
411	R	97.4	Very high	93.9	Very high	25 Å²	25	26.4 Å²	26.4	9%	0.094	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	11.4	175.1	-58.6	-60.7	-65.6	145.9	1	113.6	L280 H283 A284 S285 E407 I408 W409 V421 P422 H424	L280-R411 HydrophobicContact CB-CG 4.14Å; L280-R411 HydrophobicContact CD2-CB 3.89Å; L280-R411 HydrophobicContact CD2-CG 4.08Å; L280-R411 PolarHBondContact O-NE 3.41Å; H283-R411 PolarHBondContact O-NE 2.73Å; H283-R411 PolarHBondContact O-NH2 3.4Å; A284-R411 CarbonylContact C-O 3.52Å; A284-R411 VanDerWaalsContact CA-O 3.27Å; A284-R411 WeakPolarHBondContact CA-O 3.06Å; S285-R411 PolarHBondContact N-O 3.15Å; E407-R411 PolarHBondContact O-N 3.15Å; I408-R411 PolarHBondContact O-N 2.78Å; W409-R411 PolarHBondContact O-N 2.82Å; W409-R411 VanDerWaalsContact O-N 3.13Å; R411-V421 VanDerWaalsContact NH1-CG1 3.34Å; R411-P422 WeakPolarHBondContact CD-O 3.38Å; R411-P422 PolarHBondContact NH1-O 3.49Å; R411-H424 HydrophobicContact CG-CB 4.49Å
412	C	96.3	Very high	93.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-88.4	110.9	176.3	-170.2	0	0	0	0	111.2	S285 T290 I408 W409 D414 L415 F416	S285-C412 CarbonylContact O-C 3.51Å; S285-C412 WeakPolarHBondContact O-CA 3.46Å; T290-C412 HydrophobicContact CG2-CB 4.01Å; T290-C412 WeakPolarHBondContact OG1-CB 3.26Å; T290-C412 PolarHBondContact OG1-SG 3.04Å; T290-C412 VanDerWaalsContact OG1-SG 3.39Å; I408-C412 PolarHBondContact O-N 3.04Å; W409-C412 VanDerWaalsContact O-CB 3.27Å; W409-C412 WeakPolarHBondContact O-CB 3.48Å; W409-C412 PolarHBondContact O-N 2.99Å; C412-D414 VanDerWaalsContact C-N 3.29Å; C412-D414 PolarHBondContact O-N 2.83Å; C412-L415 HydrophobicContact CB-CB 4.3Å; C412-L415 HydrophobicContact CB-CD1 3.88Å; C412-L415 HydrophobicContact CB-CG 3.92Å; C412-L415 PolarHBondContact O-N 3.47Å; C412-L415 VanDerWaalsContact O-N 3.15Å; C412-F416 VanDerWaalsContact O-CD2 3.27Å; C412-F416 WeakPolarHBondContact O-CD2 3.34Å
413	S	94.4	Very high	93.5	Very high	43 Å²	43	36.8 Å²	36.8	30%	0.301	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-58.1	-36.6	-178.5	53.1	0	0	0	0	114.3	S285 L415 F416	S285-S413 PolarHBondContact O-N 2.03Å; S285-S413 PolarHBondContact O-OG 3.25Å; S413-L415 VanDerWaalsContact C-N 3.26Å; S413-L415 PolarHBondContact O-N 3.31Å; S413-F416 PolarHBondContact O-N 2.91Å; S413-F416 VanDerWaalsContact O-N 3.17Å
414	D	93	Very high	93.4	Very high	88 Å²	88	38 Å²	38	47%	0.471	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-69.8	-23.1	-178.7	-64.7	-37.6	0	0	0	112.6	W287 C412 F416	W287-D414 HydrophobicContact CB-CB 4.04Å; W287-D414 WeakPolarHBondContact CB-OD2 3.35Å; W287-D414 PolarHBondContact N-OD2 3.02Å; C412-D414 VanDerWaalsContact C-N 3.29Å; C412-D414 PolarHBondContact O-N 2.83Å; D414-F416 PolarHBondContact O-N 2.02Å
415	L	93.3	Very high	93.2	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.016	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-77.1	-7.6	175.3	-65.4	-177.4	0	0	0	113.7	W287 W409 C412 S413 N457 W458 L461 L467	W287-L415 HydrophobicContact CE3-CD2 4.26Å; W287-L415 HydrophobicContact CE3-CG 4.49Å; W287-L415 HydrophobicContact CZ3-CD1 4.45Å; W287-L415 HydrophobicContact CZ3-CD2 3.91Å; W287-L415 HydrophobicContact CZ3-CG 4.35Å; W409-L415 HydrophobicContact CB-CD1 3.73Å; W409-L415 HydrophobicContact CG-CD1 4.14Å; C412-L415 HydrophobicContact CB-CB 4.3Å; C412-L415 HydrophobicContact CB-CD1 3.88Å; C412-L415 HydrophobicContact CB-CG 3.92Å; C412-L415 PolarHBondContact O-N 3.47Å; C412-L415 VanDerWaalsContact O-N 3.15Å; S413-L415 VanDerWaalsContact C-N 3.26Å; S413-L415 PolarHBondContact O-N 3.31Å; L415-N457 PolarHBondContact O-ND2 3.07Å; L415-W458 HydrophobicContact CD1-CD2 4.39Å; L415-W458 HydrophobicContact CD1-CH2 4.24Å; L415-W458 HydrophobicContact CD1-CZ2 3.87Å; L415-L461 HydrophobicContact CB-CD1 4.29Å; L415-L461 HydrophobicContact CD2-CD1 3.59Å; L415-L467 HydrophobicContact CD1-CD1 4.04Å; L415-L467 HydrophobicContact CD2-CD1 3.77Å
416	F	90.9	Very high	93	Very high	25 Å²	25	42.7 Å²	42.7	11%	0.11	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-109.6	11.7	178	-66.1	-83.6	0	0	0	113.4	M410 C412 S413 D414 G418 G419 V421 P422 P455	M410-F416 HydrophobicContact CE-CZ 4.45Å; M410-F416 VanDerWaalsContact O-CE2 3.31Å; M410-F416 WeakPolarHBondContact O-CE2 3.31Å; M410-F416 HydrophobicContact SD-CZ 4.28Å; C412-F416 VanDerWaalsContact O-CD2 3.27Å; C412-F416 WeakPolarHBondContact O-CD2 3.34Å; S413-F416 PolarHBondContact O-N 2.91Å; S413-F416 VanDerWaalsContact O-N 3.17Å; D414-F416 PolarHBondContact O-N 2.02Å; F416-G418 PolarHBondContact O-N 3.41Å; F416-G418 VanDerWaalsContact O-N 3.08Å; F416-G419 WeakPolarHBondContact O-CA 3.27Å; F416-G419 PolarHBondContact O-N 3.31Å; F416-V421 HydrophobicContact CD2-CG1 4.22Å; F416-V421 HydrophobicContact CD2-CG2 4.43Å; F416-V421 HydrophobicContact CE2-CG1 4.29Å; F416-P422 HydrophobicContact CD1-CG 4.46Å; F416-P422 HydrophobicContact CE1-CG 3.7Å; F416-P422 HydrophobicContact CE2-CG 4.42Å; F416-P422 HydrophobicContact CZ-CG 3.68Å; F416-P455 HydrophobicContact CE1-CG 4.26Å; F416-P455 HydrophobicContact CZ-CG 4.33Å
417	A	79.5	Confident	92.8	Very high	86 Å²	86	42.5 Å²	42.5	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	37.9	171.2	0	0	0	0	0	114.5	G419	A417-G419 VanDerWaalsContact C-N 3.31Å; A417-G419 PolarHBondContact O-N 3.37Å
418	G	75.7	Confident	92.7	Very high	79 Å²	79	42.6 Å²	42.6	81%	0.814	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	0.8	-177.4	0	0	0	0	0	115.3	F416	F416-G418 PolarHBondContact O-N 3.41Å; F416-G418 VanDerWaalsContact O-N 3.08Å
419	G	84.2	Confident	92.3	Very high	44 Å²	44	45 Å²	45	45%	0.454	29%	0.29	S	S	.	.	S	Bend	trans	-71.2	172.9	166.7	0	0	0	0	0	112.8	F416 A417 V421	F416-G419 WeakPolarHBondContact O-CA 3.27Å; F416-G419 PolarHBondContact O-N 3.31Å; A417-G419 VanDerWaalsContact C-N 3.31Å; A417-G419 PolarHBondContact O-N 3.37Å; G419-V421 PolarHBondContact O-N 3.01Å
420	A	89.4	Confident	92	Very high	95 Å²	95	49.9 Å²	49.9	79%	0.785	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-67.8	127.4	176.5	0	0	0	0	0	110.6
421	V	94.2	Very high	91.6	Very high	37 Å²	37	50.8 Å²	50.8	22%	0.224	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-73.4	124.6	174.2	-171.5	0	0	0	0	108.6	A284 M410 R411 F416 G419	A284-V421 HydrophobicContact CB-CB 4.28Å; A284-V421 HydrophobicContact CB-CG1 4.09Å; A284-V421 HydrophobicContact CB-CG2 4.19Å; M410-V421 WeakPolarHBondContact O-CG1 3.39Å; R411-V421 VanDerWaalsContact NH1-CG1 3.34Å; F416-V421 HydrophobicContact CD2-CG1 4.22Å; F416-V421 HydrophobicContact CD2-CG2 4.43Å; F416-V421 HydrophobicContact CE2-CG1 4.29Å; G419-V421 PolarHBondContact O-N 3.01Å
422	P	93.9	Very high	91.1	Very high	47 Å²	47	50.5 Å²	50.5	31%	0.305	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-58.1	143.6	179.9	-22.6	32.8	0	0	0	111.8	M410 R411 F416	M410-P422 HydrophobicContact CE-CB 4.3Å; M410-P422 HydrophobicContact CE-CG 4.07Å; R411-P422 WeakPolarHBondContact CD-O 3.38Å; R411-P422 PolarHBondContact NH1-O 3.49Å; F416-P422 HydrophobicContact CD1-CG 4.46Å; F416-P422 HydrophobicContact CE1-CG 3.7Å; F416-P422 HydrophobicContact CE2-CG 4.42Å; F416-P422 HydrophobicContact CZ-CG 3.68Å
423	E	95.1	Very high	90.3	Very high	171 Å²	171	56 Å²	56	80%	0.799	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-54.9	152.3	172.4	-66.5	-172	163.7	0	0	111.6	L425	E423-L425 PolarHBondContact O-N 3.35Å
424	H	96.1	Very high	88.9	Confident	25 Å²	25	58.6 Å²	58.6	12%	0.116	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-66.2	127.3	178.4	-174.5	66.9	0	0	0	110.3	H277 L280 C281 E407 R411	H277-H424 AromaticContact CE1-CD2 3.99Å; H277-H424 AromaticContact ND1-CD2 3.95Å; H277-H424 AromaticContact ND1-NE2 3.61Å; L280-H424 WeakPolarHBondContact CB-ND1 3.03Å; C281-H424 PolarHBondContact SG-CD2 3.31Å; E407-H424 IonicContact OE2-CE1 3.13Å; E407-H424 PolarHBondContact OE2-CE1 2.84Å; E407-H424 IonicContact OE2-NE2 3.21Å; E407-H424 PolarHBondContact OE2-NE2 3.23Å; R411-H424 HydrophobicContact CG-CB 4.49Å
425	L	93.8	Very high	87.7	Confident	67 Å²	67	59.8 Å²	59.8	35%	0.351	38%	0.379	S	S	.	.			trans	-127.3	144.7	173.8	-66.1	177.9	0	0	0	108.2	E423 E429 L430	E423-L425 PolarHBondContact O-N 3.35Å; L425-E429 WeakPolarHBondContact CA-OE2 3.38Å; L425-E429 HydrophobicContact CB-CB 4.3Å; L425-L430 HydrophobicContact CD1-CB 4.1Å; L425-L430 HydrophobicContact CD1-CD1 4.38Å
426	L	94.7	Very high	87.1	Confident	33 Å²	33	60.7 Å²	60.7	17%	0.173	39%	0.385	C	S	.	.			trans	-67.7	156.6	168.8	-66.1	174.3	0	0	0	109.9	Y428 E429	L426-Y428 PolarHBondContact O-N 2.92Å; L426-E429 HydrophobicContact CB-CG 3.91Å; L426-E429 PolarHBondContact N-OE2 3.34Å; L426-E429 WeakPolarHBondContact O-CB 3.24Å; L426-E429 PolarHBondContact O-N 3.31Å
427	P	95.8	Very high	86.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	136.7	174.7	-25	33.8	0	0	0	111	N374 Y375 L403 E407 E429 P452	N374-P427 HydrophobicContact CB-CB 4.44Å; N374-P427 PolarHBondContact ND2-O 3.41Å; Y375-P427 HydrophobicContact CD1-CG 4.4Å; Y375-P427 HydrophobicContact CE1-CG 3.82Å; L403-P427 HydrophobicContact CB-CB 4.29Å; L403-P427 HydrophobicContact CB-CG 3.87Å; L403-P427 HydrophobicContact CD1-CB 4.41Å; L403-P427 HydrophobicContact CD2-CB 4.1Å; E407-P427 HydrophobicContact CG-CG 4.13Å; P427-E429 VanDerWaalsContact C-N 3.28Å; P427-E429 PolarHBondContact O-N 3.44Å; P427-P452 HydrophobicContact CB-CG 4.1Å
428	Y	95.2	Very high	87	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	-7.2	179.8	-47.4	-70.2	0	0	0	117.5	N374 Y399 L403 L426 L430 E431 L432 L441 F444 V445 P452	N374-Y428 WeakPolarHBondContact O-CD2 3.37Å; N374-Y428 WeakPolarHBondContact O-CE2 2.96Å; Y399-Y428 PolarHBondContact OH-OH 3.07Å; L403-Y428 HydrophobicContact CD1-CE2 4.13Å; L403-Y428 HydrophobicContact CD2-CE2 4.19Å; L426-Y428 PolarHBondContact O-N 2.92Å; Y428-L430 VanDerWaalsContact C-N 3.28Å; Y428-L430 PolarHBondContact O-N 3.25Å; Y428-E431 VanDerWaalsContact CA-OE2 3.29Å; Y428-E431 WeakPolarHBondContact CA-OE2 3.04Å; Y428-E431 PolarHBondContact O-N 2.96Å; Y428-L432 WeakPolarHBondContact O-CB 3.29Å; Y428-L432 PolarHBondContact O-N 3.46Å; Y428-L441 HydrophobicContact CD2-CD2 3.62Å; Y428-L441 HydrophobicContact CE2-CD2 4.22Å; Y428-L441 HydrophobicContact CG-CD2 3.83Å; Y428-F444 AromaticContact CD1-CD1 3.96Å; Y428-F444 HydrophobicContact CD1-CD1 3.96Å; Y428-F444 AromaticContact CD1-CE1 3.98Å; Y428-F444 HydrophobicContact CD1-CE1 3.98Å; Y428-F444 HydrophobicContact CE1-CD1 4.18Å; Y428-F444 HydrophobicContact CE1-CE1 4.22Å; Y428-V445 HydrophobicContact CD1-CG2 4.32Å; Y428-V445 HydrophobicContact CE1-CG2 3.68Å; Y428-V445 HydrophobicContact CE2-CG2 4.11Å; Y428-P452 HydrophobicContact CD1-CG 4.13Å; Y428-P452 VanDerWaalsContact CE1-CD 3.44Å; Y428-P452 HydrophobicContact CE1-CG 3.84Å
429	E	91.1	Very high	87.4	Confident	52 Å²	52	61.7 Å²	61.7	24%	0.243	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-32.2	178.4	-74.3	-174.7	154.5	0	0	112.8	L425 L426 P427 D433 V436	L425-E429 WeakPolarHBondContact CA-OE2 3.38Å; L425-E429 HydrophobicContact CB-CB 4.3Å; L426-E429 HydrophobicContact CB-CG 3.91Å; L426-E429 PolarHBondContact N-OE2 3.34Å; L426-E429 WeakPolarHBondContact O-CB 3.24Å; L426-E429 PolarHBondContact O-N 3.31Å; P427-E429 VanDerWaalsContact C-N 3.28Å; P427-E429 PolarHBondContact O-N 3.44Å; E429-D433 CarbonylContact O-C 3.58Å; E429-D433 VanDerWaalsContact O-CA 3.25Å; E429-D433 WeakPolarHBondContact O-CA 3.42Å; E429-D433 PolarHBondContact O-N 2.85Å; E429-D433 VanDerWaalsContact O-N 3.17Å; E429-V436 HydrophobicContact CG-CG2 4.24Å
430	L	90.1	Very high	87.5	Confident	103 Å²	103	64.6 Å²	64.6	54%	0.539	36%	0.355	S	S	.	.	H	α-helix	trans	-68.7	-37.4	176.6	-178	64.4	0	0	0	111.6	L425 Y428	L425-L430 HydrophobicContact CD1-CB 4.1Å; L425-L430 HydrophobicContact CD1-CD1 4.38Å; Y428-L430 VanDerWaalsContact C-N 3.28Å; Y428-L430 PolarHBondContact O-N 3.25Å
431	E	89.9	Confident	87.4	Confident	42 Å²	42	60.1 Å²	60.1	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-86.5	-31.2	-174.9	-66.2	77.3	-169.4	0	0	113.8	Y428 F444 S453	Y428-E431 VanDerWaalsContact CA-OE2 3.29Å; Y428-E431 WeakPolarHBondContact CA-OE2 3.04Å; Y428-E431 PolarHBondContact O-N 2.96Å; E431-F444 HydrophobicContact CB-CE1 4.12Å; E431-F444 HydrophobicContact CB-CE2 4.05Å; E431-F444 HydrophobicContact CB-CZ 3.61Å; E431-F444 HydrophobicContact CG-CE1 4.21Å; E431-F444 HydrophobicContact CG-CZ 3.7Å; E431-S453 VanDerWaalsContact OE1-CB 3.32Å; E431-S453 WeakPolarHBondContact OE1-CB 3.29Å; E431-S453 PolarHBondContact OE1-N 2.84Å; E431-S453 PolarHBondContact OE1-OG 3.46Å
432	L	86.4	Confident	87	Confident	19 Å²	19	60.7 Å²	60.7	10%	0.099	32%	0.319	C	S	.	.	H	α-helix	trans	-115.5	6.7	-171	-60.3	-179.8	0	0	0	113.9	Y428 V436 R440 L441 F444	Y428-L432 WeakPolarHBondContact O-CB 3.29Å; Y428-L432 PolarHBondContact O-N 3.46Å; L432-V436 HydrophobicContact CB-CG2 4.28Å; L432-V436 HydrophobicContact CD1-CG1 4.35Å; L432-R440 HydrophobicContact CD1-CB 4.24Å; L432-R440 PolarHBondContact O-NH1 2.79Å; L432-L441 HydrophobicContact CD1-CD2 3.91Å; L432-L441 HydrophobicContact CD1-CG 4.4Å; L432-F444 HydrophobicContact CD1-CB 4.19Å; L432-F444 HydrophobicContact CD1-CG 4.4Å; L432-F444 HydrophobicContact CD2-CB 4Å; L432-F444 HydrophobicContact CD2-CD2 3.73Å; L432-F444 HydrophobicContact CD2-CE2 4.36Å; L432-F444 HydrophobicContact CD2-CG 3.9Å; L432-F444 HydrophobicContact CG-CG 4.41Å
433	D	79.7	Confident	86.6	Confident	117 Å²	117	63.3 Å²	63.3	63%	0.626	33%	0.33	S	S	*	.			trans	61.6	177.1	-168.5	-51.3	-60.3	0	0	0	112.8	E429 N435	E429-D433 CarbonylContact O-C 3.58Å; E429-D433 VanDerWaalsContact O-CA 3.25Å; E429-D433 WeakPolarHBondContact O-CA 3.42Å; E429-D433 PolarHBondContact O-N 2.85Å; E429-D433 VanDerWaalsContact O-N 3.17Å; D433-N435 PolarHBondContact O-N 2.83Å
434	A	64.9	Low	86.3	Confident	96 Å²	96	56.1 Å²	56.1	79%	0.793	30%	0.296	S	S	*	.	S	Bend	trans	-61.8	-7.8	-176.8	0	0	0	0	0	115.4
435	N	68.6	Low	86.1	Confident	114 Å²	114	54.9 Å²	54.9	61%	0.61	29%	0.291	S	S	*	.			trans	-110.4	67.1	179.7	-160.8	10.4	0	0	0	110.7	D433 T437	D433-N435 PolarHBondContact O-N 2.83Å; N435-T437 PolarHBondContact O-N 3.37Å
436	V	80.4	Confident	85.7	Confident	21 Å²	21	51.7 Å²	51.7	13%	0.127	27%	0.274	C	S	.	.			trans	-68.6	111.5	173.6	-177.7	0	0	0	0	108.5	E429 L432 L441	E429-V436 HydrophobicContact CG-CG2 4.24Å; L432-V436 HydrophobicContact CB-CG2 4.28Å; L432-V436 HydrophobicContact CD1-CG1 4.35Å; V436-L441 HydrophobicContact CG1-CD1 3.53Å; V436-L441 HydrophobicContact CG1-CD2 3.71Å; V436-L441 HydrophobicContact CG1-CG 3.49Å; V436-L441 VanDerWaalsContact CG1-CG 3.49Å
437	T	85.3	Confident	85.1	Confident	39 Å²	39	54.3 Å²	54.3	24%	0.239	29%	0.285	C	S	.	.			trans	-107.8	158.9	175.1	81.1	0	0	0	0	110.8	N435 E439 R440 L441	N435-T437 PolarHBondContact O-N 3.37Å; T437-E439 VanDerWaalsContact C-N 3.28Å; T437-E439 VanDerWaalsContact CB-OE2 3.3Å; T437-E439 WeakPolarHBondContact CB-OE2 3.47Å; T437-E439 PolarHBondContact O-N 2.86Å; T437-E439 PolarHBondContact OG1-OE2 3.4Å; T437-R440 PolarHBondContact O-N 2.82Å; T437-R440 VanDerWaalsContact O-N 3.16Å; T437-R440 PolarHBondContact OG1-N 3.03Å; T437-L441 PolarHBondContact O-N 3.41Å
438	L	83.1	Confident	84.7	Confident	41 Å²	41	57.4 Å²	57.4	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-54.8	-44.3	177.3	177	63.2	0	0	0	111.7	L368 L373 L381 R440 L441 I442	L368-L438 HydrophobicContact CD1-CD2 4.15Å; L373-L438 HydrophobicContact CD2-CD1 4.21Å; L381-L438 HydrophobicContact CD2-CD1 3.67Å; L438-R440 VanDerWaalsContact C-N 3.32Å; L438-R440 PolarHBondContact O-N 2.94Å; L438-L441 PolarHBondContact O-N 2.81Å; L438-I442 HydrophobicContact CD1-CD1 4.1Å; L438-I442 HydrophobicContact CD1-CG1 4.29Å; L438-I442 HydrophobicContact CG-CD1 3.91Å; L438-I442 WeakPolarHBondContact O-CG1 3.45Å; L438-I442 PolarHBondContact O-N 2.8Å
439	E	84.1	Confident	84.6	Confident	132 Å²	132	61 Å²	61	62%	0.617	32%	0.32	S	S	*	.	H	α-helix	trans	-65	-37.4	-178.9	-54.9	76.8	-167.5	0	0	111.9	T437 L443	T437-E439 VanDerWaalsContact C-N 3.28Å; T437-E439 VanDerWaalsContact CB-OE2 3.3Å; T437-E439 WeakPolarHBondContact CB-OE2 3.47Å; T437-E439 PolarHBondContact O-N 2.86Å; T437-E439 PolarHBondContact OG1-OE2 3.4Å; E439-L443 PolarHBondContact O-N 3.36Å; E439-L443 VanDerWaalsContact O-N 3.09Å
440	R	85.8	Confident	84.7	Confident	104 Å²	104	64 Å²	64	39%	0.392	33%	0.329	S	S	.	.	H	α-helix	trans	-68.8	-39.6	176	-72.8	-177.8	168.4	-157.2	-4.4	111.4	L432 T437 L438 L443 F444	L432-R440 HydrophobicContact CD1-CB 4.24Å; L432-R440 PolarHBondContact O-NH1 2.79Å; T437-R440 PolarHBondContact O-N 2.82Å; T437-R440 VanDerWaalsContact O-N 3.16Å; T437-R440 PolarHBondContact OG1-N 3.03Å; L438-R440 VanDerWaalsContact C-N 3.32Å; L438-R440 PolarHBondContact O-N 2.94Å; R440-L443 PolarHBondContact O-N 3.21Å; R440-F444 VanDerWaalsContact O-CB 3.26Å; R440-F444 WeakPolarHBondContact O-CB 3.33Å; R440-F444 PolarHBondContact O-N 2.79Å
441	L	88.3	Confident	85.1	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-44.7	176	-75.7	171.2	0	0	0	111.8	L373 L381 Y428 L432 V436 T437 L438 L443 F444 V445	L373-L441 HydrophobicContact CB-CD1 3.73Å; L373-L441 WeakPolarHBondContact O-CD1 3.3Å; L381-L441 HydrophobicContact CD1-CB 4.22Å; L381-L441 HydrophobicContact CD2-CB 4.18Å; Y428-L441 HydrophobicContact CD2-CD2 3.62Å; Y428-L441 HydrophobicContact CE2-CD2 4.22Å; Y428-L441 HydrophobicContact CG-CD2 3.83Å; L432-L441 HydrophobicContact CD1-CD2 3.91Å; L432-L441 HydrophobicContact CD1-CG 4.4Å; V436-L441 HydrophobicContact CG1-CD1 3.53Å; V436-L441 HydrophobicContact CG1-CD2 3.71Å; V436-L441 HydrophobicContact CG1-CG 3.49Å; V436-L441 VanDerWaalsContact CG1-CG 3.49Å; T437-L441 PolarHBondContact O-N 3.41Å; L438-L441 PolarHBondContact O-N 2.81Å; L441-L443 VanDerWaalsContact C-N 3.3Å; L441-L443 PolarHBondContact O-N 2.86Å; L441-F444 PolarHBondContact O-N 3.23Å; L441-V445 HydrophobicContact CD2-CG2 4.14Å; L441-V445 VanDerWaalsContact O-CB 3.25Å; L441-V445 WeakPolarHBondContact O-CB 3.19Å; L441-V445 PolarHBondContact O-N 2.82Å
442	I	85.8	Confident	85.4	Confident	49 Å²	49	58.8 Å²	58.8	25%	0.251	30%	0.301	S	S	.	.	I	π-helix	trans	-55.3	-49.5	174	-69.3	165.3	0	0	0	109.7	L381 L438 F444 S446 E447	L381-I442 HydrophobicContact CB-CG1 4.06Å; L381-I442 HydrophobicContact CD2-CG1 4.5Å; L438-I442 HydrophobicContact CD1-CD1 4.1Å; L438-I442 HydrophobicContact CD1-CG1 4.29Å; L438-I442 HydrophobicContact CG-CD1 3.91Å; L438-I442 WeakPolarHBondContact O-CG1 3.45Å; L438-I442 PolarHBondContact O-N 2.8Å; I442-F444 PolarHBondContact O-N 2.74Å; I442-S446 CarbonylContact O-C 3.52Å; I442-S446 WeakPolarHBondContact O-CA 3.2Å; I442-S446 WeakPolarHBondContact O-CB 3.23Å; I442-S446 PolarHBondContact O-N 2.95Å; I442-E447 PolarHBondContact O-N 2.84Å
443	L	84.8	Confident	85.8	Confident	102 Å²	102	60.9 Å²	60.9	53%	0.534	32%	0.317	S	S	.	.	I	π-helix	trans	-61.8	-45.9	178.3	-177.5	66.6	0	0	0	112.3	E439 R440 L441 E447 M448	E439-L443 PolarHBondContact O-N 3.36Å; E439-L443 VanDerWaalsContact O-N 3.09Å; R440-L443 PolarHBondContact O-N 3.21Å; L441-L443 VanDerWaalsContact C-N 3.3Å; L441-L443 PolarHBondContact O-N 2.86Å; L443-E447 HydrophobicContact CD1-CB 4.09Å; L443-E447 HydrophobicContact CD1-CG 4.35Å; L443-E447 WeakPolarHBondContact O-CB 3.34Å; L443-E447 PolarHBondContact O-N 2.77Å; L443-M448 HydrophobicContact CG-SD 4.31Å; L443-M448 WeakPolarHBondContact O-CB 3.35Å; L443-M448 VanDerWaalsContact O-CG 3.24Å; L443-M448 WeakPolarHBondContact O-CG 3.26Å; L443-M448 PolarHBondContact O-N 2.83Å
444	F	88.9	Confident	86.4	Confident	20 Å²	20	57.4 Å²	57.4	9%	0.088	30%	0.298	C	S	.	.	I	π-helix	trans	-78.5	-44.8	-171.7	-168.1	-94.9	0	0	0	113.3	Y428 E431 L432 R440 L441 I442 M448 R450	Y428-F444 AromaticContact CD1-CD1 3.96Å; Y428-F444 HydrophobicContact CD1-CD1 3.96Å; Y428-F444 AromaticContact CD1-CE1 3.98Å; Y428-F444 HydrophobicContact CD1-CE1 3.98Å; Y428-F444 HydrophobicContact CE1-CD1 4.18Å; Y428-F444 HydrophobicContact CE1-CE1 4.22Å; E431-F444 HydrophobicContact CB-CE1 4.12Å; E431-F444 HydrophobicContact CB-CE2 4.05Å; E431-F444 HydrophobicContact CB-CZ 3.61Å; E431-F444 HydrophobicContact CG-CE1 4.21Å; E431-F444 HydrophobicContact CG-CZ 3.7Å; L432-F444 HydrophobicContact CD1-CB 4.19Å; L432-F444 HydrophobicContact CD1-CG 4.4Å; L432-F444 HydrophobicContact CD2-CB 4Å; L432-F444 HydrophobicContact CD2-CD2 3.73Å; L432-F444 HydrophobicContact CD2-CE2 4.36Å; L432-F444 HydrophobicContact CD2-CG 3.9Å; L432-F444 HydrophobicContact CG-CG 4.41Å; R440-F444 VanDerWaalsContact O-CB 3.26Å; R440-F444 WeakPolarHBondContact O-CB 3.33Å; R440-F444 PolarHBondContact O-N 2.79Å; L441-F444 PolarHBondContact O-N 3.23Å; I442-F444 PolarHBondContact O-N 2.74Å; F444-M448 HydrophobicContact CD2-SD 4.42Å; F444-M448 WeakPolarHBondContact O-CB 3.17Å; F444-R450 HydrophobicContact CD1-CB 3.7Å; F444-R450 HydrophobicContact CD2-CB 4.36Å; F444-R450 HydrophobicContact CE1-CB 3.28Å; F444-R450 HydrophobicContact CE1-CG 4.44Å; F444-R450 HydrophobicContact CE2-CB 4.02Å; F444-R450 HydrophobicContact CE2-CG 4.41Å; F444-R450 HydrophobicContact CG-CB 4.22Å; F444-R450 HydrophobicContact CZ-CB 3.45Å; F444-R450 VanDerWaalsContact CZ-CB 3.45Å; F444-R450 HydrophobicContact CZ-CG 4.2Å; F444-R450 WeakPolarHBondContact O-CB 3.47Å; F444-R450 PolarHBondContact O-N 2Å
445	V	92.1	Very high	87.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.268	C	S	.	.	I	π-helix	trans	-85.6	-48.1	-175.5	175.8	0	0	0	0	110.7	P378 L381 Y399 Y428 L441 D449 R451	P378-V445 HydrophobicContact CB-CG1 4.38Å; P378-V445 HydrophobicContact CG-CG1 3.81Å; L381-V445 HydrophobicContact CD1-CB 3.84Å; L381-V445 HydrophobicContact CD1-CG1 3.86Å; L381-V445 HydrophobicContact CD1-CG2 4.38Å; Y399-V445 WeakPolarHBondContact OH-CG1 3.32Å; Y428-V445 HydrophobicContact CD1-CG2 4.32Å; Y428-V445 HydrophobicContact CE1-CG2 3.68Å; Y428-V445 HydrophobicContact CE2-CG2 4.11Å; L441-V445 HydrophobicContact CD2-CG2 4.14Å; L441-V445 VanDerWaalsContact O-CB 3.25Å; L441-V445 WeakPolarHBondContact O-CB 3.19Å; L441-V445 PolarHBondContact O-N 2.82Å; V445-D449 WeakPolarHBondContact O-CA 3.42Å; V445-R451 PolarHBondContact O-NH1 2.76Å
446	S	84.6	Confident	88.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	I	π-helix	trans	-88.7	-44.4	-174	-56.9	0	0	0	0	112.9	P378 E382 I442 R477	P378-S446 WeakPolarHBondContact CA-OG 3.43Å; P378-S446 PolarHBondContact O-OG 2.9Å; E382-S446 WeakPolarHBondContact OE1-CB 3.3Å; I442-S446 CarbonylContact O-C 3.52Å; I442-S446 WeakPolarHBondContact O-CA 3.2Å; I442-S446 WeakPolarHBondContact O-CB 3.23Å; I442-S446 PolarHBondContact O-N 2.95Å; S446-R477 PolarHBondContact O-NH1 3.25Å; S446-R477 PolarHBondContact O-NH2 2.03Å
447	E	82.6	Confident	88.9	Confident	88 Å²	88	52.9 Å²	52.9	41%	0.411	27%	0.274	S	S	.	.	I	π-helix	trans	-84.7	-43.3	-177.6	-60	-62.4	142.7	0	0	112.7	I442 L443	I442-E447 PolarHBondContact O-N 2.84Å; L443-E447 HydrophobicContact CD1-CB 4.09Å; L443-E447 HydrophobicContact CD1-CG 4.35Å; L443-E447 WeakPolarHBondContact O-CB 3.34Å; L443-E447 PolarHBondContact O-N 2.77Å
448	M	87.2	Confident	89.1	Confident	65 Å²	65	51.1 Å²	51.1	32%	0.32	26%	0.263	S	S	.	.	S	Bend	trans	-89.1	-7.9	-177.3	-64.9	175.3	62.7	0	0	113.9	L443 F444 R450	L443-M448 HydrophobicContact CG-SD 4.31Å; L443-M448 WeakPolarHBondContact O-CB 3.35Å; L443-M448 VanDerWaalsContact O-CG 3.24Å; L443-M448 WeakPolarHBondContact O-CG 3.26Å; L443-M448 PolarHBondContact O-N 2.83Å; F444-M448 HydrophobicContact CD2-SD 4.42Å; F444-M448 WeakPolarHBondContact O-CB 3.17Å; M448-R450 VanDerWaalsContact C-N 3.3Å; M448-R450 HydrophobicContact CB-CG 4.09Å; M448-R450 PolarHBondContact O-N 3.03Å
449	D	92.1	Very high	89.1	Confident	77 Å²	77	55 Å²	55	41%	0.412	28%	0.28	S	S	.	.			trans	46.6	48.9	-174.3	-163.4	27.8	0	0	0	113.8	V445 R451	V445-D449 WeakPolarHBondContact O-CA 3.42Å; D449-R451 IonicContact OD1-CZ 2.98Å; D449-R451 IonicContact OD1-NH1 2.63Å; D449-R451 PolarHBondContact OD1-NH1 3.4Å; D449-R451 IonicContact OD1-NH2 3.82Å; D449-R451 PolarHBondContact OD1-NH2 2.82Å
450	R	94.9	Very high	89.2	Confident	114 Å²	114	56.1 Å²	56.1	43%	0.43	29%	0.288	S	S	.	.			trans	-104.8	157.1	177.4	-66	-169.1	174	-166	-5.2	112.1	F444 M448	F444-R450 HydrophobicContact CD1-CB 3.7Å; F444-R450 HydrophobicContact CD2-CB 4.36Å; F444-R450 HydrophobicContact CE1-CB 3.28Å; F444-R450 HydrophobicContact CE1-CG 4.44Å; F444-R450 HydrophobicContact CE2-CB 4.02Å; F444-R450 HydrophobicContact CE2-CG 4.41Å; F444-R450 HydrophobicContact CG-CB 4.22Å; F444-R450 HydrophobicContact CZ-CB 3.45Å; F444-R450 VanDerWaalsContact CZ-CB 3.45Å; F444-R450 HydrophobicContact CZ-CG 4.2Å; F444-R450 WeakPolarHBondContact O-CB 3.47Å; F444-R450 PolarHBondContact O-N 2Å; M448-R450 VanDerWaalsContact C-N 3.3Å; M448-R450 HydrophobicContact CB-CG 4.09Å; M448-R450 PolarHBondContact O-N 3.03Å
451	R	97.2	Very high	89.3	Confident	31 Å²	31	53 Å²	53	12%	0.117	28%	0.279	C	S	.	.			trans	-133.3	167.9	-179.3	-61	-61.7	-179.1	-72.9	-14	109.5	V445 D449 W475	V445-R451 PolarHBondContact O-NH1 2.76Å; D449-R451 IonicContact OD1-CZ 2.98Å; D449-R451 IonicContact OD1-NH1 2.63Å; D449-R451 PolarHBondContact OD1-NH1 3.4Å; D449-R451 IonicContact OD1-NH2 3.82Å; D449-R451 PolarHBondContact OD1-NH2 2.82Å; R451-W475 HydrophobicContact CB-CD2 3.9Å; R451-W475 HydrophobicContact CB-CE3 4.27Å; R451-W475 HydrophobicContact CB-CG 4.42Å; R451-W475 HydrophobicContact CB-CH2 4.15Å; R451-W475 HydrophobicContact CB-CZ2 3.78Å; R451-W475 HydrophobicContact CB-CZ3 4.39Å; R451-W475 HydrophobicContact CG-CD2 3.87Å; R451-W475 HydrophobicContact CG-CG 3.85Å; R451-W475 HydrophobicContact CG-CZ2 4.44Å; R451-W475 VanDerWaalsContact CZ-O 3.26Å; R451-W475 PolarHBondContact NE-O 3.12Å; R451-W475 PolarHBondContact NH2-O 2.69Å
452	P	96.6	Very high	89.2	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.026	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-54.8	141.6	174.2	-25.5	36.7	0	0	0	111.6	L403 W406 P427 Y428 I454 W475	L403-P452 HydrophobicContact CD2-CG 3.63Å; W406-P452 HydrophobicContact CD2-CB 3.82Å; W406-P452 HydrophobicContact CE3-CB 4.21Å; W406-P452 HydrophobicContact CG-CB 4.34Å; W406-P452 HydrophobicContact CH2-CB 4.14Å; W406-P452 HydrophobicContact CZ2-CB 3.71Å; W406-P452 HydrophobicContact CZ3-CB 4.37Å; P427-P452 HydrophobicContact CB-CG 4.1Å; Y428-P452 HydrophobicContact CD1-CG 4.13Å; Y428-P452 VanDerWaalsContact CE1-CD 3.44Å; Y428-P452 HydrophobicContact CE1-CG 3.84Å; P452-I454 PolarHBondContact O-N 2.95Å; P452-W475 HydrophobicContact CB-CH2 4.49Å; P452-W475 HydrophobicContact CB-CZ3 4.35Å; P452-W475 HydrophobicContact CG-CZ3 4.13Å
453	S	94.3	Very high	89.2	Confident	63 Å²	63	59.3 Å²	59.3	44%	0.441	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-68	130.4	-174.7	-56	0	0	0	0	110.5	W406 E431	W406-S453 PolarHBondContact NE1-O 2.89Å; E431-S453 VanDerWaalsContact OE1-CB 3.32Å; E431-S453 WeakPolarHBondContact OE1-CB 3.29Å; E431-S453 PolarHBondContact OE1-N 2.84Å; E431-S453 PolarHBondContact OE1-OG 3.46Å
454	I	93.9	Very high	89.4	Confident	44 Å²	44	54.5 Å²	54.5	23%	0.226	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-91.8	124.9	172.4	-61.7	173.5	0	0	0	108.1	P452 G456 W458 K468 L471 W475	P452-I454 PolarHBondContact O-N 2.95Å; I454-G456 PolarHBondContact O-N 2.93Å; I454-W458 HydrophobicContact CG2-CD2 4.16Å; I454-W458 HydrophobicContact CG2-CE3 3.56Å; I454-W458 HydrophobicContact CG2-CZ3 4Å; I454-K468 HydrophobicContact CD1-CB 4.37Å; I454-K468 HydrophobicContact CD1-CG 3.89Å; I454-L471 HydrophobicContact CD1-CB 4.29Å; I454-L471 HydrophobicContact CD1-CD1 3.75Å; I454-L471 HydrophobicContact CG1-CD1 4.08Å; I454-W475 HydrophobicContact CD1-CH2 4.17Å; I454-W475 HydrophobicContact CD1-CZ2 3.85Å; I454-W475 HydrophobicContact CG1-CH2 4.15Å; I454-W475 HydrophobicContact CG1-CZ2 4.25Å
455	P	91.8	Very high	89.4	Confident	27 Å²	27	57.7 Å²	57.7	18%	0.175	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-57.6	126.1	178.9	-25.8	34.9	0	0	0	112.4	M410 F416 N457 W458	M410-P455 HydrophobicContact CE-CG 4.19Å; M410-P455 HydrophobicContact SD-CG 3.61Å; F416-P455 HydrophobicContact CE1-CG 4.26Å; F416-P455 HydrophobicContact CZ-CG 4.33Å; P455-N457 WeakPolarHBondContact CB-OD1 3.38Å; P455-N457 PolarHBondContact O-N 3.15Å; P455-N457 VanDerWaalsContact O-N 3.13Å; P455-W458 HydrophobicContact CB-CG 4.34Å; P455-W458 HydrophobicContact CG-CD2 4.49Å; P455-W458 HydrophobicContact CG-CZ2 4.14Å; P455-W458 WeakPolarHBondContact O-CB 3.33Å; P455-W458 PolarHBondContact O-N 2.77Å
456	G	87.7	Confident	89.5	Confident	56 Å²	56	58.7 Å²	58.7	58%	0.577	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-62.8	-22.4	-176.4	0	0	0	0	0	114.1	I454 W458 E459	I454-G456 PolarHBondContact O-N 2.93Å; G456-W458 PolarHBondContact O-N 3.06Å; G456-E459 PolarHBondContact O-N 3.16Å
457	N	85.4	Confident	90	Very high	53 Å²	53	58.7 Å²	58.7	28%	0.283	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-67.3	-20	174.9	65.3	-54.4	0	0	0	113.2	L415 P455 E459 M460	L415-N457 PolarHBondContact O-ND2 3.07Å; P455-N457 WeakPolarHBondContact CB-OD1 3.38Å; P455-N457 PolarHBondContact O-N 3.15Å; P455-N457 VanDerWaalsContact O-N 3.13Å; N457-E459 PolarHBondContact O-N 2.74Å; N457-M460 HydrophobicContact CB-CE 3.79Å; N457-M460 PolarHBondContact O-N 3.38Å
458	W	89.6	Confident	90.5	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.008	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-63.1	-34.2	175.3	-68.6	9.8	0	0	0	111.4	W409 M410 L415 I454 P455 G456 M460 L461 G464 L467 L471	W409-W458 HydrophobicContact CB-CH2 3.41Å; W409-W458 VanDerWaalsContact CB-CH2 3.41Å; W409-W458 HydrophobicContact CB-CZ2 4.03Å; W409-W458 HydrophobicContact CB-CZ3 4.07Å; W409-W458 HydrophobicContact CE3-CH2 4.35Å; W409-W458 AromaticContact CE3-CZ3 3.91Å; W409-W458 HydrophobicContact CE3-CZ3 3.91Å; W409-W458 HydrophobicContact CG-CH2 4.46Å; M410-W458 HydrophobicContact SD-CH2 4.26Å; M410-W458 HydrophobicContact SD-CZ2 3.9Å; L415-W458 HydrophobicContact CD1-CD2 4.39Å; L415-W458 HydrophobicContact CD1-CH2 4.24Å; L415-W458 HydrophobicContact CD1-CZ2 3.87Å; I454-W458 HydrophobicContact CG2-CD2 4.16Å; I454-W458 HydrophobicContact CG2-CE3 3.56Å; I454-W458 HydrophobicContact CG2-CZ3 4Å; P455-W458 HydrophobicContact CB-CG 4.34Å; P455-W458 HydrophobicContact CG-CD2 4.49Å; P455-W458 HydrophobicContact CG-CZ2 4.14Å; P455-W458 WeakPolarHBondContact O-CB 3.33Å; P455-W458 PolarHBondContact O-N 2.77Å; G456-W458 PolarHBondContact O-N 3.06Å; W458-M460 PolarHBondContact O-N 3.35Å; W458-M460 VanDerWaalsContact O-N 3.07Å; W458-L461 WeakPolarHBondContact O-CB 3.18Å; W458-L461 PolarHBondContact O-N 3.01Å; W458-G464 VanDerWaalsContact O-CA 3.22Å; W458-G464 WeakPolarHBondContact O-CA 3.36Å; W458-L467 HydrophobicContact CE3-CD1 4.47Å; W458-L471 HydrophobicContact CZ3-CD1 4.39Å
459	E	84.2	Confident	90.9	Very high	122 Å²	122	60.2 Å²	60.2	57%	0.57	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-61.4	-20.1	178.8	-62.8	-171.7	170.6	0	0	113.4	G456 N457 L461 K468	G456-E459 PolarHBondContact O-N 3.16Å; N457-E459 PolarHBondContact O-N 2.74Å; E459-L461 VanDerWaalsContact C-N 3.32Å; E459-K468 IonicContact OE1-NZ 2.85Å; E459-K468 PolarHBondContact OE1-NZ 3.27Å
460	M	85.5	Confident	91.2	Very high	157 Å²	157	56.6 Å²	56.6	77%	0.773	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-83	-10.4	176	-58.6	-170.5	-73.6	0	0	113.1	N457 W458	N457-M460 HydrophobicContact CB-CE 3.79Å; N457-M460 PolarHBondContact O-N 3.38Å; W458-M460 PolarHBondContact O-N 3.35Å; W458-M460 VanDerWaalsContact O-N 3.07Å
461	L	87.7	Confident	91.4	Very high	39 Å²	39	51.2 Å²	51.2	20%	0.204	29%	0.292	C	S	.	.	S	Bend	trans	-88.4	147.8	-179.3	-58.9	174.3	0	0	0	110.8	L415 W458 E459 Q463 G464	L415-L461 HydrophobicContact CB-CD1 4.29Å; L415-L461 HydrophobicContact CD2-CD1 3.59Å; W458-L461 WeakPolarHBondContact O-CB 3.18Å; W458-L461 PolarHBondContact O-N 3.01Å; E459-L461 VanDerWaalsContact C-N 3.32Å; L461-Q463 PolarHBondContact O-N 3.38Å; L461-Q463 VanDerWaalsContact O-N 3.15Å; L461-G464 PolarHBondContact O-N 3.4Å
462	P	87.2	Confident	91.3	Very high	114 Å²	114	51.9 Å²	51.9	74%	0.74	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.8	-179.6	-25.5	34	0	0	0	114
463	Q	85.8	Confident	91.4	Very high	68 Å²	68	53.5 Å²	53.5	32%	0.318	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-10.7	-179.7	-58.7	82.3	2.8	0	0	113.3	W287 L461 S465 G466 L467 L495	W287-Q463 HydrophobicContact CH2-CB 4.28Å; W287-Q463 HydrophobicContact CH2-CG 4.35Å; W287-Q463 HydrophobicContact CZ2-CG 4.11Å; L461-Q463 PolarHBondContact O-N 3.38Å; L461-Q463 VanDerWaalsContact O-N 3.15Å; Q463-S465 PolarHBondContact O-N 3.44Å; Q463-G466 PolarHBondContact O-N 2.86Å; Q463-G466 VanDerWaalsContact O-N 3.08Å; Q463-L467 WeakPolarHBondContact O-CG 3.02Å; Q463-L467 PolarHBondContact O-N 2.96Å; Q463-L467 VanDerWaalsContact O-N 3.09Å; Q463-L495 HydrophobicContact CB-CD2 4.25Å
464	G	87.6	Confident	91.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-40.3	-164.8	0	0	0	0	0	115.5	W458 L461 G466 L467 K468	W458-G464 VanDerWaalsContact O-CA 3.22Å; W458-G464 WeakPolarHBondContact O-CA 3.36Å; L461-G464 PolarHBondContact O-N 3.4Å; G464-G466 VanDerWaalsContact C-N 3.33Å; G464-G466 PolarHBondContact O-N 3.03Å; G464-L467 PolarHBondContact O-N 3.03Å; G464-K468 PolarHBondContact O-N 3.19Å
465	S	89.2	Confident	91.8	Very high	86 Å²	86	49.1 Å²	49.1	60%	0.601	28%	0.281	S	S	*	.	H	α-helix	trans	-63.4	-40.9	176.8	58.1	0	0	0	0	111.7	Q463 K468 E469	Q463-S465 PolarHBondContact O-N 3.44Å; S465-K468 PolarHBondContact O-N 3.43Å; S465-E469 WeakPolarHBondContact O-CB 3.4Å; S465-E469 PolarHBondContact O-N 3.02Å
466	G	93.6	Very high	92	Very high	22 Å²	22	50.7 Å²	50.7	23%	0.227	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-37.6	177.8	0	0	0	0	0	112.5	Q463 G464 L470	Q463-G466 PolarHBondContact O-N 2.86Å; Q463-G466 VanDerWaalsContact O-N 3.08Å; G464-G466 VanDerWaalsContact C-N 3.33Å; G464-G466 PolarHBondContact O-N 3.03Å; G466-L470 WeakPolarHBondContact O-CB 3.24Å; G466-L470 PolarHBondContact O-N 3.4Å
467	L	95.2	Very high	92.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-48.1	174.1	-60.8	178	0	0	0	111.5	W287 W409 L415 W458 Q463 G464 E469 L470 L471 L495	W287-L467 HydrophobicContact CH2-CD1 4.33Å; W287-L467 HydrophobicContact CH2-CD2 4.05Å; W287-L467 HydrophobicContact CZ3-CD1 4.26Å; W409-L467 HydrophobicContact CD2-CD2 4.07Å; W409-L467 HydrophobicContact CE3-CB 4.09Å; W409-L467 HydrophobicContact CE3-CD2 4.1Å; W409-L467 HydrophobicContact CE3-CG 4.5Å; W409-L467 HydrophobicContact CH2-CB 3.96Å; W409-L467 HydrophobicContact CH2-CD2 3.33Å; W409-L467 HydrophobicContact CH2-CG 4.23Å; W409-L467 HydrophobicContact CZ2-CD2 3.31Å; W409-L467 HydrophobicContact CZ3-CB 3.58Å; W409-L467 HydrophobicContact CZ3-CD2 3.71Å; W409-L467 HydrophobicContact CZ3-CG 4.18Å; W409-L467 WeakPolarHBondContact CZ3-O 3.49Å; L415-L467 HydrophobicContact CD1-CD1 4.04Å; L415-L467 HydrophobicContact CD2-CD1 3.77Å; W458-L467 HydrophobicContact CE3-CD1 4.47Å; Q463-L467 WeakPolarHBondContact O-CG 3.02Å; Q463-L467 PolarHBondContact O-N 2.96Å; Q463-L467 VanDerWaalsContact O-N 3.09Å; G464-L467 PolarHBondContact O-N 3.03Å; L467-E469 PolarHBondContact O-N 3.5Å; L467-L470 PolarHBondContact O-N 3.01Å; L467-L471 WeakPolarHBondContact O-CG 3.49Å; L467-L471 PolarHBondContact O-N 2.83Å; L467-L495 HydrophobicContact CD2-CD1 3.66Å
468	K	94.8	Very high	92.6	Very high	83 Å²	83	54 Å²	54	36%	0.361	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-44.2	179.4	-175.9	179.9	-176.4	-177.7	0	112	I454 E459 G464 S465 S472	I454-K468 HydrophobicContact CD1-CB 4.37Å; I454-K468 HydrophobicContact CD1-CG 3.89Å; E459-K468 IonicContact OE1-NZ 2.85Å; E459-K468 PolarHBondContact OE1-NZ 3.27Å; G464-K468 PolarHBondContact O-N 3.19Å; S465-K468 PolarHBondContact O-N 3.43Å; K468-S472 WeakPolarHBondContact O-CB 3.49Å; K468-S472 PolarHBondContact O-N 2.83Å; K468-S472 PolarHBondContact O-OG 2.92Å
469	E	95.7	Very high	92.6	Very high	102 Å²	102	55.4 Å²	55.4	48%	0.477	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.3	-167.9	-170	138.2	0	0	110.9	S465 L467 L471 S472 D473 R491	S465-E469 WeakPolarHBondContact O-CB 3.4Å; S465-E469 PolarHBondContact O-N 3.02Å; L467-E469 PolarHBondContact O-N 3.5Å; E469-L471 PolarHBondContact O-N 3.5Å; E469-S472 PolarHBondContact O-N 3.34Å; E469-D473 VanDerWaalsContact O-CG 3.29Å; E469-D473 PolarHBondContact O-N 3.48Å; E469-R491 IonicContact OE1-CZ 3.73Å; E469-R491 IonicContact OE1-NH1 2.71Å; E469-R491 PolarHBondContact OE1-NH1 3.44Å; E469-R491 IonicContact OE1-NH2 3.33Å
470	L	97.5	Very high	92.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-46	179	-176.3	61.7	0	0	0	112.1	L405 W409 G466 L467 D473 C474 L483 I488 R491 L492	L405-L470 HydrophobicContact CD1-CD2 4.31Å; W409-L470 HydrophobicContact CH2-CB 4.32Å; W409-L470 HydrophobicContact CH2-CD2 3.84Å; W409-L470 HydrophobicContact CH2-CG 4.4Å; W409-L470 HydrophobicContact CZ2-CD2 4.21Å; G466-L470 WeakPolarHBondContact O-CB 3.24Å; G466-L470 PolarHBondContact O-N 3.4Å; L467-L470 PolarHBondContact O-N 3.01Å; L470-D473 PolarHBondContact O-N 3.13Å; L470-C474 PolarHBondContact O-N 3.16Å; L470-C474 PolarHBondContact O-SG 3.13Å; L470-L483 HydrophobicContact CD1-CD1 3.55Å; L470-I488 HydrophobicContact CD1-CG1 4.33Å; L470-I488 HydrophobicContact CD1-CG2 4.28Å; L470-R491 HydrophobicContact CD1-CB 3.94Å; L470-R491 HydrophobicContact CD1-CG 4.43Å; L470-L492 HydrophobicContact CD2-CD2 3.59Å; L470-L492 HydrophobicContact CD2-CG 3.89Å
471	L	98.1	Very high	93.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-46.7	176.3	-67.8	172.6	0	0	0	111.3	G402 L405 W406 W409 I454 W458 L467 E469 D473 C474 W475	G402-L471 WeakPolarHBondContact O-CD2 3.23Å; L405-L471 HydrophobicContact CB-CD2 3.97Å; W406-L471 HydrophobicContact CB-CD1 4.16Å; W406-L471 HydrophobicContact CB-CD2 3.97Å; W409-L471 HydrophobicContact CE3-CD1 3.82Å; W409-L471 HydrophobicContact CE3-CD2 4.18Å; W409-L471 HydrophobicContact CE3-CG 4.06Å; W409-L471 HydrophobicContact CH2-CG 4.38Å; W409-L471 HydrophobicContact CZ3-CD1 3.69Å; W409-L471 HydrophobicContact CZ3-CD2 3.81Å; W409-L471 HydrophobicContact CZ3-CG 3.49Å; W409-L471 VanDerWaalsContact CZ3-CG 3.49Å; I454-L471 HydrophobicContact CD1-CB 4.29Å; I454-L471 HydrophobicContact CD1-CD1 3.75Å; I454-L471 HydrophobicContact CG1-CD1 4.08Å; W458-L471 HydrophobicContact CZ3-CD1 4.39Å; L467-L471 WeakPolarHBondContact O-CG 3.49Å; L467-L471 PolarHBondContact O-N 2.83Å; E469-L471 PolarHBondContact O-N 3.5Å; L471-D473 VanDerWaalsContact C-N 3.3Å; L471-D473 PolarHBondContact O-N 3.38Å; L471-C474 PolarHBondContact O-N 2.81Å; L471-W475 HydrophobicContact CB-CD2 4.35Å; L471-W475 HydrophobicContact CB-CH2 4.02Å; L471-W475 HydrophobicContact CB-CZ2 3.78Å; L471-W475 HydrophobicContact CB-CZ3 4.37Å; L471-W475 HydrophobicContact CD1-CH2 4.08Å; L471-W475 HydrophobicContact CD1-CZ2 4.5Å; L471-W475 HydrophobicContact CD2-CZ3 4.46Å; L471-W475 HydrophobicContact CG-CH2 4.48Å; L471-W475 PolarHBondContact O-N 3.3Å; L471-W475 PolarHBondContact O-NE1 3.41Å
472	S	96.9	Very high	93.7	Very high	45 Å²	45	49.4 Å²	49.4	32%	0.315	28%	0.275	S	S	.	.	H	α-helix	trans	-55.8	-45.5	179.5	-57.1	0	0	0	0	111.7	K468 E469 C474 D476	K468-S472 WeakPolarHBondContact O-CB 3.49Å; K468-S472 PolarHBondContact O-N 2.83Å; K468-S472 PolarHBondContact O-OG 2.92Å; E469-S472 PolarHBondContact O-N 3.34Å; S472-C474 VanDerWaalsContact C-N 3.33Å; S472-C474 PolarHBondContact O-N 2.88Å; S472-D476 PolarHBondContact O-N 3Å
473	D	98	Very high	94.2	Very high	39 Å²	39	44.8 Å²	44.8	21%	0.209	25%	0.245	C	C	.	.	H	α-helix	trans	-75.6	-19.3	179	-60.3	-11.7	0	0	0	112.9	E469 L470 L471 R482 L483 R491	E469-D473 VanDerWaalsContact O-CG 3.29Å; E469-D473 PolarHBondContact O-N 3.48Å; L470-D473 PolarHBondContact O-N 3.13Å; L471-D473 VanDerWaalsContact C-N 3.3Å; L471-D473 PolarHBondContact O-N 3.38Å; D473-R482 WeakPolarHBondContact O-CA 2.97Å; D473-L483 HydrophobicContact CB-CD1 3.77Å; D473-L483 HydrophobicContact CB-CD2 3.88Å; D473-L483 HydrophobicContact CB-CG 3.56Å; D473-L483 PolarHBondContact O-N 3.07Å; D473-L483 VanDerWaalsContact O-N 3.07Å; D473-R491 IonicContact OD2-CZ 3.5Å; D473-R491 IonicContact OD2-NH1 3.53Å; D473-R491 PolarHBondContact OD2-NH1 3.17Å; D473-R491 IonicContact OD2-NH2 3.59Å; D473-R491 PolarHBondContact OD2-NH2 3.26Å
474	C	98.4	Very high	94.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-81	-43.4	174.7	-69.1	0	0	0	0	111.8	I398 Y399 L470 L471 S472 R482 I488	I398-C474 HydrophobicContact CG2-CB 4.38Å; Y399-C474 WeakPolarHBondContact CA-O 3.01Å; L470-C474 PolarHBondContact O-N 3.16Å; L470-C474 PolarHBondContact O-SG 3.13Å; L471-C474 PolarHBondContact O-N 2.81Å; S472-C474 VanDerWaalsContact C-N 3.33Å; S472-C474 PolarHBondContact O-N 2.88Å; C474-R482 VanDerWaalsContact O-CD 3.28Å; C474-R482 WeakPolarHBondContact O-CD 3.36Å; C474-R482 WeakPolarHBondContact O-CG 3.43Å; C474-I488 WeakPolarHBondContact SG-CD1 3.28Å
475	W	97.7	Very high	95.2	Very high	15 Å²	15	44.5 Å²	44.5	6%	0.057	25%	0.25	C	C	.	.	S	Bend	trans	-101.7	22.3	-173.8	64.4	22.9	0	0	0	113.7	Y399 L403 W406 R451 P452 I454 L471	Y399-W475 HydrophobicContact CD2-CB 3.78Å; Y399-W475 HydrophobicContact CE2-CB 3.78Å; L403-W475 HydrophobicContact CD2-CE3 3.62Å; L403-W475 HydrophobicContact CD2-CZ3 3.99Å; L403-W475 HydrophobicContact CG-CE3 4.42Å; W406-W475 HydrophobicContact CB-CZ3 4.05Å; W406-W475 HydrophobicContact CG-CH2 4.45Å; W406-W475 HydrophobicContact CG-CZ3 4.22Å; R451-W475 HydrophobicContact CB-CD2 3.9Å; R451-W475 HydrophobicContact CB-CE3 4.27Å; R451-W475 HydrophobicContact CB-CG 4.42Å; R451-W475 HydrophobicContact CB-CH2 4.15Å; R451-W475 HydrophobicContact CB-CZ2 3.78Å; R451-W475 HydrophobicContact CB-CZ3 4.39Å; R451-W475 HydrophobicContact CG-CD2 3.87Å; R451-W475 HydrophobicContact CG-CG 3.85Å; R451-W475 HydrophobicContact CG-CZ2 4.44Å; R451-W475 VanDerWaalsContact CZ-O 3.26Å; R451-W475 PolarHBondContact NE-O 3.12Å; R451-W475 PolarHBondContact NH2-O 2.69Å; P452-W475 HydrophobicContact CB-CH2 4.49Å; P452-W475 HydrophobicContact CB-CZ3 4.35Å; P452-W475 HydrophobicContact CG-CZ3 4.13Å; I454-W475 HydrophobicContact CD1-CH2 4.17Å; I454-W475 HydrophobicContact CD1-CZ2 3.85Å; I454-W475 HydrophobicContact CG1-CH2 4.15Å; I454-W475 HydrophobicContact CG1-CZ2 4.25Å; L471-W475 HydrophobicContact CB-CD2 4.35Å; L471-W475 HydrophobicContact CB-CH2 4.02Å; L471-W475 HydrophobicContact CB-CZ2 3.78Å; L471-W475 HydrophobicContact CB-CZ3 4.37Å; L471-W475 HydrophobicContact CD1-CH2 4.08Å; L471-W475 HydrophobicContact CD1-CZ2 4.5Å; L471-W475 HydrophobicContact CD2-CZ3 4.46Å; L471-W475 HydrophobicContact CG-CH2 4.48Å; L471-W475 PolarHBondContact O-N 3.3Å; L471-W475 PolarHBondContact O-NE1 3.41Å
476	D	97.2	Very high	95.6	Very high	59 Å²	59	43.1 Å²	43.1	32%	0.316	24%	0.239	S	C	.	.			trans	-54.3	147.4	177.5	-160.1	-65.5	0	0	0	110.9	S472 D478 A481 R482	S472-D476 PolarHBondContact O-N 3Å; D476-D478 VanDerWaalsContact C-N 3.33Å; D476-D478 PolarHBondContact OD1-N 3.35Å; D476-A481 HydrophobicContact CB-CB 4.22Å; D476-R482 HydrophobicContact CB-CG 3.95Å; D476-R482 PolarHBondContact O-NE 3.45Å; D476-R482 PolarHBondContact O-NH2 2.83Å; D476-R482 VanDerWaalsContact O-NH2 3.1Å
477	R	93.1	Very high	95.8	Very high	94 Å²	94	44 Å²	44	36%	0.355	24%	0.241	S	C	.	.	S	Bend	trans	-62.6	-45.3	175.6	-172	-169.6	-178.3	110.6	11.8	110.4	P378 E382 S446 T479 R482	P378-R477 HydrophobicContact CG-CG 4.5Å; E382-R477 IonicContact OE1-CZ 2.67Å; E382-R477 IonicContact OE1-NH2 2.78Å; E382-R477 PolarHBondContact OE1-NH2 3.32Å; S446-R477 PolarHBondContact O-NH1 3.25Å; S446-R477 PolarHBondContact O-NH2 2.03Å; R477-T479 PolarHBondContact O-N 3.06Å; R477-R482 PolarHBondContact O-NH2 3.23Å
478	D	91	Very high	95.9	Very high	86 Å²	86	44 Å²	44	46%	0.46	24%	0.241	S	C	.	.	S	Bend	trans	-75.4	120.4	-179.6	-175.6	-5	0	0	0	110	D476 D480 A481 R482	D476-D478 VanDerWaalsContact C-N 3.33Å; D476-D478 PolarHBondContact OD1-N 3.35Å; D478-D480 PolarHBondContact O-N 2.67Å; D478-D480 PolarHBondContact OD1-N 2.98Å; D478-A481 HydrophobicContact CB-CB 3.89Å; D478-A481 PolarHBondContact O-N 2.01Å; D478-R482 PolarHBondContact O-N 3.02Å
479	T	91.1	Very high	96.1	Very high	30 Å²	30	41.1 Å²	41.1	18%	0.184	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-33.6	178.3	55.2	0	0	0	0	112.3	E379 Q395 R477 A481	E379-T479 VanDerWaalsContact CD-CG2 3.44Å; E379-T479 HydrophobicContact CG-CG2 3.91Å; E379-T479 WeakPolarHBondContact OE1-CG2 3.32Å; Q395-T479 HydrophobicContact CB-CG2 4.39Å; Q395-T479 WeakPolarHBondContact CG-O 3.38Å; Q395-T479 PolarHBondContact NE2-O 3.39Å; R477-T479 PolarHBondContact O-N 3.06Å; T479-A481 VanDerWaalsContact C-N 3.34Å
480	D	89.6	Confident	96.2	Very high	133 Å²	133	41.8 Å²	41.8	71%	0.711	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.6	-176.9	-69	-20.1	0	0	0	112.4	D478	D478-D480 PolarHBondContact O-N 2.67Å; D478-D480 PolarHBondContact OD1-N 2.98Å
481	A	93.7	Very high	96.1	Very high	48 Å²	48	44.9 Å²	44.9	40%	0.397	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.5	174.2	0	0	0	0	0	112.6	D476 D478 T479	D476-A481 HydrophobicContact CB-CB 4.22Å; D478-A481 HydrophobicContact CB-CB 3.89Å; D478-A481 PolarHBondContact O-N 2.01Å; T479-A481 VanDerWaalsContact C-N 3.34Å
482	R	97.1	Very high	96	Very high	11 Å²	11	44.9 Å²	44.9	4%	0.042	25%	0.249	C	C	.	.	S	Bend	trans	-65.6	144.1	-178	-64.6	176.3	-160.2	148	15	112.3	E379 Q395 I398 D473 C474 D476 R477 D478	E379-R482 IonicContact OE1-CZ 3.23Å; E379-R482 IonicContact OE1-NH1 3.98Å; E379-R482 PolarHBondContact OE1-NH1 3.08Å; E379-R482 IonicContact OE1-NH2 3.92Å; E379-R482 IonicContact OE2-CZ 3.86Å; E379-R482 IonicContact OE2-NH1 3.63Å; E379-R482 IonicContact OE2-NH2 2.84Å; E379-R482 PolarHBondContact OE2-NH2 3.4Å; Q395-R482 PolarHBondContact NE2-O 3.48Å; Q395-R482 PolarHBondContact O-NH1 2.91Å; I398-R482 HydrophobicContact CG2-CB 4.13Å; D473-R482 WeakPolarHBondContact O-CA 2.97Å; C474-R482 VanDerWaalsContact O-CD 3.28Å; C474-R482 WeakPolarHBondContact O-CD 3.36Å; C474-R482 WeakPolarHBondContact O-CG 3.43Å; D476-R482 HydrophobicContact CB-CG 3.95Å; D476-R482 PolarHBondContact O-NE 3.45Å; D476-R482 PolarHBondContact O-NH2 2.83Å; D476-R482 VanDerWaalsContact O-NH2 3.1Å; R477-R482 PolarHBondContact O-NH2 3.23Å; D478-R482 PolarHBondContact O-N 3.02Å
483	L	97.3	Very high	95.8	Very high	18 Å²	18	48.5 Å²	48.5	9%	0.094	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-59.4	159.4	175.4	-59	179.4	0	0	0	112.3	I398 L470 D473 C487 I488	I398-L483 WeakPolarHBondContact CG1-O 3.26Å; I398-L483 WeakPolarHBondContact CG2-O 3.49Å; L470-L483 HydrophobicContact CD1-CD1 3.55Å; D473-L483 HydrophobicContact CB-CD1 3.77Å; D473-L483 HydrophobicContact CB-CD2 3.88Å; D473-L483 HydrophobicContact CB-CG 3.56Å; D473-L483 PolarHBondContact O-N 3.07Å; D473-L483 VanDerWaalsContact O-N 3.07Å; L483-C487 HydrophobicContact CB-CB 4.42Å; L483-I488 HydrophobicContact CB-CD1 4.16Å; L483-I488 HydrophobicContact CB-CG1 3.77Å; L483-I488 HydrophobicContact CD1-CG1 3.83Å; L483-I488 HydrophobicContact CG-CG1 4.46Å
484	S	97.1	Very high	95.4	Very high	61 Å²	61	51.3 Å²	51.3	43%	0.427	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-87	153.4	163	68.1	0	0	0	0	110.4	P486 C487 I488	S484-P486 VanDerWaalsContact C-N 3.34Å; S484-C487 WeakPolarHBondContact O-CA 3.2Å; S484-C487 WeakPolarHBondContact O-CB 3.43Å; S484-C487 PolarHBondContact O-N 2.95Å; S484-C487 PolarHBondContact OG-N 3.33Å; S484-I488 PolarHBondContact O-N 2.89Å; S484-I488 VanDerWaalsContact O-N 3.11Å
485	A	97.1	Very high	94.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-54.3	-41.1	177.6	0	0	0	0	0	113.7	L301 I398 C487 I488 V489	L301-A485 HydrophobicContact CB-CB 4.45Å; L301-A485 HydrophobicContact CD2-CB 4.46Å; L301-A485 HydrophobicContact CG-CB 4.31Å; I398-A485 HydrophobicContact CD1-CB 3.78Å; A485-C487 VanDerWaalsContact C-N 3.33Å; A485-C487 PolarHBondContact O-N 3.35Å; A485-I488 PolarHBondContact O-N 3.37Å; A485-V489 WeakPolarHBondContact O-CG2 3.26Å; A485-V489 PolarHBondContact O-N 3.47Å; A485-V489 VanDerWaalsContact O-N 3.11Å
486	P	97.2	Very high	94.6	Very high	58 Å²	58	56.1 Å²	56.1	38%	0.377	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-38.5	171.8	-23.3	31.7	0	0	0	114	S302 S484 I488 V489 D490	S302-P486 WeakPolarHBondContact OG-CG 3.31Å; S484-P486 VanDerWaalsContact C-N 3.34Å; P486-I488 VanDerWaalsContact C-N 3.3Å; P486-I488 PolarHBondContact O-N 2.84Å; P486-V489 WeakPolarHBondContact O-CB 3.29Å; P486-V489 PolarHBondContact O-N 3.03Å; P486-D490 PolarHBondContact O-N 3.43Å
487	C	97.9	Very high	94.5	Very high	41 Å²	41	55.9 Å²	55.9	28%	0.277	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-35.2	178.3	-173.3	0	0	0	0	111.9	L483 S484 A485 D490 R491	L483-C487 HydrophobicContact CB-CB 4.42Å; S484-C487 WeakPolarHBondContact O-CA 3.2Å; S484-C487 WeakPolarHBondContact O-CB 3.43Å; S484-C487 PolarHBondContact O-N 2.95Å; S484-C487 PolarHBondContact OG-N 3.33Å; A485-C487 VanDerWaalsContact C-N 3.33Å; A485-C487 PolarHBondContact O-N 3.35Å; C487-D490 PolarHBondContact O-N 3.3Å; C487-R491 WeakPolarHBondContact O-CG 3.49Å; C487-R491 PolarHBondContact O-N 2.95Å
488	I	98.4	Very high	94.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-42.8	174.9	-62.5	166.9	0	0	0	110.4	I398 L401 L405 L470 C474 L483 S484 A485 P486 D490 R491 L492	I398-I488 HydrophobicContact CD1-CD1 4.1Å; I398-I488 HydrophobicContact CG2-CD1 3.96Å; L401-I488 HydrophobicContact CD2-CD1 3.72Å; L401-I488 HydrophobicContact CD2-CG2 4.16Å; L405-I488 HydrophobicContact CD1-CG2 4.11Å; L470-I488 HydrophobicContact CD1-CG1 4.33Å; L470-I488 HydrophobicContact CD1-CG2 4.28Å; C474-I488 WeakPolarHBondContact SG-CD1 3.28Å; L483-I488 HydrophobicContact CB-CD1 4.16Å; L483-I488 HydrophobicContact CB-CG1 3.77Å; L483-I488 HydrophobicContact CD1-CG1 3.83Å; L483-I488 HydrophobicContact CG-CG1 4.46Å; S484-I488 PolarHBondContact O-N 2.89Å; S484-I488 VanDerWaalsContact O-N 3.11Å; A485-I488 PolarHBondContact O-N 3.37Å; P486-I488 VanDerWaalsContact C-N 3.3Å; P486-I488 PolarHBondContact O-N 2.84Å; I488-D490 PolarHBondContact O-N 3.4Å; I488-R491 PolarHBondContact O-N 3.29Å; I488-L492 HydrophobicContact CG2-CD1 3.9Å; I488-L492 HydrophobicContact CG2-CG 4.3Å; I488-L492 WeakPolarHBondContact O-CB 3.4Å; I488-L492 VanDerWaalsContact O-CG 3.31Å; I488-L492 WeakPolarHBondContact O-CG 3.29Å; I488-L492 PolarHBondContact O-N 2.96Å
489	V	98.1	Very high	94.8	Very high	22 Å²	22	51.9 Å²	51.9	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-56.4	-50	173.6	174.6	0	0	0	0	110.6	E299 A485 P486 R491 L492 M493	E299-V489 HydrophobicContact CG-CG1 4.29Å; E299-V489 HydrophobicContact CG-CG2 4.32Å; A485-V489 WeakPolarHBondContact O-CG2 3.26Å; A485-V489 PolarHBondContact O-N 3.47Å; A485-V489 VanDerWaalsContact O-N 3.11Å; P486-V489 WeakPolarHBondContact O-CB 3.29Å; P486-V489 PolarHBondContact O-N 3.03Å; V489-R491 PolarHBondContact O-N 2.95Å; V489-L492 PolarHBondContact O-N 3.49Å; V489-M493 VanDerWaalsContact O-CG 3.32Å; V489-M493 WeakPolarHBondContact O-CG 3.29Å; V489-M493 PolarHBondContact O-N 2.56Å
490	D	96.9	Very high	95	Very high	116 Å²	116	53.3 Å²	53.3	62%	0.62	31%	0.307	S	S	*	.	H	α-helix	trans	-60.5	-42.7	179.3	-70.5	-22.5	0	0	0	112.3	P486 C487 I488 M493 S494	P486-D490 PolarHBondContact O-N 3.43Å; C487-D490 PolarHBondContact O-N 3.3Å; I488-D490 PolarHBondContact O-N 3.4Å; D490-M493 PolarHBondContact O-N 2.96Å; D490-S494 PolarHBondContact O-N 3.41Å
491	R	96.4	Very high	95.4	Very high	66 Å²	66	47.9 Å²	47.9	25%	0.249	28%	0.281	C	S	.	.	H	α-helix	trans	-66	-41.9	177.7	-74.4	-170.3	-177.4	-154.8	13.6	111.9	E469 L470 D473 C487 I488 V489 M493 S494 L495	E469-R491 IonicContact OE1-CZ 3.73Å; E469-R491 IonicContact OE1-NH1 2.71Å; E469-R491 PolarHBondContact OE1-NH1 3.44Å; E469-R491 IonicContact OE1-NH2 3.33Å; L470-R491 HydrophobicContact CD1-CB 3.94Å; L470-R491 HydrophobicContact CD1-CG 4.43Å; D473-R491 IonicContact OD2-CZ 3.5Å; D473-R491 IonicContact OD2-NH1 3.53Å; D473-R491 PolarHBondContact OD2-NH1 3.17Å; D473-R491 IonicContact OD2-NH2 3.59Å; D473-R491 PolarHBondContact OD2-NH2 3.26Å; C487-R491 WeakPolarHBondContact O-CG 3.49Å; C487-R491 PolarHBondContact O-N 2.95Å; I488-R491 PolarHBondContact O-N 3.29Å; V489-R491 PolarHBondContact O-N 2.95Å; R491-M493 VanDerWaalsContact C-N 3.25Å; R491-M493 PolarHBondContact O-N 3.36Å; R491-S494 PolarHBondContact O-N 3.48Å; R491-S494 VanDerWaalsContact O-N 3.08Å; R491-S494 PolarHBondContact O-OG 3.27Å; R491-L495 PolarHBondContact O-N 3.3Å
492	L	96.3	Very high	95.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-26.4	175.9	-72.4	171.5	0	0	0	113.3	M291 C294 Q295 S298 L405 W409 L470 I488 V489 S494 L495	M291-L492 HydrophobicContact CE-CB 4.24Å; M291-L492 HydrophobicContact CE-CD2 3.86Å; M291-L492 WeakPolarHBondContact CE-O 3.45Å; C294-L492 HydrophobicContact CB-CD1 3.96Å; C294-L492 HydrophobicContact CB-CD2 3.99Å; Q295-L492 HydrophobicContact CG-CB 4.01Å; Q295-L492 PolarHBondContact NE2-O 3.33Å; S298-L492 WeakPolarHBondContact OG-CD1 3.18Å; L405-L492 HydrophobicContact CD2-CD1 4.39Å; W409-L492 HydrophobicContact CZ2-CD2 3.96Å; L470-L492 HydrophobicContact CD2-CD2 3.59Å; L470-L492 HydrophobicContact CD2-CG 3.89Å; I488-L492 HydrophobicContact CG2-CD1 3.9Å; I488-L492 HydrophobicContact CG2-CG 4.3Å; I488-L492 WeakPolarHBondContact O-CB 3.4Å; I488-L492 VanDerWaalsContact O-CG 3.31Å; I488-L492 WeakPolarHBondContact O-CG 3.29Å; I488-L492 PolarHBondContact O-N 2.96Å; V489-L492 PolarHBondContact O-N 3.49Å; L492-S494 VanDerWaalsContact C-N 3.31Å; L492-L495 HydrophobicContact CD2-CD1 4.33Å
493	M	91.6	Very high	95.3	Very high	121 Å²	121	50.8 Å²	50.8	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-77.4	-18.7	173.7	-69.9	-69	-77.8	0	0	113	Q295 V489 D490 R491	Q295-M493 HydrophobicContact CG-SD 4.44Å; V489-M493 VanDerWaalsContact O-CG 3.32Å; V489-M493 WeakPolarHBondContact O-CG 3.29Å; V489-M493 PolarHBondContact O-N 2.56Å; D490-M493 PolarHBondContact O-N 2.96Å; R491-M493 VanDerWaalsContact C-N 3.25Å; R491-M493 PolarHBondContact O-N 3.36Å
494	S	89.2	Confident	95.2	Very high	98 Å²	98	53.5 Å²	53.5	69%	0.685	31%	0.306	S	S	*	.	H	α-helix	trans	-88.8	-12.4	178.4	73.8	0	0	0	0	114.3	D490 R491 L492	D490-S494 PolarHBondContact O-N 3.41Å; R491-S494 PolarHBondContact O-N 3.48Å; R491-S494 VanDerWaalsContact O-N 3.08Å; R491-S494 PolarHBondContact O-OG 3.27Å; L492-S494 VanDerWaalsContact C-N 3.31Å
495	L	86.1	Confident	95	Very high	58 Å²	58	52.8 Å²	52.8	30%	0.304	30%	0.295	S	S	.	.			trans	-89	0	174.7	-67	169.5	0	0	0	110.8	W287 M291 Q463 L467 R491 L492	W287-L495 HydrophobicContact CZ2-CB 4.41Å; M291-L495 HydrophobicContact CE-CB 3.89Å; M291-L495 HydrophobicContact CE-CD1 4.4Å; Q463-L495 HydrophobicContact CB-CD2 4.25Å; L467-L495 HydrophobicContact CD2-CD1 3.66Å; R491-L495 PolarHBondContact O-N 3.3Å; L492-L495 HydrophobicContact CD2-CD1 4.33Å

Retrieved 495 of 495 residues in 104.3 ms (Link to these results)

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