A0A087Y5Y5_POEFO Loading...

Myeloid differentiation primary response protein MyD88

Adapter protein involved in the Toll-like receptor and IL-1 receptor signaling pathway in the innate immune response.

AlphaFold DB , UniProt , Accession A0A087Y5Y5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 290 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	N	31.6	Very low	45.5	Very low	218 Å²	218	132.3 Å²	132.3	100%	1.166	71%	0.709	S	S	*	*				0	91.8	0	-65.6	-5.5	0	0	0	107.7	D3	N1-D3 PolarHBondContact O-N 2.99Å
2	M	30.5	Very low	47.4	Very low	186 Å²	186	124.7 Å²	124.7	92%	0.916	69%	0.686	S	S	*	*			trans	-60.8	119.4	168.7	-88.2	124.2	139.9	0	0	107.9
3	D	29.3	Very low	49.1	Very low	136 Å²	136	121.3 Å²	121.3	73%	0.727	68%	0.676	S	S	*	*			trans	-96.5	84.4	164.5	-163.5	-1	0	0	0	106	N1 T5	N1-D3 PolarHBondContact O-N 2.99Å; D3-T5 VanDerWaalsContact C-N 3.3Å; D3-T5 PolarHBondContact O-N 2.68Å; D3-T5 PolarHBondContact OD1-OG1 3.19Å; D3-T5 VanDerWaalsContact OD1-OG1 3.09Å
4	D	33.4	Very low	51	Low	151 Å²	151	112.7 Å²	112.7	81%	0.807	63%	0.628	S	S	*	*			trans	-94.2	68.1	176.3	-136.8	-0.5	0	0	0	106.8	D6	D4-D6 VanDerWaalsContact C-N 3.29Å; D4-D6 PolarHBondContact O-N 3.32Å
5	T	32.6	Very low	52.7	Low	103 Å²	103	106.9 Å²	106.9	63%	0.632	60%	0.597	S	S	*	*			trans	-88	80.3	170.1	25.5	0	0	0	0	108.2	D3 S7	D3-T5 VanDerWaalsContact C-N 3.3Å; D3-T5 PolarHBondContact O-N 2.68Å; D3-T5 PolarHBondContact OD1-OG1 3.19Å; D3-T5 VanDerWaalsContact OD1-OG1 3.09Å; T5-S7 PolarHBondContact O-N 2.83Å; T5-S7 VanDerWaalsContact O-N 3.13Å
6	D	37	Very low	54	Low	141 Å²	141	100.3 Å²	100.3	75%	0.754	56%	0.561	S	S	*	*			trans	-42.1	118	163	-171.2	23.3	0	0	0	108.8	D4 K8	D4-D6 VanDerWaalsContact C-N 3.29Å; D4-D6 PolarHBondContact O-N 3.32Å; D6-K8 PolarHBondContact O-N 2.6Å
7	S	43.9	Very low	54.9	Low	106 Å²	106	102.9 Å²	102.9	74%	0.741	57%	0.565	S	S	*	*			trans	-72.7	76.1	-173.2	-60.9	0	0	0	0	108.8	T5 V9	T5-S7 PolarHBondContact O-N 2.83Å; T5-S7 VanDerWaalsContact O-N 3.13Å; S7-V9 PolarHBondContact O-N 2.61Å
8	K	55.1	Low	55.7	Low	192 Å²	192	98.4 Å²	98.4	84%	0.835	54%	0.543	S	S	*	.			trans	-48.7	106.2	176.2	-101.8	-177.4	177.1	179.5	0	108.6	D6 N10	D6-K8 PolarHBondContact O-N 2.6Å; K8-N10 PolarHBondContact O-N 2.9Å
9	V	62.2	Low	56.7	Low	61 Å²	61	93.6 Å²	93.6	37%	0.37	52%	0.517	S	S	.	.			trans	-63.4	129.9	-178.9	-171.6	0	0	0	0	108.5	S7 L11 I14 V109 L113	S7-V9 PolarHBondContact O-N 2.61Å; V9-L11 PolarHBondContact O-N 2.74Å; V9-I14 HydrophobicContact CG1-CD1 4.11Å; V9-V109 HydrophobicContact CB-CG1 3.71Å; V9-V109 HydrophobicContact CG1-CG1 3.15Å; V9-V109 HydrophobicContact CG2-CG1 4.05Å; V9-L113 HydrophobicContact CG1-CD1 3.58Å
10	N	71.7	Confident	57.2	Low	113 Å²	113	91.8 Å²	91.8	60%	0.604	51%	0.506	S	S	*	.			trans	-71.5	94.3	-179.3	-170.2	-33.1	0	0	0	109.7	K8 G12 S13	K8-N10 PolarHBondContact O-N 2.9Å; N10-G12 PolarHBondContact O-N 2.78Å; N10-G12 PolarHBondContact OD1-N 2.8Å; N10-G12 VanDerWaalsContact OD1-N 3.07Å; N10-S13 PolarHBondContact O-N 2.57Å; N10-S13 PolarHBondContact O-OG 3.46Å
11	L	73.5	Confident	57.9	Low	48 Å²	48	90 Å²	90	25%	0.251	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-64.1	-20.1	-179.8	-60	177.4	0	0	0	112.9	V9 S13 I14 V81 G82 V85 I104 V109	V9-L11 PolarHBondContact O-N 2.74Å; L11-S13 VanDerWaalsContact C-N 3.32Å; L11-S13 PolarHBondContact O-N 3.4Å; L11-I14 HydrophobicContact CD2-CD1 4.48Å; L11-I14 PolarHBondContact O-N 3.31Å; L11-V81 HydrophobicContact CB-CG1 4.5Å; L11-V81 HydrophobicContact CD2-CG1 4.38Å; L11-G82 PolarHBondContact O-N 2.8Å; L11-V85 HydrophobicContact CD1-CG2 4.47Å; L11-I104 HydrophobicContact CD2-CG2 4.18Å; L11-V109 HydrophobicContact CD2-CG2 3.58Å
12	G	68.1	Low	59.9	Low	41 Å²	41	83 Å²	83	42%	0.423	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-70.4	-24.8	-178.5	0	0	0	0	0	114.1	N10 S80	N10-G12 PolarHBondContact O-N 2.78Å; N10-G12 PolarHBondContact OD1-N 2.8Å; N10-G12 VanDerWaalsContact OD1-N 3.07Å; G12-S80 VanDerWaalsContact O-CB 3.23Å; G12-S80 WeakPolarHBondContact O-CB 3.06Å; G12-S80 PolarHBondContact O-OG 3.37Å
13	S	68.8	Low	62.4	Low	81 Å²	81	74.3 Å²	74.3	57%	0.566	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-88.9	-3.2	177.9	63.9	0	0	0	0	113.7	N10 L11	N10-S13 PolarHBondContact O-N 2.57Å; N10-S13 PolarHBondContact O-OG 3.46Å; L11-S13 VanDerWaalsContact C-N 3.32Å; L11-S13 PolarHBondContact O-N 3.4Å
14	I	76.1	Confident	64.9	Low	1 Å²	1	69.2 Å²	69.2	1%	0.005	39%	0.391	C	S	.	.	S	Bend	trans	-99.1	117.3	-173.4	-59.3	177.7	0	0	0	108.2	V9 L11 A18 S80 V81 V109 Y112	V9-I14 HydrophobicContact CG1-CD1 4.11Å; L11-I14 HydrophobicContact CD2-CD1 4.48Å; L11-I14 PolarHBondContact O-N 3.31Å; I14-A18 HydrophobicContact CG2-CB 3.68Å; I14-S80 CarbonylContact O-C 3.51Å; I14-S80 WeakPolarHBondContact O-CA 3.45Å; I14-S80 WeakPolarHBondContact O-CB 3.34Å; I14-V81 HydrophobicContact CB-CB 4.46Å; I14-V81 HydrophobicContact CB-CG2 4.23Å; I14-V81 HydrophobicContact CG2-CG2 3.8Å; I14-V81 PolarHBondContact O-N 2.84Å; I14-V109 HydrophobicContact CD1-CB 3.83Å; I14-V109 HydrophobicContact CD1-CG1 3.32Å; I14-V109 HydrophobicContact CD1-CG2 3.52Å; I14-Y112 HydrophobicContact CG1-CD1 4.21Å; I14-Y112 HydrophobicContact CG1-CE1 4.46Å; I14-Y112 HydrophobicContact CG2-CD1 3.97Å; I14-Y112 HydrophobicContact CG2-CE1 4.36Å; I14-Y112 HydrophobicContact CG2-CG 4.42Å
15	P	76	Confident	67.2	Low	25 Å²	25	68.3 Å²	68.3	16%	0.162	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-68.2	149.7	-176.3	29.9	-35	0	0	0	110.6	F17 A18 Y112	P15-F17 HydrophobicContact CB-CD1 3.62Å; P15-F17 HydrophobicContact CB-CE1 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.44Å; P15-F17 HydrophobicContact CB-CG 4.35Å; P15-F17 HydrophobicContact CB-CZ 3.73Å; P15-F17 HydrophobicContact CG-CD1 3.98Å; P15-F17 HydrophobicContact CG-CD2 4.3Å; P15-F17 HydrophobicContact CG-CE1 3.37Å; P15-F17 HydrophobicContact CG-CE2 3.72Å; P15-F17 HydrophobicContact CG-CG 4.41Å; P15-F17 HydrophobicContact CG-CZ 3.21Å; P15-F17 PolarHBondContact O-N 3.14Å; P15-F17 VanDerWaalsContact O-N 3.15Å; P15-A18 HydrophobicContact CG-CB 4.47Å; P15-A18 WeakPolarHBondContact O-CB 3.33Å; P15-A18 PolarHBondContact O-N 3.06Å; P15-Y112 VanDerWaalsContact CD-CZ 3.42Å; P15-Y112 WeakPolarHBondContact CD-OH 3.49Å; P15-Y112 HydrophobicContact CG-CE1 4.47Å; P15-Y112 HydrophobicContact CG-CE2 4.02Å
16	L	73.9	Confident	69.7	Low	2 Å²	2	67.3 Å²	67.3	1%	0.01	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-59.2	-33.4	-173.5	-163.5	73	0	0	0	113.2	A18 L19 R24 L69 W72 A73 A79 L84	L16-A18 PolarHBondContact O-N 2.83Å; L16-A18 VanDerWaalsContact O-N 3.13Å; L16-L19 HydrophobicContact CD1-CD1 3.76Å; L16-L19 HydrophobicContact CG-CD1 4.35Å; L16-L19 WeakPolarHBondContact O-CB 3.46Å; L16-L19 PolarHBondContact O-N 2.84Å; L16-R24 VanDerWaalsContact C-NH2 3.34Å; L16-R24 PolarHBondContact O-NH2 3.26Å; L16-L69 HydrophobicContact CD2-CD2 4.22Å; L16-W72 HydrophobicContact CD1-CE3 4.41Å; L16-W72 HydrophobicContact CD1-CZ3 3.69Å; L16-W72 HydrophobicContact CD2-CD2 4.45Å; L16-W72 HydrophobicContact CD2-CE3 3.3Å; L16-W72 HydrophobicContact CD2-CZ3 3.46Å; L16-W72 VanDerWaalsContact CD2-CZ3 3.46Å; L16-W72 HydrophobicContact CG-CE3 4.41Å; L16-W72 HydrophobicContact CG-CZ3 4.12Å; L16-A73 HydrophobicContact CB-CB 4.48Å; L16-A73 HydrophobicContact CD2-CB 4.06Å; L16-A79 HydrophobicContact CB-CB 4.25Å; L16-A79 WeakPolarHBondContact CB-O 3.37Å; L16-A79 PolarHBondContact N-O 3.29Å; L16-L84 HydrophobicContact CD1-CB 3.78Å; L16-L84 HydrophobicContact CD1-CD2 3.86Å; L16-L84 HydrophobicContact CD1-CG 4.35Å
17	F	68.8	Low	72.2	Confident	145 Å²	145	60.8 Å²	60.8	64%	0.636	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-61.8	-18	177.6	67.3	-106.8	0	0	0	113.4	P15 L19 Y112	P15-F17 HydrophobicContact CB-CD1 3.62Å; P15-F17 HydrophobicContact CB-CE1 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.44Å; P15-F17 HydrophobicContact CB-CG 4.35Å; P15-F17 HydrophobicContact CB-CZ 3.73Å; P15-F17 HydrophobicContact CG-CD1 3.98Å; P15-F17 HydrophobicContact CG-CD2 4.3Å; P15-F17 HydrophobicContact CG-CE1 3.37Å; P15-F17 HydrophobicContact CG-CE2 3.72Å; P15-F17 HydrophobicContact CG-CG 4.41Å; P15-F17 HydrophobicContact CG-CZ 3.21Å; P15-F17 PolarHBondContact O-N 3.14Å; P15-F17 VanDerWaalsContact O-N 3.15Å; F17-L19 PolarHBondContact O-N 3.47Å; F17-Y112 HydrophobicContact CE2-CE2 4.38Å
18	A	70.1	Confident	74.4	Confident	21 Å²	21	55.8 Å²	55.8	17%	0.174	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-68.6	-16.9	175	0	0	0	0	0	112.8	I14 P15 L16 N20 Y112	I14-A18 HydrophobicContact CG2-CB 3.68Å; P15-A18 HydrophobicContact CG-CB 4.47Å; P15-A18 WeakPolarHBondContact O-CB 3.33Å; P15-A18 PolarHBondContact O-N 3.06Å; L16-A18 PolarHBondContact O-N 2.83Å; L16-A18 VanDerWaalsContact O-N 3.13Å; A18-N20 PolarHBondContact O-N 3.1Å; A18-Y112 HydrophobicContact CB-CD2 3.92Å; A18-Y112 HydrophobicContact CB-CE2 4.48Å; A18-Y112 HydrophobicContact CB-CG 4.07Å
19	L	74.4	Confident	76	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.037	29%	0.29	C	S	.	.	S	Bend	trans	-68.8	127.3	174.8	-68	175.2	0	0	0	111.7	L16 F17 V23 R24 V81 L84 I104	L16-L19 HydrophobicContact CD1-CD1 3.76Å; L16-L19 HydrophobicContact CG-CD1 4.35Å; L16-L19 WeakPolarHBondContact O-CB 3.46Å; L16-L19 PolarHBondContact O-N 2.84Å; F17-L19 PolarHBondContact O-N 3.47Å; L19-V23 HydrophobicContact CD2-CG1 4.3Å; L19-R24 HydrophobicContact CB-CG 4.39Å; L19-R24 PolarHBondContact O-NE 3.22Å; L19-V81 HydrophobicContact CD1-CG2 4.17Å; L19-V81 HydrophobicContact CD2-CG1 3.96Å; L19-V81 HydrophobicContact CD2-CG2 3.81Å; L19-V81 HydrophobicContact CG-CG2 3.7Å; L19-L84 HydrophobicContact CD1-CD2 3.71Å; L19-I104 HydrophobicContact CD2-CG1 4.02Å; L19-I104 HydrophobicContact CD2-CG2 4.21Å
20	N	67.6	Low	77.3	Confident	58 Å²	58	52.8 Å²	52.8	31%	0.31	29%	0.285	S	S	.	.			trans	-69.6	154.8	-178.9	-174.2	-18.7	0	0	0	111.7	A18 T22 V23 R24 D108	A18-N20 PolarHBondContact O-N 3.1Å; N20-T22 PolarHBondContact O-N 3.37Å; N20-T22 PolarHBondContact OD1-N 3.14Å; N20-V23 PolarHBondContact O-N 3.5Å; N20-V23 VanDerWaalsContact O-N 3.09Å; N20-R24 PolarHBondContact O-N 3.37Å; N20-D108 WeakPolarHBondContact CB-OD1 3.35Å; N20-D108 WeakPolarHBondContact CB-OD2 3.43Å; N20-D108 PolarHBondContact N-OD2 3.09Å
21	V	70.3	Confident	78.2	Confident	55 Å²	55	47.5 Å²	47.5	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-53.8	-34	176.4	179.9	0	0	0	0	111.4	K25	V21-K25 HydrophobicContact CG1-CD 3.99Å; V21-K25 HydrophobicContact CG1-CG 4.23Å; V21-K25 VanDerWaalsContact O-CB 3.28Å; V21-K25 WeakPolarHBondContact O-CB 3.37Å; V21-K25 VanDerWaalsContact O-CG 3.24Å; V21-K25 WeakPolarHBondContact O-CG 3.41Å; V21-K25 PolarHBondContact O-N 3.02Å
22	T	75.5	Confident	79.1	Confident	71 Å²	71	47.1 Å²	47.1	44%	0.436	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-48.2	176.7	-56.3	0	0	0	0	111.9	N20 K25 K26	N20-T22 PolarHBondContact O-N 3.37Å; N20-T22 PolarHBondContact OD1-N 3.14Å; T22-K25 PolarHBondContact O-N 3.21Å; T22-K26 PolarHBondContact O-N 3.29Å
23	V	82.3	Confident	80.1	Confident	2 Å²	2	48 Å²	48	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-45.7	178	178.7	0	0	0	0	110.3	L19 N20 K25 K26 L27 L100 L103 I104 D108	L19-V23 HydrophobicContact CD2-CG1 4.3Å; N20-V23 PolarHBondContact O-N 3.5Å; N20-V23 VanDerWaalsContact O-N 3.09Å; V23-K25 VanDerWaalsContact C-N 3.32Å; V23-K25 PolarHBondContact O-N 3.15Å; V23-K26 PolarHBondContact O-N 3.21Å; V23-L27 HydrophobicContact CG1-CD1 4.22Å; V23-L27 HydrophobicContact CG1-CG 4.49Å; V23-L27 WeakPolarHBondContact O-CG 3.47Å; V23-L27 PolarHBondContact O-N 3.33Å; V23-L100 HydrophobicContact CG1-CD1 4.22Å; V23-L103 HydrophobicContact CG2-CB 3.94Å; V23-I104 HydrophobicContact CG1-CD1 4.27Å; V23-I104 HydrophobicContact CG1-CG1 3.91Å; V23-I104 HydrophobicContact CG2-CG1 4.39Å; V23-D108 WeakPolarHBondContact CG2-OD2 3.49Å
24	R	81.9	Confident	80.8	Confident	29 Å²	29	51.6 Å²	51.6	11%	0.109	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-39	176.5	-67.6	175.2	177.3	-101.1	-11.1	113	L16 L19 N20 G28 D70	L16-R24 VanDerWaalsContact C-NH2 3.34Å; L16-R24 PolarHBondContact O-NH2 3.26Å; L19-R24 HydrophobicContact CB-CG 4.39Å; L19-R24 PolarHBondContact O-NE 3.22Å; N20-R24 PolarHBondContact O-N 3.37Å; R24-G28 PolarHBondContact O-N 3.37Å; R24-D70 IonicContact NH1-OD1 3.3Å; R24-D70 PolarHBondContact NH1-OD1 3.11Å
25	K	81.8	Confident	80.9	Confident	132 Å²	132	56.2 Å²	56.2	57%	0.574	28%	0.28	S	S	*	.	H	α-helix	trans	-65.8	-45.9	174.6	-80.7	175.9	178.5	175.3	0	111.2	V21 T22 V23 G28 L29	V21-K25 HydrophobicContact CG1-CD 3.99Å; V21-K25 HydrophobicContact CG1-CG 4.23Å; V21-K25 VanDerWaalsContact O-CB 3.28Å; V21-K25 WeakPolarHBondContact O-CB 3.37Å; V21-K25 VanDerWaalsContact O-CG 3.24Å; V21-K25 WeakPolarHBondContact O-CG 3.41Å; V21-K25 PolarHBondContact O-N 3.02Å; T22-K25 PolarHBondContact O-N 3.21Å; V23-K25 VanDerWaalsContact C-N 3.32Å; V23-K25 PolarHBondContact O-N 3.15Å; K25-G28 PolarHBondContact O-N 3.27Å; K25-L29 WeakPolarHBondContact O-CG 3.3Å; K25-L29 PolarHBondContact O-N 3.01Å
26	K	85.4	Confident	80.8	Confident	82 Å²	82	62.2 Å²	62.2	36%	0.357	32%	0.316	S	S	.	.	H	α-helix	trans	-62.3	-43.3	177.3	-75.9	-168.2	174.4	-167.8	0	112	T22 V23 G28 L29 F30 L100 L103	T22-K26 PolarHBondContact O-N 3.29Å; V23-K26 PolarHBondContact O-N 3.21Å; K26-G28 VanDerWaalsContact C-N 3.26Å; K26-G28 PolarHBondContact O-N 3.32Å; K26-L29 WeakPolarHBondContact O-CA 3.43Å; K26-L29 WeakPolarHBondContact O-CB 3.45Å; K26-L29 PolarHBondContact O-N 2.92Å; K26-F30 HydrophobicContact CB-CE2 4.45Å; K26-F30 WeakPolarHBondContact O-CD2 3.27Å; K26-F30 PolarHBondContact O-N 2.59Å; K26-L100 HydrophobicContact CB-CD2 3.76Å; K26-L100 HydrophobicContact CD-CD2 3.56Å; K26-L100 HydrophobicContact CG-CD2 4.33Å; K26-L103 HydrophobicContact CD-CD1 3.92Å
27	L	89.1	Confident	80.9	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-52.7	-46.6	172.6	-75.3	168.9	0	0	0	111.3	V23 L29 F30 L31 T65 L69 L84 L88 I96 L100	V23-L27 HydrophobicContact CG1-CD1 4.22Å; V23-L27 HydrophobicContact CG1-CG 4.49Å; V23-L27 WeakPolarHBondContact O-CG 3.47Å; V23-L27 PolarHBondContact O-N 3.33Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.44Å; L27-F30 PolarHBondContact O-N 3.16Å; L27-L31 HydrophobicContact CD2-CD1 4.39Å; L27-L31 WeakPolarHBondContact O-CB 3.05Å; L27-L31 PolarHBondContact O-N 3.39Å; L27-T65 HydrophobicContact CB-CG2 4.22Å; L27-L69 HydrophobicContact CD1-CD1 4.04Å; L27-L84 HydrophobicContact CD1-CD2 3.92Å; L27-L88 HydrophobicContact CD2-CD1 4.01Å; L27-I96 HydrophobicContact CD2-CG2 3.64Å; L27-L100 HydrophobicContact CD2-CD1 3.5Å; L27-L100 HydrophobicContact CG-CD1 3.67Å
28	G	89.9	Confident	81.6	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-35.8	174.6	0	0	0	0	0	114	R24 K25 K26 F30 N32	R24-G28 PolarHBondContact O-N 3.37Å; K25-G28 PolarHBondContact O-N 3.27Å; K26-G28 VanDerWaalsContact C-N 3.26Å; K26-G28 PolarHBondContact O-N 3.32Å; G28-F30 VanDerWaalsContact C-N 3.33Å; G28-N32 WeakPolarHBondContact O-CB 3.32Å; G28-N32 PolarHBondContact O-N 2.82Å; G28-N32 PolarHBondContact O-ND2 2.81Å
29	L	88.7	Confident	82.4	Confident	129 Å²	129	64.1 Å²	64.1	68%	0.675	34%	0.344	S	S	*	.	H	α-helix	trans	-66.8	-34.7	176.3	-67	174.1	0	0	0	112.4	K25 K26 L27 P33	K25-L29 WeakPolarHBondContact O-CG 3.3Å; K25-L29 PolarHBondContact O-N 3.01Å; K26-L29 WeakPolarHBondContact O-CA 3.43Å; K26-L29 WeakPolarHBondContact O-CB 3.45Å; K26-L29 PolarHBondContact O-N 2.92Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.44Å; L29-P33 VanDerWaalsContact O-CD 3.23Å; L29-P33 WeakPolarHBondContact O-CD 3.44Å; L29-P33 WeakPolarHBondContact O-CG 3.36Å
30	F	89.2	Confident	83.2	Confident	60 Å²	60	64.9 Å²	64.9	26%	0.263	35%	0.348	S	S	.	.	H	α-helix	trans	-83.7	-27.5	-179.8	-74.1	-68.8	0	0	0	114.5	K26 L27 G28 R93 I96 D99 L100	K26-F30 HydrophobicContact CB-CE2 4.45Å; K26-F30 WeakPolarHBondContact O-CD2 3.27Å; K26-F30 PolarHBondContact O-N 2.59Å; L27-F30 PolarHBondContact O-N 3.16Å; G28-F30 VanDerWaalsContact C-N 3.33Å; F30-R93 PolarHBondContact O-NH1 3.33Å; F30-R93 PolarHBondContact O-NH2 3.35Å; F30-I96 HydrophobicContact CB-CD1 3.63Å; F30-I96 HydrophobicContact CB-CG1 3.85Å; F30-I96 HydrophobicContact CG-CD1 4.42Å; F30-I96 HydrophobicContact CG-CG1 4.11Å; F30-D99 HydrophobicContact CZ-CB 4.45Å; F30-L100 HydrophobicContact CE2-CD2 4.45Å
31	L	91.6	Very high	84.4	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.016	34%	0.335	C	S	.	.	H	α-helix	trans	-109.3	-25.7	-171	-68	168.9	0	0	0	114.1	L27 D40 W41 V44 T65 L88 R93 I96	L27-L31 HydrophobicContact CD2-CD1 4.39Å; L27-L31 WeakPolarHBondContact O-CB 3.05Å; L27-L31 PolarHBondContact O-N 3.39Å; L31-D40 WeakPolarHBondContact O-CB 3.22Å; L31-W41 HydrophobicContact CB-CB 4.07Å; L31-W41 PolarHBondContact O-N 2.89Å; L31-V44 HydrophobicContact CD1-CG2 4.26Å; L31-V44 HydrophobicContact CD2-CG2 3.99Å; L31-T65 HydrophobicContact CB-CG2 4.31Å; L31-T65 WeakPolarHBondContact CB-OG1 3.45Å; L31-T65 HydrophobicContact CD1-CG2 3.95Å; L31-L88 HydrophobicContact CD1-CD2 4.05Å; L31-R93 HydrophobicContact CD2-CG 4.4Å; L31-I96 HydrophobicContact CD1-CD1 4.23Å; L31-I96 HydrophobicContact CD2-CD1 3.54Å; L31-I96 HydrophobicContact CG-CD1 3.65Å
32	N	91.9	Very high	85.5	Confident	39 Å²	39	61.5 Å²	61.5	21%	0.209	33%	0.329	C	S	.	.	S	Bend	trans	-71.2	-36.9	179.7	-66.6	-26.9	0	0	0	114.5	G28 K34 N63 T65	G28-N32 WeakPolarHBondContact O-CB 3.32Å; G28-N32 PolarHBondContact O-N 2.82Å; G28-N32 PolarHBondContact O-ND2 2.81Å; N32-K34 PolarHBondContact O-N 3.06Å; N32-N63 VanDerWaalsContact ND2-CG 3.32Å; N32-N63 PolarHBondContact ND2-OD1 3.47Å; N32-T65 VanDerWaalsContact OD1-CB 3.25Å; N32-T65 WeakPolarHBondContact OD1-CB 3.39Å; N32-T65 PolarHBondContact OD1-N 3.04Å; N32-T65 PolarHBondContact OD1-OG1 3.25Å
33	P	88.9	Confident	86.3	Confident	60 Å²	60	59.4 Å²	59.4	39%	0.39	32%	0.318	S	S	.	.	S	Bend	trans	-64.8	135.3	176.6	-20.7	33.5	0	0	0	111.1	L29 H35	L29-P33 VanDerWaalsContact O-CD 3.23Å; L29-P33 WeakPolarHBondContact O-CD 3.44Å; L29-P33 WeakPolarHBondContact O-CG 3.36Å; P33-H35 PolarHBondContact O-CD2 2.84Å; P33-H35 VanDerWaalsContact O-CD2 3.23Å; P33-H35 PolarHBondContact O-N 3.22Å
34	K	82.9	Confident	86.8	Confident	157 Å²	157	59.6 Å²	59.6	68%	0.683	32%	0.32	S	S	*	.			trans	-73.1	114.4	174.2	-66.1	-166.8	176.2	-169.2	0	109.2	N32 E59	N32-K34 PolarHBondContact O-N 3.06Å; K34-E59 IonicContact NZ-OE1 3.75Å
35	H	78.5	Confident	87.3	Confident	98 Å²	98	58.2 Å²	58.2	45%	0.454	31%	0.314	S	S	.	.			trans	-101.8	147.8	172.7	-68.5	-77.6	0	0	0	109.9	P33 A38	P33-H35 PolarHBondContact O-CD2 2.84Å; P33-H35 VanDerWaalsContact O-CD2 3.23Å; P33-H35 PolarHBondContact O-N 3.22Å; H35-A38 HydrophobicContact CB-CB 3.88Å; H35-A38 WeakPolarHBondContact CB-O 3.38Å
36	T	74	Confident	87.8	Confident	151 Å²	151	57.5 Å²	57.5	93%	0.926	31%	0.313	S	S	*	.	S	Bend	trans	-81.8	-20.5	178.4	47.3	0	0	0	0	113.2
37	V	76.6	Confident	88.1	Confident	141 Å²	141	56.4 Å²	56.4	86%	0.855	31%	0.314	S	S	*	.	S	Bend	trans	-122.4	-29.2	-171.8	-174.8	0	0	0	0	112
38	A	82.6	Confident	88.2	Confident	36 Å²	36	57.2 Å²	57.2	30%	0.298	32%	0.317	S	S	.	.	S	Bend	trans	-100.5	140.5	-179.7	0	0	0	0	0	110.2	H35	H35-A38 HydrophobicContact CB-CB 3.88Å; H35-A38 WeakPolarHBondContact CB-O 3.38Å
39	A	86.7	Confident	88.2	Confident	30 Å²	30	60.1 Å²	60.1	25%	0.248	35%	0.348	C	S	.	.			trans	-64.3	141.6	174	0	0	0	0	0	111.5	A43 V91 R93	A39-A43 HydrophobicContact CB-CB 3.92Å; A39-V91 HydrophobicContact CB-CG1 3.16Å; A39-R93 HydrophobicContact CB-CG 4.47Å; A39-R93 PolarHBondContact O-NH1 2.81Å
40	D	91.8	Very high	88.3	Confident	23 Å²	23	54.6 Å²	54.6	12%	0.123	32%	0.318	C	S	.	.			trans	-105.5	-174.5	-178.2	70.5	10	0	0	0	111.1	L31 T42 A43 V44	L31-D40 WeakPolarHBondContact O-CB 3.22Å; D40-T42 PolarHBondContact O-N 3.27Å; D40-T42 VanDerWaalsContact O-N 3.14Å; D40-T42 WeakPolarHBondContact OD1-CB 3.23Å; D40-T42 PolarHBondContact OD1-N 3.25Å; D40-T42 PolarHBondContact OD1-OG1 3.15Å; D40-A43 PolarHBondContact O-N 3.01Å; D40-V44 PolarHBondContact O-N 3.18Å
41	W	93.3	Very high	88.4	Confident	10 Å²	10	54.4 Å²	54.4	4%	0.038	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-22.2	179.2	70.9	-85.7	0	0	0	114.1	L31 A45 I55 F58 E59 P64 T65 V68	L31-W41 HydrophobicContact CB-CB 4.07Å; L31-W41 PolarHBondContact O-N 2.89Å; W41-A45 WeakPolarHBondContact O-CB 3.34Å; W41-A45 PolarHBondContact O-N 3.15Å; W41-I55 HydrophobicContact CH2-CG2 4.02Å; W41-I55 VanDerWaalsContact CH2-O 3.31Å; W41-I55 WeakPolarHBondContact CH2-O 3.24Å; W41-I55 HydrophobicContact CZ3-CG2 3.93Å; W41-F58 HydrophobicContact CH2-CB 3.79Å; W41-F58 HydrophobicContact CZ3-CB 3.7Å; W41-E59 HydrophobicContact CH2-CG 3.95Å; W41-E59 HydrophobicContact CZ2-CG 3.84Å; W41-P64 HydrophobicContact CD2-CB 3.42Å; W41-P64 VanDerWaalsContact CD2-CB 3.42Å; W41-P64 HydrophobicContact CD2-CG 4.39Å; W41-P64 HydrophobicContact CE3-CB 3.63Å; W41-P64 HydrophobicContact CG-CB 4.07Å; W41-P64 HydrophobicContact CH2-CB 3.67Å; W41-P64 HydrophobicContact CH2-CG 4.41Å; W41-P64 HydrophobicContact CZ2-CB 3.47Å; W41-P64 VanDerWaalsContact CZ2-CB 3.47Å; W41-P64 HydrophobicContact CZ2-CG 3.87Å; W41-P64 HydrophobicContact CZ3-CB 3.76Å; W41-T65 VanDerWaalsContact CB-OG1 3.22Å; W41-T65 WeakPolarHBondContact CB-OG1 3.09Å; W41-V68 HydrophobicContact CE3-CG2 3.94Å; W41-V68 HydrophobicContact CZ3-CG2 4.01Å
42	T	93.3	Very high	88.4	Confident	33 Å²	33	61.5 Å²	61.5	20%	0.202	35%	0.352	C	S	.	.	H	α-helix	trans	-71.9	-44.3	179.4	68.2	0	0	0	0	110.6	D40 V44 A45 E46 I55	D40-T42 PolarHBondContact O-N 3.27Å; D40-T42 VanDerWaalsContact O-N 3.14Å; D40-T42 WeakPolarHBondContact OD1-CB 3.23Å; D40-T42 PolarHBondContact OD1-N 3.25Å; D40-T42 PolarHBondContact OD1-OG1 3.15Å; T42-V44 VanDerWaalsContact C-N 3.3Å; T42-V44 PolarHBondContact O-N 3.29Å; T42-A45 WeakPolarHBondContact O-CB 3.38Å; T42-A45 PolarHBondContact O-N 3.46Å; T42-A45 VanDerWaalsContact O-N 3.11Å; T42-E46 WeakPolarHBondContact O-CG 3.04Å; T42-E46 PolarHBondContact O-N 2.64Å; T42-I55 HydrophobicContact CG2-CG2 3.79Å
43	A	92.3	Very high	88.3	Confident	26 Å²	26	65.9 Å²	65.9	22%	0.215	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-40.4	174.2	0	0	0	0	0	111.6	A39 D40 A45 E46 T47 V91	A39-A43 HydrophobicContact CB-CB 3.92Å; D40-A43 PolarHBondContact O-N 3.01Å; A43-A45 VanDerWaalsContact C-N 3.35Å; A43-A45 PolarHBondContact O-N 3.27Å; A43-E46 PolarHBondContact O-N 3.08Å; A43-T47 PolarHBondContact O-N 3.5Å; A43-T47 VanDerWaalsContact O-N 3.1Å; A43-T47 PolarHBondContact O-OG1 3.38Å; A43-T47 VanDerWaalsContact O-OG1 3.07Å; A43-V91 HydrophobicContact CB-CG1 3.9Å
44	V	92.4	Very high	88.3	Confident	6 Å²	6	65.4 Å²	65.4	4%	0.036	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-42.3	174.2	176.1	0	0	0	0	111.4	L31 D40 T42 T47 M48 I87 L88 V91	L31-V44 HydrophobicContact CD1-CG2 4.26Å; L31-V44 HydrophobicContact CD2-CG2 3.99Å; D40-V44 PolarHBondContact O-N 3.18Å; T42-V44 VanDerWaalsContact C-N 3.3Å; T42-V44 PolarHBondContact O-N 3.29Å; V44-T47 PolarHBondContact O-N 2.93Å; V44-M48 HydrophobicContact CG1-CE 3.44Å; V44-M48 VanDerWaalsContact CG1-CE 3.44Å; V44-M48 HydrophobicContact CG1-SD 4.12Å; V44-M48 VanDerWaalsContact O-CG 3.28Å; V44-M48 WeakPolarHBondContact O-CG 3.41Å; V44-M48 PolarHBondContact O-N 3.4Å; V44-I87 HydrophobicContact CG1-CG2 4.05Å; V44-L88 HydrophobicContact CG2-CD2 4.12Å; V44-V91 HydrophobicContact CG2-CG1 4.08Å; V44-V91 HydrophobicContact CG2-CG2 4.5Å
45	A	92.9	Very high	88.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.7	-38.5	177.6	0	0	0	0	0	112.4	W41 T42 A43 M48 G49 F50 I55 V68	W41-A45 WeakPolarHBondContact O-CB 3.34Å; W41-A45 PolarHBondContact O-N 3.15Å; T42-A45 WeakPolarHBondContact O-CB 3.38Å; T42-A45 PolarHBondContact O-N 3.46Å; T42-A45 VanDerWaalsContact O-N 3.11Å; A43-A45 VanDerWaalsContact C-N 3.35Å; A43-A45 PolarHBondContact O-N 3.27Å; A45-M48 WeakPolarHBondContact O-CB 3.32Å; A45-M48 PolarHBondContact O-N 3.13Å; A45-G49 PolarHBondContact O-N 3.26Å; A45-F50 HydrophobicContact CB-CB 4.32Å; A45-F50 HydrophobicContact CB-CD2 4.14Å; A45-F50 WeakPolarHBondContact O-CB 3.41Å; A45-F50 VanDerWaalsContact O-CD2 3.32Å; A45-F50 WeakPolarHBondContact O-CD2 3.3Å; A45-F50 PolarHBondContact O-N 3.28Å; A45-I55 HydrophobicContact CB-CD1 4.01Å; A45-I55 HydrophobicContact CB-CG1 3.85Å; A45-V68 HydrophobicContact CB-CG1 3.79Å; A45-V68 HydrophobicContact CB-CG2 4.04Å
46	E	92.7	Very high	89.3	Confident	117 Å²	117	59 Å²	59	55%	0.547	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-46.2	175	-71.3	-176.6	169.8	0	0	111.3	T42 A43 M48 G49 I55	T42-E46 WeakPolarHBondContact O-CG 3.04Å; T42-E46 PolarHBondContact O-N 2.64Å; A43-E46 PolarHBondContact O-N 3.08Å; E46-M48 VanDerWaalsContact C-N 3.25Å; E46-M48 PolarHBondContact O-N 2.94Å; E46-G49 WeakPolarHBondContact O-CA 3.33Å; E46-G49 PolarHBondContact O-N 3.09Å; E46-I55 HydrophobicContact CB-CD1 4.34Å; E46-I55 HydrophobicContact CG-CD1 3.31Å
47	T	91.9	Very high	90.1	Very high	60 Å²	60	57.6 Å²	57.6	37%	0.368	33%	0.325	S	S	.	.	H	α-helix	trans	-65.2	-29.3	176.7	-50.5	0	0	0	0	112.3	A43 V44 G49 I87 E90 V91	A43-T47 PolarHBondContact O-N 3.5Å; A43-T47 VanDerWaalsContact O-N 3.1Å; A43-T47 PolarHBondContact O-OG1 3.38Å; A43-T47 VanDerWaalsContact O-OG1 3.07Å; V44-T47 PolarHBondContact O-N 2.93Å; T47-G49 PolarHBondContact O-N 3.21Å; T47-I87 HydrophobicContact CG2-CB 4.41Å; T47-I87 HydrophobicContact CG2-CG1 4.1Å; T47-I87 HydrophobicContact CG2-CG2 3.9Å; T47-E90 VanDerWaalsContact CG2-OE2 3.28Å; T47-E90 WeakPolarHBondContact CG2-OE2 3.36Å; T47-V91 WeakPolarHBondContact OG1-CG2 3.41Å
48	M	90.2	Very high	90.8	Very high	20 Å²	20	52 Å²	52	10%	0.099	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-7.6	170.9	-73.1	173.8	-176	0	0	113.7	V44 A45 E46 F50 V68 L69 W72 L84 I87	V44-M48 HydrophobicContact CG1-CE 3.44Å; V44-M48 VanDerWaalsContact CG1-CE 3.44Å; V44-M48 HydrophobicContact CG1-SD 4.12Å; V44-M48 VanDerWaalsContact O-CG 3.28Å; V44-M48 WeakPolarHBondContact O-CG 3.41Å; V44-M48 PolarHBondContact O-N 3.4Å; A45-M48 WeakPolarHBondContact O-CB 3.32Å; A45-M48 PolarHBondContact O-N 3.13Å; E46-M48 VanDerWaalsContact C-N 3.25Å; E46-M48 PolarHBondContact O-N 2.94Å; M48-F50 HydrophobicContact CB-CD2 3.74Å; M48-F50 HydrophobicContact CB-CE2 3.79Å; M48-F50 HydrophobicContact SD-CE2 4.37Å; M48-V68 HydrophobicContact SD-CG1 3.71Å; M48-L69 HydrophobicContact CE-CD2 3.7Å; M48-W72 HydrophobicContact CB-CG 4.34Å; M48-W72 HydrophobicContact CE-CD2 4.27Å; M48-W72 HydrophobicContact CE-CE3 3.86Å; M48-W72 HydrophobicContact CE-CZ3 4.1Å; M48-W72 HydrophobicContact CG-CD2 4.08Å; M48-W72 HydrophobicContact CG-CG 4.19Å; M48-W72 HydrophobicContact SD-CB 4.19Å; M48-W72 HydrophobicContact SD-CD2 3.91Å; M48-W72 HydrophobicContact SD-CE3 4.04Å; M48-W72 HydrophobicContact SD-CG 3.95Å; M48-L84 HydrophobicContact CE-CD1 3.49Å; M48-L84 VanDerWaalsContact CE-CD1 3.49Å; M48-I87 HydrophobicContact CE-CD1 4.28Å; M48-I87 HydrophobicContact CE-CG2 4.47Å; M48-I87 HydrophobicContact CG-CD1 3.73Å
49	G	89.2	Confident	91.1	Very high	64 Å²	64	55 Å²	55	66%	0.66	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	16.2	177.4	0	0	0	0	0	114.7	A45 E46 T47	A45-G49 PolarHBondContact O-N 3.26Å; E46-G49 WeakPolarHBondContact O-CA 3.33Å; E46-G49 PolarHBondContact O-N 3.09Å; T47-G49 PolarHBondContact O-N 3.21Å
50	F	91.4	Very high	91.1	Very high	12 Å²	12	58 Å²	58	5%	0.053	32%	0.323	C	S	.	.			trans	-74.1	139.6	174.1	-70.3	-83.9	0	0	0	111.1	A45 M48 E54 I55 F58 V68 D71 W72	A45-F50 HydrophobicContact CB-CB 4.32Å; A45-F50 HydrophobicContact CB-CD2 4.14Å; A45-F50 WeakPolarHBondContact O-CB 3.41Å; A45-F50 VanDerWaalsContact O-CD2 3.32Å; A45-F50 WeakPolarHBondContact O-CD2 3.3Å; A45-F50 PolarHBondContact O-N 3.28Å; M48-F50 HydrophobicContact CB-CD2 3.74Å; M48-F50 HydrophobicContact CB-CE2 3.79Å; M48-F50 HydrophobicContact SD-CE2 4.37Å; F50-E54 HydrophobicContact CB-CB 4.5Å; F50-E54 HydrophobicContact CD1-CB 4.28Å; F50-I55 HydrophobicContact CB-CD1 4.32Å; F50-I55 HydrophobicContact CB-CG1 3.91Å; F50-F58 AromaticContact CD1-CE2 3.9Å; F50-F58 HydrophobicContact CD1-CE2 3.9Å; F50-F58 HydrophobicContact CE1-CE2 4.01Å; F50-F58 HydrophobicContact CE1-CZ 4.22Å; F50-V68 HydrophobicContact CD2-CG1 4.05Å; F50-V68 HydrophobicContact CE2-CG1 3.7Å; F50-V68 HydrophobicContact CZ-CG1 4.38Å; F50-D71 HydrophobicContact CE1-CB 4.32Å; F50-D71 WeakPolarHBondContact CE1-OD2 3.25Å; F50-D71 HydrophobicContact CZ-CB 4.24Å; F50-W72 HydrophobicContact CE2-CB 3.92Å; F50-W72 HydrophobicContact CE2-CG 4.42Å; F50-W72 HydrophobicContact CZ-CB 3.95Å
51	S	92.2	Very high	90.9	Very high	57 Å²	57	59.2 Å²	59.2	40%	0.399	33%	0.333	S	S	.	.			trans	-75.4	157.1	175.6	68.3	0	0	0	0	111.7	L53 E54 I55	S51-L53 PolarHBondContact O-N 2.74Å; S51-L53 VanDerWaalsContact O-N 3.14Å; S51-E54 WeakPolarHBondContact CB-OE2 2.94Å; S51-E54 PolarHBondContact N-OE2 2.92Å; S51-E54 WeakPolarHBondContact O-CB 3.48Å; S51-E54 PolarHBondContact O-N 2.89Å; S51-E54 WeakPolarHBondContact OG-CG 3.49Å; S51-E54 PolarHBondContact OG-OE2 2.95Å; S51-I55 WeakPolarHBondContact O-CG1 3.46Å; S51-I55 PolarHBondContact O-N 3.37Å
52	Y	90.3	Very high	90.5	Very high	151 Å²	151	69.1 Å²	69.1	59%	0.592	38%	0.376	S	S	*	.	H	α-helix	trans	-50.5	-41.2	178	172.1	-101.2	0	0	0	113.7	I55 K56	Y52-I55 PolarHBondContact O-N 2.91Å; Y52-K56 HydrophobicContact CE1-CD 4.22Å; Y52-K56 WeakPolarHBondContact O-CB 3.5Å; Y52-K56 PolarHBondContact O-N 3.01Å
53	L	89.8	Confident	90.2	Very high	132 Å²	132	69.6 Å²	69.6	69%	0.691	38%	0.378	S	S	*	.	H	α-helix	trans	-68.5	-35.6	-179.4	-68.3	178.5	0	0	0	112.3	S51 N57	S51-L53 PolarHBondContact O-N 2.74Å; S51-L53 VanDerWaalsContact O-N 3.14Å; L53-N57 WeakPolarHBondContact O-CB 3.46Å; L53-N57 PolarHBondContact O-N 2.9Å
54	E	89.2	Confident	90.2	Very high	50 Å²	50	69 Å²	69	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-68.4	-45.9	176.4	-67.8	169.5	120.9	0	0	110.7	F50 S51 K56 N57 F58 R75	F50-E54 HydrophobicContact CB-CB 4.5Å; F50-E54 HydrophobicContact CD1-CB 4.28Å; S51-E54 WeakPolarHBondContact CB-OE2 2.94Å; S51-E54 PolarHBondContact N-OE2 2.92Å; S51-E54 WeakPolarHBondContact O-CB 3.48Å; S51-E54 PolarHBondContact O-N 2.89Å; S51-E54 WeakPolarHBondContact OG-CG 3.49Å; S51-E54 PolarHBondContact OG-OE2 2.95Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.49Å; E54-N57 WeakPolarHBondContact O-CB 3.36Å; E54-N57 PolarHBondContact O-N 3.35Å; E54-F58 HydrophobicContact CB-CE2 4.25Å; E54-F58 WeakPolarHBondContact O-CD2 3.34Å; E54-F58 PolarHBondContact O-N 3.14Å; E54-R75 IonicContact OE1-CZ 2.89Å; E54-R75 VanDerWaalsContact OE1-CZ 3.24Å; E54-R75 IonicContact OE1-NH1 3.18Å; E54-R75 PolarHBondContact OE1-NH1 2.77Å; E54-R75 IonicContact OE1-NH2 3.84Å; E54-R75 PolarHBondContact OE1-NH2 2.93Å
55	I	92.1	Very high	90.2	Very high	9 Å²	9	69 Å²	69	5%	0.046	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-48.4	175	-63.5	174	0	0	0	110	W41 T42 A45 E46 F50 S51 Y52 N57 F58 E59	W41-I55 HydrophobicContact CH2-CG2 4.02Å; W41-I55 VanDerWaalsContact CH2-O 3.31Å; W41-I55 WeakPolarHBondContact CH2-O 3.24Å; W41-I55 HydrophobicContact CZ3-CG2 3.93Å; T42-I55 HydrophobicContact CG2-CG2 3.79Å; A45-I55 HydrophobicContact CB-CD1 4.01Å; A45-I55 HydrophobicContact CB-CG1 3.85Å; E46-I55 HydrophobicContact CB-CD1 4.34Å; E46-I55 HydrophobicContact CG-CD1 3.31Å; F50-I55 HydrophobicContact CB-CD1 4.32Å; F50-I55 HydrophobicContact CB-CG1 3.91Å; S51-I55 WeakPolarHBondContact O-CG1 3.46Å; S51-I55 PolarHBondContact O-N 3.37Å; Y52-I55 PolarHBondContact O-N 2.91Å; I55-N57 VanDerWaalsContact C-N 3.26Å; I55-N57 PolarHBondContact O-N 3.49Å; I55-F58 PolarHBondContact O-N 3.48Å; I55-E59 PolarHBondContact O-N 2.85Å
56	K	89.9	Confident	90	Very high	111 Å²	111	72.7 Å²	72.7	48%	0.483	39%	0.388	S	S	.	.	H	α-helix	trans	-60	-36.3	177.1	-167.6	171.9	-172.7	170.7	0	112.8	Y52 E54 F58 E59	Y52-K56 HydrophobicContact CE1-CD 4.22Å; Y52-K56 WeakPolarHBondContact O-CB 3.5Å; Y52-K56 PolarHBondContact O-N 3.01Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.49Å; K56-F58 VanDerWaalsContact C-N 3.33Å; K56-E59 WeakPolarHBondContact O-CB 3.22Å; K56-E59 PolarHBondContact O-N 3.33Å
57	N	91.8	Very high	89.7	Confident	121 Å²	121	68.3 Å²	68.3	65%	0.647	37%	0.371	S	S	*	.	H	α-helix	trans	-67.6	-34.6	176.6	-166.6	55.1	0	0	0	112	L53 E54 I55 E59 A60	L53-N57 WeakPolarHBondContact O-CB 3.46Å; L53-N57 PolarHBondContact O-N 2.9Å; E54-N57 WeakPolarHBondContact O-CB 3.36Å; E54-N57 PolarHBondContact O-N 3.35Å; I55-N57 VanDerWaalsContact C-N 3.26Å; I55-N57 PolarHBondContact O-N 3.49Å; N57-E59 VanDerWaalsContact C-N 3.26Å; N57-E59 PolarHBondContact O-N 2.89Å; N57-A60 PolarHBondContact O-N 3.33Å
58	F	91.2	Very high	89.8	Confident	24 Å²	24	65.6 Å²	65.6	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-68.7	-20.4	175.9	-66.2	-55.4	0	0	0	113.7	W41 F50 E54 I55 K56 A60 S61 A67 V68 D71	W41-F58 HydrophobicContact CH2-CB 3.79Å; W41-F58 HydrophobicContact CZ3-CB 3.7Å; F50-F58 AromaticContact CD1-CE2 3.9Å; F50-F58 HydrophobicContact CD1-CE2 3.9Å; F50-F58 HydrophobicContact CE1-CE2 4.01Å; F50-F58 HydrophobicContact CE1-CZ 4.22Å; E54-F58 HydrophobicContact CB-CE2 4.25Å; E54-F58 WeakPolarHBondContact O-CD2 3.34Å; E54-F58 PolarHBondContact O-N 3.14Å; I55-F58 PolarHBondContact O-N 3.48Å; K56-F58 VanDerWaalsContact C-N 3.33Å; F58-A60 PolarHBondContact O-N 3.3Å; F58-S61 WeakPolarHBondContact O-CB 3.49Å; F58-S61 PolarHBondContact O-N 2.86Å; F58-S61 PolarHBondContact O-OG 2.92Å; F58-A67 HydrophobicContact CD1-CB 3.79Å; F58-A67 HydrophobicContact CE1-CB 4.15Å; F58-V68 HydrophobicContact CB-CG2 4.35Å; F58-V68 HydrophobicContact CD2-CG2 3.59Å; F58-V68 HydrophobicContact CE2-CG2 3.97Å; F58-V68 HydrophobicContact CG-CG2 3.95Å; F58-D71 HydrophobicContact CZ-CB 4.15Å; F58-D71 WeakPolarHBondContact CZ-OD2 3.47Å
59	E	89.4	Confident	89.7	Confident	98 Å²	98	64.9 Å²	64.9	46%	0.458	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.8	175.8	-64.6	-167.6	133.4	0	0	112.9	K34 W41 I55 K56 N57 S61	K34-E59 IonicContact NZ-OE1 3.75Å; W41-E59 HydrophobicContact CH2-CG 3.95Å; W41-E59 HydrophobicContact CZ2-CG 3.84Å; I55-E59 PolarHBondContact O-N 2.85Å; K56-E59 WeakPolarHBondContact O-CB 3.22Å; K56-E59 PolarHBondContact O-N 3.33Å; N57-E59 VanDerWaalsContact C-N 3.26Å; N57-E59 PolarHBondContact O-N 2.89Å; E59-S61 PolarHBondContact O-N 3.41Å
60	A	86.5	Confident	89.4	Confident	95 Å²	95	65.1 Å²	65.1	79%	0.785	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-12.7	176.5	0	0	0	0	0	113	N57 F58	N57-A60 PolarHBondContact O-N 3.33Å; F58-A60 PolarHBondContact O-N 3.3Å
61	S	86.3	Confident	89.1	Confident	48 Å²	48	66.6 Å²	66.6	34%	0.336	35%	0.346	S	S	.	.	S	Bend	trans	-79.7	141.5	-178.4	-61.9	0	0	0	0	111.5	F58 E59 N63 P64	F58-S61 WeakPolarHBondContact O-CB 3.49Å; F58-S61 PolarHBondContact O-N 2.86Å; F58-S61 PolarHBondContact O-OG 2.92Å; E59-S61 PolarHBondContact O-N 3.41Å; S61-N63 PolarHBondContact O-N 3.24Å; S61-P64 WeakPolarHBondContact O-CD 3.47Å
62	K	84.8	Confident	88.8	Confident	217 Å²	217	64.4 Å²	64.4	94%	0.943	33%	0.329	S	S	*	.	S	Bend	trans	-60	-27.2	176.1	-173	175.8	179.9	178.4	0	113.4
63	N	87.9	Confident	88.4	Confident	44 Å²	44	58.9 Å²	58.9	24%	0.235	32%	0.315	C	S	.	.			trans	-140.2	89.8	174.1	-174.5	-23.9	0	0	0	109.2	N32 S61 T65 K66 A67	N32-N63 VanDerWaalsContact ND2-CG 3.32Å; N32-N63 PolarHBondContact ND2-OD1 3.47Å; S61-N63 PolarHBondContact O-N 3.24Å; N63-T65 PolarHBondContact O-N 2.9Å; N63-T65 PolarHBondContact OD1-N 3.2Å; N63-K66 HydrophobicContact CB-CB 4.07Å; N63-K66 PolarHBondContact O-N 2.79Å; N63-K66 PolarHBondContact OD1-N 2.99Å; N63-A67 PolarHBondContact O-N 3.47Å
64	P	92.1	Very high	87.8	Confident	14 Å²	14	56.7 Å²	56.7	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-43.4	-177.5	-26.1	35.7	0	0	0	113.2	W41 S61 K66 A67 V68	W41-P64 HydrophobicContact CD2-CB 3.42Å; W41-P64 VanDerWaalsContact CD2-CB 3.42Å; W41-P64 HydrophobicContact CD2-CG 4.39Å; W41-P64 HydrophobicContact CE3-CB 3.63Å; W41-P64 HydrophobicContact CG-CB 4.07Å; W41-P64 HydrophobicContact CH2-CB 3.67Å; W41-P64 HydrophobicContact CH2-CG 4.41Å; W41-P64 HydrophobicContact CZ2-CB 3.47Å; W41-P64 VanDerWaalsContact CZ2-CB 3.47Å; W41-P64 HydrophobicContact CZ2-CG 3.87Å; W41-P64 HydrophobicContact CZ3-CB 3.76Å; S61-P64 WeakPolarHBondContact O-CD 3.47Å; P64-K66 VanDerWaalsContact C-N 3.29Å; P64-K66 PolarHBondContact O-N 3.49Å; P64-A67 PolarHBondContact O-N 3.37Å; P64-A67 VanDerWaalsContact O-N 3.12Å; P64-V68 WeakPolarHBondContact O-CG2 3.37Å; P64-V68 PolarHBondContact O-N 3.34Å
65	T	92.3	Very high	87.1	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-54.9	-45.2	176.8	-59.8	0	0	0	0	111.8	L27 L31 N32 W41 N63 L69	L27-T65 HydrophobicContact CB-CG2 4.22Å; L31-T65 HydrophobicContact CB-CG2 4.31Å; L31-T65 WeakPolarHBondContact CB-OG1 3.45Å; L31-T65 HydrophobicContact CD1-CG2 3.95Å; N32-T65 VanDerWaalsContact OD1-CB 3.25Å; N32-T65 WeakPolarHBondContact OD1-CB 3.39Å; N32-T65 PolarHBondContact OD1-N 3.04Å; N32-T65 PolarHBondContact OD1-OG1 3.25Å; W41-T65 VanDerWaalsContact CB-OG1 3.22Å; W41-T65 WeakPolarHBondContact CB-OG1 3.09Å; N63-T65 PolarHBondContact O-N 2.9Å; N63-T65 PolarHBondContact OD1-N 3.2Å; T65-L69 HydrophobicContact CG2-CD1 4Å; T65-L69 HydrophobicContact CG2-CG 4.5Å; T65-L69 VanDerWaalsContact O-CG 3.24Å; T65-L69 WeakPolarHBondContact O-CG 3.4Å; T65-L69 PolarHBondContact O-N 3.38Å
66	K	88.8	Confident	86.3	Confident	76 Å²	76	63.2 Å²	63.2	33%	0.33	34%	0.342	S	S	.	.	H	α-helix	trans	-63.4	-47.1	178.2	-176.2	-171.2	173	-167	0	111.3	N63 P64 V68 L69 D70	N63-K66 HydrophobicContact CB-CB 4.07Å; N63-K66 PolarHBondContact O-N 2.79Å; N63-K66 PolarHBondContact OD1-N 2.99Å; P64-K66 VanDerWaalsContact C-N 3.29Å; P64-K66 PolarHBondContact O-N 3.49Å; K66-V68 VanDerWaalsContact C-N 3.32Å; K66-V68 PolarHBondContact O-N 2.96Å; K66-L69 PolarHBondContact O-N 2.96Å; K66-D70 VanDerWaalsContact CE-OD2 3.28Å; K66-D70 WeakPolarHBondContact CE-OD2 3.34Å; K66-D70 WeakPolarHBondContact O-CB 3.39Å; K66-D70 VanDerWaalsContact O-CG 3.26Å; K66-D70 PolarHBondContact O-N 3.03Å
67	A	87.3	Confident	85.2	Confident	25 Å²	25	64 Å²	64	21%	0.207	36%	0.362	C	S	.	.	H	α-helix	trans	-60.6	-42.7	-178.6	0	0	0	0	0	111.9	F58 N63 P64 D70 D71	F58-A67 HydrophobicContact CD1-CB 3.79Å; F58-A67 HydrophobicContact CE1-CB 4.15Å; N63-A67 PolarHBondContact O-N 3.47Å; P64-A67 PolarHBondContact O-N 3.37Å; P64-A67 VanDerWaalsContact O-N 3.12Å; A67-D70 PolarHBondContact O-N 2.82Å; A67-D71 WeakPolarHBondContact O-CB 3.32Å; A67-D71 PolarHBondContact O-N 3.25Å
68	V	92.4	Very high	84.4	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.018	36%	0.359	C	S	.	.	H	α-helix	trans	-61.5	-46.8	175.2	170.6	0	0	0	0	111.3	W41 A45 M48 F50 F58 P64 K66 D70 D71 W72	W41-V68 HydrophobicContact CE3-CG2 3.94Å; W41-V68 HydrophobicContact CZ3-CG2 4.01Å; A45-V68 HydrophobicContact CB-CG1 3.79Å; A45-V68 HydrophobicContact CB-CG2 4.04Å; M48-V68 HydrophobicContact SD-CG1 3.71Å; F50-V68 HydrophobicContact CD2-CG1 4.05Å; F50-V68 HydrophobicContact CE2-CG1 3.7Å; F50-V68 HydrophobicContact CZ-CG1 4.38Å; F58-V68 HydrophobicContact CB-CG2 4.35Å; F58-V68 HydrophobicContact CD2-CG2 3.59Å; F58-V68 HydrophobicContact CE2-CG2 3.97Å; F58-V68 HydrophobicContact CG-CG2 3.95Å; P64-V68 WeakPolarHBondContact O-CG2 3.37Å; P64-V68 PolarHBondContact O-N 3.34Å; K66-V68 VanDerWaalsContact C-N 3.32Å; K66-V68 PolarHBondContact O-N 2.96Å; V68-D70 PolarHBondContact O-N 3.47Å; V68-D71 PolarHBondContact O-N 2.94Å; V68-W72 WeakPolarHBondContact O-CB 3.21Å; V68-W72 PolarHBondContact O-N 3.47Å
69	L	88.5	Confident	83.9	Confident	6 Å²	6	63.5 Å²	63.5	3%	0.031	36%	0.357	C	S	.	.	H	α-helix	trans	-65	-38	179.7	-70.1	172.4	0	0	0	113	L16 L27 M48 T65 K66 W72 A73 L84	L16-L69 HydrophobicContact CD2-CD2 4.22Å; L27-L69 HydrophobicContact CD1-CD1 4.04Å; M48-L69 HydrophobicContact CE-CD2 3.7Å; T65-L69 HydrophobicContact CG2-CD1 4Å; T65-L69 HydrophobicContact CG2-CG 4.5Å; T65-L69 VanDerWaalsContact O-CG 3.24Å; T65-L69 WeakPolarHBondContact O-CG 3.4Å; T65-L69 PolarHBondContact O-N 3.38Å; K66-L69 PolarHBondContact O-N 2.96Å; L69-W72 HydrophobicContact CD2-CE3 4.36Å; L69-A73 WeakPolarHBondContact O-CB 3.25Å; L69-A73 PolarHBondContact O-N 2.93Å; L69-A73 VanDerWaalsContact O-N 3.07Å; L69-L84 HydrophobicContact CD2-CD1 3.69Å; L69-L84 HydrophobicContact CD2-CD2 4.33Å
70	D	84.1	Confident	83.7	Confident	68 Å²	68	59.2 Å²	59.2	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-69	-43.1	179.1	-68.6	-14.3	0	0	0	110.7	R24 K66 A67 V68 A74	R24-D70 IonicContact NH1-OD1 3.3Å; R24-D70 PolarHBondContact NH1-OD1 3.11Å; K66-D70 VanDerWaalsContact CE-OD2 3.28Å; K66-D70 WeakPolarHBondContact CE-OD2 3.34Å; K66-D70 WeakPolarHBondContact O-CB 3.39Å; K66-D70 VanDerWaalsContact O-CG 3.26Å; K66-D70 PolarHBondContact O-N 3.03Å; A67-D70 PolarHBondContact O-N 2.82Å; V68-D70 PolarHBondContact O-N 3.47Å; D70-A74 PolarHBondContact O-N 3.14Å; D70-A74 VanDerWaalsContact O-N 3.15Å
71	D	83.5	Confident	83.6	Confident	43 Å²	43	54.8 Å²	54.8	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-70.5	-36.6	177.1	-164.9	32	0	0	0	112.1	F50 F58 A67 V68 A74 R75	F50-D71 HydrophobicContact CE1-CB 4.32Å; F50-D71 WeakPolarHBondContact CE1-OD2 3.25Å; F50-D71 HydrophobicContact CZ-CB 4.24Å; F58-D71 HydrophobicContact CZ-CB 4.15Å; F58-D71 WeakPolarHBondContact CZ-OD2 3.47Å; A67-D71 WeakPolarHBondContact O-CB 3.32Å; A67-D71 PolarHBondContact O-N 3.25Å; V68-D71 PolarHBondContact O-N 2.94Å; D71-A74 PolarHBondContact O-N 3.4Å; D71-R75 WeakPolarHBondContact O-CB 3.18Å; D71-R75 VanDerWaalsContact O-CG 3.24Å; D71-R75 WeakPolarHBondContact O-CG 3.43Å; D71-R75 PolarHBondContact O-N 3.01Å; D71-R75 IonicContact OD1-CZ 2.83Å; D71-R75 IonicContact OD1-NE 3.86Å; D71-R75 PolarHBondContact OD1-NE 2.76Å; D71-R75 IonicContact OD1-NH2 3.08Å; D71-R75 IonicContact OD2-CZ 3.66Å; D71-R75 IonicContact OD2-NE 2.91Å; D71-R75 PolarHBondContact OD2-NE 3.3Å; D71-R75 IonicContact OD2-NH2 2.64Å; D71-R75 PolarHBondContact OD2-NH2 3.45Å
72	W	86.8	Confident	83.5	Confident	11 Å²	11	53.1 Å²	53.1	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-43.1	175.4	-177	56.4	0	0	0	111.9	L16 M48 F50 V68 L69 A74 R75 N76 A79 K83 L84 I87	L16-W72 HydrophobicContact CD1-CE3 4.41Å; L16-W72 HydrophobicContact CD1-CZ3 3.69Å; L16-W72 HydrophobicContact CD2-CD2 4.45Å; L16-W72 HydrophobicContact CD2-CE3 3.3Å; L16-W72 HydrophobicContact CD2-CZ3 3.46Å; L16-W72 VanDerWaalsContact CD2-CZ3 3.46Å; L16-W72 HydrophobicContact CG-CE3 4.41Å; L16-W72 HydrophobicContact CG-CZ3 4.12Å; M48-W72 HydrophobicContact CB-CG 4.34Å; M48-W72 HydrophobicContact CE-CD2 4.27Å; M48-W72 HydrophobicContact CE-CE3 3.86Å; M48-W72 HydrophobicContact CE-CZ3 4.1Å; M48-W72 HydrophobicContact CG-CD2 4.08Å; M48-W72 HydrophobicContact CG-CG 4.19Å; M48-W72 HydrophobicContact SD-CB 4.19Å; M48-W72 HydrophobicContact SD-CD2 3.91Å; M48-W72 HydrophobicContact SD-CE3 4.04Å; M48-W72 HydrophobicContact SD-CG 3.95Å; F50-W72 HydrophobicContact CE2-CB 3.92Å; F50-W72 HydrophobicContact CE2-CG 4.42Å; F50-W72 HydrophobicContact CZ-CB 3.95Å; V68-W72 WeakPolarHBondContact O-CB 3.21Å; V68-W72 PolarHBondContact O-N 3.47Å; L69-W72 HydrophobicContact CD2-CE3 4.36Å; W72-A74 VanDerWaalsContact C-N 3.29Å; W72-A74 PolarHBondContact O-N 3.25Å; W72-R75 PolarHBondContact O-N 3.01Å; W72-N76 PolarHBondContact O-N 3.48Å; W72-A79 HydrophobicContact CD2-CB 4.09Å; W72-A79 HydrophobicContact CE3-CB 4.16Å; W72-A79 HydrophobicContact CH2-CB 4.18Å; W72-A79 HydrophobicContact CZ2-CB 4.14Å; W72-A79 HydrophobicContact CZ3-CB 4.21Å; W72-K83 HydrophobicContact CH2-CB 3.95Å; W72-K83 HydrophobicContact CZ2-CB 4.25Å; W72-L84 HydrophobicContact CH2-CB 4.39Å; W72-L84 HydrophobicContact CZ3-CB 4.12Å; W72-L84 HydrophobicContact CZ3-CD1 4.41Å; W72-I87 HydrophobicContact CH2-CD1 4.1Å; W72-I87 HydrophobicContact CZ2-CD1 3.9Å
73	A	81.8	Confident	83.7	Confident	36 Å²	36	46.3 Å²	46.3	30%	0.298	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-32.6	175.1	0	0	0	0	0	112.9	L16 L69	L16-A73 HydrophobicContact CB-CB 4.48Å; L16-A73 HydrophobicContact CD2-CB 4.06Å; L69-A73 WeakPolarHBondContact O-CB 3.25Å; L69-A73 PolarHBondContact O-N 2.93Å; L69-A73 VanDerWaalsContact O-N 3.07Å
74	A	77.6	Confident	83.8	Confident	85 Å²	85	44.4 Å²	44.4	70%	0.702	25%	0.251	S	S	*	.	H	α-helix	trans	-74.2	-34.7	178.5	0	0	0	0	0	112.7	D70 D71 W72	D70-A74 PolarHBondContact O-N 3.14Å; D70-A74 VanDerWaalsContact O-N 3.15Å; D71-A74 PolarHBondContact O-N 3.4Å; W72-A74 VanDerWaalsContact C-N 3.29Å; W72-A74 PolarHBondContact O-N 3.25Å
75	R	74	Confident	83.6	Confident	138 Å²	138	44.7 Å²	44.7	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-85.6	-33	-175.8	-67.8	169.7	-178.2	-147.1	6.8	113.8	E54 D71 W72	E54-R75 IonicContact OE1-CZ 2.89Å; E54-R75 VanDerWaalsContact OE1-CZ 3.24Å; E54-R75 IonicContact OE1-NH1 3.18Å; E54-R75 PolarHBondContact OE1-NH1 2.77Å; E54-R75 IonicContact OE1-NH2 3.84Å; E54-R75 PolarHBondContact OE1-NH2 2.93Å; D71-R75 WeakPolarHBondContact O-CB 3.18Å; D71-R75 VanDerWaalsContact O-CG 3.24Å; D71-R75 WeakPolarHBondContact O-CG 3.43Å; D71-R75 PolarHBondContact O-N 3.01Å; D71-R75 IonicContact OD1-CZ 2.83Å; D71-R75 IonicContact OD1-NE 3.86Å; D71-R75 PolarHBondContact OD1-NE 2.76Å; D71-R75 IonicContact OD1-NH2 3.08Å; D71-R75 IonicContact OD2-CZ 3.66Å; D71-R75 IonicContact OD2-NE 2.91Å; D71-R75 PolarHBondContact OD2-NE 3.3Å; D71-R75 IonicContact OD2-NH2 2.64Å; D71-R75 PolarHBondContact OD2-NH2 3.45Å; W72-R75 PolarHBondContact O-N 3.01Å
76	N	75	Confident	83.5	Confident	58 Å²	58	47 Å²	47	31%	0.31	27%	0.27	S	S	.	.			trans	-117.8	109.6	-171.3	-165	-27.6	0	0	0	111.1	W72 E78 A79	W72-N76 PolarHBondContact O-N 3.48Å; N76-E78 PolarHBondContact O-N 2.94Å; N76-E78 VanDerWaalsContact O-N 3.16Å; N76-E78 WeakPolarHBondContact OD1-CA 3.32Å; N76-E78 VanDerWaalsContact OD1-CB 3.31Å; N76-E78 WeakPolarHBondContact OD1-CB 3.39Å; N76-E78 PolarHBondContact OD1-N 3.06Å; N76-A79 HydrophobicContact CB-CB 4.34Å; N76-A79 WeakPolarHBondContact O-CB 3.37Å; N76-A79 PolarHBondContact O-N 3.01Å
77	S	67.8	Low	83.6	Confident	129 Å²	129	44.1 Å²	44.1	90%	0.902	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16.7	175.9	54	0	0	0	0	113.6
78	E	74.7	Confident	83.8	Confident	126 Å²	126	43.2 Å²	43.2	59%	0.589	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	7.7	175.1	-50.2	-173.8	168.2	0	0	113	N76 S80 K83	N76-E78 PolarHBondContact O-N 2.94Å; N76-E78 VanDerWaalsContact O-N 3.16Å; N76-E78 WeakPolarHBondContact OD1-CA 3.32Å; N76-E78 VanDerWaalsContact OD1-CB 3.31Å; N76-E78 WeakPolarHBondContact OD1-CB 3.39Å; N76-E78 PolarHBondContact OD1-N 3.06Å; E78-S80 PolarHBondContact O-N 3.05Å; E78-K83 VanDerWaalsContact O-CD 3.24Å; E78-K83 WeakPolarHBondContact O-CD 3.3Å; E78-K83 WeakPolarHBondContact O-CE 3.38Å; E78-K83 PolarHBondContact O-NZ 3.39Å; E78-K83 IonicContact OE2-NZ 2.62Å; E78-K83 PolarHBondContact OE2-NZ 3.01Å
79	A	81.4	Confident	83.6	Confident	8 Å²	8	47.6 Å²	47.6	7%	0.066	27%	0.269	C	S	.	.			trans	-64.3	103.2	174.5	0	0	0	0	0	109.9	L16 W72 N76	L16-A79 HydrophobicContact CB-CB 4.25Å; L16-A79 WeakPolarHBondContact CB-O 3.37Å; L16-A79 PolarHBondContact N-O 3.29Å; W72-A79 HydrophobicContact CD2-CB 4.09Å; W72-A79 HydrophobicContact CE3-CB 4.16Å; W72-A79 HydrophobicContact CH2-CB 4.18Å; W72-A79 HydrophobicContact CZ2-CB 4.14Å; W72-A79 HydrophobicContact CZ3-CB 4.21Å; N76-A79 HydrophobicContact CB-CB 4.34Å; N76-A79 WeakPolarHBondContact O-CB 3.37Å; N76-A79 PolarHBondContact O-N 3.01Å
80	S	84.5	Confident	83.7	Confident	8 Å²	8	53.9 Å²	53.9	6%	0.056	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-121	161.3	-179.7	71.3	0	0	0	0	111.6	G12 I14 E78 G82 K83 L84	G12-S80 VanDerWaalsContact O-CB 3.23Å; G12-S80 WeakPolarHBondContact O-CB 3.06Å; G12-S80 PolarHBondContact O-OG 3.37Å; I14-S80 CarbonylContact O-C 3.51Å; I14-S80 WeakPolarHBondContact O-CA 3.45Å; I14-S80 WeakPolarHBondContact O-CB 3.34Å; E78-S80 PolarHBondContact O-N 3.05Å; S80-G82 PolarHBondContact O-N 3.4Å; S80-K83 PolarHBondContact O-N 3.42Å; S80-K83 PolarHBondContact OG-N 2.84Å; S80-L84 PolarHBondContact O-N 3.32Å
81	V	84.3	Confident	84	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-40.7	175.2	179.5	0	0	0	0	110.6	L11 I14 L19 K83 L84 V85 I104	L11-V81 HydrophobicContact CB-CG1 4.5Å; L11-V81 HydrophobicContact CD2-CG1 4.38Å; I14-V81 HydrophobicContact CB-CB 4.46Å; I14-V81 HydrophobicContact CB-CG2 4.23Å; I14-V81 HydrophobicContact CG2-CG2 3.8Å; I14-V81 PolarHBondContact O-N 2.84Å; L19-V81 HydrophobicContact CD1-CG2 4.17Å; L19-V81 HydrophobicContact CD2-CG1 3.96Å; L19-V81 HydrophobicContact CD2-CG2 3.81Å; L19-V81 HydrophobicContact CG-CG2 3.7Å; V81-K83 PolarHBondContact O-N 2.77Å; V81-L84 PolarHBondContact O-N 2.91Å; V81-V85 WeakPolarHBondContact O-CG2 3.31Å; V81-V85 PolarHBondContact O-N 2.73Å; V81-I104 HydrophobicContact CG1-CG2 3.58Å
82	G	84.9	Confident	84.2	Confident	13 Å²	13	57.4 Å²	57.4	13%	0.134	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-43.8	175.8	0	0	0	0	0	112.6	L11 S80 L84 V85 S86	L11-G82 PolarHBondContact O-N 2.8Å; S80-G82 PolarHBondContact O-N 3.4Å; G82-L84 PolarHBondContact O-N 3.18Å; G82-V85 PolarHBondContact O-N 2.93Å; G82-S86 PolarHBondContact O-N 2.93Å; G82-S86 PolarHBondContact O-OG 3.43Å
83	K	87.6	Confident	84.3	Confident	74 Å²	74	57.4 Å²	57.4	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-38.8	176.6	-71.4	-165.8	-168.9	-170.7	0	112.6	W72 E78 S80 V81 V85 S86 I87	W72-K83 HydrophobicContact CH2-CB 3.95Å; W72-K83 HydrophobicContact CZ2-CB 4.25Å; E78-K83 VanDerWaalsContact O-CD 3.24Å; E78-K83 WeakPolarHBondContact O-CD 3.3Å; E78-K83 WeakPolarHBondContact O-CE 3.38Å; E78-K83 PolarHBondContact O-NZ 3.39Å; E78-K83 IonicContact OE2-NZ 2.62Å; E78-K83 PolarHBondContact OE2-NZ 3.01Å; S80-K83 PolarHBondContact O-N 3.42Å; S80-K83 PolarHBondContact OG-N 2.84Å; V81-K83 PolarHBondContact O-N 2.77Å; K83-V85 VanDerWaalsContact C-N 3.31Å; K83-V85 PolarHBondContact O-N 3.41Å; K83-S86 PolarHBondContact O-N 3.32Å; K83-I87 VanDerWaalsContact O-CG1 3.26Å; K83-I87 WeakPolarHBondContact O-CG1 3.47Å; K83-I87 PolarHBondContact O-N 3.35Å
84	L	89.8	Confident	84.5	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-44.8	174.3	178.3	65	0	0	0	111	L16 L19 L27 M48 L69 W72 S80 V81 G82 I87 L88	L16-L84 HydrophobicContact CD1-CB 3.78Å; L16-L84 HydrophobicContact CD1-CD2 3.86Å; L16-L84 HydrophobicContact CD1-CG 4.35Å; L19-L84 HydrophobicContact CD1-CD2 3.71Å; L27-L84 HydrophobicContact CD1-CD2 3.92Å; M48-L84 HydrophobicContact CE-CD1 3.49Å; M48-L84 VanDerWaalsContact CE-CD1 3.49Å; L69-L84 HydrophobicContact CD2-CD1 3.69Å; L69-L84 HydrophobicContact CD2-CD2 4.33Å; W72-L84 HydrophobicContact CH2-CB 4.39Å; W72-L84 HydrophobicContact CZ3-CB 4.12Å; W72-L84 HydrophobicContact CZ3-CD1 4.41Å; S80-L84 PolarHBondContact O-N 3.32Å; V81-L84 PolarHBondContact O-N 2.91Å; G82-L84 PolarHBondContact O-N 3.18Å; L84-I87 PolarHBondContact O-N 3.03Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CG 3.21Å; L84-L88 PolarHBondContact O-N 3.17Å
85	V	88.8	Confident	84.9	Confident	19 Å²	19	60.9 Å²	60.9	12%	0.115	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-45.6	177.4	172.2	0	0	0	0	110.8	L11 V81 G82 K83 I87 L88 E89 V97	L11-V85 HydrophobicContact CD1-CG2 4.47Å; V81-V85 WeakPolarHBondContact O-CG2 3.31Å; V81-V85 PolarHBondContact O-N 2.73Å; G82-V85 PolarHBondContact O-N 2.93Å; K83-V85 VanDerWaalsContact C-N 3.31Å; K83-V85 PolarHBondContact O-N 3.41Å; V85-I87 VanDerWaalsContact C-N 3.32Å; V85-I87 PolarHBondContact O-N 2.98Å; V85-L88 PolarHBondContact O-N 3.37Å; V85-L88 VanDerWaalsContact O-N 3.15Å; V85-E89 HydrophobicContact CG1-CG 4.48Å; V85-E89 WeakPolarHBondContact O-CG 3.4Å; V85-E89 PolarHBondContact O-N 3.14Å; V85-V97 HydrophobicContact CG1-CG1 3.78Å; V85-V97 HydrophobicContact CG1-CG2 4.27Å
86	S	89.6	Confident	85.6	Confident	56 Å²	56	54.3 Å²	54.3	39%	0.392	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-41.6	175.9	-59.2	0	0	0	0	112.5	G82 K83 L88 E89 E90	G82-S86 PolarHBondContact O-N 2.93Å; G82-S86 PolarHBondContact O-OG 3.43Å; K83-S86 PolarHBondContact O-N 3.32Å; S86-L88 VanDerWaalsContact C-N 3.35Å; S86-L88 PolarHBondContact O-N 3.48Å; S86-E89 PolarHBondContact O-N 3.2Å; S86-E90 WeakPolarHBondContact O-CG 3.33Å; S86-E90 PolarHBondContact O-N 3.45Å
87	I	91.2	Very high	86.2	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.077	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-41.9	176.1	-69.2	166.2	0	0	0	111	V44 T47 M48 W72 K83 L84 V85 E89 E90 V91	V44-I87 HydrophobicContact CG1-CG2 4.05Å; T47-I87 HydrophobicContact CG2-CB 4.41Å; T47-I87 HydrophobicContact CG2-CG1 4.1Å; T47-I87 HydrophobicContact CG2-CG2 3.9Å; M48-I87 HydrophobicContact CE-CD1 4.28Å; M48-I87 HydrophobicContact CE-CG2 4.47Å; M48-I87 HydrophobicContact CG-CD1 3.73Å; W72-I87 HydrophobicContact CH2-CD1 4.1Å; W72-I87 HydrophobicContact CZ2-CD1 3.9Å; K83-I87 VanDerWaalsContact O-CG1 3.26Å; K83-I87 WeakPolarHBondContact O-CG1 3.47Å; K83-I87 PolarHBondContact O-N 3.35Å; L84-I87 PolarHBondContact O-N 3.03Å; V85-I87 VanDerWaalsContact C-N 3.32Å; V85-I87 PolarHBondContact O-N 2.98Å; I87-E89 VanDerWaalsContact C-N 3.31Å; I87-E89 PolarHBondContact O-N 3.2Å; I87-E90 PolarHBondContact O-N 3.39Å; I87-V91 HydrophobicContact CG2-CG2 4.39Å; I87-V91 WeakPolarHBondContact O-CB 3.18Å; I87-V91 WeakPolarHBondContact O-CG2 3.44Å; I87-V91 PolarHBondContact O-N 3.4Å
88	L	90.8	Very high	87	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-34.5	177.2	-68.4	171.9	0	0	0	112.2	L27 L31 V44 L84 V85 S86 E92 R93 I96 V97	L27-L88 HydrophobicContact CD2-CD1 4.01Å; L31-L88 HydrophobicContact CD1-CD2 4.05Å; V44-L88 HydrophobicContact CG2-CD2 4.12Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CG 3.21Å; L84-L88 PolarHBondContact O-N 3.17Å; V85-L88 PolarHBondContact O-N 3.37Å; V85-L88 VanDerWaalsContact O-N 3.15Å; S86-L88 VanDerWaalsContact C-N 3.35Å; S86-L88 PolarHBondContact O-N 3.48Å; L88-E92 PolarHBondContact O-N 3.27Å; L88-R93 PolarHBondContact O-N 3.3Å; L88-I96 HydrophobicContact CD1-CG2 4.24Å; L88-I96 HydrophobicContact CD2-CD1 4.48Å; L88-V97 HydrophobicContact CB-CG2 3.74Å; L88-V97 HydrophobicContact CD1-CG2 4.24Å
89	E	89.3	Confident	87.5	Confident	95 Å²	95	51.2 Å²	51.2	44%	0.444	26%	0.257	S	S	.	.	H	α-helix	trans	-68.8	-40.9	173.8	-71.4	177.2	167.1	0	0	112.3	V85 S86 I87 V91 E92 V97	V85-E89 HydrophobicContact CG1-CG 4.48Å; V85-E89 WeakPolarHBondContact O-CG 3.4Å; V85-E89 PolarHBondContact O-N 3.14Å; S86-E89 PolarHBondContact O-N 3.2Å; I87-E89 VanDerWaalsContact C-N 3.31Å; I87-E89 PolarHBondContact O-N 3.2Å; E89-V91 VanDerWaalsContact C-N 3.29Å; E89-V91 PolarHBondContact O-N 3.4Å; E89-E92 PolarHBondContact O-N 2.85Å; E89-E92 VanDerWaalsContact O-N 3.16Å; E89-V97 HydrophobicContact CG-CG2 4.38Å
90	E	91	Very high	87.6	Confident	137 Å²	137	50.9 Å²	50.9	64%	0.64	26%	0.255	S	S	*	.	H	α-helix	trans	-63.8	-35.7	175.3	-76.3	177.5	-172.1	0	0	112.2	T47 S86 I87 E92	T47-E90 VanDerWaalsContact CG2-OE2 3.28Å; T47-E90 WeakPolarHBondContact CG2-OE2 3.36Å; S86-E90 WeakPolarHBondContact O-CG 3.33Å; S86-E90 PolarHBondContact O-N 3.45Å; I87-E90 PolarHBondContact O-N 3.39Å; E90-E92 PolarHBondContact O-N 2.94Å
91	V	90.8	Very high	87.5	Confident	17 Å²	17	56 Å²	56	10%	0.103	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	11.4	178.2	179.5	0	0	0	0	111.7	A39 A43 V44 T47 I87 E89 R93	A39-V91 HydrophobicContact CB-CG1 3.16Å; A43-V91 HydrophobicContact CB-CG1 3.9Å; V44-V91 HydrophobicContact CG2-CG1 4.08Å; V44-V91 HydrophobicContact CG2-CG2 4.5Å; T47-V91 WeakPolarHBondContact OG1-CG2 3.41Å; I87-V91 HydrophobicContact CG2-CG2 4.39Å; I87-V91 WeakPolarHBondContact O-CB 3.18Å; I87-V91 WeakPolarHBondContact O-CG2 3.44Å; I87-V91 PolarHBondContact O-N 3.4Å; E89-V91 VanDerWaalsContact C-N 3.29Å; E89-V91 PolarHBondContact O-N 3.4Å; V91-R93 HydrophobicContact CG1-CG 4.43Å; V91-R93 PolarHBondContact O-N 3.49Å
92	E	87.7	Confident	87.1	Confident	169 Å²	169	59 Å²	59	79%	0.79	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	21.4	178.2	-56.2	-167.9	141.9	0	0	115.1	L88 E89 E90 K94	L88-E92 PolarHBondContact O-N 3.27Å; E89-E92 PolarHBondContact O-N 2.85Å; E89-E92 VanDerWaalsContact O-N 3.16Å; E90-E92 PolarHBondContact O-N 2.94Å; E92-K94 VanDerWaalsContact C-N 3.33Å; E92-K94 PolarHBondContact O-N 3.46Å
93	R	87.7	Confident	86.7	Confident	10 Å²	10	60.2 Å²	60.2	4%	0.038	30%	0.3	C	S	.	.			trans	-95	52.2	176.9	-68.3	-58.5	-55.6	-91.3	4.3	112.5	F30 L31 A39 L88 V91 D95 I96	F30-R93 PolarHBondContact O-NH1 3.33Å; F30-R93 PolarHBondContact O-NH2 3.35Å; L31-R93 HydrophobicContact CD2-CG 4.4Å; A39-R93 HydrophobicContact CB-CG 4.47Å; A39-R93 PolarHBondContact O-NH1 2.81Å; L88-R93 PolarHBondContact O-N 3.3Å; V91-R93 HydrophobicContact CG1-CG 4.43Å; V91-R93 PolarHBondContact O-N 3.49Å; R93-D95 VanDerWaalsContact CA-OD1 3.23Å; R93-D95 WeakPolarHBondContact CA-OD1 3.4Å; R93-D95 IonicContact CZ-OD1 3Å; R93-D95 IonicContact CZ-OD2 3.82Å; R93-D95 IonicContact NE-OD1 3.76Å; R93-D95 PolarHBondContact NE-OD1 2.92Å; R93-D95 IonicContact NE-OD2 2.89Å; R93-D95 PolarHBondContact NE-OD2 3.29Å; R93-D95 IonicContact NH2-OD1 2.9Å; R93-D95 IonicContact NH2-OD2 3.83Å; R93-D95 PolarHBondContact NH2-OD2 3.4Å; R93-D95 PolarHBondContact O-N 3.45Å; R93-I96 HydrophobicContact CB-CD1 3.91Å; R93-I96 HydrophobicContact CB-CG1 4.14Å; R93-I96 HydrophobicContact CG-CD1 4.25Å; R93-I96 VanDerWaalsContact CZ-CD1 3.4Å; R93-I96 VanDerWaalsContact NH2-CG1 3.27Å; R93-I96 PolarHBondContact O-N 2.97Å
94	K	86	Confident	86.1	Confident	125 Å²	125	57.3 Å²	57.3	54%	0.543	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-27.3	177.9	-64.6	-179.4	-178.1	175	0	112.6	E92 I96 V97 E98	E92-K94 VanDerWaalsContact C-N 3.33Å; E92-K94 PolarHBondContact O-N 3.46Å; K94-I96 VanDerWaalsContact C-N 3.31Å; K94-I96 PolarHBondContact O-N 3.22Å; K94-V97 PolarHBondContact O-N 2.74Å; K94-V97 VanDerWaalsContact O-N 3.16Å; K94-E98 WeakPolarHBondContact O-CG 3.49Å; K94-E98 PolarHBondContact O-N 2.73Å
95	D	85.8	Confident	85.1	Confident	69 Å²	69	58.7 Å²	58.7	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-54.8	-45.7	172.9	62.4	-50.5	0	0	0	112	R93 V97 D99	R93-D95 VanDerWaalsContact CA-OD1 3.23Å; R93-D95 WeakPolarHBondContact CA-OD1 3.4Å; R93-D95 IonicContact CZ-OD1 3Å; R93-D95 IonicContact CZ-OD2 3.82Å; R93-D95 IonicContact NE-OD1 3.76Å; R93-D95 PolarHBondContact NE-OD1 2.92Å; R93-D95 IonicContact NE-OD2 2.89Å; R93-D95 PolarHBondContact NE-OD2 3.29Å; R93-D95 IonicContact NH2-OD1 2.9Å; R93-D95 IonicContact NH2-OD2 3.83Å; R93-D95 PolarHBondContact NH2-OD2 3.4Å; R93-D95 PolarHBondContact O-N 3.45Å; D95-V97 VanDerWaalsContact C-N 3.34Å; D95-D99 WeakPolarHBondContact O-CB 3.34Å; D95-D99 PolarHBondContact O-N 2.64Å
96	I	88.6	Confident	83.9	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-42.2	178.3	-59	-176.7	0	0	0	110.4	L27 F30 L31 L88 R93 K94 D99 L100	L27-I96 HydrophobicContact CD2-CG2 3.64Å; F30-I96 HydrophobicContact CB-CD1 3.63Å; F30-I96 HydrophobicContact CB-CG1 3.85Å; F30-I96 HydrophobicContact CG-CD1 4.42Å; F30-I96 HydrophobicContact CG-CG1 4.11Å; L31-I96 HydrophobicContact CD1-CD1 4.23Å; L31-I96 HydrophobicContact CD2-CD1 3.54Å; L31-I96 HydrophobicContact CG-CD1 3.65Å; L88-I96 HydrophobicContact CD1-CG2 4.24Å; L88-I96 HydrophobicContact CD2-CD1 4.48Å; R93-I96 HydrophobicContact CB-CD1 3.91Å; R93-I96 HydrophobicContact CB-CG1 4.14Å; R93-I96 HydrophobicContact CG-CD1 4.25Å; R93-I96 VanDerWaalsContact CZ-CD1 3.4Å; R93-I96 VanDerWaalsContact NH2-CG1 3.27Å; R93-I96 PolarHBondContact O-N 2.97Å; K94-I96 VanDerWaalsContact C-N 3.31Å; K94-I96 PolarHBondContact O-N 3.22Å; I96-D99 PolarHBondContact O-N 3.33Å; I96-L100 HydrophobicContact CG2-CD1 3.57Å; I96-L100 HydrophobicContact CG2-CG 4.13Å; I96-L100 VanDerWaalsContact O-CB 3.28Å; I96-L100 WeakPolarHBondContact O-CB 3.12Å; I96-L100 VanDerWaalsContact O-CG 3.29Å; I96-L100 WeakPolarHBondContact O-CG 3.24Å; I96-L100 PolarHBondContact O-N 2.82Å
97	V	87.4	Confident	82.7	Confident	21 Å²	21	65.6 Å²	65.6	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-62.9	-47.6	-178.5	178.7	0	0	0	0	109.6	V85 L88 E89 K94 D95 L100 Q101	V85-V97 HydrophobicContact CG1-CG1 3.78Å; V85-V97 HydrophobicContact CG1-CG2 4.27Å; L88-V97 HydrophobicContact CB-CG2 3.74Å; L88-V97 HydrophobicContact CD1-CG2 4.24Å; E89-V97 HydrophobicContact CG-CG2 4.38Å; K94-V97 PolarHBondContact O-N 2.74Å; K94-V97 VanDerWaalsContact O-N 3.16Å; D95-V97 VanDerWaalsContact C-N 3.34Å; V97-L100 PolarHBondContact O-N 2.67Å; V97-Q101 WeakPolarHBondContact O-CA 3.26Å; V97-Q101 WeakPolarHBondContact O-CB 3.17Å; V97-Q101 PolarHBondContact O-N 2.69Å
98	E	85.5	Confident	81.5	Confident	132 Å²	132	65.3 Å²	65.3	62%	0.617	33%	0.327	S	S	*	.	H	α-helix	trans	-61.2	-44.9	178.1	-70.6	175.8	-170.8	0	0	112.2	K94 L100 P102	K94-E98 WeakPolarHBondContact O-CG 3.49Å; K94-E98 PolarHBondContact O-N 2.73Å; E98-L100 PolarHBondContact O-N 2.89Å; E98-P102 WeakPolarHBondContact O-CD 3.31Å
99	D	85	Confident	80.4	Confident	95 Å²	95	65 Å²	65	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-31.5	-179.5	-87.7	-1.8	0	0	0	113.6	F30 D95 I96	F30-D99 HydrophobicContact CZ-CB 4.45Å; D95-D99 WeakPolarHBondContact O-CB 3.34Å; D95-D99 PolarHBondContact O-N 2.64Å; I96-D99 PolarHBondContact O-N 3.33Å
100	L	83.7	Confident	79.5	Confident	2 Å²	2	68 Å²	68	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-99	-16.8	-177.1	-60.2	-174.7	0	0	0	113.4	V23 K26 L27 F30 I96 V97 E98 P102 L103 I104	V23-L100 HydrophobicContact CG1-CD1 4.22Å; K26-L100 HydrophobicContact CB-CD2 3.76Å; K26-L100 HydrophobicContact CD-CD2 3.56Å; K26-L100 HydrophobicContact CG-CD2 4.33Å; L27-L100 HydrophobicContact CD2-CD1 3.5Å; L27-L100 HydrophobicContact CG-CD1 3.67Å; F30-L100 HydrophobicContact CE2-CD2 4.45Å; I96-L100 HydrophobicContact CG2-CD1 3.57Å; I96-L100 HydrophobicContact CG2-CG 4.13Å; I96-L100 VanDerWaalsContact O-CB 3.28Å; I96-L100 WeakPolarHBondContact O-CB 3.12Å; I96-L100 VanDerWaalsContact O-CG 3.29Å; I96-L100 WeakPolarHBondContact O-CG 3.24Å; I96-L100 PolarHBondContact O-N 2.82Å; V97-L100 PolarHBondContact O-N 2.67Å; E98-L100 PolarHBondContact O-N 2.89Å; L100-P102 VanDerWaalsContact C-CD 3.5Å; L100-L103 HydrophobicContact CD2-CD1 4.18Å; L100-L103 PolarHBondContact O-N 3.12Å; L100-L103 VanDerWaalsContact O-N 3.07Å; L100-I104 HydrophobicContact CB-CD1 3.91Å; L100-I104 HydrophobicContact CB-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.27Å; L100-I104 WeakPolarHBondContact O-CG1 3.31Å; L100-I104 PolarHBondContact O-N 3.41Å
101	Q	81.4	Confident	78.4	Confident	116 Å²	116	66.8 Å²	66.8	54%	0.542	33%	0.325	S	S	.	.	H	α-helix	trans	-48	-49.7	177.5	-175.2	-171.9	-3.3	0	0	113.3	V97 L103 I104 A105	V97-Q101 WeakPolarHBondContact O-CA 3.26Å; V97-Q101 WeakPolarHBondContact O-CB 3.17Å; V97-Q101 PolarHBondContact O-N 2.69Å; Q101-L103 VanDerWaalsContact C-N 3.33Å; Q101-L103 PolarHBondContact O-N 2.89Å; Q101-I104 PolarHBondContact O-N 2.92Å; Q101-A105 VanDerWaalsContact O-CB 3.3Å; Q101-A105 WeakPolarHBondContact O-CB 3.48Å; Q101-A105 PolarHBondContact O-N 3.1Å
102	P	77.4	Confident	77.3	Confident	63 Å²	63	68.6 Å²	68.6	41%	0.409	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-38.5	-179.7	23	-32.6	0	0	0	112	E98 L100 D106	E98-P102 WeakPolarHBondContact O-CD 3.31Å; L100-P102 VanDerWaalsContact C-CD 3.5Å; P102-D106 WeakPolarHBondContact O-CB 3.34Å; P102-D106 PolarHBondContact O-N 3.42Å
103	L	75.4	Confident	76.3	Confident	38 Å²	38	63.4 Å²	63.4	20%	0.199	31%	0.308	C	S	.	.	I	π-helix	trans	-68.6	-37.8	178.2	-66.1	172	0	0	0	112.2	V23 K26 L100 Q101 D108	V23-L103 HydrophobicContact CG2-CB 3.94Å; K26-L103 HydrophobicContact CD-CD1 3.92Å; L100-L103 HydrophobicContact CD2-CD1 4.18Å; L100-L103 PolarHBondContact O-N 3.12Å; L100-L103 VanDerWaalsContact O-N 3.07Å; Q101-L103 VanDerWaalsContact C-N 3.33Å; Q101-L103 PolarHBondContact O-N 2.89Å; L103-D108 PolarHBondContact O-N 2.67Å
104	I	76.4	Confident	75.5	Confident	14 Å²	14	66.9 Å²	66.9	7%	0.072	33%	0.325	C	S	.	.	I	π-helix	trans	-68.7	-50.7	177.4	-67	167.1	0	0	0	109.8	L11 L19 V23 V81 L100 Q101 D108 V109	L11-I104 HydrophobicContact CD2-CG2 4.18Å; L19-I104 HydrophobicContact CD2-CG1 4.02Å; L19-I104 HydrophobicContact CD2-CG2 4.21Å; V23-I104 HydrophobicContact CG1-CD1 4.27Å; V23-I104 HydrophobicContact CG1-CG1 3.91Å; V23-I104 HydrophobicContact CG2-CG1 4.39Å; V81-I104 HydrophobicContact CG1-CG2 3.58Å; L100-I104 HydrophobicContact CB-CD1 3.91Å; L100-I104 HydrophobicContact CB-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.27Å; L100-I104 WeakPolarHBondContact O-CG1 3.31Å; L100-I104 PolarHBondContact O-N 3.41Å; Q101-I104 PolarHBondContact O-N 2.92Å; I104-D108 PolarHBondContact O-N 2.9Å; I104-V109 HydrophobicContact CG2-CG2 4Å; I104-V109 VanDerWaalsContact O-CB 3.26Å; I104-V109 WeakPolarHBondContact O-CB 3.32Å; I104-V109 WeakPolarHBondContact O-CG2 3.42Å; I104-V109 PolarHBondContact O-N 3.47Å
105	A	68.1	Low	74.5	Confident	33 Å²	33	63.4 Å²	63.4	27%	0.273	31%	0.314	S	S	.	.	I	π-helix	trans	-74.9	-44.9	-173.3	0	0	0	0	0	113.6	Q101	Q101-A105 VanDerWaalsContact O-CB 3.3Å; Q101-A105 WeakPolarHBondContact O-CB 3.48Å; Q101-A105 PolarHBondContact O-N 3.1Å
106	D	63.4	Low	73.6	Confident	111 Å²	111	63.7 Å²	63.7	59%	0.594	32%	0.315	S	S	*	.	I	π-helix	trans	-81.9	-34.8	-170.1	-65.7	-30	0	0	0	112.9	P102 R110	P102-D106 WeakPolarHBondContact O-CB 3.34Å; P102-D106 PolarHBondContact O-N 3.42Å; D106-R110 WeakPolarHBondContact O-CB 3.33Å
107	E	63.3	Low	72.5	Confident	110 Å²	110	71.2 Å²	71.2	51%	0.514	35%	0.348	S	S	.	.	I	π-helix	trans	-104.4	-58.2	-175	-64.7	-169.3	169.5	0	0	112.6	K111	E107-K111 WeakPolarHBondContact O-CB 3.4Å; E107-K111 PolarHBondContact O-N 2.92Å; E107-K111 VanDerWaalsContact O-N 3.14Å
108	D	66.4	Low	71.3	Confident	8 Å²	8	77.1 Å²	77.1	4%	0.043	37%	0.372	C	S	.	.	I	π-helix	trans	-75	-48.9	-167.3	-69.7	-7.2	0	0	0	112	N20 V23 L103 I104 Y112	N20-D108 WeakPolarHBondContact CB-OD1 3.35Å; N20-D108 WeakPolarHBondContact CB-OD2 3.43Å; N20-D108 PolarHBondContact N-OD2 3.09Å; V23-D108 WeakPolarHBondContact CG2-OD2 3.49Å; L103-D108 PolarHBondContact O-N 2.67Å; I104-D108 PolarHBondContact O-N 2.9Å; D108-Y112 WeakPolarHBondContact O-CB 3.46Å; D108-Y112 PolarHBondContact O-N 2.67Å
109	V	68.3	Low	69.9	Low	1 Å²	1	78.4 Å²	78.4	1%	0.006	38%	0.375	C	S	.	.	I	π-helix	trans	-68.1	-45.4	-178.3	163.6	0	0	0	0	111.4	V9 L11 I14 I104 Y112 L113	V9-V109 HydrophobicContact CB-CG1 3.71Å; V9-V109 HydrophobicContact CG1-CG1 3.15Å; V9-V109 HydrophobicContact CG2-CG1 4.05Å; L11-V109 HydrophobicContact CD2-CG2 3.58Å; I14-V109 HydrophobicContact CD1-CB 3.83Å; I14-V109 HydrophobicContact CD1-CG1 3.32Å; I14-V109 HydrophobicContact CD1-CG2 3.52Å; I104-V109 HydrophobicContact CG2-CG2 4Å; I104-V109 VanDerWaalsContact O-CB 3.26Å; I104-V109 WeakPolarHBondContact O-CB 3.32Å; I104-V109 WeakPolarHBondContact O-CG2 3.42Å; I104-V109 PolarHBondContact O-N 3.47Å; V109-Y112 PolarHBondContact O-N 3.41Å; V109-L113 HydrophobicContact CG1-CD1 4.33Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.24Å
110	R	69.3	Low	68.5	Low	158 Å²	158	77.7 Å²	77.7	60%	0.596	38%	0.383	S	S	*	.	H	α-helix	trans	-61	-47.4	177.1	-175.7	177.7	178	154.8	1.1	111.7	D106 Y112 L113 E114	D106-R110 WeakPolarHBondContact O-CB 3.33Å; R110-Y112 VanDerWaalsContact C-N 3.31Å; R110-Y112 PolarHBondContact O-N 3.04Å; R110-L113 PolarHBondContact O-N 2.91Å; R110-E114 IonicContact NE-OE1 3.15Å; R110-E114 PolarHBondContact NE-OE1 3.18Å; R110-E114 VanDerWaalsContact NE-OE1 3.15Å; R110-E114 WeakPolarHBondContact O-CB 3.22Å; R110-E114 WeakPolarHBondContact O-CG 3.33Å; R110-E114 PolarHBondContact O-N 3.39Å
111	K	68.1	Low	66.9	Low	110 Å²	110	85 Å²	85	48%	0.478	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-38.9	178.5	-173	176.9	-177.5	-179.7	0	111.9	E107 T115	E107-K111 WeakPolarHBondContact O-CB 3.4Å; E107-K111 PolarHBondContact O-N 2.92Å; E107-K111 VanDerWaalsContact O-N 3.14Å; K111-T115 WeakPolarHBondContact O-CB 3.37Å; K111-T115 PolarHBondContact O-N 2.56Å; K111-T115 VanDerWaalsContact O-N 3.14Å; K111-T115 PolarHBondContact O-OG1 3.48Å
112	Y	68	Low	65.1	Low	56 Å²	56	84.7 Å²	84.7	22%	0.22	43%	0.425	C	S	.	.	H	α-helix	trans	-64.6	-47.2	175	-178.2	-106.2	0	0	0	112.2	I14 P15 F17 A18 D108 V109 R110 T115 L116	I14-Y112 HydrophobicContact CG1-CD1 4.21Å; I14-Y112 HydrophobicContact CG1-CE1 4.46Å; I14-Y112 HydrophobicContact CG2-CD1 3.97Å; I14-Y112 HydrophobicContact CG2-CE1 4.36Å; I14-Y112 HydrophobicContact CG2-CG 4.42Å; P15-Y112 VanDerWaalsContact CD-CZ 3.42Å; P15-Y112 WeakPolarHBondContact CD-OH 3.49Å; P15-Y112 HydrophobicContact CG-CE1 4.47Å; P15-Y112 HydrophobicContact CG-CE2 4.02Å; F17-Y112 HydrophobicContact CE2-CE2 4.38Å; A18-Y112 HydrophobicContact CB-CD2 3.92Å; A18-Y112 HydrophobicContact CB-CE2 4.48Å; A18-Y112 HydrophobicContact CB-CG 4.07Å; D108-Y112 WeakPolarHBondContact O-CB 3.46Å; D108-Y112 PolarHBondContact O-N 2.67Å; V109-Y112 PolarHBondContact O-N 3.41Å; R110-Y112 VanDerWaalsContact C-N 3.31Å; R110-Y112 PolarHBondContact O-N 3.04Å; Y112-T115 WeakPolarHBondContact O-CB 3.25Å; Y112-T115 PolarHBondContact O-N 3.12Å; Y112-L116 HydrophobicContact CD1-CD1 4.13Å; Y112-L116 HydrophobicContact CE1-CD1 3.57Å; Y112-L116 HydrophobicContact CE1-CG 4.21Å; Y112-L116 PolarHBondContact O-N 3.48Å
113	L	68	Low	63.8	Low	59 Å²	59	87.2 Å²	87.2	31%	0.309	44%	0.441	S	S	.	.	H	α-helix	trans	-66.1	-39.4	179	-70.1	-180	0	0	0	113.3	V9 V109 R110 T115 L116 K117	V9-L113 HydrophobicContact CG1-CD1 3.58Å; V109-L113 HydrophobicContact CG1-CD1 4.33Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.24Å; R110-L113 PolarHBondContact O-N 2.91Å; L113-T115 PolarHBondContact O-N 3.18Å; L113-L116 HydrophobicContact CD2-CD1 4.34Å; L113-L116 PolarHBondContact O-N 3.01Å; L113-K117 PolarHBondContact O-N 3.08Å
114	E	70.7	Confident	62.8	Low	84 Å²	84	92.5 Å²	92.5	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-61.5	-36	173.3	-74.5	178.6	-172	0	0	111.5	R110 K117 K118	R110-E114 IonicContact NE-OE1 3.15Å; R110-E114 PolarHBondContact NE-OE1 3.18Å; R110-E114 VanDerWaalsContact NE-OE1 3.15Å; R110-E114 WeakPolarHBondContact O-CB 3.22Å; R110-E114 WeakPolarHBondContact O-CG 3.33Å; R110-E114 PolarHBondContact O-N 3.39Å; E114-K117 PolarHBondContact O-N 2.88Å; E114-K118 WeakPolarHBondContact O-CG 3.19Å; E114-K118 PolarHBondContact O-N 2.76Å; E114-K118 VanDerWaalsContact O-N 3.08Å
115	T	64.4	Low	61.6	Low	51 Å²	51	100 Å²	100	31%	0.313	51%	0.509	S	S	.	.	H	α-helix	trans	-67	-39.9	174.8	-57.1	0	0	0	0	111.8	K111 Y112 L113 K119	K111-T115 WeakPolarHBondContact O-CB 3.37Å; K111-T115 PolarHBondContact O-N 2.56Å; K111-T115 VanDerWaalsContact O-N 3.14Å; K111-T115 PolarHBondContact O-OG1 3.48Å; Y112-T115 WeakPolarHBondContact O-CB 3.25Å; Y112-T115 PolarHBondContact O-N 3.12Å; L113-T115 PolarHBondContact O-N 3.18Å; T115-K119 WeakPolarHBondContact O-CG 3.2Å; T115-K119 PolarHBondContact O-N 3.28Å
116	L	65.7	Low	60.4	Low	76 Å²	76	105 Å²	105	40%	0.398	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-42.1	175.1	-71.4	-180	0	0	0	112.2	Y112 L113 K119 A120	Y112-L116 HydrophobicContact CD1-CD1 4.13Å; Y112-L116 HydrophobicContact CE1-CD1 3.57Å; Y112-L116 HydrophobicContact CE1-CG 4.21Å; Y112-L116 PolarHBondContact O-N 3.48Å; L113-L116 HydrophobicContact CD2-CD1 4.34Å; L113-L116 PolarHBondContact O-N 3.01Å; L116-K119 PolarHBondContact O-N 3.29Å; L116-A120 PolarHBondContact O-N 3.3Å
117	K	67.3	Low	59.5	Low	157 Å²	157	105 Å²	105	68%	0.683	54%	0.543	S	S	*	.	H	α-helix	trans	-62	-44.2	177	-73.1	180	-179.7	179.3	0	112	L113 E114 K119 A120	L113-K117 PolarHBondContact O-N 3.08Å; E114-K117 PolarHBondContact O-N 2.88Å; K117-K119 PolarHBondContact O-N 3.23Å; K117-A120 PolarHBondContact O-N 3.01Å; K117-A120 VanDerWaalsContact O-N 3.12Å
118	K	62.3	Low	58.6	Low	145 Å²	145	109.2 Å²	109.2	63%	0.63	56%	0.562	S	S	*	*	H	α-helix	trans	-62.6	-27.4	176.1	-73.2	174.9	-179.1	176.1	0	113.5	E114	E114-K118 WeakPolarHBondContact O-CG 3.19Å; E114-K118 PolarHBondContact O-N 2.76Å; E114-K118 VanDerWaalsContact O-N 3.08Å
119	K	54.5	Low	57.5	Low	160 Å²	160	115.1 Å²	115.1	70%	0.696	60%	0.598	S	S	*	*	H	α-helix	trans	-80.4	-21.1	176.2	-73.8	177.6	178.4	-175.9	0	113.5	T115 L116 K117	T115-K119 WeakPolarHBondContact O-CG 3.2Å; T115-K119 PolarHBondContact O-N 3.28Å; L116-K119 PolarHBondContact O-N 3.29Å; K117-K119 PolarHBondContact O-N 3.23Å
120	A	56.7	Low	56	Low	80 Å²	80	120.7 Å²	120.7	66%	0.661	63%	0.628	S	S	*	*	H	α-helix	trans	-82.9	-10.8	-178.6	0	0	0	0	0	113.5	L116 K117 P122	L116-A120 PolarHBondContact O-N 3.3Å; K117-A120 PolarHBondContact O-N 3.01Å; K117-A120 VanDerWaalsContact O-N 3.12Å; A120-P122 WeakPolarHBondContact O-CD 3.38Å
121	E	49.4	Very low	54.6	Low	154 Å²	154	118.6 Å²	118.6	72%	0.72	64%	0.638	S	S	*	*	S	Bend	trans	-83.8	116	173.2	-70.2	-178.4	176.4	0	0	110.1
122	P	44.4	Very low	53.3	Low	111 Å²	111	118.4 Å²	118.4	72%	0.721	65%	0.649	S	S	*	*			trans	-72.9	138.3	-177.5	27.7	-32.1	0	0	0	111.3	A120	A120-P122 WeakPolarHBondContact O-CD 3.38Å
123	P	48.6	Very low	52.2	Low	116 Å²	116	119.6 Å²	119.6	75%	0.753	66%	0.662	S	S	*	*			trans	-69.8	134.6	174	27.3	-31.1	0	0	0	110.8	Q125	P123-Q125 PolarHBondContact O-N 3.16Å; P123-Q125 VanDerWaalsContact O-N 3.13Å
124	V	55	Low	50.8	Low	149 Å²	149	122 Å²	122	90%	0.903	68%	0.681	S	S	*	*	S	Bend	trans	-75.3	9.2	-178	179.4	0	0	0	0	113.1
125	Q	52.3	Low	49.5	Very low	170 Å²	170	128.5 Å²	128.5	79%	0.794	70%	0.702	S	S	*	*	S	Bend	trans	-123.8	133.7	-176.9	-69.7	-177.4	-19.2	0	0	111.8	P123	P123-Q125 PolarHBondContact O-N 3.16Å; P123-Q125 VanDerWaalsContact O-N 3.13Å
126	V	42.3	Very low	48.3	Very low	140 Å²	140	130.4 Å²	130.4	85%	0.848	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-69.6	131.2	-177	-151.3	0	0	0	0	109.2	E128	V126-E128 PolarHBondContact O-N 3.25Å
127	P	43.6	Very low	47.3	Very low	111 Å²	111	133 Å²	133	72%	0.721	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-69.8	124.9	-178.3	-15.4	28.8	0	0	0	111.5
128	E	45.5	Very low	46.1	Very low	198 Å²	198	131.7 Å²	131.7	93%	0.925	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-63.3	133.5	161.4	-103.9	178.1	159.6	0	0	109.6	V126 D130	V126-E128 PolarHBondContact O-N 3.25Å; E128-D130 PolarHBondContact O-N 3.05Å
129	V	43.1	Very low	45.5	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	74%	0.735	S	S	*	*			trans	-90.2	101.4	-175	-176	0	0	0	0	108.6
130	D	36.8	Very low	45.3	Very low	118 Å²	118	128.6 Å²	128.6	63%	0.631	72%	0.719	S	S	*	*			trans	-113.3	132.4	163.8	-167.4	5.3	0	0	0	110	E128 C132	E128-D130 PolarHBondContact O-N 3.05Å; D130-C132 VanDerWaalsContact C-N 3.34Å; D130-C132 PolarHBondContact O-N 2.84Å
131	S	39.3	Very low	45.1	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	5.6	-164.6	53.5	0	0	0	0	114.8
132	C	42.4	Very low	45.6	Very low	105 Å²	105	119.3 Å²	119.3	71%	0.709	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	13.9	-167.3	-67.9	0	0	0	0	115.7	D130	D130-C132 VanDerWaalsContact C-N 3.34Å; D130-C132 PolarHBondContact O-N 2.84Å
133	V	43.7	Very low	46.1	Very low	81 Å²	81	114.1 Å²	114.1	49%	0.491	64%	0.637	S	S	.	*	S	Bend	trans	-118.5	126.1	-179.5	-167.4	0	0	0	0	111	R135	V133-R135 PolarHBondContact O-N 2.9Å; V133-R135 VanDerWaalsContact O-N 3.17Å
134	P	39.7	Very low	46.4	Very low	110 Å²	110	113.3 Å²	113.3	71%	0.714	63%	0.63	S	S	*	*			trans	-55.7	121.4	166.5	-22.6	33	0	0	0	110.1	T136	P134-T136 VanDerWaalsContact C-N 3.26Å; P134-T136 PolarHBondContact O-N 2.64Å
135	R	43.3	Very low	46.5	Very low	221 Å²	221	111.4 Å²	111.4	83%	0.834	62%	0.615	S	S	*	*	S	Bend	trans	-76.6	70.4	-176	-72.2	-175.6	173	147.8	-1.4	112.6	V133	V133-R135 PolarHBondContact O-N 2.9Å; V133-R135 VanDerWaalsContact O-N 3.17Å
136	T	37.7	Very low	46.6	Very low	90 Å²	90	104.5 Å²	104.5	55%	0.552	58%	0.583	S	S	*	*			trans	-143.6	106.7	157.7	35.8	0	0	0	0	107.4	P134 E138	P134-T136 VanDerWaalsContact C-N 3.26Å; P134-T136 PolarHBondContact O-N 2.64Å; T136-E138 HydrophobicContact CG2-CG 4.48Å; T136-E138 PolarHBondContact O-N 2.84Å
137	P	44.8	Very low	47.1	Very low	131 Å²	131	102.8 Å²	102.8	85%	0.851	57%	0.573	S	S	*	*			trans	-75.3	64.4	158.8	33.9	-29	0	0	0	106.7	R139	P137-R139 PolarHBondContact O-N 2.61Å
138	E	43.1	Very low	47.3	Very low	130 Å²	130	101.3 Å²	101.3	61%	0.607	56%	0.563	S	S	*	*			trans	-72.4	82.2	161.8	-84.7	-175.1	-171.4	0	0	105.9	T136 S140	T136-E138 HydrophobicContact CG2-CG 4.48Å; T136-E138 PolarHBondContact O-N 2.84Å; E138-S140 PolarHBondContact O-N 2.85Å
139	R	48.9	Very low	47.4	Very low	189 Å²	189	95 Å²	95	71%	0.713	55%	0.552	S	S	*	*			trans	-68.2	60.4	152.1	-68.9	-175.2	179.5	-175.9	1.1	107.8	P137	P137-R139 PolarHBondContact O-N 2.61Å
140	S	51.7	Low	47.8	Very low	51 Å²	51	90.2 Å²	90.2	36%	0.357	53%	0.528	S	S	.	.			trans	-67.3	125.9	159.3	-63.1	0	0	0	0	104.6	E138 I142	E138-S140 PolarHBondContact O-N 2.85Å; S140-I142 PolarHBondContact O-N 3.01Å
141	G	52	Low	48.7	Very low	32 Å²	32	92.1 Å²	92.1	33%	0.33	54%	0.537	S	S	.	.			trans	-52.9	120.1	172.2	0	0	0	0	0	107.7	L193	G141-L193 WeakPolarHBondContact O-CD1 3.45Å
142	I	59.7	Low	50.1	Low	7 Å²	7	89 Å²	89	4%	0.036	51%	0.514	C	S	.	.			trans	-83.2	-37.7	178.5	-63.5	173.9	0	0	0	108.4	S140 D146 L193 I201 E204 L205 R209	S140-I142 PolarHBondContact O-N 3.01Å; I142-D146 PolarHBondContact N-OD2 2.85Å; I142-L193 PolarHBondContact O-N 3.31Å; I142-I201 HydrophobicContact CG2-CG2 3.56Å; I142-E204 HydrophobicContact CD1-CB 4.04Å; I142-E204 HydrophobicContact CD1-CG 3.51Å; I142-E204 WeakPolarHBondContact CD1-OE1 3.26Å; I142-E204 WeakPolarHBondContact CD1-OE2 3.47Å; I142-L205 HydrophobicContact CG2-CD1 4.29Å; I142-L205 HydrophobicContact CG2-CD2 3.63Å; I142-L205 HydrophobicContact CG2-CG 3.81Å; I142-R209 HydrophobicContact CD1-CG 4.11Å
143	T	55.1	Low	51.6	Low	2 Å²	2	85.4 Å²	85.4	1%	0.012	49%	0.487	C	S	.	.	B	Isolated β-bridge	trans	-111	160.1	-179.2	72.5	0	0	0	0	112.1	D145 D146 E153 F155 N191 L205	T143-D145 PolarHBondContact O-N 3.49Å; T143-D146 PolarHBondContact N-OD2 3.25Å; T143-D146 PolarHBondContact O-N 3.23Å; T143-E153 WeakPolarHBondContact CB-OE2 3.45Å; T143-E153 PolarHBondContact OG1-OE2 3.21Å; T143-F155 HydrophobicContact CG2-CE2 3.64Å; T143-F155 HydrophobicContact CG2-CZ 3.71Å; T143-N191 VanDerWaalsContact CA-O 3.27Å; T143-N191 WeakPolarHBondContact CA-O 3.47Å; T143-L205 HydrophobicContact CG2-CD2 4.49Å
144	V	53.8	Low	53.4	Low	99 Å²	99	86 Å²	86	60%	0.6	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.5	-179.4	-171.7	0	0	0	0	111.7	L193	V144-L193 HydrophobicContact CG2-CD2 3.99Å
145	D	57.1	Low	55.6	Low	109 Å²	109	81 Å²	81	58%	0.583	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-0.2	-176.7	-59.5	-48.2	0	0	0	113.6	T143 V147	T143-D145 PolarHBondContact O-N 3.49Å; D145-V147 PolarHBondContact O-N 3.03Å; D145-V147 VanDerWaalsContact O-N 3.14Å
146	D	55.4	Low	57.8	Low	25 Å²	25	71.5 Å²	71.5	13%	0.134	42%	0.418	C	S	.	.			trans	-68	110.5	176.9	-87.2	-22.3	0	0	0	110.8	I142 T143 E153 R209	I142-D146 PolarHBondContact N-OD2 2.85Å; T143-D146 PolarHBondContact N-OD2 3.25Å; T143-D146 PolarHBondContact O-N 3.23Å; D146-E153 PolarHBondContact OD1-N 2.92Å; D146-R209 IonicContact OD1-CZ 3.24Å; D146-R209 IonicContact OD1-NH1 2.69Å; D146-R209 PolarHBondContact OD1-NH1 2.89Å; D146-R209 IonicContact OD1-NH2 3Å; D146-R209 IonicContact OD2-CZ 2.67Å; D146-R209 IonicContact OD2-NH1 3.79Å; D146-R209 PolarHBondContact OD2-NH1 2.94Å; D146-R209 IonicContact OD2-NH2 2.89Å; D146-R209 PolarHBondContact OD2-NH2 3.2Å
147	V	51.9	Low	60.4	Low	104 Å²	104	67.2 Å²	67.2	63%	0.63	39%	0.392	S	S	*	.			trans	-81.1	130.1	175	-176.3	0	0	0	0	110.2	D145 G149 G150	D145-V147 PolarHBondContact O-N 3.03Å; D145-V147 VanDerWaalsContact O-N 3.14Å; V147-G149 PolarHBondContact O-N 3.31Å; V147-G150 PolarHBondContact O-N 2.9Å
148	P	48.5	Very low	62.6	Low	79 Å²	79	61 Å²	61	51%	0.513	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	112.7	178.2	-23.4	32.8	0	0	0	112.5
149	G	47.4	Very low	64.9	Low	67 Å²	67	55 Å²	55	69%	0.691	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-1.5	-177.8	0	0	0	0	0	115.2	V147	V147-G149 PolarHBondContact O-N 3.31Å
150	G	52.3	Low	66.9	Low	30 Å²	30	46 Å²	46	31%	0.309	29%	0.29	S	S	.	.	S	Bend	trans	-78.9	177.3	173.1	0	0	0	0	0	113.4	V147	V147-G150 PolarHBondContact O-N 2.9Å
151	I	56.1	Low	68.7	Low	159 Å²	159	44.8 Å²	44.8	82%	0.815	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-67	127.1	168.2	-59.6	172.1	0	0	0	106.7
152	P	66.9	Low	70.4	Confident	48 Å²	48	44.3 Å²	44.3	31%	0.312	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-61.8	142.7	-179	-8.4	19.2	0	0	0	111	M154	P152-M154 PolarHBondContact O-N 3.27Å
153	E	74.6	Confident	71.5	Confident	30 Å²	30	51.7 Å²	51.7	14%	0.14	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-61	132.3	175.4	-171.5	174.5	-149.3	0	0	110.5	T143 D146 F155 K184 R209	T143-E153 WeakPolarHBondContact CB-OE2 3.45Å; T143-E153 PolarHBondContact OG1-OE2 3.21Å; D146-E153 PolarHBondContact OD1-N 2.92Å; E153-F155 HydrophobicContact CB-CE2 4.42Å; E153-F155 HydrophobicContact CB-CZ 4.49Å; E153-F155 VanDerWaalsContact CD-CZ 3.47Å; E153-F155 HydrophobicContact CG-CE1 4.34Å; E153-F155 HydrophobicContact CG-CE2 4.02Å; E153-F155 HydrophobicContact CG-CZ 3.77Å; E153-F155 VanDerWaalsContact OE2-CZ 3.26Å; E153-F155 WeakPolarHBondContact OE2-CZ 3.29Å; E153-K184 IonicContact OE1-NZ 2.82Å; E153-R209 VanDerWaalsContact N-NH1 3.11Å; E153-R209 PolarHBondContact O-NH1 3.07Å
154	M	81.1	Confident	73.1	Confident	92 Å²	92	55.6 Å²	55.6	45%	0.453	33%	0.33	S	S	.	.			trans	-116.3	145.4	-178.9	-60.9	-65.9	-71.2	0	0	109.9	P152 R208 R209	P152-M154 PolarHBondContact O-N 3.27Å; M154-R208 VanDerWaalsContact CE-O 3.32Å; M154-R208 WeakPolarHBondContact CE-O 3.42Å; M154-R209 WeakPolarHBondContact CA-O 3.34Å
155	F	87.3	Confident	74.7	Confident	5 Å²	5	50.9 Å²	50.9	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	148.4	-178.1	-59.4	-86.7	0	0	0	111.1	T143 E153 K184 C186 L205 R209 C210 K211	T143-F155 HydrophobicContact CG2-CE2 3.64Å; T143-F155 HydrophobicContact CG2-CZ 3.71Å; E153-F155 HydrophobicContact CB-CE2 4.42Å; E153-F155 HydrophobicContact CB-CZ 4.49Å; E153-F155 VanDerWaalsContact CD-CZ 3.47Å; E153-F155 HydrophobicContact CG-CE1 4.34Å; E153-F155 HydrophobicContact CG-CE2 4.02Å; E153-F155 HydrophobicContact CG-CZ 3.77Å; E153-F155 VanDerWaalsContact OE2-CZ 3.26Å; E153-F155 WeakPolarHBondContact OE2-CZ 3.29Å; F155-K184 HydrophobicContact CD1-CB 4.17Å; F155-C186 HydrophobicContact CB-CB 4.04Å; F155-C186 HydrophobicContact CD1-CB 3.66Å; F155-C186 HydrophobicContact CD2-CB 3.91Å; F155-C186 HydrophobicContact CE1-CB 4.06Å; F155-C186 HydrophobicContact CE2-CB 4.31Å; F155-C186 HydrophobicContact CG-CB 3.58Å; F155-C186 HydrophobicContact CZ-CB 4.37Å; F155-L205 HydrophobicContact CE2-CD2 4.49Å; F155-R209 HydrophobicContact CD2-CB 4.34Å; F155-R209 PolarHBondContact N-O 3.18Å; F155-C210 WeakPolarHBondContact O-CA 3.24Å; F155-K211 PolarHBondContact O-N 2.84Å
156	D	89.4	Confident	76.2	Confident	22 Å²	22	49.7 Å²	49.7	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-35.9	174	-63	-56.9	0	0	0	110.8	L183 K184 K211 R212	D156-L183 HydrophobicContact CB-CD2 4.02Å; D156-L183 WeakPolarHBondContact OD2-CA 3.44Å; D156-K184 PolarHBondContact N-O 3Å; D156-K184 PolarHBondContact OD2-N 2.9Å; D156-K211 IonicContact OD1-NZ 3.49Å; D156-K211 PolarHBondContact OD1-NZ 3.03Å; D156-R212 PolarHBondContact O-N 2.75Å; D156-R212 VanDerWaalsContact O-N 3.08Å
157	A	91.1	Very high	77.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	146.6	172.5	0	0	0	0	0	115.3	L185 C186 R212 V214 L287	A157-L185 HydrophobicContact CB-CD2 3.98Å; A157-C186 PolarHBondContact O-N 3.14Å; A157-R212 CarbonylContact C-O 3.47Å; A157-R212 VanDerWaalsContact CA-O 3.22Å; A157-R212 WeakPolarHBondContact CA-O 3.23Å; A157-R212 HydrophobicContact CB-CB 4.37Å; A157-V214 HydrophobicContact CB-CG2 4.12Å; A157-L287 HydrophobicContact CB-CD1 4.28Å; A157-L287 HydrophobicContact CB-CD2 3.7Å
158	F	90.4	Very high	79.7	Confident	2 Å²	2	52 Å²	52	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.3	160.5	-177.6	-111.6	0	0	0	110	C160 C186 F188 T202 L205 I206 C210 R212 M213 V214	F158-C160 HydrophobicContact CD1-CB 4.22Å; F158-C160 HydrophobicContact CE1-CB 3.93Å; F158-C186 HydrophobicContact CD2-CB 4.31Å; F158-F188 HydrophobicContact CE2-CB 4.32Å; F158-F188 HydrophobicContact CZ-CB 4.4Å; F158-T202 HydrophobicContact CE1-CG2 4.09Å; F158-T202 HydrophobicContact CZ-CG2 3.84Å; F158-L205 HydrophobicContact CD2-CD1 4.48Å; F158-L205 HydrophobicContact CE2-CD1 4.23Å; F158-I206 HydrophobicContact CD1-CD1 4.23Å; F158-I206 HydrophobicContact CD1-CG1 3.79Å; F158-I206 HydrophobicContact CE1-CD1 4.17Å; F158-I206 HydrophobicContact CE1-CG1 4.14Å; F158-I206 HydrophobicContact CG-CG1 4.28Å; F158-C210 HydrophobicContact CB-CB 3.97Å; F158-R212 PolarHBondContact N-O 3.37Å; F158-M213 HydrophobicContact CD1-CE 4.09Å; F158-M213 HydrophobicContact CD1-CG 4.11Å; F158-M213 HydrophobicContact CD1-SD 4.45Å; F158-M213 HydrophobicContact CE1-CE 4.2Å; F158-M213 CarbonylContact O-C 3.54Å; F158-M213 WeakPolarHBondContact O-CA 3.22Å; F158-V214 PolarHBondContact O-N 3.37Å
159	I	91.4	Very high	81.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.9	175.2	-58.1	167.5	0	0	0	109.1	Y161 V169 M172 I173 L185 C186 V187 V216	I159-Y161 HydrophobicContact CG2-CD1 4.09Å; I159-V169 HydrophobicContact CG2-CG1 3.93Å; I159-V169 HydrophobicContact CG2-CG2 4.23Å; I159-M172 HydrophobicContact CB-CE 4.36Å; I159-M172 HydrophobicContact CD1-CE 3.74Å; I159-M172 HydrophobicContact CG1-CE 3.96Å; I159-M172 HydrophobicContact CG2-CE 3.46Å; I159-M172 VanDerWaalsContact CG2-CE 3.46Å; I159-I173 HydrophobicContact CD1-CD1 3.99Å; I159-I173 HydrophobicContact CD1-CG1 3.54Å; I159-L185 HydrophobicContact CD1-CB 4.05Å; I159-L185 HydrophobicContact CD1-CD1 4.18Å; I159-C186 PolarHBondContact N-O 3.4Å; I159-V187 HydrophobicContact CD1-CG2 4.08Å; I159-V216 HydrophobicContact CG2-CG2 4.23Å
160	C	91.5	Very high	83.6	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.1	174.7	-175.6	0	0	0	0	109.8	F158 M213 V214 V215 V216 Y221 Q230	F158-C160 HydrophobicContact CD1-CB 4.22Å; F158-C160 HydrophobicContact CE1-CB 3.93Å; C160-M213 HydrophobicContact CB-CE 3.27Å; C160-M213 HydrophobicContact CB-CG 4.45Å; C160-M213 VanDerWaalsContact SG-CE 3.59Å; C160-V214 PolarHBondContact N-O 2.85Å; C160-V215 HydrophobicContact CB-CG2 4.45Å; C160-V216 PolarHBondContact O-N 3.22Å; C160-Y221 HydrophobicContact CB-CE2 4.5Å; C160-Y221 VanDerWaalsContact SG-CE2 3.6Å; C160-Y221 PolarHBondContact SG-OH 2.93Å; C160-Q230 PolarHBondContact SG-OE1 3.25Å
161	Y	90.3	Very high	85.4	Confident	25 Å²	25	51.6 Å²	51.6	10%	0.098	26%	0.262	C	S	.	.			trans	-150.9	161.9	-174.2	69	-73	0	0	0	110.2	I159 F166 V169 V187 D189	I159-Y161 HydrophobicContact CG2-CD1 4.09Å; Y161-F166 HydrophobicContact CE2-CB 3.96Å; Y161-F166 AromaticContact CE2-CD2 3.64Å; Y161-F166 HydrophobicContact CE2-CD2 3.64Å; Y161-F166 HydrophobicContact CE2-CG 4.27Å; Y161-F166 AromaticContact CZ-CD2 3.88Å; Y161-V169 HydrophobicContact CD1-CG1 4.34Å; Y161-V169 HydrophobicContact CD1-CG2 4.21Å; Y161-V169 HydrophobicContact CD2-CB 4.36Å; Y161-V169 HydrophobicContact CD2-CG2 3.81Å; Y161-V169 HydrophobicContact CE1-CG1 4.41Å; Y161-V169 HydrophobicContact CG-CB 4.44Å; Y161-V169 HydrophobicContact CG-CG1 4.48Å; Y161-V169 HydrophobicContact CG-CG2 3.63Å; Y161-V187 HydrophobicContact CE1-CG1 3.45Å; Y161-V187 VanDerWaalsContact CE1-CG1 3.45Å; Y161-V187 WeakPolarHBondContact OH-CG1 3.33Å; Y161-D189 PolarHBondContact OH-OD2 2.96Å
162	C	87.2	Confident	87.1	Confident	22 Å²	22	44 Å²	44	15%	0.149	22%	0.223	C	C	.	.			trans	-89.1	149.7	168.9	-171.7	0	0	0	0	109.6	S164 D165 E220	C162-S164 PolarHBondContact O-N 2.99Å; C162-D165 PolarHBondContact O-N 2.99Å; C162-E220 HydrophobicContact CB-CB 4.36Å
163	Q	83.3	Confident	88.1	Confident	162 Å²	162	42.3 Å²	42.3	76%	0.757	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-54.7	-32.5	-177.3	-168	173.2	25.2	0	0	113.3	D165 F166	Q163-D165 PolarHBondContact O-N 2.82Å; Q163-F166 VanDerWaalsContact O-CB 3.23Å; Q163-F166 WeakPolarHBondContact O-CB 3.37Å; Q163-F166 PolarHBondContact O-N 3.03Å
164	S	87.6	Confident	88.7	Confident	84 Å²	84	46.8 Å²	46.8	59%	0.587	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-64.5	-19.8	175.9	-57.6	0	0	0	0	114.2	C162	C162-S164 PolarHBondContact O-N 2.99Å
165	D	88.8	Confident	89.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-98.1	7.5	-179.5	-50.8	-51.6	0	0	0	112.3	C162 Q163 E167 F168 V169 V216 S218 Y251 K252	C162-D165 PolarHBondContact O-N 2.99Å; Q163-D165 PolarHBondContact O-N 2.82Å; D165-E167 VanDerWaalsContact C-N 3.31Å; D165-E167 PolarHBondContact O-N 2.85Å; D165-F168 PolarHBondContact O-N 2.81Å; D165-V169 PolarHBondContact O-N 3.21Å; D165-V169 VanDerWaalsContact O-N 3.15Å; D165-V216 HydrophobicContact CB-CG1 4.26Å; D165-S218 VanDerWaalsContact OD1-CB 3.27Å; D165-S218 WeakPolarHBondContact OD1-CB 3.48Å; D165-S218 PolarHBondContact OD1-OG 2.91Å; D165-S218 VanDerWaalsContact OD2-CB 3.3Å; D165-S218 WeakPolarHBondContact OD2-CB 3.19Å; D165-S218 PolarHBondContact OD2-OG 3.3Å; D165-Y251 HydrophobicContact CB-CE1 4.01Å; D165-Y251 PolarHBondContact OD1-OH 3.28Å; D165-K252 IonicContact OD1-NZ 2.61Å; D165-K252 PolarHBondContact OD1-NZ 2.88Å
166	F	87	Confident	89.2	Confident	84 Å²	84	45.3 Å²	45.3	37%	0.368	22%	0.222	S	C	.	.	H	α-helix	trans	-58.4	-37.5	-173.6	-178.5	-120.1	0	0	0	113.8	Y161 Q163 F168 V169 L170	Y161-F166 HydrophobicContact CE2-CB 3.96Å; Y161-F166 AromaticContact CE2-CD2 3.64Å; Y161-F166 HydrophobicContact CE2-CD2 3.64Å; Y161-F166 HydrophobicContact CE2-CG 4.27Å; Y161-F166 AromaticContact CZ-CD2 3.88Å; Q163-F166 VanDerWaalsContact O-CB 3.23Å; Q163-F166 WeakPolarHBondContact O-CB 3.37Å; Q163-F166 PolarHBondContact O-N 3.03Å; F166-F168 PolarHBondContact O-N 3.49Å; F166-V169 WeakPolarHBondContact O-CB 3.25Å; F166-V169 PolarHBondContact O-N 3.34Å; F166-V169 VanDerWaalsContact O-N 3.14Å; F166-L170 HydrophobicContact CD1-CD1 3.96Å; F166-L170 HydrophobicContact CD1-CG 4.31Å; F166-L170 HydrophobicContact CD2-CG 4.39Å; F166-L170 HydrophobicContact CE1-CD1 3.5Å; F166-L170 VanDerWaalsContact CE1-CD1 3.5Å; F166-L170 HydrophobicContact CE1-CD2 4.29Å; F166-L170 HydrophobicContact CE1-CG 3.94Å; F166-L170 HydrophobicContact CE2-CD1 4.48Å; F166-L170 HydrophobicContact CE2-CD2 3.97Å; F166-L170 HydrophobicContact CE2-CG 4.02Å; F166-L170 HydrophobicContact CZ-CD1 3.8Å; F166-L170 HydrophobicContact CZ-CD2 3.7Å; F166-L170 HydrophobicContact CZ-CG 3.79Å; F166-L170 WeakPolarHBondContact O-CG 3.43Å; F166-L170 PolarHBondContact O-N 2.84Å
167	E	88.3	Confident	88.8	Confident	166 Å²	166	48.6 Å²	48.6	78%	0.776	24%	0.237	S	C	*	.	H	α-helix	trans	-61.2	-44.9	179.9	-173.4	173.6	-164.2	0	0	111.9	D165 V169 L170 E171	D165-E167 VanDerWaalsContact C-N 3.31Å; D165-E167 PolarHBondContact O-N 2.85Å; E167-V169 VanDerWaalsContact C-N 3.32Å; E167-V169 PolarHBondContact O-N 3.37Å; E167-L170 PolarHBondContact O-N 3.05Å; E167-E171 PolarHBondContact O-N 2.84Å
168	F	92.4	Very high	88.4	Confident	11 Å²	11	54.9 Å²	54.9	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-37.1	174.4	172.9	-101.3	0	0	0	111.8	D165 F166 L170 E171 M172 V216 V249 Y251 Y270 W280	D165-F168 PolarHBondContact O-N 2.81Å; F166-F168 PolarHBondContact O-N 3.49Å; F168-L170 VanDerWaalsContact C-N 3.34Å; F168-L170 PolarHBondContact O-N 3.25Å; F168-E171 PolarHBondContact O-N 3.33Å; F168-M172 HydrophobicContact CE1-SD 4.37Å; F168-M172 WeakPolarHBondContact O-CB 3.42Å; F168-M172 PolarHBondContact O-N 3.45Å; F168-V216 HydrophobicContact CD1-CG1 3.93Å; F168-V216 HydrophobicContact CE1-CG1 4.16Å; F168-V249 HydrophobicContact CE1-CG1 3.87Å; F168-V249 HydrophobicContact CZ-CG1 4.03Å; F168-Y251 HydrophobicContact CB-CD1 4.48Å; F168-Y251 HydrophobicContact CB-CD2 3.74Å; F168-Y251 HydrophobicContact CB-CE1 4.43Å; F168-Y251 HydrophobicContact CB-CE2 3.66Å; F168-Y251 HydrophobicContact CB-CG 4.15Å; F168-Y251 AromaticContact CD1-CD1 3.73Å; F168-Y251 HydrophobicContact CD1-CD1 3.73Å; F168-Y251 HydrophobicContact CD1-CD2 4.07Å; F168-Y251 HydrophobicContact CD1-CE1 4.3Å; F168-Y251 AromaticContact CD1-CG 3.59Å; F168-Y251 HydrophobicContact CD1-CG 3.59Å; F168-Y251 AromaticContact CD2-CD2 3.56Å; F168-Y251 HydrophobicContact CD2-CD2 3.56Å; F168-Y251 HydrophobicContact CD2-CE2 4.35Å; F168-Y251 AromaticContact CD2-CG 3.72Å; F168-Y251 HydrophobicContact CD2-CG 3.72Å; F168-Y251 HydrophobicContact CE1-CD1 4.13Å; F168-Y251 AromaticContact CE1-CG 3.89Å; F168-Y251 HydrophobicContact CE1-CG 3.89Å; F168-Y251 VanDerWaalsContact CE2-CB 3.42Å; F168-Y251 HydrophobicContact CE2-CD2 4.2Å; F168-Y251 AromaticContact CE2-CG 4Å; F168-Y251 HydrophobicContact CE2-CG 4Å; F168-Y251 HydrophobicContact CG-CD1 4.01Å; F168-Y251 AromaticContact CG-CD2 3.48Å; F168-Y251 HydrophobicContact CG-CD2 3.48Å; F168-Y251 VanDerWaalsContact CG-CD2 3.48Å; F168-Y251 HydrophobicContact CG-CE1 4.43Å; F168-Y251 AromaticContact CG-CE2 3.94Å; F168-Y251 HydrophobicContact CG-CE2 3.94Å; F168-Y251 AromaticContact CG-CG 3.5Å; F168-Y251 HydrophobicContact CG-CG 3.5Å; F168-Y251 HydrophobicContact CZ-CG 4.08Å; F168-Y270 AromaticContact CE2-CD1 3.81Å; F168-Y270 HydrophobicContact CE2-CD1 3.81Å; F168-Y270 HydrophobicContact CE2-CE1 4.07Å; F168-Y270 HydrophobicContact CE2-CG 4.33Å; F168-W280 AromaticContact CE2-CH2 3.74Å; F168-W280 HydrophobicContact CE2-CH2 3.74Å; F168-W280 HydrophobicContact CE2-CZ2 4.36Å; F168-W280 AromaticContact CZ-CH2 3.84Å; F168-W280 HydrophobicContact CZ-CH2 3.84Å; F168-W280 HydrophobicContact CZ-CZ3 4.44Å
169	V	91	Very high	87.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-39	177.2	170.2	0	0	0	0	111.7	I159 Y161 D165 F166 E167 M172 I173 V216	I159-V169 HydrophobicContact CG2-CG1 3.93Å; I159-V169 HydrophobicContact CG2-CG2 4.23Å; Y161-V169 HydrophobicContact CD1-CG1 4.34Å; Y161-V169 HydrophobicContact CD1-CG2 4.21Å; Y161-V169 HydrophobicContact CD2-CB 4.36Å; Y161-V169 HydrophobicContact CD2-CG2 3.81Å; Y161-V169 HydrophobicContact CE1-CG1 4.41Å; Y161-V169 HydrophobicContact CG-CB 4.44Å; Y161-V169 HydrophobicContact CG-CG1 4.48Å; Y161-V169 HydrophobicContact CG-CG2 3.63Å; D165-V169 PolarHBondContact O-N 3.21Å; D165-V169 VanDerWaalsContact O-N 3.15Å; F166-V169 WeakPolarHBondContact O-CB 3.25Å; F166-V169 PolarHBondContact O-N 3.34Å; F166-V169 VanDerWaalsContact O-N 3.14Å; E167-V169 VanDerWaalsContact C-N 3.32Å; E167-V169 PolarHBondContact O-N 3.37Å; V169-M172 HydrophobicContact CG1-CE 4.42Å; V169-M172 HydrophobicContact CG2-CE 4.33Å; V169-M172 PolarHBondContact O-N 2.89Å; V169-I173 HydrophobicContact CG1-CD1 3.68Å; V169-I173 HydrophobicContact CG1-CG1 4.37Å; V169-I173 WeakPolarHBondContact O-CD1 3.46Å; V169-I173 VanDerWaalsContact O-CG1 3.22Å; V169-I173 WeakPolarHBondContact O-CG1 3.07Å; V169-I173 PolarHBondContact O-N 3.22Å; V169-V216 HydrophobicContact CG2-CG2 4.03Å
170	L	87.2	Confident	87.4	Confident	88 Å²	88	64.7 Å²	64.7	46%	0.461	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-44.4	174.1	-73.6	177.9	0	0	0	112.1	F166 E167 F168 I173 K174	F166-L170 HydrophobicContact CD1-CD1 3.96Å; F166-L170 HydrophobicContact CD1-CG 4.31Å; F166-L170 HydrophobicContact CD2-CG 4.39Å; F166-L170 HydrophobicContact CE1-CD1 3.5Å; F166-L170 VanDerWaalsContact CE1-CD1 3.5Å; F166-L170 HydrophobicContact CE1-CD2 4.29Å; F166-L170 HydrophobicContact CE1-CG 3.94Å; F166-L170 HydrophobicContact CE2-CD1 4.48Å; F166-L170 HydrophobicContact CE2-CD2 3.97Å; F166-L170 HydrophobicContact CE2-CG 4.02Å; F166-L170 HydrophobicContact CZ-CD1 3.8Å; F166-L170 HydrophobicContact CZ-CD2 3.7Å; F166-L170 HydrophobicContact CZ-CG 3.79Å; F166-L170 WeakPolarHBondContact O-CG 3.43Å; F166-L170 PolarHBondContact O-N 2.84Å; E167-L170 PolarHBondContact O-N 3.05Å; F168-L170 VanDerWaalsContact C-N 3.34Å; F168-L170 PolarHBondContact O-N 3.25Å; L170-I173 PolarHBondContact O-N 3.44Å; L170-K174 WeakPolarHBondContact O-CB 3.34Å; L170-K174 PolarHBondContact O-N 3.44Å
171	E	90.8	Very high	86.8	Confident	79 Å²	79	68.9 Å²	68.9	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-58.9	-49.3	173.3	-174.5	-173.4	163	0	0	110.5	E167 F168 I173 K174 E175 Y270 W280	E167-E171 PolarHBondContact O-N 2.84Å; F168-E171 PolarHBondContact O-N 3.33Å; E171-I173 PolarHBondContact O-N 2.9Å; E171-K174 PolarHBondContact O-N 3.47Å; E171-E175 HydrophobicContact CG-CG 4.34Å; E171-E175 WeakPolarHBondContact O-CG 3.33Å; E171-E175 PolarHBondContact O-N 2.94Å; E171-Y270 PolarHBondContact OE1-OH 3.43Å; E171-W280 HydrophobicContact CG-CZ2 4.33Å
172	M	90.8	Very high	86.2	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-46.1	178.6	170.7	169.7	78.3	0	0	112.5	I159 F168 V169 E175 L176 V214 V216 W280 L283	I159-M172 HydrophobicContact CB-CE 4.36Å; I159-M172 HydrophobicContact CD1-CE 3.74Å; I159-M172 HydrophobicContact CG1-CE 3.96Å; I159-M172 HydrophobicContact CG2-CE 3.46Å; I159-M172 VanDerWaalsContact CG2-CE 3.46Å; F168-M172 HydrophobicContact CE1-SD 4.37Å; F168-M172 WeakPolarHBondContact O-CB 3.42Å; F168-M172 PolarHBondContact O-N 3.45Å; V169-M172 HydrophobicContact CG1-CE 4.42Å; V169-M172 HydrophobicContact CG2-CE 4.33Å; V169-M172 PolarHBondContact O-N 2.89Å; M172-E175 PolarHBondContact O-N 3.24Å; M172-L176 HydrophobicContact CG-CD1 3.54Å; M172-L176 HydrophobicContact CG-CG 4.2Å; M172-L176 VanDerWaalsContact O-CB 3.24Å; M172-L176 WeakPolarHBondContact O-CB 3.44Å; M172-L176 WeakPolarHBondContact O-CG 3.48Å; M172-L176 PolarHBondContact O-N 3.02Å; M172-L176 HydrophobicContact SD-CD1 4.34Å; M172-V214 HydrophobicContact CE-CG1 4.22Å; M172-V214 HydrophobicContact SD-CG1 4.19Å; M172-V216 HydrophobicContact CE-CG2 3.93Å; M172-W280 VanDerWaalsContact CA-CZ3 3.48Å; M172-W280 HydrophobicContact CB-CH2 3.73Å; M172-W280 HydrophobicContact CB-CZ3 3.54Å; M172-W280 HydrophobicContact CG-CE3 4.47Å; M172-W280 HydrophobicContact CG-CH2 4.31Å; M172-W280 HydrophobicContact CG-CZ3 3.61Å; M172-W280 HydrophobicContact SD-CZ3 4.45Å; M172-L283 HydrophobicContact CG-CD2 4.47Å; M172-L283 HydrophobicContact SD-CD2 4.03Å
173	I	88	Confident	86.2	Confident	13 Å²	13	73.6 Å²	73.6	7%	0.067	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-47.7	178.9	-68.4	158.4	0	0	0	110	I159 V169 L170 E171 E175 L176 E177 L185 V187	I159-I173 HydrophobicContact CD1-CD1 3.99Å; I159-I173 HydrophobicContact CD1-CG1 3.54Å; V169-I173 HydrophobicContact CG1-CD1 3.68Å; V169-I173 HydrophobicContact CG1-CG1 4.37Å; V169-I173 WeakPolarHBondContact O-CD1 3.46Å; V169-I173 VanDerWaalsContact O-CG1 3.22Å; V169-I173 WeakPolarHBondContact O-CG1 3.07Å; V169-I173 PolarHBondContact O-N 3.22Å; L170-I173 PolarHBondContact O-N 3.44Å; E171-I173 PolarHBondContact O-N 2.9Å; I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 3.07Å; I173-L176 PolarHBondContact O-N 2.95Å; I173-E177 HydrophobicContact CG2-CG 4.08Å; I173-E177 WeakPolarHBondContact CG2-OE1 3.42Å; I173-E177 VanDerWaalsContact O-CB 3.31Å; I173-E177 WeakPolarHBondContact O-CB 3.24Å; I173-E177 VanDerWaalsContact O-CG 3.31Å; I173-E177 WeakPolarHBondContact O-CG 3.5Å; I173-E177 PolarHBondContact O-N 2.87Å; I173-L185 HydrophobicContact CG1-CD1 4.33Å; I173-V187 HydrophobicContact CD1-CG2 3.43Å; I173-V187 VanDerWaalsContact CD1-CG2 3.43Å; I173-V187 HydrophobicContact CG1-CG2 4.38Å
174	K	87.9	Confident	86.2	Confident	124 Å²	124	71.2 Å²	71.2	54%	0.539	34%	0.343	S	S	.	.	H	α-helix	trans	-58	-46.5	179.7	-178.7	-175.4	173.4	-167.7	0	111.7	L170 E171 Q178	L170-K174 WeakPolarHBondContact O-CB 3.34Å; L170-K174 PolarHBondContact O-N 3.44Å; E171-K174 PolarHBondContact O-N 3.47Å; K174-Q178 WeakPolarHBondContact O-CB 3.48Å; K174-Q178 WeakPolarHBondContact O-CG 3.18Å; K174-Q178 PolarHBondContact O-N 2.84Å
175	E	90.1	Very high	86.1	Confident	64 Å²	64	67.7 Å²	67.7	30%	0.299	32%	0.318	S	S	.	.	H	α-helix	trans	-69.1	-40.2	-179.9	-67.9	-64.3	137.2	0	0	111.8	E171 M172 I173 Q178 T179 W280	E171-E175 HydrophobicContact CG-CG 4.34Å; E171-E175 WeakPolarHBondContact O-CG 3.33Å; E171-E175 PolarHBondContact O-N 2.94Å; M172-E175 PolarHBondContact O-N 3.24Å; I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 3.07Å; E175-Q178 PolarHBondContact O-N 3.4Å; E175-T179 WeakPolarHBondContact O-CG2 3.37Å; E175-W280 HydrophobicContact CB-CB 4.36Å; E175-W280 HydrophobicContact CB-CD2 3.7Å; E175-W280 HydrophobicContact CB-CE3 4.15Å; E175-W280 HydrophobicContact CB-CG 3.79Å; E175-W280 HydrophobicContact CG-CD2 4.17Å; E175-W280 HydrophobicContact CG-CG 4.3Å; E175-W280 HydrophobicContact CG-CZ2 4.29Å
176	L	88.4	Confident	85.7	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-71.5	-38	179.9	-70.1	176.3	0	0	0	112.9	M172 I173 Q178 T179 L183 L185 W280 L283 A284 L287	M172-L176 HydrophobicContact CG-CD1 3.54Å; M172-L176 HydrophobicContact CG-CG 4.2Å; M172-L176 VanDerWaalsContact O-CB 3.24Å; M172-L176 WeakPolarHBondContact O-CB 3.44Å; M172-L176 WeakPolarHBondContact O-CG 3.48Å; M172-L176 PolarHBondContact O-N 3.02Å; M172-L176 HydrophobicContact SD-CD1 4.34Å; I173-L176 PolarHBondContact O-N 2.95Å; L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.33Å; L176-T179 PolarHBondContact O-N 3.49Å; L176-T179 PolarHBondContact O-OG1 3.07Å; L176-L183 HydrophobicContact CB-CD1 4.42Å; L176-L183 HydrophobicContact CD2-CD1 4.49Å; L176-L185 HydrophobicContact CB-CD1 3.76Å; L176-L185 HydrophobicContact CD1-CD1 3.75Å; L176-L185 HydrophobicContact CG-CD1 4.43Å; L176-W280 HydrophobicContact CD2-CE3 4.4Å; L176-W280 HydrophobicContact CG-CE3 4.38Å; L176-L283 HydrophobicContact CD1-CD2 3.99Å; L176-L283 HydrophobicContact CD1-CG 4.33Å; L176-L283 HydrophobicContact CD2-CB 4.17Å; L176-L283 HydrophobicContact CD2-CD2 4.2Å; L176-L283 HydrophobicContact CD2-CG 4.06Å; L176-A284 HydrophobicContact CD2-CB 3.75Å; L176-L287 HydrophobicContact CD1-CD1 3.99Å
177	E	82.4	Confident	85.1	Confident	92 Å²	92	64 Å²	64	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-68.4	-26.5	175.9	-74.1	179.9	173	0	0	112.2	I173 T179	I173-E177 HydrophobicContact CG2-CG 4.08Å; I173-E177 WeakPolarHBondContact CG2-OE1 3.42Å; I173-E177 VanDerWaalsContact O-CB 3.31Å; I173-E177 WeakPolarHBondContact O-CB 3.24Å; I173-E177 VanDerWaalsContact O-CG 3.31Å; I173-E177 WeakPolarHBondContact O-CG 3.5Å; I173-E177 PolarHBondContact O-N 2.87Å; E177-T179 VanDerWaalsContact C-N 3.3Å
178	Q	81.4	Confident	84	Confident	131 Å²	131	58.2 Å²	58.2	61%	0.612	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.8	176.1	-73.5	176.1	20.2	0	0	114	K174 E175 L176	K174-Q178 WeakPolarHBondContact O-CB 3.48Å; K174-Q178 WeakPolarHBondContact O-CG 3.18Å; K174-Q178 PolarHBondContact O-N 2.84Å; E175-Q178 PolarHBondContact O-N 3.4Å; L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.33Å
179	T	80.4	Confident	82.4	Confident	24 Å²	24	63 Å²	63	15%	0.147	30%	0.3	C	S	.	.	S	Bend	trans	-75.9	159.2	176.7	67.8	0	0	0	0	112.2	E175 L176 E177 Y181 A284	E175-T179 WeakPolarHBondContact O-CG2 3.37Å; L176-T179 PolarHBondContact O-N 3.49Å; L176-T179 PolarHBondContact O-OG1 3.07Å; E177-T179 VanDerWaalsContact C-N 3.3Å; T179-Y181 PolarHBondContact O-N 3.28Å; T179-A284 HydrophobicContact CG2-CB 3.85Å
180	E	81.1	Confident	80.7	Confident	186 Å²	186	71.2 Å²	71.2	87%	0.869	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-5.9	179.7	-59.1	179.2	175.7	0	0	114.5
181	Y	78.3	Confident	78.9	Confident	90 Å²	90	68.3 Å²	68.3	35%	0.353	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.9	-173.7	-63.2	-71.2	0	0	0	114.4	T179 L183 A284 K285 S288	T179-Y181 PolarHBondContact O-N 3.28Å; Y181-L183 PolarHBondContact O-N 3.11Å; Y181-A284 HydrophobicContact CD2-CB 3.63Å; Y181-A284 HydrophobicContact CE2-CB 4.1Å; Y181-K285 HydrophobicContact CE2-CB 4.32Å; Y181-S288 WeakPolarHBondContact CD1-OG 3.44Å
182	N	78.6	Confident	77.1	Confident	137 Å²	137	65.6 Å²	65.6	73%	0.733	31%	0.305	S	S	*	.			trans	46.9	45.8	-179.5	-65.6	-50.1	0	0	0	113.2
183	L	85.9	Confident	75.1	Confident	9 Å²	9	68.2 Å²	68.2	5%	0.047	32%	0.319	C	S	.	.			trans	-67.4	134.3	-173	-65.6	171	0	0	0	111.5	D156 L176 Y181 L185 A284 L287	D156-L183 HydrophobicContact CB-CD2 4.02Å; D156-L183 WeakPolarHBondContact OD2-CA 3.44Å; L176-L183 HydrophobicContact CB-CD1 4.42Å; L176-L183 HydrophobicContact CD2-CD1 4.49Å; Y181-L183 PolarHBondContact O-N 3.11Å; L183-L185 HydrophobicContact CB-CD2 4.29Å; L183-L185 HydrophobicContact CB-CG 4.43Å; L183-A284 HydrophobicContact CD1-CB 3.73Å; L183-L287 HydrophobicContact CD1-CB 4.03Å; L183-L287 HydrophobicContact CD1-CD1 4.29Å; L183-L287 HydrophobicContact CD2-CB 4.03Å
184	K	83.8	Confident	73.1	Confident	112 Å²	112	71.7 Å²	71.7	49%	0.487	34%	0.342	S	S	.	.			trans	-96.1	108.9	169.2	-70.5	-169.1	173.9	-160.7	0	110.2	E153 F155 D156	E153-K184 IonicContact OE1-NZ 2.82Å; F155-K184 HydrophobicContact CD1-CB 4.17Å; D156-K184 PolarHBondContact N-O 3Å; D156-K184 PolarHBondContact OD2-N 2.9Å
185	L	84.9	Confident	71.1	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.052	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.9	-179.5	-54.9	176.7	0	0	0	110.3	A157 I159 I173 L176 L183 L287	A157-L185 HydrophobicContact CB-CD2 3.98Å; I159-L185 HydrophobicContact CD1-CB 4.05Å; I159-L185 HydrophobicContact CD1-CD1 4.18Å; I173-L185 HydrophobicContact CG1-CD1 4.33Å; L176-L185 HydrophobicContact CB-CD1 3.76Å; L176-L185 HydrophobicContact CD1-CD1 3.75Å; L176-L185 HydrophobicContact CG-CD1 4.43Å; L183-L185 HydrophobicContact CB-CD2 4.29Å; L183-L185 HydrophobicContact CB-CG 4.43Å; L185-L287 HydrophobicContact CD2-CD1 4.03Å
186	C	80.7	Confident	69.5	Low	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.7	177	-172.2	0	0	0	0	110.1	F155 A157 F158 I159	F155-C186 HydrophobicContact CB-CB 4.04Å; F155-C186 HydrophobicContact CD1-CB 3.66Å; F155-C186 HydrophobicContact CD2-CB 3.91Å; F155-C186 HydrophobicContact CE1-CB 4.06Å; F155-C186 HydrophobicContact CE2-CB 4.31Å; F155-C186 HydrophobicContact CG-CB 3.58Å; F155-C186 HydrophobicContact CZ-CB 4.37Å; A157-C186 PolarHBondContact O-N 3.14Å; F158-C186 HydrophobicContact CD2-CB 4.31Å; I159-C186 PolarHBondContact N-O 3.4Å
187	V	75.8	Confident	67.8	Low	6 Å²	6	72.7 Å²	72.7	4%	0.036	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.2	172.1	-168.8	0	0	0	0	108.2	I159 Y161 I173 D189 R190 N191	I159-V187 HydrophobicContact CD1-CG2 4.08Å; Y161-V187 HydrophobicContact CE1-CG1 3.45Å; Y161-V187 VanDerWaalsContact CE1-CG1 3.45Å; Y161-V187 WeakPolarHBondContact OH-CG1 3.33Å; I173-V187 HydrophobicContact CD1-CG2 3.43Å; I173-V187 VanDerWaalsContact CD1-CG2 3.43Å; I173-V187 HydrophobicContact CG1-CG2 4.38Å; V187-D189 VanDerWaalsContact C-N 3.3Å; V187-D189 PolarHBondContact O-N 3.03Å; V187-R190 HydrophobicContact CB-CB 4.41Å; V187-R190 PolarHBondContact O-N 3.03Å; V187-R190 VanDerWaalsContact O-N 3.16Å; V187-N191 PolarHBondContact N-OD1 2.96Å; V187-N191 PolarHBondContact O-N 3.19Å; V187-N191 PolarHBondContact O-OD1 2.75Å
188	F	63.3	Low	66.9	Low	46 Å²	46	71.6 Å²	71.6	20%	0.202	38%	0.384	C	S	.	.	H	α-helix	trans	-54.8	-45	-176.6	-168.3	-92.7	0	0	0	112.6	F158 R190 V192 V198 I201 T202	F158-F188 HydrophobicContact CE2-CB 4.32Å; F158-F188 HydrophobicContact CZ-CB 4.4Å; F188-R190 VanDerWaalsContact C-N 3.26Å; F188-R190 PolarHBondContact O-N 2.82Å; F188-V192 HydrophobicContact CD2-CB 4.48Å; F188-V192 HydrophobicContact CD2-CG2 3.79Å; F188-V192 HydrophobicContact CE2-CB 4.32Å; F188-V192 HydrophobicContact CE2-CG1 4.07Å; F188-V192 HydrophobicContact CE2-CG2 3.95Å; F188-V192 HydrophobicContact CG-CG2 4.33Å; F188-V192 HydrophobicContact CZ-CG1 4.15Å; F188-V192 WeakPolarHBondContact O-CB 3.44Å; F188-V198 HydrophobicContact CE1-CB 4.49Å; F188-V198 HydrophobicContact CE1-CG1 3.87Å; F188-V198 HydrophobicContact CE1-CG2 4.14Å; F188-V198 HydrophobicContact CE2-CG1 4.02Å; F188-V198 HydrophobicContact CZ-CB 3.89Å; F188-V198 HydrophobicContact CZ-CG1 3.47Å; F188-V198 VanDerWaalsContact CZ-CG1 3.47Å; F188-V198 HydrophobicContact CZ-CG2 3.82Å; F188-I201 HydrophobicContact CE2-CB 4.49Å; F188-I201 HydrophobicContact CE2-CG2 4.28Å; F188-T202 WeakPolarHBondContact CD2-OG1 3.49Å; F188-T202 WeakPolarHBondContact CE2-OG1 3.43Å
189	D	60	Low	66.1	Low	112 Å²	112	70.5 Å²	70.5	60%	0.599	37%	0.374	S	S	*	.	H	α-helix	trans	-71.1	-13.8	-176.2	-67.7	-32.2	0	0	0	114.9	Y161 V187	Y161-D189 PolarHBondContact OH-OD2 2.96Å; V187-D189 VanDerWaalsContact C-N 3.3Å; V187-D189 PolarHBondContact O-N 3.03Å
190	R	54.8	Low	65.4	Low	172 Å²	172	73.7 Å²	73.7	65%	0.649	39%	0.393	S	S	*	.	H	α-helix	trans	-113.9	-37	-174.5	-172	179.8	176.9	-160.8	-1.8	113.5	V187 F188	V187-R190 HydrophobicContact CB-CB 4.41Å; V187-R190 PolarHBondContact O-N 3.03Å; V187-R190 VanDerWaalsContact O-N 3.16Å; F188-R190 VanDerWaalsContact C-N 3.26Å; F188-R190 PolarHBondContact O-N 2.82Å
191	N	50.5	Low	64.9	Low	27 Å²	27	65.2 Å²	65.2	14%	0.144	35%	0.354	C	S	.	.	H	α-helix	trans	-104.9	-9.2	-166.7	-62.5	95.4	0	0	0	114.2	T143 V187	T143-N191 VanDerWaalsContact CA-O 3.27Å; T143-N191 WeakPolarHBondContact CA-O 3.47Å; V187-N191 PolarHBondContact N-OD1 2.96Å; V187-N191 PolarHBondContact O-N 3.19Å; V187-N191 PolarHBondContact O-OD1 2.75Å
192	V	52.6	Low	64.8	Low	22 Å²	22	61 Å²	61	13%	0.133	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-97.7	133.1	-173.2	176.8	0	0	0	0	111.8	F188 I201 L205	F188-V192 HydrophobicContact CD2-CB 4.48Å; F188-V192 HydrophobicContact CD2-CG2 3.79Å; F188-V192 HydrophobicContact CE2-CB 4.32Å; F188-V192 HydrophobicContact CE2-CG1 4.07Å; F188-V192 HydrophobicContact CE2-CG2 3.95Å; F188-V192 HydrophobicContact CG-CG2 4.33Å; F188-V192 HydrophobicContact CZ-CG1 4.15Å; F188-V192 WeakPolarHBondContact O-CB 3.44Å; V192-I201 HydrophobicContact CG1-CB 4.42Å; V192-I201 HydrophobicContact CG1-CD1 3.44Å; V192-I201 VanDerWaalsContact CG1-CD1 3.44Å; V192-I201 HydrophobicContact CG1-CG1 4.48Å; V192-I201 HydrophobicContact CG1-CG2 3.65Å; V192-I201 HydrophobicContact CG2-CG2 4.01Å; V192-L205 HydrophobicContact CG2-CD1 3.7Å
193	L	47.8	Very low	64.8	Low	55 Å²	55	55.5 Å²	55.5	29%	0.288	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-69.4	127.7	173.7	-71.2	177.3	0	0	0	111	G141 I142 V144	G141-L193 WeakPolarHBondContact O-CD1 3.45Å; I142-L193 PolarHBondContact O-N 3.31Å; V144-L193 HydrophobicContact CG2-CD2 3.99Å
194	P	46.9	Very low	64.6	Low	85 Å²	85	57.7 Å²	57.7	55%	0.552	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	133.2	177.6	28.2	-32.9	0	0	0	110.4
195	G	46.1	Very low	64.5	Low	84 Å²	84	52.3 Å²	52.3	87%	0.866	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.4	-12.4	174.3	0	0	0	0	0	115.7
196	S	54.7	Low	64.5	Low	57 Å²	57	52 Å²	52	40%	0.399	30%	0.295	S	S	.	.	S	Bend	trans	-104.8	156.2	171.3	-11.5	0	0	0	0	111.5	V198	S196-V198 PolarHBondContact O-N 3.17Å; S196-V198 VanDerWaalsContact O-N 3.12Å
197	C	54.7	Low	64.7	Low	70 Å²	70	55.7 Å²	55.7	47%	0.473	31%	0.312	S	S	.	.			trans	-56.1	119	-179.2	-178.3	0	0	0	0	110.5	W199 T200 I201	C197-W199 PolarHBondContact O-N 3.2Å; C197-W199 VanDerWaalsContact O-N 3.1Å; C197-T200 PolarHBondContact O-N 3.4Å; C197-I201 PolarHBondContact O-N 2.99Å
198	V	61.9	Low	64.9	Low	69 Å²	69	61.8 Å²	61.8	42%	0.418	34%	0.335	S	S	.	.	H	α-helix	trans	-47.6	-42.4	-177.8	168.7	0	0	0	0	111.5	F188 S196 T202	F188-V198 HydrophobicContact CE1-CB 4.49Å; F188-V198 HydrophobicContact CE1-CG1 3.87Å; F188-V198 HydrophobicContact CE1-CG2 4.14Å; F188-V198 HydrophobicContact CE2-CG1 4.02Å; F188-V198 HydrophobicContact CZ-CB 3.89Å; F188-V198 HydrophobicContact CZ-CG1 3.47Å; F188-V198 VanDerWaalsContact CZ-CG1 3.47Å; F188-V198 HydrophobicContact CZ-CG2 3.82Å; S196-V198 PolarHBondContact O-N 3.17Å; S196-V198 VanDerWaalsContact O-N 3.12Å; V198-T202 VanDerWaalsContact O-CB 3.25Å; V198-T202 WeakPolarHBondContact O-CB 3.32Å; V198-T202 PolarHBondContact O-N 3.44Å; V198-T202 PolarHBondContact O-OG1 3.03Å
199	W	66.4	Low	65.9	Low	108 Å²	108	60.3 Å²	60.3	41%	0.409	33%	0.328	S	S	.	.	H	α-helix	trans	-68.4	-44.4	-179.4	-54.8	106.2	0	0	0	112.8	C197 T202 S203 A226 F229	C197-W199 PolarHBondContact O-N 3.2Å; C197-W199 VanDerWaalsContact O-N 3.1Å; W199-T202 PolarHBondContact O-N 2.99Å; W199-S203 VanDerWaalsContact O-CB 3.32Å; W199-S203 WeakPolarHBondContact O-CB 3.46Å; W199-S203 PolarHBondContact O-N 3.23Å; W199-S203 PolarHBondContact O-OG 3.05Å; W199-A226 HydrophobicContact CH2-CB 3.74Å; W199-A226 HydrophobicContact CZ3-CB 4.15Å; W199-F229 AromaticContact CE3-CD1 3.33Å; W199-F229 HydrophobicContact CE3-CD1 3.33Å; W199-F229 AromaticContact CE3-CE1 3.61Å; W199-F229 HydrophobicContact CE3-CE1 3.61Å; W199-F229 HydrophobicContact CE3-CG 4Å; W199-F229 HydrophobicContact CE3-CZ 4.46Å; W199-F229 HydrophobicContact CH2-CB 4.35Å; W199-F229 HydrophobicContact CZ3-CB 3.74Å; W199-F229 AromaticContact CZ3-CD1 3.32Å; W199-F229 HydrophobicContact CZ3-CD1 3.32Å; W199-F229 HydrophobicContact CZ3-CE1 4.1Å; W199-F229 AromaticContact CZ3-CG 3.64Å; W199-F229 HydrophobicContact CZ3-CG 3.64Å
200	T	64.6	Low	67.1	Low	90 Å²	90	55.2 Å²	55.2	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-63.6	-45.9	178.7	-51.8	0	0	0	0	110.8	C197 S203 E204	C197-T200 PolarHBondContact O-N 3.4Å; T200-S203 PolarHBondContact O-N 3.41Å; T200-E204 WeakPolarHBondContact O-CB 3.42Å; T200-E204 PolarHBondContact O-N 2.97Å
201	I	71.3	Confident	68.7	Low	9 Å²	9	51.6 Å²	51.6	5%	0.046	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-48.4	177.2	-62.4	175.6	0	0	0	110.6	I142 F188 V192 C197 S203 E204 L205	I142-I201 HydrophobicContact CG2-CG2 3.56Å; F188-I201 HydrophobicContact CE2-CB 4.49Å; F188-I201 HydrophobicContact CE2-CG2 4.28Å; V192-I201 HydrophobicContact CG1-CB 4.42Å; V192-I201 HydrophobicContact CG1-CD1 3.44Å; V192-I201 VanDerWaalsContact CG1-CD1 3.44Å; V192-I201 HydrophobicContact CG1-CG1 4.48Å; V192-I201 HydrophobicContact CG1-CG2 3.65Å; V192-I201 HydrophobicContact CG2-CG2 4.01Å; C197-I201 PolarHBondContact O-N 2.99Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3Å; I201-E204 PolarHBondContact O-N 3.07Å; I201-L205 HydrophobicContact CG2-CD1 3.82Å; I201-L205 HydrophobicContact CG2-CG 4.13Å; I201-L205 WeakPolarHBondContact O-CB 3.39Å; I201-L205 WeakPolarHBondContact O-CG 3.46Å; I201-L205 PolarHBondContact O-N 3.15Å
202	T	74.8	Confident	70.6	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-41.3	-177.1	-56.2	0	0	0	0	111.1	F158 F188 V198 W199 L205 I206 Q230	F158-T202 HydrophobicContact CE1-CG2 4.09Å; F158-T202 HydrophobicContact CZ-CG2 3.84Å; F188-T202 WeakPolarHBondContact CD2-OG1 3.49Å; F188-T202 WeakPolarHBondContact CE2-OG1 3.43Å; V198-T202 VanDerWaalsContact O-CB 3.25Å; V198-T202 WeakPolarHBondContact O-CB 3.32Å; V198-T202 PolarHBondContact O-N 3.44Å; V198-T202 PolarHBondContact O-OG1 3.03Å; W199-T202 PolarHBondContact O-N 2.99Å; T202-L205 PolarHBondContact O-N 3.05Å; T202-I206 HydrophobicContact CG2-CD1 3.68Å; T202-I206 HydrophobicContact CG2-CG1 4.27Å; T202-I206 WeakPolarHBondContact O-CB 3.19Å; T202-I206 WeakPolarHBondContact O-CG1 3.28Å; T202-I206 PolarHBondContact O-N 2.96Å; T202-Q230 HydrophobicContact CG2-CG 3.7Å
203	S	80.1	Confident	72.4	Confident	22 Å²	22	50.3 Å²	50.3	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-44.5	174.8	-66.1	0	0	0	0	111.7	W199 T200 I201 I206 E207 F233	W199-S203 VanDerWaalsContact O-CB 3.32Å; W199-S203 WeakPolarHBondContact O-CB 3.46Å; W199-S203 PolarHBondContact O-N 3.23Å; W199-S203 PolarHBondContact O-OG 3.05Å; T200-S203 PolarHBondContact O-N 3.41Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3Å; S203-I206 PolarHBondContact O-N 3.03Å; S203-E207 WeakPolarHBondContact O-CB 3.24Å; S203-E207 PolarHBondContact O-N 3.16Å; S203-F233 VanDerWaalsContact CA-CE1 3.47Å; S203-F233 WeakPolarHBondContact O-CE1 3.39Å
204	E	80.9	Confident	74.6	Confident	54 Å²	54	47.7 Å²	47.7	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-67.5	-38.8	178.1	-171.2	171.4	176.3	0	0	112.6	I142 T200 I201 E207 R208 R209	I142-E204 HydrophobicContact CD1-CB 4.04Å; I142-E204 HydrophobicContact CD1-CG 3.51Å; I142-E204 WeakPolarHBondContact CD1-OE1 3.26Å; I142-E204 WeakPolarHBondContact CD1-OE2 3.47Å; T200-E204 WeakPolarHBondContact O-CB 3.42Å; T200-E204 PolarHBondContact O-N 2.97Å; I201-E204 PolarHBondContact O-N 3.07Å; E204-E207 PolarHBondContact O-N 3.45Å; E204-R208 HydrophobicContact CG-CB 4.37Å; E204-R208 WeakPolarHBondContact O-CA 3.22Å; E204-R208 WeakPolarHBondContact O-CB 3.27Å; E204-R208 PolarHBondContact O-N 2.8Å; E204-R209 PolarHBondContact O-N 3.43Å
205	L	82.6	Confident	76.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-59.8	-50.5	173.5	-77.6	173.5	0	0	0	111.1	I142 T143 F155 F158 V192 I201 T202 R209 C210	I142-L205 HydrophobicContact CG2-CD1 4.29Å; I142-L205 HydrophobicContact CG2-CD2 3.63Å; I142-L205 HydrophobicContact CG2-CG 3.81Å; T143-L205 HydrophobicContact CG2-CD2 4.49Å; F155-L205 HydrophobicContact CE2-CD2 4.49Å; F158-L205 HydrophobicContact CD2-CD1 4.48Å; F158-L205 HydrophobicContact CE2-CD1 4.23Å; V192-L205 HydrophobicContact CG2-CD1 3.7Å; I201-L205 HydrophobicContact CG2-CD1 3.82Å; I201-L205 HydrophobicContact CG2-CG 4.13Å; I201-L205 WeakPolarHBondContact O-CB 3.39Å; I201-L205 WeakPolarHBondContact O-CG 3.46Å; I201-L205 PolarHBondContact O-N 3.15Å; T202-L205 PolarHBondContact O-N 3.05Å; L205-R209 HydrophobicContact CD2-CB 3.98Å; L205-R209 HydrophobicContact CD2-CG 4.11Å; L205-R209 PolarHBondContact O-N 2.88Å; L205-C210 VanDerWaalsContact O-CB 3.29Å; L205-C210 WeakPolarHBondContact O-CB 3.48Å; L205-C210 PolarHBondContact O-N 3.19Å; L205-C210 PolarHBondContact O-SG 3.36Å
206	I	84.6	Confident	79.2	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.2	C	C	.	.	I	π-helix	trans	-63.2	-45.8	-179.5	-69.8	170	0	0	0	110.3	F158 T202 S203 M213 Q230 F233 A234 L237 R245	F158-I206 HydrophobicContact CD1-CD1 4.23Å; F158-I206 HydrophobicContact CD1-CG1 3.79Å; F158-I206 HydrophobicContact CE1-CD1 4.17Å; F158-I206 HydrophobicContact CE1-CG1 4.14Å; F158-I206 HydrophobicContact CG-CG1 4.28Å; T202-I206 HydrophobicContact CG2-CD1 3.68Å; T202-I206 HydrophobicContact CG2-CG1 4.27Å; T202-I206 WeakPolarHBondContact O-CB 3.19Å; T202-I206 WeakPolarHBondContact O-CG1 3.28Å; T202-I206 PolarHBondContact O-N 2.96Å; S203-I206 PolarHBondContact O-N 3.03Å; I206-M213 HydrophobicContact CD1-CE 3.96Å; I206-M213 HydrophobicContact CD1-SD 4.06Å; I206-M213 HydrophobicContact CG1-SD 4.27Å; I206-M213 HydrophobicContact CG2-SD 4.39Å; I206-Q230 HydrophobicContact CD1-CB 4.17Å; I206-Q230 HydrophobicContact CD1-CG 4.41Å; I206-F233 HydrophobicContact CB-CD1 4.31Å; I206-F233 HydrophobicContact CB-CE1 4.23Å; I206-F233 HydrophobicContact CD1-CD1 4.32Å; I206-F233 HydrophobicContact CG2-CD1 4.04Å; I206-F233 HydrophobicContact CG2-CE1 4.16Å; I206-A234 HydrophobicContact CG2-CB 3.79Å; I206-L237 HydrophobicContact CG2-CD1 4Å; I206-R245 PolarHBondContact O-NH2 3.1Å
207	E	84.1	Confident	81	Confident	77 Å²	77	37 Å²	37	36%	0.36	18%	0.181	S	C	.	.	I	π-helix	trans	-76.7	-46.4	-172.7	-174.3	-168.1	137.6	0	0	112.8	S203 E204 F233 L237 R245	S203-E207 WeakPolarHBondContact O-CB 3.24Å; S203-E207 PolarHBondContact O-N 3.16Å; E204-E207 PolarHBondContact O-N 3.45Å; E207-F233 HydrophobicContact CB-CE1 4.39Å; E207-F233 HydrophobicContact CB-CZ 4.43Å; E207-L237 HydrophobicContact CB-CD1 3.75Å; E207-L237 HydrophobicContact CG-CD1 3.99Å; E207-L237 HydrophobicContact CG-CD2 4.03Å; E207-R245 PolarHBondContact O-NH2 3.03Å
208	R	81.3	Confident	82.9	Confident	134 Å²	134	33.6 Å²	33.6	51%	0.506	16%	0.158	S	C	.	.	I	π-helix	trans	-118.3	-26.9	-162.1	-61.1	-172	174.6	-157.9	-3.7	114.7	M154 E204	M154-R208 VanDerWaalsContact CE-O 3.32Å; M154-R208 WeakPolarHBondContact CE-O 3.42Å; E204-R208 HydrophobicContact CG-CB 4.37Å; E204-R208 WeakPolarHBondContact O-CA 3.22Å; E204-R208 WeakPolarHBondContact O-CB 3.27Å; E204-R208 PolarHBondContact O-N 2.8Å
209	R	82.7	Confident	84.5	Confident	15 Å²	15	31.4 Å²	31.4	6%	0.057	14%	0.144	C	C	.	.	I	π-helix	trans	-101.4	-25.6	-175.8	-53.8	-57.2	-162.3	97.8	8	113.9	I142 D146 E153 M154 F155 E204 L205	I142-R209 HydrophobicContact CD1-CG 4.11Å; D146-R209 IonicContact OD1-CZ 3.24Å; D146-R209 IonicContact OD1-NH1 2.69Å; D146-R209 PolarHBondContact OD1-NH1 2.89Å; D146-R209 IonicContact OD1-NH2 3Å; D146-R209 IonicContact OD2-CZ 2.67Å; D146-R209 IonicContact OD2-NH1 3.79Å; D146-R209 PolarHBondContact OD2-NH1 2.94Å; D146-R209 IonicContact OD2-NH2 2.89Å; D146-R209 PolarHBondContact OD2-NH2 3.2Å; E153-R209 VanDerWaalsContact N-NH1 3.11Å; E153-R209 PolarHBondContact O-NH1 3.07Å; M154-R209 WeakPolarHBondContact CA-O 3.34Å; F155-R209 HydrophobicContact CD2-CB 4.34Å; F155-R209 PolarHBondContact N-O 3.18Å; E204-R209 PolarHBondContact O-N 3.43Å; L205-R209 HydrophobicContact CD2-CB 3.98Å; L205-R209 HydrophobicContact CD2-CG 4.11Å; L205-R209 PolarHBondContact O-N 2.88Å
210	C	86.8	Confident	85.8	Confident	4 Å²	4	29.8 Å²	29.8	3%	0.027	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.9	-174.8	-58.2	0	0	0	0	112	F155 F158 L205 R245	F155-C210 WeakPolarHBondContact O-CA 3.24Å; F158-C210 HydrophobicContact CB-CB 3.97Å; L205-C210 VanDerWaalsContact O-CB 3.29Å; L205-C210 WeakPolarHBondContact O-CB 3.48Å; L205-C210 PolarHBondContact O-N 3.19Å; L205-C210 PolarHBondContact O-SG 3.36Å; C210-R245 PolarHBondContact O-NH2 3.4Å
211	K	87.3	Confident	87.1	Confident	97 Å²	97	25.9 Å²	25.9	42%	0.422	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-39.9	176.1	-60.6	175.2	-170	158.4	0	111.8	F155 D156 R245	F155-K211 PolarHBondContact O-N 2.84Å; D156-K211 IonicContact OD1-NZ 3.49Å; D156-K211 PolarHBondContact OD1-NZ 3.03Å; K211-R245 WeakPolarHBondContact O-CG 3.23Å
212	R	90.1	Very high	88.1	Confident	18 Å²	18	28 Å²	28	7%	0.068	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	167.1	-179.8	-63.5	-165.3	178.9	74.3	9	112.2	D156 A157 F158 K244 R245 A286 L287 L289 P290	D156-R212 PolarHBondContact O-N 2.75Å; D156-R212 VanDerWaalsContact O-N 3.08Å; A157-R212 CarbonylContact C-O 3.47Å; A157-R212 VanDerWaalsContact CA-O 3.22Å; A157-R212 WeakPolarHBondContact CA-O 3.23Å; A157-R212 HydrophobicContact CB-CB 4.37Å; F158-R212 PolarHBondContact N-O 3.37Å; R212-K244 PolarHBondContact NE-O 2.94Å; R212-R245 CarbonylContact C-O 3.59Å; R212-R245 WeakPolarHBondContact CA-O 3.38Å; R212-R245 VanDerWaalsContact CB-O 3.3Å; R212-R245 WeakPolarHBondContact CB-O 2.97Å; R212-A286 PolarHBondContact NE-O 3.18Å; R212-A286 PolarHBondContact NH1-O 2.74Å; R212-L287 HydrophobicContact CB-CD2 4.11Å; R212-L287 PolarHBondContact NH1-O 3.09Å; R212-L289 PolarHBondContact NH1-O 3.39Å; R212-L289 VanDerWaalsContact NH2-C 3.28Å; R212-L289 PolarHBondContact NH2-O 2.86Å; R212-P290 PolarHBondContact NH2-O 3.36Å
213	M	91.3	Very high	88.9	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.015	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.9	172.6	-177.1	175.8	-175.7	0	0	108.7	F158 C160 I206 V215 Q230 A234 R245 L246 I247	F158-M213 HydrophobicContact CD1-CE 4.09Å; F158-M213 HydrophobicContact CD1-CG 4.11Å; F158-M213 HydrophobicContact CD1-SD 4.45Å; F158-M213 HydrophobicContact CE1-CE 4.2Å; F158-M213 CarbonylContact O-C 3.54Å; F158-M213 WeakPolarHBondContact O-CA 3.22Å; C160-M213 HydrophobicContact CB-CE 3.27Å; C160-M213 HydrophobicContact CB-CG 4.45Å; C160-M213 VanDerWaalsContact SG-CE 3.59Å; I206-M213 HydrophobicContact CD1-CE 3.96Å; I206-M213 HydrophobicContact CD1-SD 4.06Å; I206-M213 HydrophobicContact CG1-SD 4.27Å; I206-M213 HydrophobicContact CG2-SD 4.39Å; M213-V215 HydrophobicContact CE-CG2 4.12Å; M213-V215 HydrophobicContact CG-CG2 4.03Å; M213-V215 HydrophobicContact SD-CG2 4.31Å; M213-Q230 HydrophobicContact CE-CB 3.92Å; M213-A234 HydrophobicContact CE-CB 4.47Å; M213-A234 HydrophobicContact SD-CB 3.32Å; M213-A234 WeakPolarHBondContact SD-CB 3.21Å; M213-R245 PolarHBondContact N-O 3.47Å; M213-L246 CarbonylContact O-C 3.57Å; M213-L246 WeakPolarHBondContact O-CA 3.45Å; M213-L246 HydrophobicContact SD-CD1 4.13Å; M213-I247 PolarHBondContact O-N 3.47Å
214	V	93.8	Very high	89.3	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.5	169.7	179	0	0	0	0	107.6	A157 F158 C160 M172 V216 I247 V249 L287	A157-V214 HydrophobicContact CB-CG2 4.12Å; F158-V214 PolarHBondContact O-N 3.37Å; C160-V214 PolarHBondContact N-O 2.85Å; M172-V214 HydrophobicContact CE-CG1 4.22Å; M172-V214 HydrophobicContact SD-CG1 4.19Å; V214-V216 HydrophobicContact CG1-CG2 4.41Å; V214-I247 WeakPolarHBondContact CA-O 3.43Å; V214-V249 HydrophobicContact CG1-CB 4.27Å; V214-V249 HydrophobicContact CG1-CG2 3.63Å; V214-L287 HydrophobicContact CG2-CD1 4.13Å; V214-L287 HydrophobicContact CG2-CD2 3.81Å
215	V	93.9	Very high	89.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107.8	179.5	174.3	0	0	0	0	108.5	C160 M213 I217 Y221 L246 I247 P248 V249	C160-V215 HydrophobicContact CB-CG2 4.45Å; M213-V215 HydrophobicContact CE-CG2 4.12Å; M213-V215 HydrophobicContact CG-CG2 4.03Å; M213-V215 HydrophobicContact SD-CG2 4.31Å; V215-I217 HydrophobicContact CG1-CD1 4.36Å; V215-I217 HydrophobicContact CG1-CG1 3.76Å; V215-I217 PolarHBondContact O-N 3.09Å; V215-Y221 HydrophobicContact CG1-CD1 4.47Å; V215-Y221 HydrophobicContact CG1-CE1 3.58Å; V215-Y221 HydrophobicContact CG1-CE2 4.07Å; V215-Y221 VanDerWaalsContact CG1-OH 3.24Å; V215-Y221 WeakPolarHBondContact CG1-OH 3.48Å; V215-L246 HydrophobicContact CB-CD2 4.3Å; V215-L246 HydrophobicContact CG2-CD1 4.12Å; V215-L246 HydrophobicContact CG2-CD2 3.75Å; V215-L246 HydrophobicContact CG2-CG 3.86Å; V215-I247 PolarHBondContact N-O 3.04Å; V215-P248 CarbonylContact O-C 3.58Å; V215-P248 WeakPolarHBondContact O-CA 3.41Å; V215-V249 PolarHBondContact O-N 3.17Å
216	V	94.9	Very high	89.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	103.9	178.7	-177.5	0	0	0	0	108.6	I159 C160 D165 F168 V169 M172 V214 Y221 Y251	I159-V216 HydrophobicContact CG2-CG2 4.23Å; C160-V216 PolarHBondContact O-N 3.22Å; D165-V216 HydrophobicContact CB-CG1 4.26Å; F168-V216 HydrophobicContact CD1-CG1 3.93Å; F168-V216 HydrophobicContact CE1-CG1 4.16Å; V169-V216 HydrophobicContact CG2-CG2 4.03Å; M172-V216 HydrophobicContact CE-CG2 3.93Å; V214-V216 HydrophobicContact CG1-CG2 4.41Å; V216-Y221 WeakPolarHBondContact O-CD2 3.48Å; V216-Y251 HydrophobicContact CG1-CD1 3.83Å; V216-Y251 HydrophobicContact CG1-CE1 4.03Å
217	I	94.2	Very high	89.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.2	-173	-57.3	177.9	0	0	0	110.3	V215 L222 P248 V249 M254 F258 L262	V215-I217 HydrophobicContact CG1-CD1 4.36Å; V215-I217 HydrophobicContact CG1-CG1 3.76Å; V215-I217 PolarHBondContact O-N 3.09Å; I217-L222 HydrophobicContact CG2-CD2 4.27Å; I217-P248 HydrophobicContact CD1-CB 3.7Å; I217-V249 PolarHBondContact N-O 3.17Å; I217-M254 HydrophobicContact CG2-CE 3.7Å; I217-M254 HydrophobicContact CG2-SD 3.58Å; I217-M254 VanDerWaalsContact CG2-SD 3.58Å; I217-F258 HydrophobicContact CD1-CD2 4.26Å; I217-F258 HydrophobicContact CD1-CE1 4.5Å; I217-F258 HydrophobicContact CD1-CE2 3.29Å; I217-F258 HydrophobicContact CD1-CZ 3.43Å; I217-F258 VanDerWaalsContact CD1-CZ 3.43Å; I217-F258 HydrophobicContact CG2-CE2 4.42Å; I217-L262 HydrophobicContact CD1-CD1 3.58Å; I217-L262 HydrophobicContact CG1-CD1 4.49Å
218	S	94.6	Very high	89.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.			trans	-141.5	169.9	175.1	61.7	0	0	0	0	110.3	D165 E220 Y221 L222	D165-S218 VanDerWaalsContact OD1-CB 3.27Å; D165-S218 WeakPolarHBondContact OD1-CB 3.48Å; D165-S218 PolarHBondContact OD1-OG 2.91Å; D165-S218 VanDerWaalsContact OD2-CB 3.3Å; D165-S218 WeakPolarHBondContact OD2-CB 3.19Å; D165-S218 PolarHBondContact OD2-OG 3.3Å; S218-E220 WeakPolarHBondContact CB-OE2 3.28Å; S218-E220 PolarHBondContact O-N 2.92Å; S218-Y221 WeakPolarHBondContact O-CB 3.46Å; S218-Y221 PolarHBondContact O-N 3.32Å; S218-Y221 WeakPolarHBondContact OG-CB 3.39Å; S218-Y221 PolarHBondContact OG-N 3.45Å; S218-L222 WeakPolarHBondContact O-CG 3.32Å; S218-L222 PolarHBondContact O-N 2.87Å
219	D	94.1	Very high	90.2	Very high	22 Å²	22	36.4 Å²	36.4	12%	0.118	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-33.9	174.8	-75.5	-25.6	0	0	0	111.5	L222 M254 T255 K256	D219-L222 PolarHBondContact O-N 2.82Å; D219-M254 WeakPolarHBondContact OD1-CB 3.41Å; D219-T255 PolarHBondContact OD1-N 2.98Å; D219-T255 WeakPolarHBondContact OD2-CB 3.35Å; D219-T255 PolarHBondContact OD2-N 3.17Å; D219-T255 PolarHBondContact OD2-OG1 2.87Å; D219-K256 HydrophobicContact CB-CD 4.31Å; D219-K256 PolarHBondContact O-NZ 3.45Å; D219-K256 WeakPolarHBondContact OD1-CB 3.23Å; D219-K256 PolarHBondContact OD1-N 3.2Å
220	E	93.3	Very high	90.5	Very high	75 Å²	75	36.7 Å²	36.7	35%	0.35	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-35.8	176.8	-60.7	76.9	-170.2	0	0	112.1	C162 S218 L222 D223 S224 K252	C162-E220 HydrophobicContact CB-CB 4.36Å; S218-E220 WeakPolarHBondContact CB-OE2 3.28Å; S218-E220 PolarHBondContact O-N 2.92Å; E220-L222 PolarHBondContact O-N 2.62Å; E220-D223 PolarHBondContact O-N 2.92Å; E220-D223 VanDerWaalsContact O-N 3.16Å; E220-S224 PolarHBondContact O-N 3.32Å; E220-K252 IonicContact OE1-NZ 3.8Å; E220-K252 WeakPolarHBondContact OE2-CE 3.28Å; E220-K252 IonicContact OE2-NZ 2.88Å; E220-K252 PolarHBondContact OE2-NZ 2.87Å
221	Y	93.2	Very high	90.6	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-59	-38.7	173.1	-174	-86.7	0	0	0	111.4	C160 V215 V216 S218 D223 S224 C227 T231	C160-Y221 HydrophobicContact CB-CE2 4.5Å; C160-Y221 VanDerWaalsContact SG-CE2 3.6Å; C160-Y221 PolarHBondContact SG-OH 2.93Å; V215-Y221 HydrophobicContact CG1-CD1 4.47Å; V215-Y221 HydrophobicContact CG1-CE1 3.58Å; V215-Y221 HydrophobicContact CG1-CE2 4.07Å; V215-Y221 VanDerWaalsContact CG1-OH 3.24Å; V215-Y221 WeakPolarHBondContact CG1-OH 3.48Å; V216-Y221 WeakPolarHBondContact O-CD2 3.48Å; S218-Y221 WeakPolarHBondContact O-CB 3.46Å; S218-Y221 PolarHBondContact O-N 3.32Å; S218-Y221 WeakPolarHBondContact OG-CB 3.39Å; S218-Y221 PolarHBondContact OG-N 3.45Å; Y221-D223 VanDerWaalsContact C-N 3.26Å; Y221-D223 PolarHBondContact O-N 2.82Å; Y221-S224 PolarHBondContact O-N 3.47Å; Y221-C227 HydrophobicContact CD1-CB 4.13Å; Y221-C227 HydrophobicContact CD2-CB 3.74Å; Y221-C227 VanDerWaalsContact CD2-SG 3.53Å; Y221-C227 HydrophobicContact CE1-CB 3.86Å; Y221-C227 HydrophobicContact CE2-CB 3.45Å; Y221-C227 VanDerWaalsContact CE2-CB 3.45Å; Y221-C227 WeakPolarHBondContact CE2-SG 3.4Å; Y221-C227 HydrophobicContact CG-CB 4.06Å; Y221-C227 VanDerWaalsContact CZ-CB 3.48Å; Y221-C227 PolarHBondContact OH-O 3.13Å; Y221-T231 PolarHBondContact OH-OG1 2.99Å
222	L	91.5	Very high	90.6	Very high	52 Å²	52	37.2 Å²	37.2	27%	0.272	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-70.4	-19.8	178.9	-61.1	-169.8	0	0	0	114	I217 S218 D219 E220 M254 K256 P259	I217-L222 HydrophobicContact CG2-CD2 4.27Å; S218-L222 WeakPolarHBondContact O-CG 3.32Å; S218-L222 PolarHBondContact O-N 2.87Å; D219-L222 PolarHBondContact O-N 2.82Å; E220-L222 PolarHBondContact O-N 2.62Å; L222-M254 HydrophobicContact CD1-CE 3.45Å; L222-M254 VanDerWaalsContact CD1-CE 3.45Å; L222-M254 HydrophobicContact CG-CE 3.96Å; L222-K256 HydrophobicContact CB-CD 4.34Å; L222-K256 HydrophobicContact CD1-CB 3.82Å; L222-K256 HydrophobicContact CD1-CD 4.25Å; L222-P259 HydrophobicContact CD1-CG 4.35Å; L222-P259 HydrophobicContact CD2-CG 3.24Å; L222-P259 HydrophobicContact CG-CG 4.43Å
223	D	91.3	Very high	90.5	Very high	113 Å²	113	38.3 Å²	38.3	60%	0.604	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-92	-11.1	176.5	-70.8	-20.8	0	0	0	113.1	E220 Y221 D225 K256	E220-D223 PolarHBondContact O-N 2.92Å; E220-D223 VanDerWaalsContact O-N 3.16Å; Y221-D223 VanDerWaalsContact C-N 3.26Å; Y221-D223 PolarHBondContact O-N 2.82Å; D223-D225 PolarHBondContact O-N 3.5Å; D223-K256 IonicContact OD1-NZ 3.46Å; D223-K256 PolarHBondContact OD1-NZ 3.25Å; D223-K256 IonicContact OD2-NZ 2.75Å; D223-K256 PolarHBondContact OD2-NZ 3.05Å
224	S	88.7	Confident	90.3	Very high	30 Å²	30	38.4 Å²	38.4	21%	0.21	20%	0.199	C	C	.	.			trans	-85.7	111.3	-176.5	172.2	0	0	0	0	111.1	E220 Y221 A226 C227 D228	E220-S224 PolarHBondContact O-N 3.32Å; Y221-S224 PolarHBondContact O-N 3.47Å; S224-A226 PolarHBondContact O-N 3.15Å; S224-C227 WeakPolarHBondContact O-CB 3.49Å; S224-C227 PolarHBondContact O-N 3.06Å; S224-C227 VanDerWaalsContact O-N 3.09Å; S224-C227 PolarHBondContact OG-N 2.75Å; S224-C227 PolarHBondContact OG-SG 3.4Å; S224-D228 PolarHBondContact O-N 2.94Å
225	D	85.5	Confident	90	Very high	136 Å²	136	39.4 Å²	39.4	73%	0.727	20%	0.204	S	C	*	.	H	α-helix	trans	-56.7	-33	174.4	-69.9	-29.8	0	0	0	112.3	D223 F229	D223-D225 PolarHBondContact O-N 3.5Å; D225-F229 WeakPolarHBondContact O-CB 3.18Å; D225-F229 PolarHBondContact O-N 3.2Å
226	A	83	Confident	89.6	Confident	35 Å²	35	43.2 Å²	43.2	29%	0.289	23%	0.231	S	C	.	.	H	α-helix	trans	-67.7	-44.4	176.1	0	0	0	0	0	112.5	W199 S224 F229 Q230	W199-A226 HydrophobicContact CH2-CB 3.74Å; W199-A226 HydrophobicContact CZ3-CB 4.15Å; S224-A226 PolarHBondContact O-N 3.15Å; A226-F229 PolarHBondContact O-N 3.49Å; A226-Q230 WeakPolarHBondContact O-CB 3.24Å; A226-Q230 WeakPolarHBondContact O-CG 3.49Å; A226-Q230 PolarHBondContact O-N 3.39Å
227	C	88.1	Confident	88.9	Confident	4 Å²	4	45.8 Å²	45.8	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-40.4	176.3	-69	0	0	0	0	111.7	Y221 S224 Q230 T231	Y221-C227 HydrophobicContact CD1-CB 4.13Å; Y221-C227 HydrophobicContact CD2-CB 3.74Å; Y221-C227 VanDerWaalsContact CD2-SG 3.53Å; Y221-C227 HydrophobicContact CE1-CB 3.86Å; Y221-C227 HydrophobicContact CE2-CB 3.45Å; Y221-C227 VanDerWaalsContact CE2-CB 3.45Å; Y221-C227 WeakPolarHBondContact CE2-SG 3.4Å; Y221-C227 HydrophobicContact CG-CB 4.06Å; Y221-C227 VanDerWaalsContact CZ-CB 3.48Å; Y221-C227 PolarHBondContact OH-O 3.13Å; S224-C227 WeakPolarHBondContact O-CB 3.49Å; S224-C227 PolarHBondContact O-N 3.06Å; S224-C227 VanDerWaalsContact O-N 3.09Å; S224-C227 PolarHBondContact OG-N 2.75Å; S224-C227 PolarHBondContact OG-SG 3.4Å; C227-Q230 PolarHBondContact O-N 3.29Å; C227-T231 WeakPolarHBondContact O-CB 3.39Å; C227-T231 PolarHBondContact O-N 2.96Å; C227-T231 PolarHBondContact O-OG1 3.32Å
228	D	88.9	Confident	87.8	Confident	64 Å²	64	46.9 Å²	46.9	34%	0.342	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-48.6	176	177.5	65.6	0	0	0	111.6	S224 T231 K232	S224-D228 PolarHBondContact O-N 2.94Å; D228-T231 PolarHBondContact O-N 3.31Å; D228-K232 VanDerWaalsContact CG-NZ 3.26Å; D228-K232 WeakPolarHBondContact O-CB 3.28Å; D228-K232 WeakPolarHBondContact O-CG 3.16Å; D228-K232 PolarHBondContact O-N 2.99Å; D228-K232 WeakPolarHBondContact OD1-CE 3.42Å; D228-K232 IonicContact OD1-NZ 2.78Å; D228-K232 PolarHBondContact OD1-NZ 2.93Å; D228-K232 VanDerWaalsContact OD1-NZ 3.08Å; D228-K232 VanDerWaalsContact OD2-CE 3.3Å; D228-K232 WeakPolarHBondContact OD2-CE 3.26Å; D228-K232 IonicContact OD2-NZ 3.65Å; D228-K232 PolarHBondContact OD2-NZ 3.26Å
229	F	87.6	Confident	86.4	Confident	88 Å²	88	52.6 Å²	52.6	39%	0.386	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-50.6	175.2	173.1	-90.1	0	0	0	111.8	W199 D225 A226 T231 K232 F233	W199-F229 AromaticContact CE3-CD1 3.33Å; W199-F229 HydrophobicContact CE3-CD1 3.33Å; W199-F229 AromaticContact CE3-CE1 3.61Å; W199-F229 HydrophobicContact CE3-CE1 3.61Å; W199-F229 HydrophobicContact CE3-CG 4Å; W199-F229 HydrophobicContact CE3-CZ 4.46Å; W199-F229 HydrophobicContact CH2-CB 4.35Å; W199-F229 HydrophobicContact CZ3-CB 3.74Å; W199-F229 AromaticContact CZ3-CD1 3.32Å; W199-F229 HydrophobicContact CZ3-CD1 3.32Å; W199-F229 HydrophobicContact CZ3-CE1 4.1Å; W199-F229 AromaticContact CZ3-CG 3.64Å; W199-F229 HydrophobicContact CZ3-CG 3.64Å; D225-F229 WeakPolarHBondContact O-CB 3.18Å; D225-F229 PolarHBondContact O-N 3.2Å; A226-F229 PolarHBondContact O-N 3.49Å; F229-T231 VanDerWaalsContact C-N 3.3Å; F229-T231 PolarHBondContact O-N 3.34Å; F229-K232 PolarHBondContact O-N 2.9Å; F229-F233 HydrophobicContact CE1-CB 4.42Å; F229-F233 WeakPolarHBondContact O-CB 3.17Å; F229-F233 PolarHBondContact O-N 3.47Å
230	Q	88	Confident	84.8	Confident	20 Å²	20	53.3 Å²	53.3	9%	0.093	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-41.3	-178.3	-70.9	172.8	16.1	0	0	111.5	C160 T202 I206 M213 A226 C227 A234	C160-Q230 PolarHBondContact SG-OE1 3.25Å; T202-Q230 HydrophobicContact CG2-CG 3.7Å; I206-Q230 HydrophobicContact CD1-CB 4.17Å; I206-Q230 HydrophobicContact CD1-CG 4.41Å; M213-Q230 HydrophobicContact CE-CB 3.92Å; A226-Q230 WeakPolarHBondContact O-CB 3.24Å; A226-Q230 WeakPolarHBondContact O-CG 3.49Å; A226-Q230 PolarHBondContact O-N 3.39Å; C227-Q230 PolarHBondContact O-N 3.29Å; Q230-A234 WeakPolarHBondContact O-CB 3.36Å; Q230-A234 PolarHBondContact O-N 2.84Å
231	T	89.1	Confident	83.1	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.043	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-49.4	175.9	-65.4	0	0	0	0	111.5	Y221 C227 D228 F229 F233 A234 L235 L262	Y221-T231 PolarHBondContact OH-OG1 2.99Å; C227-T231 WeakPolarHBondContact O-CB 3.39Å; C227-T231 PolarHBondContact O-N 2.96Å; C227-T231 PolarHBondContact O-OG1 3.32Å; D228-T231 PolarHBondContact O-N 3.31Å; F229-T231 VanDerWaalsContact C-N 3.3Å; F229-T231 PolarHBondContact O-N 3.34Å; T231-F233 VanDerWaalsContact C-N 3.33Å; T231-F233 PolarHBondContact O-N 3Å; T231-A234 PolarHBondContact O-N 2.93Å; T231-L235 HydrophobicContact CG2-CD1 3.86Å; T231-L235 HydrophobicContact CG2-CG 4.5Å; T231-L235 WeakPolarHBondContact O-CB 3.19Å; T231-L235 WeakPolarHBondContact O-CD1 3.36Å; T231-L235 VanDerWaalsContact O-CG 3.25Å; T231-L235 WeakPolarHBondContact O-CG 3.31Å; T231-L235 PolarHBondContact O-N 3.48Å; T231-L262 HydrophobicContact CG2-CD1 4.28Å; T231-L262 HydrophobicContact CG2-CD2 3.81Å; T231-L262 HydrophobicContact CG2-CG 4.36Å
232	K	88.5	Confident	81.3	Confident	105 Å²	105	64.6 Å²	64.6	46%	0.457	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-41.6	179.1	-75.3	171	176.6	165.6	0	111.6	D228 F229 L235 S236 I261	D228-K232 VanDerWaalsContact CG-NZ 3.26Å; D228-K232 WeakPolarHBondContact O-CB 3.28Å; D228-K232 WeakPolarHBondContact O-CG 3.16Å; D228-K232 PolarHBondContact O-N 2.99Å; D228-K232 WeakPolarHBondContact OD1-CE 3.42Å; D228-K232 IonicContact OD1-NZ 2.78Å; D228-K232 PolarHBondContact OD1-NZ 2.93Å; D228-K232 VanDerWaalsContact OD1-NZ 3.08Å; D228-K232 VanDerWaalsContact OD2-CE 3.3Å; D228-K232 WeakPolarHBondContact OD2-CE 3.26Å; D228-K232 IonicContact OD2-NZ 3.65Å; D228-K232 PolarHBondContact OD2-NZ 3.26Å; F229-K232 PolarHBondContact O-N 2.9Å; K232-L235 PolarHBondContact O-N 3.15Å; K232-S236 PolarHBondContact O-N 2.98Å; K232-I261 HydrophobicContact CG-CD1 4.26Å
233	F	87.6	Confident	80	Confident	41 Å²	41	64.4 Å²	64.4	18%	0.18	36%	0.357	C	S	.	.	H	α-helix	trans	-59.8	-51.4	175.2	179.7	-104.3	0	0	0	111	S203 I206 E207 F229 T231 L235 S236 L237	S203-F233 VanDerWaalsContact CA-CE1 3.47Å; S203-F233 WeakPolarHBondContact O-CE1 3.39Å; I206-F233 HydrophobicContact CB-CD1 4.31Å; I206-F233 HydrophobicContact CB-CE1 4.23Å; I206-F233 HydrophobicContact CD1-CD1 4.32Å; I206-F233 HydrophobicContact CG2-CD1 4.04Å; I206-F233 HydrophobicContact CG2-CE1 4.16Å; E207-F233 HydrophobicContact CB-CE1 4.39Å; E207-F233 HydrophobicContact CB-CZ 4.43Å; F229-F233 HydrophobicContact CE1-CB 4.42Å; F229-F233 WeakPolarHBondContact O-CB 3.17Å; F229-F233 PolarHBondContact O-N 3.47Å; T231-F233 VanDerWaalsContact C-N 3.33Å; T231-F233 PolarHBondContact O-N 3Å; F233-L235 VanDerWaalsContact C-N 3.29Å; F233-L235 PolarHBondContact O-N 3.14Å; F233-S236 WeakPolarHBondContact O-CB 3.41Å; F233-S236 PolarHBondContact O-N 3.41Å; F233-S236 PolarHBondContact O-OG 3.3Å; F233-L237 HydrophobicContact CD1-CD1 4.23Å; F233-L237 HydrophobicContact CE1-CD1 3.67Å; F233-L237 HydrophobicContact CE1-CG 4.29Å; F233-L237 HydrophobicContact CZ-CD1 4.04Å; F233-L237 HydrophobicContact CZ-CD2 4.17Å; F233-L237 HydrophobicContact CZ-CG 4.3Å; F233-L237 PolarHBondContact O-N 3.47Å
234	A	86.9	Confident	79.1	Confident	5 Å²	5	66.4 Å²	66.4	4%	0.041	36%	0.361	C	S	.	.	H	α-helix	trans	-60.5	-37.3	178.8	0	0	0	0	0	113.1	I206 M213 Q230 T231 L237 L246	I206-A234 HydrophobicContact CG2-CB 3.79Å; M213-A234 HydrophobicContact CE-CB 4.47Å; M213-A234 HydrophobicContact SD-CB 3.32Å; M213-A234 WeakPolarHBondContact SD-CB 3.21Å; Q230-A234 WeakPolarHBondContact O-CB 3.36Å; Q230-A234 PolarHBondContact O-N 2.84Å; T231-A234 PolarHBondContact O-N 2.93Å; A234-L237 PolarHBondContact O-N 3.04Å; A234-L246 HydrophobicContact CB-CD1 3.67Å
235	L	86.4	Confident	78.9	Confident	23 Å²	23	67.5 Å²	67.5	12%	0.12	36%	0.36	C	S	.	.	H	α-helix	trans	-67.5	-36.2	174.1	-71.6	166.5	0	0	0	112.5	T231 K232 F233 L237 C238 L246 I261 L262 F264 L265	T231-L235 HydrophobicContact CG2-CD1 3.86Å; T231-L235 HydrophobicContact CG2-CG 4.5Å; T231-L235 WeakPolarHBondContact O-CB 3.19Å; T231-L235 WeakPolarHBondContact O-CD1 3.36Å; T231-L235 VanDerWaalsContact O-CG 3.25Å; T231-L235 WeakPolarHBondContact O-CG 3.31Å; T231-L235 PolarHBondContact O-N 3.48Å; K232-L235 PolarHBondContact O-N 3.15Å; F233-L235 VanDerWaalsContact C-N 3.29Å; F233-L235 PolarHBondContact O-N 3.14Å; L235-L237 VanDerWaalsContact C-N 3.27Å; L235-L237 PolarHBondContact O-N 2.89Å; L235-C238 CarbonylContact O-C 3.14Å; L235-C238 PolarHBondContact O-N 3.16Å; L235-C238 VanDerWaalsContact O-N 3.11Å; L235-L246 HydrophobicContact CD2-CD1 4.39Å; L235-L246 HydrophobicContact CG-CD1 4.25Å; L235-I261 HydrophobicContact CD1-CB 4.33Å; L235-I261 HydrophobicContact CD1-CD1 3.43Å; L235-I261 VanDerWaalsContact CD1-CD1 3.43Å; L235-I261 HydrophobicContact CD1-CG1 3.58Å; L235-I261 HydrophobicContact CD1-CG2 4Å; L235-L262 HydrophobicContact CD1-CD2 4Å; L235-L262 HydrophobicContact CD2-CD2 4.31Å; L235-F264 HydrophobicContact CD2-CZ 3.88Å; L235-L265 HydrophobicContact CD2-CD1 4.45Å
236	S	85.5	Confident	79.1	Confident	79 Å²	79	61.7 Å²	61.7	55%	0.552	33%	0.329	S	S	*	.	H	α-helix	trans	-64.9	-31.3	178	78.4	0	0	0	0	112.8	K232 F233 C238	K232-S236 PolarHBondContact O-N 2.98Å; F233-S236 WeakPolarHBondContact O-CB 3.41Å; F233-S236 PolarHBondContact O-N 3.41Å; F233-S236 PolarHBondContact O-OG 3.3Å; S236-C238 PolarHBondContact O-N 3.34Å
237	L	81.9	Confident	79.5	Confident	54 Å²	54	60.7 Å²	60.7	28%	0.283	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.6	175.3	-62.3	177.3	0	0	0	113.1	I206 E207 F233 A234 L235	I206-L237 HydrophobicContact CG2-CD1 4Å; E207-L237 HydrophobicContact CB-CD1 3.75Å; E207-L237 HydrophobicContact CG-CD1 3.99Å; E207-L237 HydrophobicContact CG-CD2 4.03Å; F233-L237 HydrophobicContact CD1-CD1 4.23Å; F233-L237 HydrophobicContact CE1-CD1 3.67Å; F233-L237 HydrophobicContact CE1-CG 4.29Å; F233-L237 HydrophobicContact CZ-CD1 4.04Å; F233-L237 HydrophobicContact CZ-CD2 4.17Å; F233-L237 HydrophobicContact CZ-CG 4.3Å; F233-L237 PolarHBondContact O-N 3.47Å; A234-L237 PolarHBondContact O-N 3.04Å; L235-L237 VanDerWaalsContact C-N 3.27Å; L235-L237 PolarHBondContact O-N 2.89Å
238	C	70.2	Confident	79.7	Confident	23 Å²	23	60.5 Å²	60.5	16%	0.155	32%	0.317	C	S	.	.	S	Bend	trans	-139.1	68.5	-173.4	-80.1	0	0	0	0	110.2	L235 S236 G240 S243 R245	L235-C238 CarbonylContact O-C 3.14Å; L235-C238 PolarHBondContact O-N 3.16Å; L235-C238 VanDerWaalsContact O-N 3.11Å; S236-C238 PolarHBondContact O-N 3.34Å; C238-G240 PolarHBondContact O-N 3.42Å; C238-S243 VanDerWaalsContact CB-OG 3.22Å; C238-S243 WeakPolarHBondContact CB-OG 3.36Å; C238-S243 PolarHBondContact SG-OG 3.16Å; C238-S243 VanDerWaalsContact SG-OG 3.33Å; C238-R245 WeakPolarHBondContact SG-CD 3.37Å
239	P	65.9	Low	80	Confident	121 Å²	121	57.4 Å²	57.4	79%	0.786	30%	0.301	S	S	*	.			trans	-67.6	101.5	179.1	25.8	-31.4	0	0	0	110.1
240	G	60.1	Low	80.4	Confident	37 Å²	37	55.5 Å²	55.5	38%	0.381	29%	0.292	S	S	.	.	S	Bend	trans	120.8	166.2	173.7	0	0	0	0	0	114.6	C238 R242	C238-G240 PolarHBondContact O-N 3.42Å; G240-R242 PolarHBondContact O-N 3.23Å
241	A	56.6	Low	80.6	Confident	64 Å²	64	56.8 Å²	56.8	53%	0.529	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	1.8	-174.5	0	0	0	0	0	114.9	F264	A241-F264 HydrophobicContact CB-CD2 3.91Å; A241-F264 HydrophobicContact CB-CE2 4.47Å
242	R	56.7	Low	80.8	Confident	255 Å²	255	59 Å²	59	96%	0.962	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-40.7	-173.4	-92.2	-176.2	174.5	172.6	-1.4	112.8	G240 K244	G240-R242 PolarHBondContact O-N 3.23Å; R242-K244 PolarHBondContact O-N 3.07Å
243	S	63.5	Low	80.9	Confident	48 Å²	48	58.8 Å²	58.8	34%	0.336	32%	0.318	S	S	.	.	S	Bend	trans	-86.6	106.3	172.4	50.1	0	0	0	0	108.2	C238 R245	C238-S243 VanDerWaalsContact CB-OG 3.22Å; C238-S243 WeakPolarHBondContact CB-OG 3.36Å; C238-S243 PolarHBondContact SG-OG 3.16Å; C238-S243 VanDerWaalsContact SG-OG 3.33Å; S243-R245 PolarHBondContact O-N 2.96Å
244	K	71.5	Confident	81.2	Confident	156 Å²	156	58 Å²	58	68%	0.678	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	41.3	170.4	-62	179.1	-179	175.8	0	111.5	R212 R242	R212-K244 PolarHBondContact NE-O 2.94Å; R242-K244 PolarHBondContact O-N 3.07Å
245	R	84.6	Confident	81.5	Confident	53 Å²	53	63.8 Å²	63.8	20%	0.2	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-37.6	-175.5	-172.9	171.6	-170.2	166.9	5.8	110.5	I206 E207 C210 K211 R212 M213 C238 S243	I206-R245 PolarHBondContact O-NH2 3.1Å; E207-R245 PolarHBondContact O-NH2 3.03Å; C210-R245 PolarHBondContact O-NH2 3.4Å; K211-R245 WeakPolarHBondContact O-CG 3.23Å; R212-R245 CarbonylContact C-O 3.59Å; R212-R245 WeakPolarHBondContact CA-O 3.38Å; R212-R245 VanDerWaalsContact CB-O 3.3Å; R212-R245 WeakPolarHBondContact CB-O 2.97Å; M213-R245 PolarHBondContact N-O 3.47Å; C238-R245 WeakPolarHBondContact SG-CD 3.37Å; S243-R245 PolarHBondContact O-N 2.96Å
246	L	89.6	Confident	81.7	Confident	13 Å²	13	65.8 Å²	65.8	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124	-178.7	-157.6	140.4	0	0	0	110.4	M213 V215 A234 L235 P248 L262 L265	M213-L246 CarbonylContact O-C 3.57Å; M213-L246 WeakPolarHBondContact O-CA 3.45Å; M213-L246 HydrophobicContact SD-CD1 4.13Å; V215-L246 HydrophobicContact CB-CD2 4.3Å; V215-L246 HydrophobicContact CG2-CD1 4.12Å; V215-L246 HydrophobicContact CG2-CD2 3.75Å; V215-L246 HydrophobicContact CG2-CG 3.86Å; A234-L246 HydrophobicContact CB-CD1 3.67Å; L235-L246 HydrophobicContact CD2-CD1 4.39Å; L235-L246 HydrophobicContact CG-CD1 4.25Å; L246-P248 HydrophobicContact CD2-CG 4.24Å; L246-L262 HydrophobicContact CD2-CD2 3.62Å; L246-L265 HydrophobicContact CB-CD1 4.04Å; L246-L265 HydrophobicContact CD2-CD1 3.4Å; L246-L265 VanDerWaalsContact CD2-CD1 3.4Å; L246-L265 HydrophobicContact CG-CD1 4.33Å
247	I	92.1	Very high	82	Confident	14 Å²	14	67 Å²	67	7%	0.072	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	102.2	-177.4	-58.3	178.5	0	0	0	108.7	M213 V214 V215 V249 L283 A286 L287	M213-I247 PolarHBondContact O-N 3.47Å; V214-I247 WeakPolarHBondContact CA-O 3.43Å; V215-I247 PolarHBondContact N-O 3.04Å; I247-V249 PolarHBondContact O-N 3.45Å; I247-L283 HydrophobicContact CG2-CD1 4Å; I247-A286 HydrophobicContact CD1-CB 3.95Å; I247-L287 HydrophobicContact CD1-CD2 3.82Å
248	P	93.4	Very high	82.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	129.1	171.7	-20.4	33.7	0	0	0	111.2	V215 I217 L246 F258 L265 V267 C268	V215-P248 CarbonylContact O-C 3.58Å; V215-P248 WeakPolarHBondContact O-CA 3.41Å; I217-P248 HydrophobicContact CD1-CB 3.7Å; L246-P248 HydrophobicContact CD2-CG 4.24Å; P248-F258 HydrophobicContact CB-CZ 3.98Å; P248-F258 HydrophobicContact CG-CZ 4.43Å; P248-L265 HydrophobicContact CG-CB 3.82Å; P248-L265 HydrophobicContact CG-CD1 3.93Å; P248-V267 HydrophobicContact CB-CG1 4.34Å; P248-V267 HydrophobicContact CB-CG2 4.15Å; P248-C268 PolarHBondContact O-N 3.44Å
249	V	95.1	Very high	83.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.4	173	169.6	0	0	0	0	108.8	F168 V214 V215 I217 I247 C268 F279 L283	F168-V249 HydrophobicContact CE1-CG1 3.87Å; F168-V249 HydrophobicContact CZ-CG1 4.03Å; V214-V249 HydrophobicContact CG1-CB 4.27Å; V214-V249 HydrophobicContact CG1-CG2 3.63Å; V215-V249 PolarHBondContact O-N 3.17Å; I217-V249 PolarHBondContact N-O 3.17Å; I247-V249 PolarHBondContact O-N 3.45Å; V249-C268 CarbonylContact C-O 3.59Å; V249-C268 WeakPolarHBondContact CA-O 3.48Å; V249-C268 HydrophobicContact CG2-CB 3.96Å; V249-F279 HydrophobicContact CG1-CZ 3.88Å; V249-F279 HydrophobicContact CG2-CZ 4.49Å; V249-L283 HydrophobicContact CG2-CD1 4.29Å; V249-L283 HydrophobicContact CG2-CD2 4.23Å
250	K	94.3	Very high	84.2	Confident	47 Å²	47	66 Å²	66	20%	0.204	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.4	173.3	-177.7	-176.9	178.7	-176.1	0	108.9	K252 V267 C268 Y270 T271	K250-K252 WeakPolarHBondContact CE-O 3.29Å; K250-K252 WeakPolarHBondContact CG-O 3.28Å; K250-V267 HydrophobicContact CB-CG1 4.24Å; K250-C268 PolarHBondContact N-O 3.5Å; K250-Y270 PolarHBondContact O-N 3.49Å; K250-T271 HydrophobicContact CG-CG2 4.5Å
251	Y	94	Very high	85.5	Confident	47 Å²	47	67.5 Å²	67.5	18%	0.184	36%	0.356	C	S	.	.			trans	-116.1	-21.4	-176.1	83.8	-81.9	0	0	0	115.2	D165 F168 V216 T271	D165-Y251 HydrophobicContact CB-CE1 4.01Å; D165-Y251 PolarHBondContact OD1-OH 3.28Å; F168-Y251 HydrophobicContact CB-CD1 4.48Å; F168-Y251 HydrophobicContact CB-CD2 3.74Å; F168-Y251 HydrophobicContact CB-CE1 4.43Å; F168-Y251 HydrophobicContact CB-CE2 3.66Å; F168-Y251 HydrophobicContact CB-CG 4.15Å; F168-Y251 AromaticContact CD1-CD1 3.73Å; F168-Y251 HydrophobicContact CD1-CD1 3.73Å; F168-Y251 HydrophobicContact CD1-CD2 4.07Å; F168-Y251 HydrophobicContact CD1-CE1 4.3Å; F168-Y251 AromaticContact CD1-CG 3.59Å; F168-Y251 HydrophobicContact CD1-CG 3.59Å; F168-Y251 AromaticContact CD2-CD2 3.56Å; F168-Y251 HydrophobicContact CD2-CD2 3.56Å; F168-Y251 HydrophobicContact CD2-CE2 4.35Å; F168-Y251 AromaticContact CD2-CG 3.72Å; F168-Y251 HydrophobicContact CD2-CG 3.72Å; F168-Y251 HydrophobicContact CE1-CD1 4.13Å; F168-Y251 AromaticContact CE1-CG 3.89Å; F168-Y251 HydrophobicContact CE1-CG 3.89Å; F168-Y251 VanDerWaalsContact CE2-CB 3.42Å; F168-Y251 HydrophobicContact CE2-CD2 4.2Å; F168-Y251 AromaticContact CE2-CG 4Å; F168-Y251 HydrophobicContact CE2-CG 4Å; F168-Y251 HydrophobicContact CG-CD1 4.01Å; F168-Y251 AromaticContact CG-CD2 3.48Å; F168-Y251 HydrophobicContact CG-CD2 3.48Å; F168-Y251 VanDerWaalsContact CG-CD2 3.48Å; F168-Y251 HydrophobicContact CG-CE1 4.43Å; F168-Y251 AromaticContact CG-CE2 3.94Å; F168-Y251 HydrophobicContact CG-CE2 3.94Å; F168-Y251 AromaticContact CG-CG 3.5Å; F168-Y251 HydrophobicContact CG-CG 3.5Å; F168-Y251 HydrophobicContact CZ-CG 4.08Å; V216-Y251 HydrophobicContact CG1-CD1 3.83Å; V216-Y251 HydrophobicContact CG1-CE1 4.03Å; Y251-T271 VanDerWaalsContact C-CG2 3.42Å; Y251-T271 VanDerWaalsContact O-CG2 3.32Å; Y251-T271 WeakPolarHBondContact O-CG2 3.07Å
252	K	92.2	Very high	86.9	Confident	54 Å²	54	64.6 Å²	64.6	24%	0.235	33%	0.331	C	S	.	.	S	Bend	trans	-126.4	162.2	175.1	64.4	-178	-179.1	-158.7	0	111	D165 E220 K250	D165-K252 IonicContact OD1-NZ 2.61Å; D165-K252 PolarHBondContact OD1-NZ 2.88Å; E220-K252 IonicContact OE1-NZ 3.8Å; E220-K252 WeakPolarHBondContact OE2-CE 3.28Å; E220-K252 IonicContact OE2-NZ 2.88Å; E220-K252 PolarHBondContact OE2-NZ 2.87Å; K250-K252 WeakPolarHBondContact CE-O 3.29Å; K250-K252 WeakPolarHBondContact CG-O 3.28Å
253	S	91.9	Very high	88.3	Confident	101 Å²	101	61.1 Å²	61.1	71%	0.706	32%	0.318	S	S	*	.			trans	-64.7	150.1	169.9	-163.4	0	0	0	0	109.8
254	M	92.5	Very high	89.4	Confident	24 Å²	24	63.6 Å²	63.6	12%	0.118	32%	0.323	C	S	.	.			trans	-124.5	140.5	-178.6	-70.6	176.4	66.4	0	0	108.7	I217 D219 L222	I217-M254 HydrophobicContact CG2-CE 3.7Å; I217-M254 HydrophobicContact CG2-SD 3.58Å; I217-M254 VanDerWaalsContact CG2-SD 3.58Å; D219-M254 WeakPolarHBondContact OD1-CB 3.41Å; L222-M254 HydrophobicContact CD1-CE 3.45Å; L222-M254 VanDerWaalsContact CD1-CE 3.45Å; L222-M254 HydrophobicContact CG-CE 3.96Å
255	T	92.9	Very high	90.1	Very high	127 Å²	127	57.3 Å²	57.3	78%	0.779	30%	0.297	S	S	*	.	S	Bend	trans	-82.9	-29.7	171.6	60.7	0	0	0	0	111.2	D219	D219-T255 PolarHBondContact OD1-N 2.98Å; D219-T255 WeakPolarHBondContact OD2-CB 3.35Å; D219-T255 PolarHBondContact OD2-N 3.17Å; D219-T255 PolarHBondContact OD2-OG1 2.87Å
256	K	91.8	Very high	90.3	Very high	64 Å²	64	59.4 Å²	59.4	28%	0.278	32%	0.315	S	S	.	.	S	Bend	trans	-85.8	152.5	-178.9	-65.2	177.4	-169.3	164.9	0	112.3	D219 L222 D223	D219-K256 HydrophobicContact CB-CD 4.31Å; D219-K256 PolarHBondContact O-NZ 3.45Å; D219-K256 WeakPolarHBondContact OD1-CB 3.23Å; D219-K256 PolarHBondContact OD1-N 3.2Å; L222-K256 HydrophobicContact CB-CD 4.34Å; L222-K256 HydrophobicContact CD1-CB 3.82Å; L222-K256 HydrophobicContact CD1-CD 4.25Å; D223-K256 IonicContact OD1-NZ 3.46Å; D223-K256 PolarHBondContact OD1-NZ 3.25Å; D223-K256 IonicContact OD2-NZ 2.75Å; D223-K256 PolarHBondContact OD2-NZ 3.05Å
257	P	91.4	Very high	90.3	Very high	106 Å²	106	61.2 Å²	61.2	69%	0.688	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-66.7	144	175.9	28.9	-34.9	0	0	0	111
258	F	89.3	Confident	90.3	Very high	51 Å²	51	61.3 Å²	61.3	22%	0.224	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-61	134.3	174.9	-167.1	-92.3	0	0	0	111.1	I217 P248 S260 L262 R263 V267	I217-F258 HydrophobicContact CD1-CD2 4.26Å; I217-F258 HydrophobicContact CD1-CE1 4.5Å; I217-F258 HydrophobicContact CD1-CE2 3.29Å; I217-F258 HydrophobicContact CD1-CZ 3.43Å; I217-F258 VanDerWaalsContact CD1-CZ 3.43Å; I217-F258 HydrophobicContact CG2-CE2 4.42Å; P248-F258 HydrophobicContact CB-CZ 3.98Å; P248-F258 HydrophobicContact CG-CZ 4.43Å; F258-S260 PolarHBondContact O-N 3.36Å; F258-L262 HydrophobicContact CD1-CB 4.41Å; F258-L262 HydrophobicContact CE1-CB 3.49Å; F258-L262 VanDerWaalsContact CE1-CB 3.49Å; F258-L262 HydrophobicContact CZ-CB 3.96Å; F258-R263 HydrophobicContact CD1-CG 4.23Å; F258-V267 HydrophobicContact CE1-CG2 4.09Å; F258-V267 HydrophobicContact CE2-CG1 4.31Å; F258-V267 HydrophobicContact CE2-CG2 3.98Å; F258-V267 HydrophobicContact CZ-CG2 3.5Å
259	P	88.1	Confident	90.2	Very high	28 Å²	28	62.4 Å²	62.4	18%	0.182	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-54.8	128.2	-175.9	-29.4	37	0	0	0	112.9	L222 I261 L262 R263	L222-P259 HydrophobicContact CD1-CG 4.35Å; L222-P259 HydrophobicContact CD2-CG 3.24Å; L222-P259 HydrophobicContact CG-CG 4.43Å; P259-I261 HydrophobicContact CB-CG2 4.16Å; P259-I261 PolarHBondContact O-N 2.76Å; P259-L262 HydrophobicContact CB-CB 4.46Å; P259-L262 HydrophobicContact CB-CD1 4.34Å; P259-L262 HydrophobicContact CB-CG 4.26Å; P259-L262 HydrophobicContact CG-CD1 4.38Å; P259-L262 PolarHBondContact O-N 3.16Å; P259-R263 PolarHBondContact O-N 3.41Å
260	S	87.6	Confident	90	Very high	96 Å²	96	64.2 Å²	64.2	67%	0.671	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-56.9	-35.7	178.6	52.8	0	0	0	0	112.2	F258 L262 R263	F258-S260 PolarHBondContact O-N 3.36Å; S260-L262 PolarHBondContact O-N 2.97Å; S260-R263 WeakPolarHBondContact O-CB 3.17Å; S260-R263 PolarHBondContact O-N 3.34Å
261	I	85.6	Confident	89.8	Confident	70 Å²	70	64.8 Å²	64.8	36%	0.359	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-66.6	-16.5	179.8	-151.8	-179.5	0	0	0	113.7	K232 L235 P259 F264	K232-I261 HydrophobicContact CG-CD1 4.26Å; L235-I261 HydrophobicContact CD1-CB 4.33Å; L235-I261 HydrophobicContact CD1-CD1 3.43Å; L235-I261 VanDerWaalsContact CD1-CD1 3.43Å; L235-I261 HydrophobicContact CD1-CG1 3.58Å; L235-I261 HydrophobicContact CD1-CG2 4Å; P259-I261 HydrophobicContact CB-CG2 4.16Å; P259-I261 PolarHBondContact O-N 2.76Å; I261-F264 WeakPolarHBondContact O-CE1 3.39Å
262	L	87.3	Confident	89.5	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-108.2	-4.5	178.3	-59.6	-178.6	0	0	0	112.6	I217 T231 L235 L246 F258 P259 S260 F264 L265	I217-L262 HydrophobicContact CD1-CD1 3.58Å; I217-L262 HydrophobicContact CG1-CD1 4.49Å; T231-L262 HydrophobicContact CG2-CD1 4.28Å; T231-L262 HydrophobicContact CG2-CD2 3.81Å; T231-L262 HydrophobicContact CG2-CG 4.36Å; L235-L262 HydrophobicContact CD1-CD2 4Å; L235-L262 HydrophobicContact CD2-CD2 4.31Å; L246-L262 HydrophobicContact CD2-CD2 3.62Å; F258-L262 HydrophobicContact CD1-CB 4.41Å; F258-L262 HydrophobicContact CE1-CB 3.49Å; F258-L262 VanDerWaalsContact CE1-CB 3.49Å; F258-L262 HydrophobicContact CZ-CB 3.96Å; P259-L262 HydrophobicContact CB-CB 4.46Å; P259-L262 HydrophobicContact CB-CD1 4.34Å; P259-L262 HydrophobicContact CB-CG 4.26Å; P259-L262 HydrophobicContact CG-CD1 4.38Å; P259-L262 PolarHBondContact O-N 3.16Å; S260-L262 PolarHBondContact O-N 2.97Å; L262-F264 PolarHBondContact O-N 3.03Å; L262-F264 VanDerWaalsContact O-N 3.15Å; L262-L265 HydrophobicContact CB-CD1 4.49Å; L262-L265 HydrophobicContact CD2-CD1 3.76Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3.03Å
263	R	85.9	Confident	89.1	Confident	182 Å²	182	72.1 Å²	72.1	69%	0.687	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.7	-173.7	-81.7	-177.4	172.1	-165.6	-6.4	114.5	F258 P259 S260 L265	F258-R263 HydrophobicContact CD1-CG 4.23Å; P259-R263 PolarHBondContact O-N 3.41Å; S260-R263 WeakPolarHBondContact O-CB 3.17Å; S260-R263 PolarHBondContact O-N 3.34Å; R263-L265 VanDerWaalsContact C-N 3.26Å
264	F	85.5	Confident	88.6	Confident	101 Å²	101	72.7 Å²	72.7	44%	0.443	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.3	179.2	64.8	-96.7	0	0	0	113.1	L235 A241 I261 L262	L235-F264 HydrophobicContact CD2-CZ 3.88Å; A241-F264 HydrophobicContact CB-CD2 3.91Å; A241-F264 HydrophobicContact CB-CE2 4.47Å; I261-F264 WeakPolarHBondContact O-CE1 3.39Å; L262-F264 PolarHBondContact O-N 3.03Å; L262-F264 VanDerWaalsContact O-N 3.15Å
265	L	87.8	Confident	88.1	Confident	23 Å²	23	73.7 Å²	73.7	12%	0.12	40%	0.399	C	S	.	.	S	Bend	trans	-92.4	152.1	-179.9	-60.2	174.2	0	0	0	111.2	L235 L246 P248 L262 R263 V267	L235-L265 HydrophobicContact CD2-CD1 4.45Å; L246-L265 HydrophobicContact CB-CD1 4.04Å; L246-L265 HydrophobicContact CD2-CD1 3.4Å; L246-L265 VanDerWaalsContact CD2-CD1 3.4Å; L246-L265 HydrophobicContact CG-CD1 4.33Å; P248-L265 HydrophobicContact CG-CB 3.82Å; P248-L265 HydrophobicContact CG-CD1 3.93Å; L262-L265 HydrophobicContact CB-CD1 4.49Å; L262-L265 HydrophobicContact CD2-CD1 3.76Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3.03Å; R263-L265 VanDerWaalsContact C-N 3.26Å; L265-V267 PolarHBondContact O-N 2.86Å
266	T	87.8	Confident	87.7	Confident	97 Å²	97	71.8 Å²	71.8	60%	0.595	38%	0.381	S	S	*	.			trans	-76.3	114.8	173.8	-57.6	0	0	0	0	109.5
267	V	90.4	Very high	87.4	Confident	52 Å²	52	72.7 Å²	72.7	32%	0.315	40%	0.4	S	S	.	.			trans	-83.3	130.5	178.9	-175.1	0	0	0	0	110.5	P248 K250 F258 L265	P248-V267 HydrophobicContact CB-CG1 4.34Å; P248-V267 HydrophobicContact CB-CG2 4.15Å; K250-V267 HydrophobicContact CB-CG1 4.24Å; F258-V267 HydrophobicContact CE1-CG2 4.09Å; F258-V267 HydrophobicContact CE2-CG1 4.31Å; F258-V267 HydrophobicContact CE2-CG2 3.98Å; F258-V267 HydrophobicContact CZ-CG2 3.5Å; L265-V267 PolarHBondContact O-N 2.86Å
268	C	91.2	Very high	87.1	Confident	16 Å²	16	76.4 Å²	76.4	11%	0.108	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	103.5	167	-77.3	0	0	0	0	109.3	P248 V249 K250 F279	P248-C268 PolarHBondContact O-N 3.44Å; V249-C268 CarbonylContact C-O 3.59Å; V249-C268 WeakPolarHBondContact CA-O 3.48Å; V249-C268 HydrophobicContact CG2-CB 3.96Å; K250-C268 PolarHBondContact N-O 3.5Å; C268-F279 HydrophobicContact CB-CE2 3.78Å; C268-F279 HydrophobicContact CB-CZ 4.2Å
269	D	91.4	Very high	87.3	Confident	23 Å²	23	74.4 Å²	74.4	12%	0.123	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	109.3	-176.4	-166.3	-10.4	0	0	0	110.8	T271 R272 T275	D269-T271 WeakPolarHBondContact OD1-CB 3.4Å; D269-T271 PolarHBondContact OD1-N 2.89Å; D269-T271 PolarHBondContact OD1-OG1 2.78Å; D269-R272 HydrophobicContact CB-CG 4.39Å; D269-R272 IonicContact OD2-CZ 3.93Å; D269-R272 IonicContact OD2-NE 2.74Å; D269-R272 PolarHBondContact OD2-NE 3.07Å; D269-R272 IonicContact OD2-NH2 2.6Å; D269-T275 PolarHBondContact O-OG1 3.31Å
270	Y	91.1	Very high	87.4	Confident	37 Å²	37	74.4 Å²	74.4	15%	0.145	39%	0.389	C	S	.	.	S	Bend	trans	-84.5	-14.5	177	-174	-113.6	0	0	0	112.4	F168 E171 K250 R272 Q276 F279 W280	F168-Y270 AromaticContact CE2-CD1 3.81Å; F168-Y270 HydrophobicContact CE2-CD1 3.81Å; F168-Y270 HydrophobicContact CE2-CE1 4.07Å; F168-Y270 HydrophobicContact CE2-CG 4.33Å; E171-Y270 PolarHBondContact OE1-OH 3.43Å; K250-Y270 PolarHBondContact O-N 3.49Å; Y270-R272 PolarHBondContact O-N 3.42Å; Y270-Q276 HydrophobicContact CD2-CG 3.95Å; Y270-Q276 HydrophobicContact CE2-CG 3.51Å; Y270-Q276 PolarHBondContact OH-NE2 3.27Å; Y270-F279 HydrophobicContact CD2-CB 3.89Å; Y270-F279 AromaticContact CD2-CD1 3.45Å; Y270-F279 HydrophobicContact CD2-CD1 3.45Å; Y270-F279 VanDerWaalsContact CD2-CD1 3.45Å; Y270-F279 AromaticContact CD2-CD2 3.97Å; Y270-F279 HydrophobicContact CD2-CD2 3.97Å; Y270-F279 AromaticContact CD2-CE1 3.92Å; Y270-F279 HydrophobicContact CD2-CE1 3.92Å; Y270-F279 HydrophobicContact CD2-CE2 4.37Å; Y270-F279 AromaticContact CD2-CG 3.5Å; Y270-F279 HydrophobicContact CD2-CG 3.5Å; Y270-F279 VanDerWaalsContact CD2-CG 3.5Å; Y270-F279 HydrophobicContact CD2-CZ 4.37Å; Y270-F279 HydrophobicContact CE2-CB 4.32Å; Y270-F279 HydrophobicContact CE2-CD1 4.02Å; Y270-F279 HydrophobicContact CE2-CG 4.26Å; Y270-F279 HydrophobicContact CG-CD1 4.29Å; Y270-F279 HydrophobicContact CG-CE1 4.33Å; Y270-F279 HydrophobicContact CG-CG 4.4Å; Y270-F279 HydrophobicContact CG-CZ 4.48Å; Y270-W280 HydrophobicContact CD2-CZ2 4.47Å; Y270-W280 AromaticContact CE2-CZ2 3.85Å; Y270-W280 HydrophobicContact CE2-CZ2 3.85Å; Y270-W280 AromaticContact CZ-CZ2 3.93Å
271	T	89.1	Confident	87.6	Confident	60 Å²	60	73.9 Å²	73.9	37%	0.368	38%	0.381	S	S	.	.	S	Bend	trans	-72.1	-14.7	179.1	69.5	0	0	0	0	113	K250 Y251 D269 P273	K250-T271 HydrophobicContact CG-CG2 4.5Å; Y251-T271 VanDerWaalsContact C-CG2 3.42Å; Y251-T271 VanDerWaalsContact O-CG2 3.32Å; Y251-T271 WeakPolarHBondContact O-CG2 3.07Å; D269-T271 WeakPolarHBondContact OD1-CB 3.4Å; D269-T271 PolarHBondContact OD1-N 2.89Å; D269-T271 PolarHBondContact OD1-OG1 2.78Å; T271-P273 WeakPolarHBondContact O-CD 3.03Å
272	R	87.9	Confident	87.8	Confident	151 Å²	151	77.6 Å²	77.6	57%	0.57	39%	0.391	S	S	*	.			trans	-90.2	120.8	-177.1	-64.8	179.6	-166.8	-154.3	-0.5	110.5	D269 Y270 C274 T275 Q276	D269-R272 HydrophobicContact CB-CG 4.39Å; D269-R272 IonicContact OD2-CZ 3.93Å; D269-R272 IonicContact OD2-NE 2.74Å; D269-R272 PolarHBondContact OD2-NE 3.07Å; D269-R272 IonicContact OD2-NH2 2.6Å; Y270-R272 PolarHBondContact O-N 3.42Å; R272-C274 PolarHBondContact O-N 3.36Å; R272-C274 VanDerWaalsContact O-N 3.14Å; R272-T275 WeakPolarHBondContact CB-OG1 3.27Å; R272-T275 PolarHBondContact O-N 3.23Å; R272-T275 VanDerWaalsContact O-N 3.09Å; R272-T275 PolarHBondContact O-OG1 3.07Å; R272-T275 VanDerWaalsContact O-OG1 3.1Å; R272-Q276 PolarHBondContact O-N 3.22Å; R272-Q276 VanDerWaalsContact O-N 3.14Å
273	P	85.3	Confident	88	Confident	103 Å²	103	77.5 Å²	77.5	67%	0.669	39%	0.39	S	S	*	.	H	α-helix	trans	-56.9	-35.5	-179.4	-26.5	34.3	0	0	0	113.5	T271 T275 Q276	T271-P273 WeakPolarHBondContact O-CD 3.03Å; P273-T275 VanDerWaalsContact C-N 3.31Å; P273-T275 PolarHBondContact O-N 3.2Å; P273-Q276 PolarHBondContact O-N 3.03Å
274	C	81.5	Confident	88.3	Confident	114 Å²	114	68.9 Å²	68.9	77%	0.77	36%	0.357	S	S	*	.	H	α-helix	trans	-68.1	-26.9	-178	-51.1	0	0	0	0	113.7	R272	R272-C274 PolarHBondContact O-N 3.36Å; R272-C274 VanDerWaalsContact O-N 3.14Å
275	T	80.8	Confident	88.6	Confident	45 Å²	45	69.8 Å²	69.8	28%	0.276	36%	0.361	S	S	.	.	H	α-helix	trans	-98.3	-18.7	179.8	47.5	0	0	0	0	112.6	D269 R272 P273 A277 W278 F279	D269-T275 PolarHBondContact O-OG1 3.31Å; R272-T275 WeakPolarHBondContact CB-OG1 3.27Å; R272-T275 PolarHBondContact O-N 3.23Å; R272-T275 VanDerWaalsContact O-N 3.09Å; R272-T275 PolarHBondContact O-OG1 3.07Å; R272-T275 VanDerWaalsContact O-OG1 3.1Å; P273-T275 VanDerWaalsContact C-N 3.31Å; P273-T275 PolarHBondContact O-N 3.2Å; T275-A277 PolarHBondContact O-N 3.28Å; T275-W278 PolarHBondContact O-N 3.24Å; T275-F279 WeakPolarHBondContact O-CA 3.45Å; T275-F279 WeakPolarHBondContact O-CB 3.16Å; T275-F279 PolarHBondContact O-N 3.42Å
276	Q	84.6	Confident	88.7	Confident	87 Å²	87	70 Å²	70	41%	0.407	37%	0.367	S	S	.	.	H	α-helix	trans	-57	-45.7	-175.4	-160.4	179.6	8	0	0	112.8	Y270 R272 P273 W278 F279	Y270-Q276 HydrophobicContact CD2-CG 3.95Å; Y270-Q276 HydrophobicContact CE2-CG 3.51Å; Y270-Q276 PolarHBondContact OH-NE2 3.27Å; R272-Q276 PolarHBondContact O-N 3.22Å; R272-Q276 VanDerWaalsContact O-N 3.14Å; P273-Q276 PolarHBondContact O-N 3.03Å; Q276-W278 PolarHBondContact O-N 2.98Å; Q276-W278 VanDerWaalsContact O-N 3.13Å; Q276-F279 VanDerWaalsContact O-CB 3.32Å; Q276-F279 WeakPolarHBondContact O-CB 3.43Å; Q276-F279 PolarHBondContact O-N 3.03Å; Q276-F279 VanDerWaalsContact O-N 3.15Å
277	A	85.1	Confident	88.8	Confident	82 Å²	82	65.4 Å²	65.4	68%	0.678	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	-177	0	0	0	0	0	114.5	T275	T275-A277 PolarHBondContact O-N 3.28Å
278	W	86.9	Confident	88.7	Confident	185 Å²	185	64.9 Å²	64.9	70%	0.701	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	8.4	-177.6	-34.5	88.5	0	0	0	111.9	T275 Q276 V281 R282	T275-W278 PolarHBondContact O-N 3.24Å; Q276-W278 PolarHBondContact O-N 2.98Å; Q276-W278 VanDerWaalsContact O-N 3.13Å; W278-V281 PolarHBondContact O-N 3.21Å; W278-R282 VanDerWaalsContact O-CB 3.25Å; W278-R282 WeakPolarHBondContact O-CB 3.3Å; W278-R282 PolarHBondContact O-N 3.14Å
279	F	91.9	Very high	88.4	Confident	9 Å²	9	68.2 Å²	68.2	4%	0.039	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-54.1	-168.4	177.4	-95.9	0	0	0	111.2	V249 C268 Y270 T275 Q276 V281 R282 L283	V249-F279 HydrophobicContact CG1-CZ 3.88Å; V249-F279 HydrophobicContact CG2-CZ 4.49Å; C268-F279 HydrophobicContact CB-CE2 3.78Å; C268-F279 HydrophobicContact CB-CZ 4.2Å; Y270-F279 HydrophobicContact CD2-CB 3.89Å; Y270-F279 AromaticContact CD2-CD1 3.45Å; Y270-F279 HydrophobicContact CD2-CD1 3.45Å; Y270-F279 VanDerWaalsContact CD2-CD1 3.45Å; Y270-F279 AromaticContact CD2-CD2 3.97Å; Y270-F279 HydrophobicContact CD2-CD2 3.97Å; Y270-F279 AromaticContact CD2-CE1 3.92Å; Y270-F279 HydrophobicContact CD2-CE1 3.92Å; Y270-F279 HydrophobicContact CD2-CE2 4.37Å; Y270-F279 AromaticContact CD2-CG 3.5Å; Y270-F279 HydrophobicContact CD2-CG 3.5Å; Y270-F279 VanDerWaalsContact CD2-CG 3.5Å; Y270-F279 HydrophobicContact CD2-CZ 4.37Å; Y270-F279 HydrophobicContact CE2-CB 4.32Å; Y270-F279 HydrophobicContact CE2-CD1 4.02Å; Y270-F279 HydrophobicContact CE2-CG 4.26Å; Y270-F279 HydrophobicContact CG-CD1 4.29Å; Y270-F279 HydrophobicContact CG-CE1 4.33Å; Y270-F279 HydrophobicContact CG-CG 4.4Å; Y270-F279 HydrophobicContact CG-CZ 4.48Å; T275-F279 WeakPolarHBondContact O-CA 3.45Å; T275-F279 WeakPolarHBondContact O-CB 3.16Å; T275-F279 PolarHBondContact O-N 3.42Å; Q276-F279 VanDerWaalsContact O-CB 3.32Å; Q276-F279 WeakPolarHBondContact O-CB 3.43Å; Q276-F279 PolarHBondContact O-N 3.03Å; Q276-F279 VanDerWaalsContact O-N 3.15Å; F279-V281 PolarHBondContact O-N 3.41Å; F279-R282 PolarHBondContact O-N 3.46Å; F279-L283 HydrophobicContact CE1-CD2 4.03Å; F279-L283 HydrophobicContact CZ-CD2 4.27Å; F279-L283 WeakPolarHBondContact O-CB 3.39Å; F279-L283 PolarHBondContact O-N 2.98Å
280	W	91.9	Very high	87.4	Confident	28 Å²	28	74.9 Å²	74.9	11%	0.106	40%	0.398	C	S	.	.	H	α-helix	trans	-62.6	-43.6	-178.9	-56.1	126.1	0	0	0	111.8	F168 E171 M172 E175 L176 Y270 R282 L283 A284	F168-W280 AromaticContact CE2-CH2 3.74Å; F168-W280 HydrophobicContact CE2-CH2 3.74Å; F168-W280 HydrophobicContact CE2-CZ2 4.36Å; F168-W280 AromaticContact CZ-CH2 3.84Å; F168-W280 HydrophobicContact CZ-CH2 3.84Å; F168-W280 HydrophobicContact CZ-CZ3 4.44Å; E171-W280 HydrophobicContact CG-CZ2 4.33Å; M172-W280 VanDerWaalsContact CA-CZ3 3.48Å; M172-W280 HydrophobicContact CB-CH2 3.73Å; M172-W280 HydrophobicContact CB-CZ3 3.54Å; M172-W280 HydrophobicContact CG-CE3 4.47Å; M172-W280 HydrophobicContact CG-CH2 4.31Å; M172-W280 HydrophobicContact CG-CZ3 3.61Å; M172-W280 HydrophobicContact SD-CZ3 4.45Å; E175-W280 HydrophobicContact CB-CB 4.36Å; E175-W280 HydrophobicContact CB-CD2 3.7Å; E175-W280 HydrophobicContact CB-CE3 4.15Å; E175-W280 HydrophobicContact CB-CG 3.79Å; E175-W280 HydrophobicContact CG-CD2 4.17Å; E175-W280 HydrophobicContact CG-CG 4.3Å; E175-W280 HydrophobicContact CG-CZ2 4.29Å; L176-W280 HydrophobicContact CD2-CE3 4.4Å; L176-W280 HydrophobicContact CG-CE3 4.38Å; Y270-W280 HydrophobicContact CD2-CZ2 4.47Å; Y270-W280 AromaticContact CE2-CZ2 3.85Å; Y270-W280 HydrophobicContact CE2-CZ2 3.85Å; Y270-W280 AromaticContact CZ-CZ2 3.93Å; W280-R282 VanDerWaalsContact C-N 3.33Å; W280-R282 PolarHBondContact O-N 3.08Å; W280-L283 HydrophobicContact CE3-CD2 4.43Å; W280-L283 HydrophobicContact CZ3-CD2 4.42Å; W280-L283 PolarHBondContact O-N 2.91Å; W280-A284 WeakPolarHBondContact O-CB 3.19Å; W280-A284 PolarHBondContact O-N 3.19Å
281	V	90.4	Very high	87.2	Confident	84 Å²	84	76.8 Å²	76.8	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-60.7	-43.6	176.8	-179.4	0	0	0	0	111.1	W278 F279 K285	W278-V281 PolarHBondContact O-N 3.21Å; F279-V281 PolarHBondContact O-N 3.41Å; V281-K285 VanDerWaalsContact O-CB 3.26Å; V281-K285 WeakPolarHBondContact O-CB 3.37Å; V281-K285 PolarHBondContact O-N 2.92Å
282	R	90.4	Very high	87.1	Confident	149 Å²	149	77.6 Å²	77.6	56%	0.562	41%	0.412	S	S	*	.	H	α-helix	trans	-68.3	-41.3	179.1	-177.6	176.2	172.3	171.9	-2.7	111.9	W278 F279 W280 A286	W278-R282 VanDerWaalsContact O-CB 3.25Å; W278-R282 WeakPolarHBondContact O-CB 3.3Å; W278-R282 PolarHBondContact O-N 3.14Å; F279-R282 PolarHBondContact O-N 3.46Å; W280-R282 VanDerWaalsContact C-N 3.33Å; W280-R282 PolarHBondContact O-N 3.08Å; R282-A286 WeakPolarHBondContact O-CB 3.39Å; R282-A286 PolarHBondContact O-N 3.12Å
283	L	92.2	Very high	87.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-65.9	-47.7	177	-178.1	57.8	0	0	0	110.3	M172 L176 I247 V249 F279 W280 K285 A286 L287	M172-L283 HydrophobicContact CG-CD2 4.47Å; M172-L283 HydrophobicContact SD-CD2 4.03Å; L176-L283 HydrophobicContact CD1-CD2 3.99Å; L176-L283 HydrophobicContact CD1-CG 4.33Å; L176-L283 HydrophobicContact CD2-CB 4.17Å; L176-L283 HydrophobicContact CD2-CD2 4.2Å; L176-L283 HydrophobicContact CD2-CG 4.06Å; I247-L283 HydrophobicContact CG2-CD1 4Å; V249-L283 HydrophobicContact CG2-CD1 4.29Å; V249-L283 HydrophobicContact CG2-CD2 4.23Å; F279-L283 HydrophobicContact CE1-CD2 4.03Å; F279-L283 HydrophobicContact CZ-CD2 4.27Å; F279-L283 WeakPolarHBondContact O-CB 3.39Å; F279-L283 PolarHBondContact O-N 2.98Å; W280-L283 HydrophobicContact CE3-CD2 4.43Å; W280-L283 HydrophobicContact CZ3-CD2 4.42Å; W280-L283 PolarHBondContact O-N 2.91Å; L283-K285 VanDerWaalsContact C-N 3.34Å; L283-K285 PolarHBondContact O-N 2.9Å; L283-A286 WeakPolarHBondContact O-CA 3.26Å; L283-A286 WeakPolarHBondContact O-CB 3.5Å; L283-A286 PolarHBondContact O-N 3.3Å; L283-L287 HydrophobicContact CD1-CD1 4.41Å; L283-L287 HydrophobicContact CD1-CG 4.38Å; L283-L287 HydrophobicContact CG-CD1 4.27Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.15Å
284	A	91.8	Very high	87.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-44.1	177.5	0	0	0	0	0	112.1	L176 T179 Y181 L183 W280 A286 L287 S288	L176-A284 HydrophobicContact CD2-CB 3.75Å; T179-A284 HydrophobicContact CG2-CB 3.85Å; Y181-A284 HydrophobicContact CD2-CB 3.63Å; Y181-A284 HydrophobicContact CE2-CB 4.1Å; L183-A284 HydrophobicContact CD1-CB 3.73Å; W280-A284 WeakPolarHBondContact O-CB 3.19Å; W280-A284 PolarHBondContact O-N 3.19Å; A284-A286 VanDerWaalsContact C-N 3.32Å; A284-A286 PolarHBondContact O-N 2.87Å; A284-L287 PolarHBondContact O-N 3.24Å; A284-L287 VanDerWaalsContact O-N 3.14Å; A284-S288 PolarHBondContact O-N 3.4Å; A284-S288 PolarHBondContact O-OG 3.14Å
285	K	90.6	Very high	87.5	Confident	120 Å²	120	69.2 Å²	69.2	52%	0.522	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-39.1	173.2	-176.5	173.5	-178	172.9	0	112.4	Y181 V281 L283 L287 S288 L289	Y181-K285 HydrophobicContact CE2-CB 4.32Å; V281-K285 VanDerWaalsContact O-CB 3.26Å; V281-K285 WeakPolarHBondContact O-CB 3.37Å; V281-K285 PolarHBondContact O-N 2.92Å; L283-K285 VanDerWaalsContact C-N 3.34Å; L283-K285 PolarHBondContact O-N 2.9Å; K285-L287 VanDerWaalsContact C-N 3.27Å; K285-L287 PolarHBondContact O-N 3.13Å; K285-S288 PolarHBondContact O-OG 3.13Å; K285-L289 WeakPolarHBondContact O-CG 3.35Å
286	A	89.7	Confident	88	Confident	29 Å²	29	70.8 Å²	70.8	24%	0.24	37%	0.37	C	S	.	.	H	α-helix	trans	-66.6	-33.3	176.3	0	0	0	0	0	111.9	R212 I247 R282 L283 A284	R212-A286 PolarHBondContact NE-O 3.18Å; R212-A286 PolarHBondContact NH1-O 2.74Å; I247-A286 HydrophobicContact CD1-CB 3.95Å; R282-A286 WeakPolarHBondContact O-CB 3.39Å; R282-A286 PolarHBondContact O-N 3.12Å; L283-A286 WeakPolarHBondContact O-CA 3.26Å; L283-A286 WeakPolarHBondContact O-CB 3.5Å; L283-A286 PolarHBondContact O-N 3.3Å; A284-A286 VanDerWaalsContact C-N 3.32Å; A284-A286 PolarHBondContact O-N 2.87Å
287	L	90.5	Very high	88.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-78.1	-30.2	178.7	-67.5	-178.3	0	0	0	113.8	A157 L176 L183 L185 R212 V214 I247 L283 A284 K285	A157-L287 HydrophobicContact CB-CD1 4.28Å; A157-L287 HydrophobicContact CB-CD2 3.7Å; L176-L287 HydrophobicContact CD1-CD1 3.99Å; L183-L287 HydrophobicContact CD1-CB 4.03Å; L183-L287 HydrophobicContact CD1-CD1 4.29Å; L183-L287 HydrophobicContact CD2-CB 4.03Å; L185-L287 HydrophobicContact CD2-CD1 4.03Å; R212-L287 HydrophobicContact CB-CD2 4.11Å; R212-L287 PolarHBondContact NH1-O 3.09Å; V214-L287 HydrophobicContact CG2-CD1 4.13Å; V214-L287 HydrophobicContact CG2-CD2 3.81Å; I247-L287 HydrophobicContact CD1-CD2 3.82Å; L283-L287 HydrophobicContact CD1-CD1 4.41Å; L283-L287 HydrophobicContact CD1-CG 4.38Å; L283-L287 HydrophobicContact CG-CD1 4.27Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.15Å; A284-L287 PolarHBondContact O-N 3.24Å; A284-L287 VanDerWaalsContact O-N 3.14Å; K285-L287 VanDerWaalsContact C-N 3.27Å; K285-L287 PolarHBondContact O-N 3.13Å
288	S	88.7	Confident	88.5	Confident	41 Å²	41	68.7 Å²	68.7	29%	0.287	34%	0.344	S	S	.	.	H	α-helix	trans	-79.7	-17.3	-178.9	66.2	0	0	0	0	114.6	Y181 A284 K285	Y181-S288 WeakPolarHBondContact CD1-OG 3.44Å; A284-S288 PolarHBondContact O-N 3.4Å; A284-S288 PolarHBondContact O-OG 3.14Å; K285-S288 PolarHBondContact O-OG 3.13Å
289	L	84.4	Confident	88.6	Confident	86 Å²	86	59 Å²	59	45%	0.45	31%	0.314	S	S	.	.			trans	-63	154.9	177.8	-72	169.5	0	0	0	111.3	R212 K285	R212-L289 PolarHBondContact NH1-O 3.39Å; R212-L289 VanDerWaalsContact NH2-C 3.28Å; R212-L289 PolarHBondContact NH2-O 2.86Å; K285-L289 WeakPolarHBondContact O-CG 3.35Å
290	P	71	Confident	88.3	Confident	162 Å²	162	63.5 Å²	63.5	100%	1.052	34%	0.339	S	S	*	.			trans	-65.7	0	172.3	25.8	-31.8	0	0	0	112.6	R212	R212-P290 PolarHBondContact NH2-O 3.36Å

Retrieved 290 of 290 residues in 308.7 ms (Link to these results)

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