A0A096NMW3_PAPAN Loading...

Neuronal acetylcholine receptor subunit beta-4

AlphaFold DB , UniProt , Accession A0A096NMW3, Species PAPAN (Papio anubis, Olive baboon), Gene CHRNB4, Length 492 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	51.1	Low	225 Å²	225	140.9 Å²	140.9	100%	1.108	74%	0.739	S	S	*	*				0	112.8	0	-80.6	176.4	174.1	0	0	110.1
2	R	43.4	Very low	51.3	Low	221 Å²	221	138.8 Å²	138.8	83%	0.834	73%	0.728	S	S	*	*			trans	64.7	91.6	136.8	-59.7	179	179.3	-170.9	-0.3	116.3
3	H	47.6	Very low	51.6	Low	195 Å²	195	136.1 Å²	136.1	90%	0.903	72%	0.72	S	S	*	*				41	82.8	77.4	-68.3	-56.8	0	0	0	114.6
4	A	53.9	Low	51.7	Low	88 Å²	88	131.1 Å²	131.1	73%	0.727	71%	0.708	S	S	*	*			trans	-163.8	90.3	152.4	0	0	0	0	0	110.6
5	P	51.1	Low	51.6	Low	116 Å²	116	131.5 Å²	131.5	75%	0.753	71%	0.709	S	S	*	*	S	Bend	trans	-134.6	9.9	138.7	36.3	-23.9	0	0	0	113.5
6	S	53.7	Low	51.3	Low	89 Å²	89	130.6 Å²	130.6	62%	0.622	71%	0.713	S	S	*	*	H	α-helix	trans	-84.9	-18.5	-178.6	-154.7	0	0	0	0	113.9
7	L	54.8	Low	51	Low	129 Å²	129	126.4 Å²	126.4	68%	0.675	71%	0.708	S	S	*	*	H	α-helix	trans	-84.2	-25.8	-172.6	-116.8	141.4	0	0	0	114.1	L11	L7-L11 HydrophobicContact CD2-CD1 4.21Å; L7-L11 PolarHBondContact O-N 3.18Å
8	V	56.1	Low	50.9	Low	104 Å²	104	132.8 Å²	132.8	63%	0.63	72%	0.719	S	S	*	*	H	α-helix	trans	-78.4	-34	180	-179.7	0	0	0	0	111.4	L11 L12	V8-L11 PolarHBondContact O-N 3.42Å; V8-L12 HydrophobicContact CG1-CD1 4.46Å; V8-L12 PolarHBondContact O-N 3.45Å
9	L	54.6	Low	50.4	Low	128 Å²	128	129.2 Å²	129.2	67%	0.67	72%	0.716	S	S	*	*	H	α-helix	trans	-71.4	-34.7	175.8	-152.2	78.1	0	0	0	111.7	V13	L9-V13 WeakPolarHBondContact O-CG2 3.48Å; L9-V13 PolarHBondContact O-N 3.09Å
10	F	54.8	Low	50.1	Low	156 Å²	156	130.1 Å²	130.1	68%	0.684	72%	0.719	S	S	*	*	H	α-helix	trans	-70.7	-32	176	-115.1	-85.4	0	0	0	113.2	A14	F10-A14 WeakPolarHBondContact O-CB 3.45Å; F10-A14 PolarHBondContact O-N 3.49Å
11	L	54.5	Low	49.8	Very low	99 Å²	99	129.2 Å²	129.2	52%	0.518	72%	0.721	S	S	.	*	H	α-helix	trans	-73.4	-35.3	176.7	-102	142.6	0	0	0	112.9	L7 V8 A14 L15	L7-L11 HydrophobicContact CD2-CD1 4.21Å; L7-L11 PolarHBondContact O-N 3.18Å; V8-L11 PolarHBondContact O-N 3.42Å; L11-A14 PolarHBondContact O-N 3.3Å; L11-L15 HydrophobicContact CD2-CD1 4.43Å; L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 PolarHBondContact O-N 3.18Å; L11-L15 VanDerWaalsContact O-N 3.07Å
12	L	53.3	Low	50.4	Low	116 Å²	116	128.7 Å²	128.7	61%	0.607	71%	0.707	S	S	*	*	H	α-helix	trans	-72	-33.4	174.7	-83.2	159.8	0	0	0	112.6	V8 C16	V8-L12 HydrophobicContact CG1-CD1 4.46Å; V8-L12 PolarHBondContact O-N 3.45Å; L12-C16 PolarHBondContact O-N 3.2Å
13	V	55.4	Low	51	Low	103 Å²	103	123 Å²	123	62%	0.624	70%	0.697	S	S	*	*	H	α-helix	trans	-75	-33.5	173.4	176.7	0	0	0	0	111.7	L9 C16 G17	L9-V13 WeakPolarHBondContact O-CG2 3.48Å; L9-V13 PolarHBondContact O-N 3.09Å; V13-C16 PolarHBondContact O-N 2.88Å; V13-G17 PolarHBondContact O-N 2.74Å
14	A	52.8	Low	51.7	Low	67 Å²	67	114.9 Å²	114.9	55%	0.554	66%	0.663	S	S	*	*	H	α-helix	trans	-71.9	-28.9	176	0	0	0	0	0	113.6	F10 L11	F10-A14 WeakPolarHBondContact O-CB 3.45Å; F10-A14 PolarHBondContact O-N 3.49Å; L11-A14 PolarHBondContact O-N 3.3Å
15	L	49.7	Very low	53.2	Low	137 Å²	137	114.9 Å²	114.9	72%	0.717	65%	0.651	S	S	*	*	H	α-helix	trans	-82.3	-22.3	175.2	-85.9	152.7	0	0	0	113.6	L11	L11-L15 HydrophobicContact CD2-CD1 4.43Å; L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 PolarHBondContact O-N 3.18Å; L11-L15 VanDerWaalsContact O-N 3.07Å
16	C	46.6	Very low	55	Low	116 Å²	116	109.5 Å²	109.5	78%	0.784	62%	0.616	S	S	*	*	S	Bend	trans	-84.2	-6.1	169.9	-89.8	0	0	0	0	113.9	L12 V13	L12-C16 PolarHBondContact O-N 3.2Å; V13-C16 PolarHBondContact O-N 2.88Å
17	G	47.2	Very low	56.8	Low	60 Å²	60	109.1 Å²	109.1	62%	0.619	61%	0.605	S	S	*	*	S	Bend	trans	-93.2	6.3	-174.9	0	0	0	0	0	116.4	V13	V13-G17 PolarHBondContact O-N 2.74Å
18	R	49.1	Very low	58.5	Low	242 Å²	242	108.8 Å²	108.8	91%	0.913	60%	0.6	S	S	*	*			trans	-121	54.1	174.4	-81.1	-173	172.3	-178.7	-1.2	111.6
19	G	41.2	Very low	60.2	Low	64 Å²	64	108.3 Å²	108.3	66%	0.66	59%	0.589	S	S	*	*			trans	-115.7	59.4	161.7	0	0	0	0	0	109.1	C21	G19-C21 PolarHBondContact O-N 2.9Å
20	D	45	Very low	62.1	Low	146 Å²	146	102.2 Å²	102.2	78%	0.781	56%	0.557	S	S	*	*			trans	-70.9	70.3	166.7	-124.8	-12.9	0	0	0	107.6	R22	D20-R22 PolarHBondContact O-N 3.4Å
21	C	43.5	Very low	64	Low	113 Å²	113	96.6 Å²	96.6	76%	0.764	53%	0.534	S	S	*	.			trans	-72.9	68	159.5	-93.8	0	0	0	0	107.7	G19 V23	G19-C21 PolarHBondContact O-N 2.9Å; C21-V23 HydrophobicContact CB-CG2 4.22Å; C21-V23 PolarHBondContact O-N 3.3Å
22	R	51.1	Low	65.8	Low	213 Å²	213	96 Å²	96	80%	0.804	53%	0.531	S	S	*	.			trans	-72.5	74.5	148.7	-72.5	-171.8	177.9	-166.1	-1.8	106.6	D20 A24	D20-R22 PolarHBondContact O-N 3.4Å; R22-A24 PolarHBondContact O-N 3.36Å
23	V	54.9	Low	67.8	Low	102 Å²	102	93 Å²	93	62%	0.618	52%	0.515	S	S	*	.			trans	-70	76.9	159	-176.1	0	0	0	0	104.8	C21 N25	C21-V23 HydrophobicContact CB-CG2 4.22Å; C21-V23 PolarHBondContact O-N 3.3Å; V23-N25 PolarHBondContact O-N 2.84Å
24	A	62.6	Low	69.6	Low	24 Å²	24	88.7 Å²	88.7	20%	0.198	49%	0.489	C	S	.	.			trans	-54.9	132.2	168.2	0	0	0	0	0	106.4	R22 A26 K29	R22-A24 PolarHBondContact O-N 3.36Å; A24-A26 PolarHBondContact O-N 3.45Å; A24-K29 HydrophobicContact CB-CD 4.46Å; A24-K29 HydrophobicContact CB-CG 3.87Å; A24-K29 WeakPolarHBondContact O-CE 3.21Å; A24-K29 PolarHBondContact O-NZ 3.43Å
25	N	85.3	Confident	71.6	Confident	89 Å²	89	86.2 Å²	86.2	48%	0.476	47%	0.466	S	S	.	.			trans	-50.6	140.9	-178.2	-172.9	-0.1	0	0	0	108.4	V23 E27 E28 K29	V23-N25 PolarHBondContact O-N 2.84Å; N25-E27 PolarHBondContact O-N 3.41Å; N25-E27 VanDerWaalsContact O-N 3.09Å; N25-E28 HydrophobicContact CB-CB 4.12Å; N25-E28 WeakPolarHBondContact O-CA 3.47Å; N25-E28 WeakPolarHBondContact O-CB 3.4Å; N25-E28 PolarHBondContact O-N 2.94Å; N25-K29 PolarHBondContact O-N 3.34Å
26	A	88.7	Confident	73.7	Confident	3 Å²	3	84.9 Å²	84.9	3%	0.025	46%	0.46	C	S	.	.	H	α-helix	trans	-53.4	-35	180	0	0	0	0	0	111.5	A24 L30 E98 V100	A24-A26 PolarHBondContact O-N 3.45Å; A26-L30 VanDerWaalsContact O-CB 3.23Å; A26-L30 WeakPolarHBondContact O-CB 3.33Å; A26-L30 PolarHBondContact O-N 3.42Å; A26-E98 HydrophobicContact CB-CB 3.98Å; A26-E98 HydrophobicContact CB-CG 3.9Å; A26-V100 HydrophobicContact CB-CG2 4.42Å
27	E	90.7	Very high	76	Confident	80 Å²	80	87.2 Å²	87.2	37%	0.374	46%	0.457	S	S	.	.	H	α-helix	trans	-66.6	-36.3	173.3	-63.5	-174	157.3	0	0	113.8	N25 L30 M31 V100 L103	N25-E27 PolarHBondContact O-N 3.41Å; N25-E27 VanDerWaalsContact O-N 3.09Å; E27-L30 PolarHBondContact O-N 3.05Å; E27-M31 VanDerWaalsContact O-CB 3.27Å; E27-M31 WeakPolarHBondContact O-CB 3.27Å; E27-M31 PolarHBondContact O-N 3.24Å; E27-V100 HydrophobicContact CG-CG1 4.28Å; E27-V100 HydrophobicContact CG-CG2 4.06Å; E27-L103 HydrophobicContact CB-CD1 4.03Å; E27-L103 HydrophobicContact CG-CD1 4.22Å
28	E	91.9	Very high	78.1	Confident	123 Å²	123	88.6 Å²	88.6	58%	0.575	45%	0.453	S	S	*	.	H	α-helix	trans	-68.4	-45.5	177.7	-176.4	-178.3	-174.6	0	0	110.6	N25 L30 M31 D32	N25-E28 HydrophobicContact CB-CB 4.12Å; N25-E28 WeakPolarHBondContact O-CA 3.47Å; N25-E28 WeakPolarHBondContact O-CB 3.4Å; N25-E28 PolarHBondContact O-N 2.94Å; E28-L30 VanDerWaalsContact C-N 3.35Å; E28-M31 PolarHBondContact O-N 3.3Å; E28-D32 PolarHBondContact O-N 3.48Å
29	K	92.1	Very high	80.2	Confident	94 Å²	94	87.5 Å²	87.5	41%	0.409	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-45.6	173.5	-66.9	175.7	-178	162.2	0	111.1	A24 N25 M31 D32 D33	A24-K29 HydrophobicContact CB-CD 4.46Å; A24-K29 HydrophobicContact CB-CG 3.87Å; A24-K29 WeakPolarHBondContact O-CE 3.21Å; A24-K29 PolarHBondContact O-NZ 3.43Å; N25-K29 PolarHBondContact O-N 3.34Å; K29-M31 PolarHBondContact O-N 3.16Å; K29-D32 PolarHBondContact O-N 3.09Å; K29-D33 WeakPolarHBondContact O-CB 3.45Å; K29-D33 PolarHBondContact O-N 3.5Å
30	L	94	Very high	82.8	Confident	0 Å²	0	86.1 Å²	86.1	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-61.7	-42.8	177.9	178.5	62.1	0	0	0	111.9	A26 E27 E28 D33 L34 W92 Y97 V100 L103	A26-L30 VanDerWaalsContact O-CB 3.23Å; A26-L30 WeakPolarHBondContact O-CB 3.33Å; A26-L30 PolarHBondContact O-N 3.42Å; E27-L30 PolarHBondContact O-N 3.05Å; E28-L30 VanDerWaalsContact C-N 3.35Å; L30-D33 PolarHBondContact O-N 3.15Å; L30-L34 HydrophobicContact CD1-CD1 3.79Å; L30-L34 HydrophobicContact CD1-CG 3.9Å; L30-L34 HydrophobicContact CG-CD1 3.9Å; L30-L34 HydrophobicContact CG-CG 4.36Å; L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.08Å; L30-L34 PolarHBondContact O-N 3.39Å; L30-W92 HydrophobicContact CD1-CB 3.65Å; L30-W92 HydrophobicContact CD1-CD2 3.99Å; L30-W92 HydrophobicContact CD1-CG 3.58Å; L30-W92 HydrophobicContact CD2-CD2 3.85Å; L30-W92 HydrophobicContact CD2-CG 4.02Å; L30-W92 HydrophobicContact CD2-CZ2 4.1Å; L30-W92 HydrophobicContact CG-CD2 4.47Å; L30-W92 HydrophobicContact CG-CG 4.44Å; L30-Y97 HydrophobicContact CB-CD1 3.74Å; L30-Y97 HydrophobicContact CB-CE1 3.96Å; L30-Y97 HydrophobicContact CB-CG 4.17Å; L30-Y97 HydrophobicContact CD1-CD1 4.21Å; L30-Y97 HydrophobicContact CD1-CD2 3.82Å; L30-Y97 HydrophobicContact CD1-CE1 4.07Å; L30-Y97 HydrophobicContact CD1-CE2 3.68Å; L30-Y97 HydrophobicContact CD1-CG 4.09Å; L30-Y97 HydrophobicContact CG-CD1 4.5Å; L30-V100 HydrophobicContact CD2-CG1 4.1Å; L30-L103 HydrophobicContact CD2-CD1 4.43Å; L30-L103 HydrophobicContact CD2-CD2 3.97Å; L30-L103 HydrophobicContact CG-CD2 4.12Å
31	M	93.8	Very high	85.1	Confident	38 Å²	38	82.2 Å²	82.2	19%	0.187	40%	0.403	C	S	.	.	H	α-helix	trans	-62.3	-43	177.9	-173.9	72.9	71.1	0	0	111.8	E27 E28 K29 L34 L35 L103 I105	E27-M31 VanDerWaalsContact O-CB 3.27Å; E27-M31 WeakPolarHBondContact O-CB 3.27Å; E27-M31 PolarHBondContact O-N 3.24Å; E28-M31 PolarHBondContact O-N 3.3Å; K29-M31 PolarHBondContact O-N 3.16Å; M31-L34 PolarHBondContact O-N 3.36Å; M31-L35 HydrophobicContact CG-CD1 4.07Å; M31-L35 WeakPolarHBondContact O-CB 3.17Å; M31-L35 PolarHBondContact O-N 3.22Å; M31-L35 HydrophobicContact SD-CD1 3.43Å; M31-L35 WeakPolarHBondContact SD-CD1 3.47Å; M31-L35 HydrophobicContact SD-CG 4.24Å; M31-L103 HydrophobicContact CE-CD1 4.25Å; M31-L103 HydrophobicContact CE-CD2 4.16Å; M31-L103 HydrophobicContact CE-CG 4.19Å; M31-I105 HydrophobicContact CE-CB 4.43Å; M31-I105 HydrophobicContact CE-CG1 3.91Å; M31-I105 HydrophobicContact CE-CG2 4.35Å; M31-I105 HydrophobicContact SD-CD1 4.29Å; M31-I105 HydrophobicContact SD-CG1 4.18Å; M31-I105 HydrophobicContact SD-CG2 4.09Å
32	D	93.8	Very high	87.5	Confident	85 Å²	85	79.8 Å²	79.8	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-66.9	-42.4	177.7	-165.4	49.3	0	0	0	111.8	E28 K29 L34 N36 K37	E28-D32 PolarHBondContact O-N 3.48Å; K29-D32 PolarHBondContact O-N 3.09Å; D32-L34 PolarHBondContact O-N 3.49Å; D32-N36 WeakPolarHBondContact O-CB 3.37Å; D32-N36 PolarHBondContact O-N 2.78Å; D32-N36 WeakPolarHBondContact OD1-CB 3.33Å; D32-N36 PolarHBondContact OD1-ND2 3.05Å; D32-K37 PolarHBondContact O-N 3.19Å
33	D	94.2	Very high	89.6	Confident	54 Å²	54	76.3 Å²	76.3	29%	0.289	38%	0.38	S	S	.	.	I	π-helix	trans	-62.2	-40.7	175.7	-78.1	-22.6	0	0	0	112.2	K29 L30 K37 T38 Y97	K29-D33 WeakPolarHBondContact O-CB 3.45Å; K29-D33 PolarHBondContact O-N 3.5Å; L30-D33 PolarHBondContact O-N 3.15Å; D33-K37 WeakPolarHBondContact O-CB 3.41Å; D33-T38 WeakPolarHBondContact O-CG2 3.48Å; D33-Y97 WeakPolarHBondContact OD2-CE1 3.37Å; D33-Y97 PolarHBondContact OD2-OH 3.39Å
34	L	94.4	Very high	91.4	Very high	13 Å²	13	75.9 Å²	75.9	7%	0.068	37%	0.373	C	S	.	.	I	π-helix	trans	-79.3	-34.1	-176.8	-73.7	178.1	0	0	0	114.3	L30 M31 D32 T38 W92 L103	L30-L34 HydrophobicContact CD1-CD1 3.79Å; L30-L34 HydrophobicContact CD1-CG 3.9Å; L30-L34 HydrophobicContact CG-CD1 3.9Å; L30-L34 HydrophobicContact CG-CG 4.36Å; L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.08Å; L30-L34 PolarHBondContact O-N 3.39Å; M31-L34 PolarHBondContact O-N 3.36Å; D32-L34 PolarHBondContact O-N 3.49Å; L34-T38 PolarHBondContact O-OG1 2.84Å; L34-W92 HydrophobicContact CD1-CD2 4.48Å; L34-W92 HydrophobicContact CD1-CE3 3.75Å; L34-W92 HydrophobicContact CD1-CZ3 4.09Å; L34-L103 HydrophobicContact CD1-CD2 4.01Å
35	L	94.5	Very high	92.9	Very high	14 Å²	14	76.6 Å²	76.6	7%	0.073	37%	0.37	C	S	.	.	I	π-helix	trans	-103.1	-50.9	-174	-65.4	176.7	0	0	0	112.7	M31 R39 Y40 I105 R109 I110	M31-L35 HydrophobicContact CG-CD1 4.07Å; M31-L35 WeakPolarHBondContact O-CB 3.17Å; M31-L35 PolarHBondContact O-N 3.22Å; M31-L35 HydrophobicContact SD-CD1 3.43Å; M31-L35 WeakPolarHBondContact SD-CD1 3.47Å; M31-L35 HydrophobicContact SD-CG 4.24Å; L35-R39 PolarHBondContact O-N 3.38Å; L35-Y40 HydrophobicContact CD2-CD1 4.17Å; L35-Y40 HydrophobicContact CD2-CG 3.99Å; L35-Y40 PolarHBondContact O-N 3.13Å; L35-I105 HydrophobicContact CD1-CG2 4.4Å; L35-R109 HydrophobicContact CD1-CB 4.34Å; L35-I110 HydrophobicContact CD2-CG2 4.29Å
36	N	93.7	Very high	93.4	Very high	110 Å²	110	72.6 Å²	72.6	59%	0.588	35%	0.349	S	S	*	.	I	π-helix	trans	-87.3	-44.9	-171.6	-68	-28.6	0	0	0	111.5	D32 R39	D32-N36 WeakPolarHBondContact O-CB 3.37Å; D32-N36 PolarHBondContact O-N 2.78Å; D32-N36 WeakPolarHBondContact OD1-CB 3.33Å; D32-N36 PolarHBondContact OD1-ND2 3.05Å; N36-R39 PolarHBondContact O-N 2.91Å
37	K	93.8	Very high	93.6	Very high	165 Å²	165	73.3 Å²	73.3	72%	0.717	36%	0.355	S	S	*	.	I	π-helix	trans	-67.1	-42.3	-174.9	-173.6	63.8	176.4	-175.2	0	112.7	D32 D33 R39	D32-K37 PolarHBondContact O-N 3.19Å; D33-K37 WeakPolarHBondContact O-CB 3.41Å; K37-R39 VanDerWaalsContact C-N 3.31Å
38	T	91.3	Very high	93.7	Very high	89 Å²	89	74.3 Å²	74.3	55%	0.546	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.8	177	55	0	0	0	0	113.2	D33 L34	D33-T38 WeakPolarHBondContact O-CG2 3.48Å; L34-T38 PolarHBondContact O-OG1 2.84Å
39	R	93.4	Very high	93.7	Very high	218 Å²	218	71.1 Å²	71.1	82%	0.823	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	57.8	-174.1	-56	-179.4	-177.7	-177.7	-0.1	111.9	L35 N36 K37 N41	L35-R39 PolarHBondContact O-N 3.38Å; N36-R39 PolarHBondContact O-N 2.91Å; K37-R39 VanDerWaalsContact C-N 3.31Å; R39-N41 PolarHBondContact O-N 2.87Å
40	Y	95.9	Very high	93.6	Very high	35 Å²	35	71.9 Å²	71.9	14%	0.137	38%	0.375	C	S	.	.			trans	-59.4	130.3	179.2	-173.2	-82.3	0	0	0	110.9	L35 N42 D87 R89 L90 I110 W111	L35-Y40 HydrophobicContact CD2-CD1 4.17Å; L35-Y40 HydrophobicContact CD2-CG 3.99Å; L35-Y40 PolarHBondContact O-N 3.13Å; Y40-N42 HydrophobicContact CE1-CB 4.1Å; Y40-D87 PolarHBondContact OH-OD2 2.87Å; Y40-R89 HydrophobicContact CD2-CB 4.25Å; Y40-R89 HydrophobicContact CE2-CB 4.09Å; Y40-R89 PolarHBondContact OH-NH2 3.06Å; Y40-L90 HydrophobicContact CD2-CD2 4.03Å; Y40-L90 HydrophobicContact CE2-CD1 4.41Å; Y40-L90 HydrophobicContact CE2-CD2 3.8Å; Y40-L90 HydrophobicContact CE2-CG 3.97Å; Y40-I110 HydrophobicContact CE1-CB 4.15Å; Y40-I110 HydrophobicContact CE1-CG2 4.41Å; Y40-W111 PolarHBondContact OH-N 2.63Å
41	N	94.6	Very high	93.4	Very high	65 Å²	65	76.9 Å²	76.9	35%	0.348	41%	0.41	S	S	.	.			trans	-113.7	119.5	175.4	-175.5	-8.4	0	0	0	109.3	R39 L43 I44 R89	R39-N41 PolarHBondContact O-N 2.87Å; N41-L43 WeakPolarHBondContact OD1-CB 3.43Å; N41-L43 PolarHBondContact OD1-N 3.02Å; N41-I44 HydrophobicContact CB-CD1 3.99Å; N41-I44 HydrophobicContact CB-CG1 3.87Å; N41-I44 VanDerWaalsContact O-CG1 3.23Å; N41-I44 WeakPolarHBondContact O-CG1 3.42Å; N41-R89 PolarHBondContact O-NH1 2.81Å
42	N	93.9	Very high	93.4	Very high	62 Å²	62	78.5 Å²	78.5	33%	0.332	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.5	-177.8	61.2	-11.1	0	0	0	113.8	Y40 I44 K108 I110 W111	Y40-N42 HydrophobicContact CE1-CB 4.1Å; N42-I44 VanDerWaalsContact C-N 3.31Å; N42-K108 PolarHBondContact ND2-O 3.05Å; N42-I110 VanDerWaalsContact CB-C 3.43Å; N42-I110 WeakPolarHBondContact CB-O 3.46Å; N42-W111 WeakPolarHBondContact O-CA 3.22Å; N42-W111 WeakPolarHBondContact O-CB 3.25Å
43	L	93.8	Very high	93.4	Very high	140 Å²	140	77.9 Å²	77.9	73%	0.733	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.4	177.8	-58.2	178.1	0	0	0	112.8	N41	N41-L43 WeakPolarHBondContact OD1-CB 3.43Å; N41-L43 PolarHBondContact OD1-N 3.02Å
44	I	93.1	Very high	93.5	Very high	92 Å²	92	75.8 Å²	75.8	47%	0.472	40%	0.402	S	S	.	.	S	Bend	trans	-103	132.1	-178.8	57.7	168.6	0	0	0	110.6	N41 N42 R89	N41-I44 HydrophobicContact CB-CD1 3.99Å; N41-I44 HydrophobicContact CB-CG1 3.87Å; N41-I44 VanDerWaalsContact O-CG1 3.23Å; N41-I44 WeakPolarHBondContact O-CG1 3.42Å; N42-I44 VanDerWaalsContact C-N 3.31Å; I44-R89 PolarHBondContact O-NH2 3.01Å
45	R	94.6	Very high	93.5	Very high	40 Å²	40	78.2 Å²	78.2	15%	0.151	42%	0.42	C	S	.	.			trans	-67.4	144.6	178.2	72	-177.3	177.1	91.8	7.4	111.3	A47 S50 Q52 I54 W111 Y176 E180	R45-A47 HydrophobicContact CG-CB 4.22Å; R45-A47 PolarHBondContact O-N 3.2Å; R45-S50 PolarHBondContact NH2-O 3.19Å; R45-Q52 PolarHBondContact NH1-O 2.96Å; R45-I54 HydrophobicContact CB-CD1 3.69Å; R45-I54 HydrophobicContact CG-CD1 4Å; R45-W111 HydrophobicContact CB-CZ2 3.91Å; R45-Y176 HydrophobicContact CB-CE1 4.43Å; R45-E180 IonicContact NE-OE1 2.79Å
46	P	95.4	Very high	93.6	Very high	4 Å²	4	77.6 Å²	77.6	3%	0.026	42%	0.417	C	S	.	.			trans	-78.1	61.2	-177.9	32.8	-38.4	0	0	0	113.1	I54 D87 Y88 W111	P46-I54 HydrophobicContact CG-CD1 3.92Å; P46-D87 HydrophobicContact CB-CB 3.93Å; P46-D87 VanDerWaalsContact CB-OD1 3.24Å; P46-D87 WeakPolarHBondContact CB-OD1 3.48Å; P46-D87 HydrophobicContact CG-CB 4.19Å; P46-Y88 HydrophobicContact CB-CD1 4.41Å; P46-Y88 HydrophobicContact CB-CE1 4.46Å; P46-W111 HydrophobicContact CG-CD2 4.25Å; P46-W111 HydrophobicContact CG-CE3 3.71Å; P46-W111 HydrophobicContact CG-CZ3 3.93Å
47	A	93.9	Very high	93.8	Very high	18 Å²	18	77.2 Å²	77.2	15%	0.149	41%	0.41	C	S	.	.			trans	-101.1	138.9	174.5	0	0	0	0	0	111	R45 S49 Q52	R45-A47 HydrophobicContact CG-CB 4.22Å; R45-A47 PolarHBondContact O-N 3.2Å; A47-S49 WeakPolarHBondContact CB-O 3.46Å; A47-Q52 HydrophobicContact CB-CB 4.4Å
48	T	92	Very high	93.9	Very high	101 Å²	101	69.4 Å²	69.4	62%	0.62	38%	0.376	S	S	*	.	S	Bend	trans	-81.3	-27.9	174.7	65.3	0	0	0	0	112.1	Q52 Y88	T48-Q52 PolarHBondContact OG1-OE1 3.31Å; T48-Y88 HydrophobicContact CG2-CD1 3.84Å; T48-Y88 HydrophobicContact CG2-CE1 3.99Å; T48-Y88 HydrophobicContact CG2-CG 4.14Å
49	S	92.6	Very high	94.1	Very high	56 Å²	56	66.6 Å²	66.6	39%	0.392	36%	0.357	S	S	.	.	S	Bend	trans	-133.8	159.7	174	71.8	0	0	0	0	110.8	A47 S51 Q52	A47-S49 WeakPolarHBondContact CB-O 3.46Å; S49-S51 VanDerWaalsContact C-N 3.29Å; S49-S51 PolarHBondContact O-N 2.66Å; S49-Q52 PolarHBondContact O-N 3.29Å; S49-Q52 WeakPolarHBondContact OG-CB 3.4Å; S49-Q52 PolarHBondContact OG-N 3.33Å
50	S	88.1	Confident	94.2	Very high	111 Å²	111	56.2 Å²	56.2	78%	0.776	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-34.8	-179.2	-168.5	0	0	0	0	112.8	R45	R45-S50 PolarHBondContact NH2-O 3.19Å
51	S	90.1	Very high	94.2	Very high	104 Å²	104	55.5 Å²	55.5	73%	0.727	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.4	-179.9	55.8	0	0	0	0	114.4	S49 L53	S49-S51 VanDerWaalsContact C-N 3.29Å; S49-S51 PolarHBondContact O-N 2.66Å; S51-L53 PolarHBondContact O-N 2.97Å
52	Q	94.2	Very high	94.3	Very high	72 Å²	72	52.4 Å²	52.4	34%	0.336	30%	0.301	S	S	.	.			trans	-74	126.3	-179.1	-176	-178.2	1.3	0	0	110.9	R45 A47 T48 S49	R45-Q52 PolarHBondContact NH1-O 2.96Å; A47-Q52 HydrophobicContact CB-CB 4.4Å; T48-Q52 PolarHBondContact OG1-OE1 3.31Å; S49-Q52 PolarHBondContact O-N 3.29Å; S49-Q52 WeakPolarHBondContact OG-CB 3.4Å; S49-Q52 PolarHBondContact OG-N 3.33Å
53	L	93.9	Very high	94.3	Very high	73 Å²	73	50 Å²	50	38%	0.382	29%	0.29	S	S	.	.			trans	-79.6	134.9	170.4	-62.2	176.7	0	0	0	110.9	S51 H178 T179	S51-L53 PolarHBondContact O-N 2.97Å; L53-H178 VanDerWaalsContact CD2-O 3.27Å; L53-H178 WeakPolarHBondContact CD2-O 3.15Å; L53-T179 WeakPolarHBondContact CD2-O 3.42Å
54	I	95.9	Very high	94.4	Very high	9 Å²	9	47 Å²	47	5%	0.046	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.2	172.3	-58.4	168.8	0	0	0	108.3	R45 P46 I56 W85 W111 E180 I181 D182	R45-I54 HydrophobicContact CB-CD1 3.69Å; R45-I54 HydrophobicContact CG-CD1 4Å; P46-I54 HydrophobicContact CG-CD1 3.92Å; I54-I56 HydrophobicContact CG2-CG1 4.26Å; I54-I56 PolarHBondContact O-N 3.46Å; I54-W85 HydrophobicContact CG2-CB 4.49Å; I54-W111 HydrophobicContact CD1-CH2 4.01Å; I54-W111 HydrophobicContact CD1-CZ2 4.3Å; I54-W111 HydrophobicContact CG2-CH2 4.27Å; I54-W111 HydrophobicContact CG2-CZ3 4.43Å; I54-E180 PolarHBondContact N-O 2.95Å; I54-I181 HydrophobicContact CB-CG2 4.36Å; I54-I181 WeakPolarHBondContact O-CA 3.32Å; I54-D182 PolarHBondContact O-N 3.38Å
55	S	95.6	Very high	94.5	Very high	65 Å²	65	42.6 Å²	42.6	46%	0.455	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	114.2	176.1	-55.7	0	0	0	0	110.9	D182	S55-D182 CarbonylContact C-O 3.56Å; S55-D182 WeakPolarHBondContact CA-O 3.27Å
56	I	96.9	Very high	94.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.2	176.4	-57.5	154.2	0	0	0	108.2	I54 W85 P113 I115 I181 D182 V184	I54-I56 HydrophobicContact CG2-CG1 4.26Å; I54-I56 PolarHBondContact O-N 3.46Å; I56-W85 HydrophobicContact CG1-CB 4.15Å; I56-P113 HydrophobicContact CD1-CB 3.43Å; I56-P113 VanDerWaalsContact CD1-CB 3.43Å; I56-P113 HydrophobicContact CD1-CG 3.85Å; I56-P113 HydrophobicContact CG1-CB 4.39Å; I56-P113 HydrophobicContact CG1-CG 4.32Å; I56-P113 HydrophobicContact CG2-CG 4.36Å; I56-I115 HydrophobicContact CG2-CD1 3.79Å; I56-I181 HydrophobicContact CD1-CB 4.04Å; I56-I181 HydrophobicContact CD1-CD1 3.86Å; I56-I181 HydrophobicContact CD1-CG2 4.22Å; I56-D182 PolarHBondContact N-O 3.14Å; I56-V184 PolarHBondContact O-N 2.87Å
57	K	96.9	Very high	94.5	Very high	102 Å²	102	46.6 Å²	46.6	44%	0.443	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128.4	178.1	-63.3	178.6	-177.2	177.5	0	109.8	Q83 E84 V184	K57-Q83 CarbonylContact O-C 3.55Å; K57-Q83 WeakPolarHBondContact O-CA 3.36Å; K57-E84 HydrophobicContact CB-CB 4.32Å; K57-E84 PolarHBondContact N-O 2.84Å; K57-E84 PolarHBondContact O-N 3.41Å; K57-V184 CarbonylContact C-O 3.44Å; K57-V184 VanDerWaalsContact CA-O 3.29Å; K57-V184 WeakPolarHBondContact CA-O 3.47Å; K57-V184 HydrophobicContact CG-CB 4.48Å
58	L	96	Very high	94.6	Very high	1 Å²	1	46 Å²	46	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.7	-178.1	-69	160	0	0	0	110.6	L81 K82 Q83 I115 M183 V184 M186 V222	L58-L81 HydrophobicContact CD2-CD1 4.09Å; L58-L81 HydrophobicContact CD2-CD2 4.37Å; L58-L81 HydrophobicContact CD2-CG 4.26Å; L58-K82 WeakPolarHBondContact CA-O 3.25Å; L58-Q83 HydrophobicContact CD2-CB 4.49Å; L58-Q83 HydrophobicContact CD2-CG 3.85Å; L58-I115 HydrophobicContact CD1-CD1 4.11Å; L58-I115 HydrophobicContact CD2-CD1 3.59Å; L58-I115 HydrophobicContact CD2-CG2 4.34Å; L58-I115 HydrophobicContact CG-CD1 4.21Å; L58-M183 HydrophobicContact CD1-CB 4.05Å; L58-M183 HydrophobicContact CD1-CG 4.06Å; L58-M183 HydrophobicContact CD1-SD 3.93Å; L58-V184 PolarHBondContact N-O 3.35Å; L58-M186 WeakPolarHBondContact O-CB 3.13Å; L58-M186 PolarHBondContact O-N 3.46Å; L58-V222 HydrophobicContact CD1-CB 4.19Å; L58-V222 HydrophobicContact CD1-CG2 3.88Å
59	Q	95.6	Very high	94.7	Very high	31 Å²	31	43.5 Å²	43.5	15%	0.145	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	125.4	169.7	-178.7	-175	-4.3	0	0	109.3	K82 M186 Y224	Q59-K82 HydrophobicContact CB-CB 4.12Å; Q59-K82 PolarHBondContact N-O 2.79Å; Q59-K82 WeakPolarHBondContact O-CB 3.33Å; Q59-K82 PolarHBondContact O-N 3.23Å; Q59-M186 HydrophobicContact CB-CB 4.08Å; Q59-M186 HydrophobicContact CB-SD 4.43Å; Q59-Y224 WeakPolarHBondContact CA-OH 3.4Å
60	L	95.9	Very high	94.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	131.5	174	-167.9	90.9	0	0	0	109.9	V79 L81 L169 F171 A190 S191 Y224 F226	L60-V79 HydrophobicContact CD1-CB 3.91Å; L60-V79 HydrophobicContact CD1-CG1 4.19Å; L60-V79 HydrophobicContact CD1-CG2 3.94Å; L60-V79 HydrophobicContact CD2-CG1 4.41Å; L60-V79 HydrophobicContact CG-CB 4.35Å; L60-V79 HydrophobicContact CG-CG1 4.41Å; L60-L81 HydrophobicContact CD1-CD1 4.1Å; L60-L169 HydrophobicContact CD2-CD1 4.45Å; L60-F171 HydrophobicContact CD1-CE2 3.79Å; L60-F171 HydrophobicContact CD1-CZ 3.87Å; L60-A190 HydrophobicContact CB-CB 4.18Å; L60-A190 HydrophobicContact CD2-CB 4.03Å; L60-A190 WeakPolarHBondContact O-CA 3.45Å; L60-A190 WeakPolarHBondContact O-CB 3.4Å; L60-S191 PolarHBondContact O-N 3.43Å; L60-S191 PolarHBondContact O-OG 3.27Å; L60-Y224 HydrophobicContact CB-CD1 4.02Å; L60-Y224 HydrophobicContact CB-CD2 3.98Å; L60-Y224 HydrophobicContact CB-CE1 3.63Å; L60-Y224 HydrophobicContact CB-CE2 3.61Å; L60-Y224 HydrophobicContact CB-CG 4.16Å; L60-Y224 VanDerWaalsContact CB-CZ 3.41Å; L60-Y224 HydrophobicContact CD2-CD1 4.15Å; L60-Y224 HydrophobicContact CD2-CD2 4.2Å; L60-Y224 HydrophobicContact CD2-CG 3.91Å; L60-Y224 HydrophobicContact CG-CD2 4.47Å; L60-Y224 PolarHBondContact N-OH 3.09Å; L60-F226 HydrophobicContact CD2-CE2 4.24Å; L60-F226 HydrophobicContact CD2-CZ 3.9Å
61	S	95.9	Very high	94.7	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.133	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.1	165.4	-161.9	0	0	0	0	109.6	V79 W80 S191	S61-V79 CarbonylContact O-C 3.29Å; S61-V79 WeakPolarHBondContact O-CA 3.47Å; S61-W80 PolarHBondContact N-O 2.99Å; S61-W80 PolarHBondContact O-N 3.43Å; S61-S191 WeakPolarHBondContact CA-O 3.33Å; S61-S191 WeakPolarHBondContact CA-OG 3.37Å; S61-S191 WeakPolarHBondContact CB-OG 3.5Å; S61-S191 PolarHBondContact OG-OG 2.9Å
62	L	96.3	Very high	94.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.2	177.8	-179	66.9	0	0	0	110	T77 V79 S191 F195 I203 L206 F226	L62-T77 HydrophobicContact CD1-CG2 4.35Å; L62-V79 HydrophobicContact CD1-CG1 3.77Å; L62-S191 PolarHBondContact N-O 2.9Å; L62-F195 HydrophobicContact CD2-CD2 3.98Å; L62-F195 HydrophobicContact CD2-CE2 3.91Å; L62-F195 HydrophobicContact CG-CD2 4.11Å; L62-F195 HydrophobicContact CG-CE2 4.38Å; L62-I203 HydrophobicContact CD2-CD1 3.18Å; L62-L206 HydrophobicContact CB-CD1 4.28Å; L62-L206 HydrophobicContact CD2-CD1 3.81Å; L62-F226 HydrophobicContact CD1-CE1 3.99Å; L62-F226 HydrophobicContact CD1-CZ 4.49Å; L62-F226 HydrophobicContact CD2-CE1 3.98Å
63	A	94.7	Very high	94.8	Very high	13 Å²	13	43.3 Å²	43.3	11%	0.107	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-47.1	173.7	0	0	0	0	0	111.1	N78 F195 T196	A63-N78 WeakPolarHBondContact CB-O 3.39Å; A63-N78 PolarHBondContact N-O 3.29Å; A63-F195 WeakPolarHBondContact O-CA 3.47Å; A63-T196 PolarHBondContact O-N 3.26Å
64	Q	95.3	Very high	94.9	Very high	76 Å²	76	41.3 Å²	41.3	36%	0.355	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	138	-178.6	-166.9	179.7	15.3	0	0	112.2	I66 N78	Q64-I66 HydrophobicContact CG-CG1 4.43Å; Q64-N78 HydrophobicContact CB-CB 4.24Å; Q64-N78 PolarHBondContact N-O 2.95Å; Q64-N78 PolarHBondContact O-N 3.48Å
65	L	95.8	Very high	94.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	105.3	161.1	-180	64.4	0	0	0	108	V68 M75 T77 W201 I228	L65-V68 HydrophobicContact CD1-CG2 4.02Å; L65-V68 HydrophobicContact CD2-CG2 4.23Å; L65-V68 HydrophobicContact CG-CG2 4.39Å; L65-M75 HydrophobicContact CD1-CG 3.94Å; L65-M75 HydrophobicContact CD1-SD 4.11Å; L65-T77 HydrophobicContact CD1-CG2 3.68Å; L65-W201 HydrophobicContact CD2-CB 3.77Å; L65-W201 HydrophobicContact CD2-CG 4.3Å; L65-I228 HydrophobicContact CD2-CD1 4.49Å; L65-I228 HydrophobicContact CD2-CG2 4.36Å
66	I	94.8	Very high	94.9	Very high	72 Å²	72	38.8 Å²	38.8	37%	0.369	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-50.7	-172.2	-66.6	168.7	0	0	0	110.5	Q64 T76 N78 I148	Q64-I66 HydrophobicContact CG-CG1 4.43Å; I66-T76 HydrophobicContact CB-CG2 4.11Å; I66-T76 HydrophobicContact CD1-CG2 4.1Å; I66-T76 HydrophobicContact CG2-CG2 4.34Å; I66-T76 PolarHBondContact N-O 3.5Å; I66-N78 HydrophobicContact CD1-CB 4.06Å; I66-N78 HydrophobicContact CG1-CB 4.48Å; I66-I148 HydrophobicContact CD1-CG2 4.14Å
67	S	94.2	Very high	94.8	Very high	55 Å²	55	38.8 Å²	38.8	39%	0.385	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	145.8	-176.4	-179	0	0	0	0	110.8	T76	S67-T76 PolarHBondContact N-O 2.97Å; S67-T76 PolarHBondContact O-N 2.91Å
68	V	95.3	Very high	94.7	Very high	6 Å²	6	35.9 Å²	35.9	4%	0.036	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	100.7	166.5	-178.4	0	0	0	0	105.9	L65 E70 M75 I155 W201 I228	L65-V68 HydrophobicContact CD1-CG2 4.02Å; L65-V68 HydrophobicContact CD2-CG2 4.23Å; L65-V68 HydrophobicContact CG-CG2 4.39Å; V68-E70 PolarHBondContact O-N 2.95Å; V68-M75 HydrophobicContact CG2-CG 4.21Å; V68-I155 HydrophobicContact CG1-CD1 4.07Å; V68-W201 HydrophobicContact CB-CZ2 4.19Å; V68-W201 HydrophobicContact CG1-CZ2 4.16Å; V68-I228 HydrophobicContact CG2-CD1 3.8Å
69	N	94.1	Very high	94.6	Very high	49 Å²	49	35.9 Å²	35.9	26%	0.262	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	104.9	177.7	-175.3	-21.4	0	0	0	108.7	R71 E72 Q73 I74	N69-R71 VanDerWaalsContact C-N 3.35Å; N69-R71 PolarHBondContact O-N 3.32Å; N69-R71 PolarHBondContact OD1-N 3.4Å; N69-E72 HydrophobicContact CB-CB 4.38Å; N69-E72 WeakPolarHBondContact ND2-CG 3.4Å; N69-E72 PolarHBondContact ND2-OE2 3.32Å; N69-E72 PolarHBondContact OD1-N 3.44Å; N69-E72 VanDerWaalsContact OD1-N 3.13Å; N69-Q73 WeakPolarHBondContact O-CA 3.37Å; N69-Q73 PolarHBondContact O-N 2.93Å; N69-I74 PolarHBondContact N-O 3.34Å; N69-I74 PolarHBondContact O-N 3.49Å; N69-I74 VanDerWaalsContact O-N 3.1Å
70	E	91.6	Very high	94.6	Very high	19 Å²	19	38.7 Å²	38.7	9%	0.089	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-36.1	-175.5	-57.2	88.9	161.8	0	0	112.3	V68 Q73 I155 R230 P286	V68-E70 PolarHBondContact O-N 2.95Å; E70-Q73 PolarHBondContact O-N 2.97Å; E70-I155 HydrophobicContact CB-CG1 4.43Å; E70-I155 HydrophobicContact CB-CG2 4.33Å; E70-I155 HydrophobicContact CG-CG2 4.27Å; E70-R230 IonicContact OE1-CZ 3.09Å; E70-R230 IonicContact OE1-NH1 2.67Å; E70-R230 PolarHBondContact OE1-NH1 3.46Å; E70-R230 IonicContact OE1-NH2 3.14Å; E70-R230 PolarHBondContact OE1-NH2 3.47Å; E70-P286 WeakPolarHBondContact O-CB 3.3Å; E70-P286 WeakPolarHBondContact O-CD 2.95Å; E70-P286 VanDerWaalsContact O-CG 3.26Å; E70-P286 WeakPolarHBondContact O-CG 2.81Å
71	R	90.5	Very high	94.5	Very high	145 Å²	145	38.7 Å²	38.7	55%	0.547	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-43.9	-177.2	-177.6	179.3	177.9	177.7	-4	111.9	N69 Q73 K283	N69-R71 VanDerWaalsContact C-N 3.35Å; N69-R71 PolarHBondContact O-N 3.32Å; N69-R71 PolarHBondContact OD1-N 3.4Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-K283 WeakPolarHBondContact CD-O 3.18Å
72	E	92	Very high	94.5	Very high	127 Å²	127	40.5 Å²	40.5	59%	0.593	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.8	177.5	-66.4	177.8	178.2	0	0	112.7	N69 I74	N69-E72 HydrophobicContact CB-CB 4.38Å; N69-E72 WeakPolarHBondContact ND2-CG 3.4Å; N69-E72 PolarHBondContact ND2-OE2 3.32Å; N69-E72 PolarHBondContact OD1-N 3.44Å; N69-E72 VanDerWaalsContact OD1-N 3.13Å; E72-I74 VanDerWaalsContact C-N 3.33Å; E72-I74 HydrophobicContact CB-CD1 3.98Å; E72-I74 HydrophobicContact CB-CG1 4.06Å
73	Q	93.6	Very high	94.5	Very high	48 Å²	48	40.5 Å²	40.5	22%	0.224	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	39.6	-176.2	-59.5	-170.6	-24.3	0	0	112.9	N69 E70 R71 C153 I155 P286	N69-Q73 WeakPolarHBondContact O-CA 3.37Å; N69-Q73 PolarHBondContact O-N 2.93Å; E70-Q73 PolarHBondContact O-N 2.97Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; Q73-C153 WeakPolarHBondContact CB-O 3.47Å; Q73-C153 PolarHBondContact O-N 2.9Å; Q73-I155 HydrophobicContact CG-CG1 4.43Å; Q73-P286 HydrophobicContact CG-CB 4.23Å
74	I	95.4	Very high	94.6	Very high	30 Å²	30	41.7 Å²	41.7	15%	0.154	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.1	-176.7	-59.6	175.5	0	0	0	110.1	N69 E72 A121 K150 S151	N69-I74 PolarHBondContact N-O 3.34Å; N69-I74 PolarHBondContact O-N 3.49Å; N69-I74 VanDerWaalsContact O-N 3.1Å; E72-I74 VanDerWaalsContact C-N 3.33Å; E72-I74 HydrophobicContact CB-CD1 3.98Å; E72-I74 HydrophobicContact CB-CG1 4.06Å; I74-A121 HydrophobicContact CD1-CB 3.7Å; I74-A121 HydrophobicContact CG1-CB 3.7Å; I74-A121 HydrophobicContact CG2-CB 4.25Å; I74-K150 HydrophobicContact CG2-CB 3.9Å; I74-K150 HydrophobicContact CG2-CG 4.43Å; I74-S151 WeakPolarHBondContact CA-O 3.41Å
75	M	95.9	Very high	94.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.6	170.5	171	177	62.1	0	0	109.8	L65 V68 T77 K150 S151 C153 C167 L169 F226	L65-M75 HydrophobicContact CD1-CG 3.94Å; L65-M75 HydrophobicContact CD1-SD 4.11Å; V68-M75 HydrophobicContact CG2-CG 4.21Å; M75-T77 HydrophobicContact CG-CG2 3.97Å; M75-T77 HydrophobicContact SD-CG2 4.2Å; M75-K150 WeakPolarHBondContact O-CA 3.5Å; M75-S151 VanDerWaalsContact CE-OG 3.27Å; M75-S151 WeakPolarHBondContact CE-OG 3.36Å; M75-S151 PolarHBondContact N-O 3.44Å; M75-S151 PolarHBondContact O-N 3.01Å; M75-S151 PolarHBondContact O-OG 2.88Å; M75-C153 HydrophobicContact CB-CB 4.36Å; M75-C167 HydrophobicContact CE-CB 3.19Å; M75-C167 HydrophobicContact SD-CB 3.56Å; M75-C167 VanDerWaalsContact SD-CB 3.56Å; M75-L169 HydrophobicContact CE-CD2 4.33Å; M75-F226 HydrophobicContact CE-CB 4.33Å; M75-F226 HydrophobicContact CE-CD2 4.32Å; M75-F226 HydrophobicContact CE-CG 4.21Å; M75-F226 HydrophobicContact SD-CB 4.23Å; M75-F226 HydrophobicContact SD-CD1 4.37Å; M75-F226 HydrophobicContact SD-CG 4.28Å
76	T	95.3	Very high	94.7	Very high	22 Å²	22	42.3 Å²	42.3	14%	0.135	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.1	178.6	-52.5	0	0	0	0	110.3	I66 S67 I148 Y149 K150	I66-T76 HydrophobicContact CB-CG2 4.11Å; I66-T76 HydrophobicContact CD1-CG2 4.1Å; I66-T76 HydrophobicContact CG2-CG2 4.34Å; I66-T76 PolarHBondContact N-O 3.5Å; S67-T76 PolarHBondContact N-O 2.97Å; S67-T76 PolarHBondContact O-N 2.91Å; T76-I148 HydrophobicContact CG2-CG2 3.76Å; T76-Y149 WeakPolarHBondContact CA-O 3.27Å; T76-K150 HydrophobicContact CG2-CG 4.19Å
77	T	95.3	Very high	94.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.4	-177.5	51.9	0	0	0	0	110.9	L62 L65 M75 I148 Y149 F226	L62-T77 HydrophobicContact CD1-CG2 4.35Å; L65-T77 HydrophobicContact CD1-CG2 3.68Å; M75-T77 HydrophobicContact CG-CG2 3.97Å; M75-T77 HydrophobicContact SD-CG2 4.2Å; T77-I148 CarbonylContact O-C 3.57Å; T77-I148 VanDerWaalsContact O-CA 3.31Å; T77-I148 WeakPolarHBondContact O-CA 3.49Å; T77-Y149 PolarHBondContact N-O 2.9Å; T77-Y149 PolarHBondContact O-N 3.33Å; T77-F226 HydrophobicContact CG2-CE1 4.12Å
78	N	94.7	Very high	94.8	Very high	41 Å²	41	41.8 Å²	41.8	22%	0.219	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.7	167	-177.7	11.4	0	0	0	108.3	A63 Q64 I66	A63-N78 WeakPolarHBondContact CB-O 3.39Å; A63-N78 PolarHBondContact N-O 3.29Å; Q64-N78 HydrophobicContact CB-CB 4.24Å; Q64-N78 PolarHBondContact N-O 2.95Å; Q64-N78 PolarHBondContact O-N 3.48Å; I66-N78 HydrophobicContact CD1-CB 4.06Å; I66-N78 HydrophobicContact CG1-CB 4.48Å
79	V	95.1	Very high	94.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.5	-174.5	-57.6	0	0	0	0	110.9	L60 S61 L62 A147 Y149	L60-V79 HydrophobicContact CD1-CB 3.91Å; L60-V79 HydrophobicContact CD1-CG1 4.19Å; L60-V79 HydrophobicContact CD1-CG2 3.94Å; L60-V79 HydrophobicContact CD2-CG1 4.41Å; L60-V79 HydrophobicContact CG-CB 4.35Å; L60-V79 HydrophobicContact CG-CG1 4.41Å; S61-V79 CarbonylContact O-C 3.29Å; S61-V79 WeakPolarHBondContact O-CA 3.47Å; L62-V79 HydrophobicContact CD1-CG1 3.77Å; V79-A147 HydrophobicContact CG2-CB 4.32Å; V79-A147 PolarHBondContact N-O 2.94Å; V79-A147 PolarHBondContact O-N 3.3Å; V79-Y149 HydrophobicContact CG2-CD2 3.41Å; V79-Y149 VanDerWaalsContact CG2-CD2 3.41Å; V79-Y149 HydrophobicContact CG2-CE2 3.63Å
80	W	94.7	Very high	94.9	Very high	90 Å²	90	41.3 Å²	41.3	34%	0.341	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.5	165.7	-57.4	-12.9	0	0	0	108	S61 L144 D194	S61-W80 PolarHBondContact N-O 2.99Å; S61-W80 PolarHBondContact O-N 3.43Å; W80-L144 HydrophobicContact CB-CD1 3.78Å; W80-L144 HydrophobicContact CB-CG 4.18Å; W80-L144 HydrophobicContact CE3-CD2 4.34Å; W80-D194 WeakPolarHBondContact CH2-OD2 3.36Å
81	L	94.3	Very high	95.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	99	178.7	-177.3	64.8	0	0	0	108.8	L58 L60 Q83 I115 P145 F171	L58-L81 HydrophobicContact CD2-CD1 4.09Å; L58-L81 HydrophobicContact CD2-CD2 4.37Å; L58-L81 HydrophobicContact CD2-CG 4.26Å; L60-L81 HydrophobicContact CD1-CD1 4.1Å; L81-Q83 HydrophobicContact CD2-CG 4.44Å; L81-Q83 HydrophobicContact CG-CG 4.14Å; L81-Q83 PolarHBondContact O-N 2.8Å; L81-I115 HydrophobicContact CD2-CG2 4.24Å; L81-P145 WeakPolarHBondContact O-CD 3.49Å; L81-F171 HydrophobicContact CD2-CD1 3.88Å; L81-F171 HydrophobicContact CD2-CE1 3.88Å; L81-F171 HydrophobicContact CD2-CZ 4.5Å
82	K	95.3	Very high	95.3	Very high	57 Å²	57	38 Å²	38	25%	0.248	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	123.9	176	-169.9	-179	169.6	-168.9	0	109.3	L58 Q59 V142 L144	L58-K82 WeakPolarHBondContact CA-O 3.25Å; Q59-K82 HydrophobicContact CB-CB 4.12Å; Q59-K82 PolarHBondContact N-O 2.79Å; Q59-K82 WeakPolarHBondContact O-CB 3.33Å; Q59-K82 PolarHBondContact O-N 3.23Å; K82-V142 HydrophobicContact CG-CG1 4.38Å; K82-L144 VanDerWaalsContact CA-CD1 3.46Å; K82-L144 HydrophobicContact CB-CD1 3.52Å; K82-L144 HydrophobicContact CG-CD1 4.09Å
83	Q	95.8	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.3	177.8	-49.9	-176.9	17.6	0	0	108.5	K57 L58 L81 W85 V142 W143	K57-Q83 CarbonylContact O-C 3.55Å; K57-Q83 WeakPolarHBondContact O-CA 3.36Å; L58-Q83 HydrophobicContact CD2-CB 4.49Å; L58-Q83 HydrophobicContact CD2-CG 3.85Å; L81-Q83 HydrophobicContact CD2-CG 4.44Å; L81-Q83 HydrophobicContact CG-CG 4.14Å; L81-Q83 PolarHBondContact O-N 2.8Å; Q83-W85 HydrophobicContact CB-CE3 4.37Å; Q83-W85 HydrophobicContact CB-CZ3 4.03Å; Q83-V142 WeakPolarHBondContact O-CA 3.32Å; Q83-W143 HydrophobicContact CG-CE3 4.36Å; Q83-W143 PolarHBondContact N-O 3.38Å; Q83-W143 PolarHBondContact O-N 3.33Å
84	E	97	Very high	95.5	Very high	38 Å²	38	35.7 Å²	35.7	18%	0.178	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125	178.5	-179.8	167.2	-169.2	0	0	111	K57 R136 S140 V141 V142	K57-E84 HydrophobicContact CB-CB 4.32Å; K57-E84 PolarHBondContact N-O 2.84Å; K57-E84 PolarHBondContact O-N 3.41Å; E84-R136 IonicContact OE1-NH1 3.52Å; E84-R136 PolarHBondContact OE1-NH1 2.87Å; E84-S140 PolarHBondContact OE1-OG 2.91Å; E84-S140 VanDerWaalsContact OE1-OG 3.11Å; E84-V141 VanDerWaalsContact CA-O 3.29Å; E84-V141 WeakPolarHBondContact CA-O 3.45Å; E84-V142 HydrophobicContact CB-CG2 4.35Å; E84-V142 HydrophobicContact CG-CG2 3.98Å
85	W	96.7	Very high	95.3	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	179.1	175.8	68	97.9	0	0	0	110.1	I54 I56 Q83 I110 W111 L112 P113 V141 W143	I54-W85 HydrophobicContact CG2-CB 4.49Å; I56-W85 HydrophobicContact CG1-CB 4.15Å; Q83-W85 HydrophobicContact CB-CE3 4.37Å; Q83-W85 HydrophobicContact CB-CZ3 4.03Å; W85-I110 HydrophobicContact CZ2-CD1 4.23Å; W85-W111 AromaticContact CD1-CZ3 3.78Å; W85-W111 HydrophobicContact CG-CZ3 4.3Å; W85-W111 AromaticContact NE1-CE3 3.77Å; W85-W111 AromaticContact NE1-CZ3 3.77Å; W85-L112 HydrophobicContact CH2-CD1 3.57Å; W85-L112 HydrophobicContact CZ2-CD1 4.15Å; W85-L112 HydrophobicContact CZ3-CD1 4.4Å; W85-P113 HydrophobicContact CD2-CG 4.5Å; W85-P113 HydrophobicContact CE3-CG 4.23Å; W85-P113 HydrophobicContact CZ3-CG 4.34Å; W85-V141 HydrophobicContact CD2-CB 4Å; W85-V141 HydrophobicContact CD2-CG1 4.14Å; W85-V141 HydrophobicContact CE3-CG1 4.41Å; W85-V141 HydrophobicContact CG-CB 4.37Å; W85-V141 HydrophobicContact CH2-CB 4.47Å; W85-V141 HydrophobicContact CH2-CG1 3.59Å; W85-V141 HydrophobicContact CZ2-CB 3.97Å; W85-V141 HydrophobicContact CZ2-CG1 3.28Å; W85-V141 HydrophobicContact CZ3-CG1 4.15Å; W85-V141 PolarHBondContact N-O 2.85Å; W85-V141 PolarHBondContact O-N 3.4Å; W85-W143 HydrophobicContact CH2-CB 3.92Å; W85-W143 HydrophobicContact CZ3-CB 3.89Å
86	T	96.8	Very high	95.1	Very high	87 Å²	87	48.5 Å²	48.5	53%	0.534	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.5	178.3	-56	0	0	0	0	109.7	G139	T86-G139 WeakPolarHBondContact CA-O 3.44Å
87	D	96.8	Very high	95	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.			trans	-113	110.6	171.8	-170.2	-23.8	0	0	0	109.1	Y40 P46 R89 L90 G139 V141	Y40-D87 PolarHBondContact OH-OD2 2.87Å; P46-D87 HydrophobicContact CB-CB 3.93Å; P46-D87 VanDerWaalsContact CB-OD1 3.24Å; P46-D87 WeakPolarHBondContact CB-OD1 3.48Å; P46-D87 HydrophobicContact CG-CB 4.19Å; D87-R89 PolarHBondContact O-N 3Å; D87-R89 VanDerWaalsContact OD1-CB 3.29Å; D87-R89 WeakPolarHBondContact OD1-CB 3.22Å; D87-R89 IonicContact OD1-CZ 3.88Å; D87-R89 PolarHBondContact OD1-N 3.44Å; D87-R89 IonicContact OD1-NE 3.05Å; D87-R89 PolarHBondContact OD1-NE 2.98Å; D87-R89 IonicContact OD1-NH2 3.83Å; D87-R89 IonicContact OD2-CZ 3.64Å; D87-R89 IonicContact OD2-NE 3.52Å; D87-R89 IonicContact OD2-NH2 2.99Å; D87-R89 PolarHBondContact OD2-NH2 3.21Å; D87-L90 HydrophobicContact CB-CB 4.37Å; D87-L90 HydrophobicContact CB-CD1 4.02Å; D87-L90 HydrophobicContact CB-CG 4.18Å; D87-L90 PolarHBondContact O-N 2.91Å; D87-L90 VanDerWaalsContact O-N 3.17Å; D87-G139 PolarHBondContact N-O 3.34Å; D87-V141 HydrophobicContact CB-CG2 4.26Å
88	Y	95.1	Very high	94.7	Very high	115 Å²	115	55.6 Å²	55.6	45%	0.451	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19	-178.2	73.9	-91.3	0	0	0	113.2	P46 T48 L90 T91	P46-Y88 HydrophobicContact CB-CD1 4.41Å; P46-Y88 HydrophobicContact CB-CE1 4.46Å; T48-Y88 HydrophobicContact CG2-CD1 3.84Å; T48-Y88 HydrophobicContact CG2-CE1 3.99Å; T48-Y88 HydrophobicContact CG2-CG 4.14Å; Y88-L90 VanDerWaalsContact C-N 3.34Å; Y88-T91 WeakPolarHBondContact O-CG2 3.47Å; Y88-T91 PolarHBondContact O-OG1 3.47Å
89	R	95.1	Very high	94.6	Very high	45 Å²	45	55.4 Å²	55.4	17%	0.17	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.9	179.6	-57.3	170.2	-67.5	176.5	-2.7	111.9	Y40 N41 I44 D87 T91	Y40-R89 HydrophobicContact CD2-CB 4.25Å; Y40-R89 HydrophobicContact CE2-CB 4.09Å; Y40-R89 PolarHBondContact OH-NH2 3.06Å; N41-R89 PolarHBondContact O-NH1 2.81Å; I44-R89 PolarHBondContact O-NH2 3.01Å; D87-R89 PolarHBondContact O-N 3Å; D87-R89 VanDerWaalsContact OD1-CB 3.29Å; D87-R89 WeakPolarHBondContact OD1-CB 3.22Å; D87-R89 IonicContact OD1-CZ 3.88Å; D87-R89 PolarHBondContact OD1-N 3.44Å; D87-R89 IonicContact OD1-NE 3.05Å; D87-R89 PolarHBondContact OD1-NE 2.98Å; D87-R89 IonicContact OD1-NH2 3.83Å; D87-R89 IonicContact OD2-CZ 3.64Å; D87-R89 IonicContact OD2-NE 3.52Å; D87-R89 IonicContact OD2-NH2 2.99Å; D87-R89 PolarHBondContact OD2-NH2 3.21Å; R89-T91 VanDerWaalsContact C-N 3.33Å; R89-T91 PolarHBondContact O-N 3.39Å
90	L	95.5	Very high	94.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-98.4	40.9	-178.2	-60.1	176.6	0	0	0	111.6	Y40 D87 Y88 W92 I110 V135 V141	Y40-L90 HydrophobicContact CD2-CD2 4.03Å; Y40-L90 HydrophobicContact CE2-CD1 4.41Å; Y40-L90 HydrophobicContact CE2-CD2 3.8Å; Y40-L90 HydrophobicContact CE2-CG 3.97Å; D87-L90 HydrophobicContact CB-CB 4.37Å; D87-L90 HydrophobicContact CB-CD1 4.02Å; D87-L90 HydrophobicContact CB-CG 4.18Å; D87-L90 PolarHBondContact O-N 2.91Å; D87-L90 VanDerWaalsContact O-N 3.17Å; Y88-L90 VanDerWaalsContact C-N 3.34Å; L90-W92 VanDerWaalsContact O-CZ3 3.27Å; L90-W92 WeakPolarHBondContact O-CZ3 3.4Å; L90-I110 HydrophobicContact CD1-CD1 4.43Å; L90-I110 HydrophobicContact CD1-CG2 4.18Å; L90-V135 HydrophobicContact CB-CG1 3.96Å; L90-V135 HydrophobicContact CD1-CG2 4.34Å; L90-V141 HydrophobicContact CD1-CG2 4.23Å
91	T	95.6	Very high	94.4	Very high	68 Å²	68	56.6 Å²	56.6	42%	0.417	29%	0.29	S	S	.	.			trans	-107.4	142	178.6	60.4	0	0	0	0	111	Y88 R89	Y88-T91 WeakPolarHBondContact O-CG2 3.47Å; Y88-T91 PolarHBondContact O-OG1 3.47Å; R89-T91 VanDerWaalsContact C-N 3.33Å; R89-T91 PolarHBondContact O-N 3.39Å
92	W	95.3	Very high	94.4	Very high	26 Å²	26	60.1 Å²	60.1	10%	0.098	31%	0.308	C	S	.	.			trans	-148	160.3	175	66	95.2	0	0	0	111.9	L30 L34 L90 Y97 V100 L103 V135 R136 S137	L30-W92 HydrophobicContact CD1-CB 3.65Å; L30-W92 HydrophobicContact CD1-CD2 3.99Å; L30-W92 HydrophobicContact CD1-CG 3.58Å; L30-W92 HydrophobicContact CD2-CD2 3.85Å; L30-W92 HydrophobicContact CD2-CG 4.02Å; L30-W92 HydrophobicContact CD2-CZ2 4.1Å; L30-W92 HydrophobicContact CG-CD2 4.47Å; L30-W92 HydrophobicContact CG-CG 4.44Å; L34-W92 HydrophobicContact CD1-CD2 4.48Å; L34-W92 HydrophobicContact CD1-CE3 3.75Å; L34-W92 HydrophobicContact CD1-CZ3 4.09Å; L90-W92 VanDerWaalsContact O-CZ3 3.27Å; L90-W92 WeakPolarHBondContact O-CZ3 3.4Å; W92-Y97 HydrophobicContact CB-CE2 4.31Å; W92-V100 PolarHBondContact NE1-O 3.02Å; W92-L103 HydrophobicContact CH2-CB 3.78Å; W92-L103 HydrophobicContact CZ2-CB 4.1Å; W92-V135 HydrophobicContact CH2-CB 4.24Å; W92-V135 HydrophobicContact CH2-CG1 4.02Å; W92-V135 HydrophobicContact CZ3-CB 4.35Å; W92-V135 HydrophobicContact CZ3-CG1 3.73Å; W92-R136 VanDerWaalsContact CH2-C 3.45Å; W92-S137 PolarHBondContact N-O 2.93Å
93	N	95.3	Very high	94.4	Very high	107 Å²	107	57.6 Å²	57.6	57%	0.572	30%	0.297	S	S	*	.			trans	-87	112.3	172.6	-171.8	-11.1	0	0	0	110	S95 R96	N93-S95 PolarHBondContact O-N 3.28Å; N93-S95 PolarHBondContact OD1-N 3.21Å; N93-R96 WeakPolarHBondContact O-CB 3.39Å; N93-R96 PolarHBondContact O-N 3.42Å
94	S	93.9	Very high	94.3	Very high	20 Å²	20	64.5 Å²	64.5	14%	0.14	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-53.2	-38.7	-179.4	-178.9	0	0	0	0	113	R96 Y97 G99 V100 N101	S94-R96 PolarHBondContact O-N 2.87Å; S94-R96 VanDerWaalsContact O-N 3.14Å; S94-Y97 CarbonylContact O-C 3.55Å; S94-Y97 PolarHBondContact O-N 3.34Å; S94-Y97 VanDerWaalsContact O-N 3.12Å; S94-G99 WeakPolarHBondContact O-CA 3.49Å; S94-G99 PolarHBondContact O-N 3.01Å; S94-G99 VanDerWaalsContact OG-CA 3.26Å; S94-G99 WeakPolarHBondContact OG-CA 3.39Å; S94-G99 PolarHBondContact OG-O 3.48Å; S94-V100 PolarHBondContact OG-O 3.5Å; S94-N101 VanDerWaalsContact CB-OD1 3.28Å; S94-N101 WeakPolarHBondContact CB-OD1 3.46Å; S94-N101 PolarHBondContact OG-OD1 3.36Å
95	S	92.5	Very high	94.2	Very high	108 Å²	108	62.7 Å²	62.7	76%	0.755	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-63.4	-21.9	-179.6	-54	0	0	0	0	114.1	N93	N93-S95 PolarHBondContact O-N 3.28Å; N93-S95 PolarHBondContact OD1-N 3.21Å
96	R	91.9	Very high	94.2	Very high	192 Å²	192	65 Å²	65	73%	0.725	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-82	-23.2	178.9	-172.3	176.3	-178.5	-174.4	-1.7	112.9	N93 S94	N93-R96 WeakPolarHBondContact O-CB 3.39Å; N93-R96 PolarHBondContact O-N 3.42Å; S94-R96 PolarHBondContact O-N 2.87Å; S94-R96 VanDerWaalsContact O-N 3.14Å
97	Y	91.6	Very high	94	Very high	24 Å²	24	61.3 Å²	61.3	9%	0.094	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	55.3	-175.1	-59.7	-86.8	0	0	0	109.8	L30 D33 W92 S94 G99 V100	L30-Y97 HydrophobicContact CB-CD1 3.74Å; L30-Y97 HydrophobicContact CB-CE1 3.96Å; L30-Y97 HydrophobicContact CB-CG 4.17Å; L30-Y97 HydrophobicContact CD1-CD1 4.21Å; L30-Y97 HydrophobicContact CD1-CD2 3.82Å; L30-Y97 HydrophobicContact CD1-CE1 4.07Å; L30-Y97 HydrophobicContact CD1-CE2 3.68Å; L30-Y97 HydrophobicContact CD1-CG 4.09Å; L30-Y97 HydrophobicContact CG-CD1 4.5Å; D33-Y97 WeakPolarHBondContact OD2-CE1 3.37Å; D33-Y97 PolarHBondContact OD2-OH 3.39Å; W92-Y97 HydrophobicContact CB-CE2 4.31Å; S94-Y97 CarbonylContact O-C 3.55Å; S94-Y97 PolarHBondContact O-N 3.34Å; S94-Y97 VanDerWaalsContact O-N 3.12Å; Y97-G99 PolarHBondContact O-N 3.24Å; Y97-V100 WeakPolarHBondContact O-CB 3.39Å; Y97-V100 WeakPolarHBondContact O-CG2 3.11Å; Y97-V100 PolarHBondContact O-N 3.46Å
98	E	90.9	Very high	93.7	Very high	146 Å²	146	69.2 Å²	69.2	68%	0.682	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	25.6	171.7	-59	176.6	-173.5	0	0	114.9	A26	A26-E98 HydrophobicContact CB-CB 3.98Å; A26-E98 HydrophobicContact CB-CG 3.9Å
99	G	90.7	Very high	93.7	Very high	38 Å²	38	70.9 Å²	70.9	39%	0.392	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	16.4	179.3	0	0	0	0	0	114.9	S94 Y97 N101	S94-G99 WeakPolarHBondContact O-CA 3.49Å; S94-G99 PolarHBondContact O-N 3.01Å; S94-G99 VanDerWaalsContact OG-CA 3.26Å; S94-G99 WeakPolarHBondContact OG-CA 3.39Å; S94-G99 PolarHBondContact OG-O 3.48Å; Y97-G99 PolarHBondContact O-N 3.24Å; G99-N101 PolarHBondContact O-N 3.09Å; G99-N101 VanDerWaalsContact O-N 3.14Å
100	V	92.5	Very high	93.7	Very high	22 Å²	22	69 Å²	69	13%	0.133	34%	0.341	C	S	.	.			trans	-65.2	111.7	177.6	174.1	0	0	0	0	110.6	A26 E27 L30 W92 S94 Y97 I102	A26-V100 HydrophobicContact CB-CG2 4.42Å; E27-V100 HydrophobicContact CG-CG1 4.28Å; E27-V100 HydrophobicContact CG-CG2 4.06Å; L30-V100 HydrophobicContact CD2-CG1 4.1Å; W92-V100 PolarHBondContact NE1-O 3.02Å; S94-V100 PolarHBondContact OG-O 3.5Å; Y97-V100 WeakPolarHBondContact O-CB 3.39Å; Y97-V100 WeakPolarHBondContact O-CG2 3.11Å; Y97-V100 PolarHBondContact O-N 3.46Å; V100-I102 WeakPolarHBondContact CG1-O 3.49Å
101	N	92.9	Very high	93.7	Very high	92 Å²	92	69.2 Å²	69.2	49%	0.492	34%	0.341	S	S	.	.			trans	-100.7	-21.4	178.9	-67.3	-40.1	0	0	0	113.8	S94 G99 R136 S137	S94-N101 VanDerWaalsContact CB-OD1 3.28Å; S94-N101 WeakPolarHBondContact CB-OD1 3.46Å; S94-N101 PolarHBondContact OG-OD1 3.36Å; G99-N101 PolarHBondContact O-N 3.09Å; G99-N101 VanDerWaalsContact O-N 3.14Å; N101-R136 WeakPolarHBondContact O-CA 3.45Å; N101-S137 PolarHBondContact O-N 3.35Å
102	I	94.9	Very high	93.6	Very high	75 Å²	75	68 Å²	68	39%	0.385	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.5	-179.8	58.9	172.5	0	0	0	109.3	V100 V134 V135 R136	V100-I102 WeakPolarHBondContact CG1-O 3.49Å; I102-V134 HydrophobicContact CB-CG1 4.18Å; I102-V134 HydrophobicContact CG2-CG1 4.3Å; I102-V135 CarbonylContact C-O 3.55Å; I102-V135 WeakPolarHBondContact CA-O 3.28Å; I102-R136 HydrophobicContact CG2-CG 4.46Å
103	L	95.1	Very high	93.5	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.5	176	-173	66.3	0	0	0	109.1	E27 L30 M31 L34 W92 I105 V135	E27-L103 HydrophobicContact CB-CD1 4.03Å; E27-L103 HydrophobicContact CG-CD1 4.22Å; L30-L103 HydrophobicContact CD2-CD1 4.43Å; L30-L103 HydrophobicContact CD2-CD2 3.97Å; L30-L103 HydrophobicContact CG-CD2 4.12Å; M31-L103 HydrophobicContact CE-CD1 4.25Å; M31-L103 HydrophobicContact CE-CD2 4.16Å; M31-L103 HydrophobicContact CE-CG 4.19Å; L34-L103 HydrophobicContact CD1-CD2 4.01Å; W92-L103 HydrophobicContact CH2-CB 3.78Å; W92-L103 HydrophobicContact CZ2-CB 4.1Å; L103-I105 HydrophobicContact CD2-CD1 3.99Å; L103-I105 HydrophobicContact CD2-CG1 4.13Å; L103-I105 HydrophobicContact CG-CD1 4.46Å; L103-I105 HydrophobicContact CG-CG1 4.1Å; L103-V135 PolarHBondContact N-O 3.44Å; L103-V135 PolarHBondContact O-N 2.9Å
104	R	95.3	Very high	93.3	Very high	146 Å²	146	63.4 Å²	63.4	55%	0.551	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	122	177.2	-72.4	174.3	178.9	79.6	-0.9	109.8	L133 V134	R104-L133 WeakPolarHBondContact CA-O 3.27Å; R104-V134 HydrophobicContact CG-CG2 4.22Å
105	I	94.9	Very high	93.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.7	-177.3	-44.7	-174.7	0	0	0	109.1	M31 L35 L103 R109 I110 N132 L133 V135	M31-I105 HydrophobicContact CE-CB 4.43Å; M31-I105 HydrophobicContact CE-CG1 3.91Å; M31-I105 HydrophobicContact CE-CG2 4.35Å; M31-I105 HydrophobicContact SD-CD1 4.29Å; M31-I105 HydrophobicContact SD-CG1 4.18Å; M31-I105 HydrophobicContact SD-CG2 4.09Å; L35-I105 HydrophobicContact CD1-CG2 4.4Å; L103-I105 HydrophobicContact CD2-CD1 3.99Å; L103-I105 HydrophobicContact CD2-CG1 4.13Å; L103-I105 HydrophobicContact CG-CD1 4.46Å; L103-I105 HydrophobicContact CG-CG1 4.1Å; I105-R109 HydrophobicContact CG2-CB 4.43Å; I105-I110 HydrophobicContact CD1-CG2 4.44Å; I105-I110 HydrophobicContact CG2-CG2 3.92Å; I105-N132 WeakPolarHBondContact O-CA 3.47Å; I105-L133 HydrophobicContact CB-CG 4.48Å; I105-L133 PolarHBondContact N-O 3.19Å; I105-L133 VanDerWaalsContact N-O 3.09Å; I105-L133 VanDerWaalsContact O-CD2 3.25Å; I105-L133 WeakPolarHBondContact O-CD2 3.38Å; I105-L133 VanDerWaalsContact O-CG 3.28Å; I105-L133 WeakPolarHBondContact O-CG 3.36Å; I105-L133 PolarHBondContact O-N 3.24Å; I105-V135 HydrophobicContact CD1-CG2 3.78Å; I105-V135 HydrophobicContact CG1-CG2 4.09Å
106	P	94.9	Very high	93.4	Very high	50 Å²	50	58.3 Å²	58.3	33%	0.325	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	136.5	169.5	-22	33.5	0	0	0	111.8	K108 R109 N132	P106-K108 VanDerWaalsContact C-N 3.27Å; P106-K108 PolarHBondContact O-N 3.15Å; P106-R109 PolarHBondContact O-N 3.37Å; P106-R109 VanDerWaalsContact O-N 3.17Å; P106-N132 WeakPolarHBondContact CA-OD1 3.39Å
107	T	93	Very high	93.5	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.055	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56.3	-36.2	-177.5	47.5	0	0	0	0	113.9	R109 I110 T131 L133 W143	T107-R109 PolarHBondContact O-N 3.47Å; T107-I110 PolarHBondContact O-N 3.29Å; T107-T131 WeakPolarHBondContact CG2-O 3.41Å; T107-L133 HydrophobicContact CG2-CD2 3.65Å; T107-W143 HydrophobicContact CG2-CD2 4.35Å; T107-W143 HydrophobicContact CG2-CG 4.38Å; T107-W143 HydrophobicContact CG2-CZ2 4.17Å
108	K	91.6	Very high	93.5	Very high	167 Å²	167	51.9 Å²	51.9	73%	0.726	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-62.5	-17.5	-178.2	-61.6	-172.2	178.7	-174.3	0	114.5	N42 P106	N42-K108 PolarHBondContact ND2-O 3.05Å; P106-K108 VanDerWaalsContact C-N 3.27Å; P106-K108 PolarHBondContact O-N 3.15Å
109	R	93.6	Very high	93.6	Very high	150 Å²	150	46.3 Å²	46.3	57%	0.566	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-95.1	-11.7	-177.5	-67.9	-168.6	177.2	-168.9	-0.3	114.1	L35 I105 P106 T107	L35-R109 HydrophobicContact CD1-CB 4.34Å; I105-R109 HydrophobicContact CG2-CB 4.43Å; P106-R109 PolarHBondContact O-N 3.37Å; P106-R109 VanDerWaalsContact O-N 3.17Å; T107-R109 PolarHBondContact O-N 3.47Å
110	I	95	Very high	93.7	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.026	21%	0.21	C	C	.	.	S	Bend	trans	-122	165.6	-178.5	68	153.4	0	0	0	111.5	L35 Y40 N42 W85 L90 I105 T107 L133 V141	L35-I110 HydrophobicContact CD2-CG2 4.29Å; Y40-I110 HydrophobicContact CE1-CB 4.15Å; Y40-I110 HydrophobicContact CE1-CG2 4.41Å; N42-I110 VanDerWaalsContact CB-C 3.43Å; N42-I110 WeakPolarHBondContact CB-O 3.46Å; W85-I110 HydrophobicContact CZ2-CD1 4.23Å; L90-I110 HydrophobicContact CD1-CD1 4.43Å; L90-I110 HydrophobicContact CD1-CG2 4.18Å; I105-I110 HydrophobicContact CD1-CG2 4.44Å; I105-I110 HydrophobicContact CG2-CG2 3.92Å; T107-I110 PolarHBondContact O-N 3.29Å; I110-L133 HydrophobicContact CD1-CD1 3.3Å; I110-L133 HydrophobicContact CD1-CD2 3.37Å; I110-L133 HydrophobicContact CD1-CG 3.93Å; I110-L133 HydrophobicContact CG1-CD1 4.37Å; I110-L133 HydrophobicContact CG1-CD2 3.62Å; I110-V141 HydrophobicContact CD1-CG1 4.27Å
111	W	95.8	Very high	93.5	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.015	22%	0.221	C	C	.	.			trans	-66.9	136.3	170.2	178.6	85	0	0	0	110.3	Y40 N42 R45 P46 I54 W85 P113 Y176	Y40-W111 PolarHBondContact OH-N 2.63Å; N42-W111 WeakPolarHBondContact O-CA 3.22Å; N42-W111 WeakPolarHBondContact O-CB 3.25Å; R45-W111 HydrophobicContact CB-CZ2 3.91Å; P46-W111 HydrophobicContact CG-CD2 4.25Å; P46-W111 HydrophobicContact CG-CE3 3.71Å; P46-W111 HydrophobicContact CG-CZ3 3.93Å; I54-W111 HydrophobicContact CD1-CH2 4.01Å; I54-W111 HydrophobicContact CD1-CZ2 4.3Å; I54-W111 HydrophobicContact CG2-CH2 4.27Å; I54-W111 HydrophobicContact CG2-CZ3 4.43Å; W85-W111 AromaticContact CD1-CZ3 3.78Å; W85-W111 HydrophobicContact CG-CZ3 4.3Å; W85-W111 AromaticContact NE1-CE3 3.77Å; W85-W111 AromaticContact NE1-CZ3 3.77Å; W111-P113 HydrophobicContact CH2-CB 3.99Å; W111-P113 HydrophobicContact CH2-CG 4.43Å; W111-P113 HydrophobicContact CZ2-CB 4.44Å; W111-P113 HydrophobicContact CZ3-CB 4.46Å; W111-P113 HydrophobicContact CZ3-CG 4.43Å; W111-Y176 HydrophobicContact CZ2-CD2 4.38Å; W111-Y176 AromaticContact CZ2-CE2 3.75Å; W111-Y176 HydrophobicContact CZ2-CE2 3.75Å; W111-Y176 AromaticContact NE1-CE2 3.82Å; W111-Y176 AromaticContact NE1-CZ 3.61Å; W111-Y176 PolarHBondContact NE1-OH 2.98Å
112	L	94.4	Very high	93	Very high	42 Å²	42	45.9 Å²	45.9	22%	0.22	22%	0.218	C	C	.	.			trans	-133.3	133.3	-179.7	-175.6	81.7	0	0	0	108.7	W85 W143	W85-L112 HydrophobicContact CH2-CD1 3.57Å; W85-L112 HydrophobicContact CZ2-CD1 4.15Å; W85-L112 HydrophobicContact CZ3-CD1 4.4Å; L112-W143 HydrophobicContact CD1-CD2 3.85Å; L112-W143 HydrophobicContact CD1-CE3 3.5Å; L112-W143 VanDerWaalsContact CD1-CE3 3.5Å; L112-W143 HydrophobicContact CD1-CG 4.44Å; L112-W143 HydrophobicContact CD1-CH2 4.37Å; L112-W143 HydrophobicContact CD1-CZ3 3.77Å; L112-W143 HydrophobicContact CD2-CE3 4.34Å; L112-W143 HydrophobicContact CD2-CH2 3.77Å; L112-W143 HydrophobicContact CD2-CZ2 4.4Å; L112-W143 HydrophobicContact CD2-CZ3 3.73Å; L112-W143 HydrophobicContact CG-CE3 4.35Å; L112-W143 HydrophobicContact CG-CZ3 4.14Å
113	P	93.8	Very high	92.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.224	C	C	.	.			trans	-70.7	133.8	167.8	31.1	-33.6	0	0	0	110.5	I56 W85 W111 I115	I56-P113 HydrophobicContact CD1-CB 3.43Å; I56-P113 VanDerWaalsContact CD1-CB 3.43Å; I56-P113 HydrophobicContact CD1-CG 3.85Å; I56-P113 HydrophobicContact CG1-CB 4.39Å; I56-P113 HydrophobicContact CG1-CG 4.32Å; I56-P113 HydrophobicContact CG2-CG 4.36Å; W85-P113 HydrophobicContact CD2-CG 4.5Å; W85-P113 HydrophobicContact CE3-CG 4.23Å; W85-P113 HydrophobicContact CZ3-CG 4.34Å; W111-P113 HydrophobicContact CH2-CB 3.99Å; W111-P113 HydrophobicContact CH2-CG 4.43Å; W111-P113 HydrophobicContact CZ2-CB 4.44Å; W111-P113 HydrophobicContact CZ3-CB 4.46Å; W111-P113 HydrophobicContact CZ3-CG 4.43Å; P113-I115 VanDerWaalsContact C-N 3.28Å; P113-I115 HydrophobicContact CB-CD1 4.36Å; P113-I115 HydrophobicContact CB-CG1 4.22Å; P113-I115 HydrophobicContact CG-CD1 4.37Å; P113-I115 PolarHBondContact O-N 2.97Å
114	D	91.1	Very high	91.5	Very high	38 Å²	38	48.9 Å²	48.9	20%	0.203	25%	0.25	C	C	.	.			trans	-87.9	61.8	-175.6	63.2	-27.1	0	0	0	111.9	V116 S173 W174 T175	D114-V116 PolarHBondContact O-N 3.35Å; D114-S173 WeakPolarHBondContact O-CA 3.23Å; D114-W174 PolarHBondContact O-N 3.36Å; D114-W174 WeakPolarHBondContact OD2-CA 3.33Å; D114-W174 WeakPolarHBondContact OD2-CB 3.43Å; D114-W174 PolarHBondContact OD2-N 2.84Å; D114-T175 PolarHBondContact OD1-OG1 2.81Å; D114-T175 WeakPolarHBondContact OD2-CB 3.31Å; D114-T175 WeakPolarHBondContact OD2-CG2 3.44Å; D114-T175 PolarHBondContact OD2-N 2.94Å; D114-T175 PolarHBondContact OD2-OG1 2.85Å
115	I	93.6	Very high	90.7	Very high	7 Å²	7	46 Å²	46	4%	0.036	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.6	-179.7	-58.4	176.3	0	0	0	109	I56 L58 L81 P113 F171	I56-I115 HydrophobicContact CG2-CD1 3.79Å; L58-I115 HydrophobicContact CD1-CD1 4.11Å; L58-I115 HydrophobicContact CD2-CD1 3.59Å; L58-I115 HydrophobicContact CD2-CG2 4.34Å; L58-I115 HydrophobicContact CG-CD1 4.21Å; L81-I115 HydrophobicContact CD2-CG2 4.24Å; P113-I115 VanDerWaalsContact C-N 3.28Å; P113-I115 HydrophobicContact CB-CD1 4.36Å; P113-I115 HydrophobicContact CB-CG1 4.22Å; P113-I115 HydrophobicContact CG-CD1 4.37Å; P113-I115 PolarHBondContact O-N 2.97Å; I115-F171 HydrophobicContact CG2-CB 3.94Å; I115-F171 HydrophobicContact CG2-CD1 4.31Å
116	V	93.5	Very high	89.8	Confident	13 Å²	13	52.3 Å²	52.3	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.1	-175.7	-61.1	0	0	0	0	111.5	D114 Y118 Y125 F171 R172 W174	D114-V116 PolarHBondContact O-N 3.35Å; V116-Y118 HydrophobicContact CG2-CD2 3.97Å; V116-Y118 HydrophobicContact CG2-CE2 3.83Å; V116-Y125 WeakPolarHBondContact CG1-O 3.48Å; V116-Y125 HydrophobicContact CG2-CD1 4.47Å; V116-F171 WeakPolarHBondContact O-CA 3.5Å; V116-R172 WeakPolarHBondContact CG2-O 3.34Å; V116-R172 PolarHBondContact N-O 3.35Å; V116-R172 PolarHBondContact O-N 3.46Å; V116-R172 VanDerWaalsContact O-N 3.08Å; V116-W174 HydrophobicContact CG2-CB 4.07Å; V116-W174 HydrophobicContact CG2-CE3 4.15Å
117	L	94.3	Very high	89.1	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	112	171.4	-178.1	74.5	0	0	0	109.8	N119 N120 Y125 Y149 L169 K170 F171	L117-N119 VanDerWaalsContact CD1-OD1 3.26Å; L117-N119 WeakPolarHBondContact CD1-OD1 3.26Å; L117-N120 HydrophobicContact CD2-CB 4.06Å; L117-N120 HydrophobicContact CG-CB 4.38Å; L117-Y125 VanDerWaalsContact O-CD1 3.24Å; L117-Y125 WeakPolarHBondContact O-CD1 3.25Å; L117-Y125 WeakPolarHBondContact O-CE1 3.37Å; L117-Y149 HydrophobicContact CB-CD1 3.9Å; L117-Y149 HydrophobicContact CB-CE1 3.99Å; L117-Y149 HydrophobicContact CD2-CD1 3.9Å; L117-Y149 HydrophobicContact CD2-CG 4.05Å; L117-L169 HydrophobicContact CD1-CB 3.93Å; L117-L169 HydrophobicContact CD1-CD2 3.84Å; L117-L169 HydrophobicContact CD1-CG 4.49Å; L117-L169 HydrophobicContact CD2-CD2 4.28Å; L117-K170 WeakPolarHBondContact CA-O 3.48Å; L117-F171 HydrophobicContact CB-CE1 4.49Å; L117-F171 HydrophobicContact CD1-CE1 4.37Å; L117-F171 HydrophobicContact CD1-CZ 4.45Å
118	Y	91.4	Very high	88.3	Confident	81 Å²	81	53.6 Å²	53.6	32%	0.318	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-38.2	-177.4	-97	-103.8	0	0	0	113.4	V116 N120 K170 R172 S173 W174	V116-Y118 HydrophobicContact CG2-CD2 3.97Å; V116-Y118 HydrophobicContact CG2-CE2 3.83Å; Y118-N120 PolarHBondContact O-N 3.36Å; Y118-N120 VanDerWaalsContact O-N 3.14Å; Y118-K170 PolarHBondContact N-O 3.35Å; Y118-R172 HydrophobicContact CD2-CB 3.59Å; Y118-R172 HydrophobicContact CD2-CG 4.21Å; Y118-R172 HydrophobicContact CE2-CB 3.46Å; Y118-R172 VanDerWaalsContact CE2-CB 3.46Å; Y118-R172 HydrophobicContact CE2-CG 3.59Å; Y118-S173 PolarHBondContact OH-O 3.3Å; Y118-S173 VanDerWaalsContact OH-O 3.06Å; Y118-W174 HydrophobicContact CE1-CE3 4.1Å; Y118-W174 AromaticContact CE1-CZ3 4Å; Y118-W174 HydrophobicContact CE1-CZ3 4Å; Y118-W174 HydrophobicContact CE2-CE3 4.21Å; Y118-W174 AromaticContact CZ-CE3 3.76Å
119	N	93.9	Very high	88	Confident	29 Å²	29	49.4 Å²	49.4	16%	0.155	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	44.5	177.1	67.4	-48.9	0	0	0	111.7	L117 S151 T152 T168 K170	L117-N119 VanDerWaalsContact CD1-OD1 3.26Å; L117-N119 WeakPolarHBondContact CD1-OD1 3.26Å; N119-S151 CarbonylContact O-C 3.59Å; N119-S151 WeakPolarHBondContact O-CA 3.22Å; N119-T152 PolarHBondContact ND2-O 3.18Å; N119-T152 PolarHBondContact O-N 2.9Å; N119-T168 PolarHBondContact ND2-O 3.35Å; N119-K170 WeakPolarHBondContact OD1-CB 3.43Å; N119-K170 PolarHBondContact OD1-N 2.85Å
120	N	92.4	Very high	87.7	Confident	20 Å²	20	46.4 Å²	46.4	11%	0.107	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-74.9	152.1	174.6	95.6	12.8	0	0	0	111.2	L117 Y118 G123 T124 Y125 K150	L117-N120 HydrophobicContact CD2-CB 4.06Å; L117-N120 HydrophobicContact CG-CB 4.38Å; Y118-N120 PolarHBondContact O-N 3.36Å; Y118-N120 VanDerWaalsContact O-N 3.14Å; N120-G123 PolarHBondContact OD1-N 3.42Å; N120-G123 VanDerWaalsContact OD1-N 3.13Å; N120-T124 VanDerWaalsContact ND2-C 3.32Å; N120-T124 PolarHBondContact ND2-O 3.22Å; N120-T124 VanDerWaalsContact ND2-O 3.16Å; N120-Y125 HydrophobicContact CB-CD1 4.46Å; N120-Y125 HydrophobicContact CB-CE1 4.22Å; N120-Y125 VanDerWaalsContact CG-CE1 3.46Å; N120-Y125 WeakPolarHBondContact ND2-CD1 3.45Å; N120-Y125 WeakPolarHBondContact ND2-CD2 3.21Å; N120-Y125 WeakPolarHBondContact ND2-CE1 3.44Å; N120-Y125 WeakPolarHBondContact ND2-CE2 3.47Å; N120-Y125 VanDerWaalsContact ND2-CG 3.25Å; N120-Y125 VanDerWaalsContact ND2-CZ 3.31Å; N120-K150 WeakPolarHBondContact CA-O 3.39Å
121	A	87.4	Confident	87.6	Confident	42 Å²	42	48 Å²	48	35%	0.347	27%	0.267	S	S	.	.	S	Bend	trans	-108.1	-14.5	175	0	0	0	0	0	113.5	I74 K150	I74-A121 HydrophobicContact CD1-CB 3.7Å; I74-A121 HydrophobicContact CG1-CB 3.7Å; I74-A121 HydrophobicContact CG2-CB 4.25Å; A121-K150 PolarHBondContact N-O 3.25Å
122	D	82.3	Confident	87.6	Confident	81 Å²	81	52.5 Å²	52.5	43%	0.433	29%	0.291	S	S	.	.	S	Bend	trans	-98.8	-6.9	-170.5	-148	29	0	0	0	113.5	T124 K150	D122-T124 PolarHBondContact O-N 2.94Å; D122-T124 VanDerWaalsContact O-N 3.11Å; D122-K150 HydrophobicContact CB-CB 4.22Å; D122-K150 HydrophobicContact CB-CD 4Å; D122-K150 IonicContact OD1-NZ 3.26Å; D122-K150 PolarHBondContact OD1-NZ 3.48Å; D122-K150 WeakPolarHBondContact OD2-CE 3.47Å; D122-K150 IonicContact OD2-NZ 3.87Å; D122-K150 PolarHBondContact OD2-NZ 3.38Å
123	G	76.8	Confident	87.6	Confident	50 Å²	50	50.5 Å²	50.5	52%	0.515	28%	0.28	S	S	.	.	S	Bend	trans	71.8	-5.1	-175.5	0	0	0	0	0	115	N120 Y125	N120-G123 PolarHBondContact OD1-N 3.42Å; N120-G123 VanDerWaalsContact OD1-N 3.13Å; G123-Y125 VanDerWaalsContact O-CD2 3.31Å; G123-Y125 WeakPolarHBondContact O-CD2 3.41Å
124	T	82.8	Confident	87.8	Confident	91 Å²	91	52.6 Å²	52.6	56%	0.558	29%	0.293	S	S	*	.			trans	-92.8	103.1	172.8	48.8	0	0	0	0	110	N120 D122	N120-T124 VanDerWaalsContact ND2-C 3.32Å; N120-T124 PolarHBondContact ND2-O 3.22Å; N120-T124 VanDerWaalsContact ND2-O 3.16Å; D122-T124 PolarHBondContact O-N 2.94Å; D122-T124 VanDerWaalsContact O-N 3.11Å
125	Y	78	Confident	88.1	Confident	85 Å²	85	50.8 Å²	50.8	33%	0.333	28%	0.283	S	S	.	.			trans	-88.9	-21.2	-178.2	-67	-87.9	0	0	0	113	V116 L117 N120 G123	V116-Y125 WeakPolarHBondContact CG1-O 3.48Å; V116-Y125 HydrophobicContact CG2-CD1 4.47Å; L117-Y125 VanDerWaalsContact O-CD1 3.24Å; L117-Y125 WeakPolarHBondContact O-CD1 3.25Å; L117-Y125 WeakPolarHBondContact O-CE1 3.37Å; N120-Y125 HydrophobicContact CB-CD1 4.46Å; N120-Y125 HydrophobicContact CB-CE1 4.22Å; N120-Y125 VanDerWaalsContact CG-CE1 3.46Å; N120-Y125 WeakPolarHBondContact ND2-CD1 3.45Å; N120-Y125 WeakPolarHBondContact ND2-CD2 3.21Å; N120-Y125 WeakPolarHBondContact ND2-CE1 3.44Å; N120-Y125 WeakPolarHBondContact ND2-CE2 3.47Å; N120-Y125 VanDerWaalsContact ND2-CG 3.25Å; N120-Y125 VanDerWaalsContact ND2-CZ 3.31Å; G123-Y125 VanDerWaalsContact O-CD2 3.31Å; G123-Y125 WeakPolarHBondContact O-CD2 3.41Å
126	E	76.4	Confident	88.2	Confident	134 Å²	134	55.3 Å²	55.3	63%	0.626	30%	0.3	S	S	*	.	S	Bend	trans	-78	156.6	179.7	-66.7	-171.3	-165.9	0	0	113	Y130	E126-Y130 WeakPolarHBondContact CG-OH 3.44Å; E126-Y130 PolarHBondContact OE2-OH 3.31Å
127	V	79.6	Confident	88.3	Confident	13 Å²	13	56.3 Å²	56.3	8%	0.079	31%	0.308	C	S	.	.			trans	-71.6	143.8	178.1	-171.9	0	0	0	0	110.9	V129 W143 P145 P146 A147	V127-V129 VanDerWaalsContact C-N 3.29Å; V127-V129 PolarHBondContact O-N 2.96Å; V127-W143 HydrophobicContact CG2-CH2 3.96Å; V127-P145 HydrophobicContact CB-CB 4.46Å; V127-P145 HydrophobicContact CG1-CB 3.65Å; V127-P145 HydrophobicContact CG1-CG 4Å; V127-P145 HydrophobicContact CG2-CG 4.25Å; V127-P146 WeakPolarHBondContact CG1-O 3.43Å; V127-A147 HydrophobicContact CG1-CB 3.71Å
128	S	77	Confident	88.4	Confident	73 Å²	73	61.3 Å²	61.3	51%	0.51	33%	0.334	S	S	.	.	S	Bend	trans	-59.4	-35.1	-175.2	-45.9	0	0	0	0	113.8	I148	S128-I148 PolarHBondContact OG-N 3.47Å
129	V	85.6	Confident	88.5	Confident	78 Å²	78	57.4 Å²	57.4	47%	0.473	32%	0.319	S	S	.	.			trans	-139.6	122	-179.4	-176.1	0	0	0	0	110.8	V127 T131 P146	V127-V129 VanDerWaalsContact C-N 3.29Å; V127-V129 PolarHBondContact O-N 2.96Å; V129-T131 HydrophobicContact CG1-CG2 4.18Å; V129-T131 PolarHBondContact O-N 3.43Å; V129-P146 HydrophobicContact CB-CG 4.36Å
130	Y	87.2	Confident	88.6	Confident	88 Å²	88	56.3 Å²	56.3	35%	0.345	31%	0.314	S	S	.	.			trans	-80.7	93.1	170.9	-70.5	-81.2	0	0	0	110.3	E126 W143	E126-Y130 WeakPolarHBondContact CG-OH 3.44Å; E126-Y130 PolarHBondContact OE2-OH 3.31Å; Y130-W143 HydrophobicContact CD1-CH2 4.45Å; Y130-W143 HydrophobicContact CD1-CZ2 4.06Å; Y130-W143 HydrophobicContact CE1-CH2 4.45Å; Y130-W143 HydrophobicContact CE1-CZ2 4.5Å
131	T	92.4	Very high	88.9	Confident	39 Å²	39	55.4 Å²	55.4	24%	0.239	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-77	161.9	173.9	56.3	0	0	0	0	111.7	T107 V129 W143 P146	T107-T131 WeakPolarHBondContact CG2-O 3.41Å; V129-T131 HydrophobicContact CG1-CG2 4.18Å; V129-T131 PolarHBondContact O-N 3.43Å; T131-W143 PolarHBondContact O-NE1 2.84Å; T131-W143 PolarHBondContact OG1-NE1 2.92Å; T131-P146 HydrophobicContact CG2-CG 4.38Å
132	N	95.1	Very high	89.3	Confident	97 Å²	97	54.5 Å²	54.5	52%	0.519	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.6	168.3	-65.6	-15.4	0	0	0	109.8	I105 P106	I105-N132 WeakPolarHBondContact O-CA 3.47Å; P106-N132 WeakPolarHBondContact CA-OD1 3.39Å
133	L	95.6	Very high	90	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	163	173.1	62.7	117.3	0	0	0	110.8	R104 I105 T107 I110 V135 V141 W143	R104-L133 WeakPolarHBondContact CA-O 3.27Å; I105-L133 HydrophobicContact CB-CG 4.48Å; I105-L133 PolarHBondContact N-O 3.19Å; I105-L133 VanDerWaalsContact N-O 3.09Å; I105-L133 VanDerWaalsContact O-CD2 3.25Å; I105-L133 WeakPolarHBondContact O-CD2 3.38Å; I105-L133 VanDerWaalsContact O-CG 3.28Å; I105-L133 WeakPolarHBondContact O-CG 3.36Å; I105-L133 PolarHBondContact O-N 3.24Å; T107-L133 HydrophobicContact CG2-CD2 3.65Å; I110-L133 HydrophobicContact CD1-CD1 3.3Å; I110-L133 HydrophobicContact CD1-CD2 3.37Å; I110-L133 HydrophobicContact CD1-CG 3.93Å; I110-L133 HydrophobicContact CG1-CD1 4.37Å; I110-L133 HydrophobicContact CG1-CD2 3.62Å; L133-V135 HydrophobicContact CD1-CG2 3.38Å; L133-V141 HydrophobicContact CD1-CG1 3.37Å; L133-V141 HydrophobicContact CG-CG1 4.5Å; L133-W143 HydrophobicContact CB-CB 4.12Å; L133-W143 HydrophobicContact CB-CG 4.32Å
134	V	96.9	Very high	90.8	Very high	44 Å²	44	52.2 Å²	52.2	27%	0.267	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.6	176.7	-177.8	0	0	0	0	108.8	I102 R104 V142	I102-V134 HydrophobicContact CB-CG1 4.18Å; I102-V134 HydrophobicContact CG2-CG1 4.3Å; R104-V134 HydrophobicContact CG-CG2 4.22Å; V134-V142 PolarHBondContact N-O 3.38Å; V134-V142 PolarHBondContact O-N 2.89Å
135	V	97.1	Very high	91.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.1	172.2	-170.7	0	0	0	0	108.6	L90 W92 I102 L103 I105 L133 S140 V141	L90-V135 HydrophobicContact CB-CG1 3.96Å; L90-V135 HydrophobicContact CD1-CG2 4.34Å; W92-V135 HydrophobicContact CH2-CB 4.24Å; W92-V135 HydrophobicContact CH2-CG1 4.02Å; W92-V135 HydrophobicContact CZ3-CB 4.35Å; W92-V135 HydrophobicContact CZ3-CG1 3.73Å; I102-V135 CarbonylContact C-O 3.55Å; I102-V135 WeakPolarHBondContact CA-O 3.28Å; L103-V135 PolarHBondContact N-O 3.44Å; L103-V135 PolarHBondContact O-N 2.9Å; I105-V135 HydrophobicContact CD1-CG2 3.78Å; I105-V135 HydrophobicContact CG1-CG2 4.09Å; L133-V135 HydrophobicContact CD1-CG2 3.38Å; V135-S140 CarbonylContact C-O 3.5Å; V135-S140 WeakPolarHBondContact CA-O 3.41Å; V135-V141 HydrophobicContact CG1-CG2 4.23Å; V135-V141 HydrophobicContact CG2-CG2 4.23Å
136	R	97	Very high	92.1	Very high	102 Å²	102	46 Å²	46	39%	0.385	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	157.6	172	-65.3	-174.8	-176.4	111.4	-5.8	110.8	E84 W92 N101 I102 N138 G139 S140	E84-R136 IonicContact OE1-NH1 3.52Å; E84-R136 PolarHBondContact OE1-NH1 2.87Å; W92-R136 VanDerWaalsContact CH2-C 3.45Å; N101-R136 WeakPolarHBondContact O-CA 3.45Å; I102-R136 HydrophobicContact CG2-CG 4.46Å; R136-N138 VanDerWaalsContact CB-OD1 3.27Å; R136-N138 WeakPolarHBondContact CB-OD1 3.34Å; R136-N138 PolarHBondContact O-N 3.05Å; R136-G139 PolarHBondContact O-N 3.42Å; R136-S140 PolarHBondContact N-O 3.36Å; R136-S140 PolarHBondContact NH1-OG 3.43Å; R136-S140 VanDerWaalsContact NH1-OG 3.07Å
137	S	95.5	Very high	92.8	Very high	34 Å²	34	39.7 Å²	39.7	24%	0.238	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.7	-178.9	54.6	0	0	0	0	115	W92 N101 G139	W92-S137 PolarHBondContact N-O 2.93Å; N101-S137 PolarHBondContact O-N 3.35Å; S137-G139 VanDerWaalsContact C-N 3.26Å; S137-G139 PolarHBondContact O-N 3.5Å
138	N	95.1	Very high	93.5	Very high	105 Å²	105	43.3 Å²	43.3	56%	0.561	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	2.1	175	70.7	-15.6	0	0	0	114.4	R136 S140	R136-N138 VanDerWaalsContact CB-OD1 3.27Å; R136-N138 WeakPolarHBondContact CB-OD1 3.34Å; R136-N138 PolarHBondContact O-N 3.05Å; N138-S140 WeakPolarHBondContact OD1-CB 3.2Å; N138-S140 PolarHBondContact OD1-N 3.13Å
139	G	94.4	Very high	94.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	84.2	3.3	-177.3	0	0	0	0	0	114.7	T86 D87 R136 S137 V141	T86-G139 WeakPolarHBondContact CA-O 3.44Å; D87-G139 PolarHBondContact N-O 3.34Å; R136-G139 PolarHBondContact O-N 3.42Å; S137-G139 VanDerWaalsContact C-N 3.26Å; S137-G139 PolarHBondContact O-N 3.5Å; G139-V141 PolarHBondContact O-N 3.19Å
140	S	96.6	Very high	94.8	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.4	170.9	164	0	0	0	0	109.6	E84 V135 R136 N138	E84-S140 PolarHBondContact OE1-OG 2.91Å; E84-S140 VanDerWaalsContact OE1-OG 3.11Å; V135-S140 CarbonylContact C-O 3.5Å; V135-S140 WeakPolarHBondContact CA-O 3.41Å; R136-S140 PolarHBondContact N-O 3.36Å; R136-S140 PolarHBondContact NH1-OG 3.43Å; R136-S140 VanDerWaalsContact NH1-OG 3.07Å; N138-S140 WeakPolarHBondContact OD1-CB 3.2Å; N138-S140 PolarHBondContact OD1-N 3.13Å
141	V	97.6	Very high	95.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127	-180	-178.6	0	0	0	0	108.6	E84 W85 D87 L90 I110 L133 V135 G139	E84-V141 VanDerWaalsContact CA-O 3.29Å; E84-V141 WeakPolarHBondContact CA-O 3.45Å; W85-V141 HydrophobicContact CD2-CB 4Å; W85-V141 HydrophobicContact CD2-CG1 4.14Å; W85-V141 HydrophobicContact CE3-CG1 4.41Å; W85-V141 HydrophobicContact CG-CB 4.37Å; W85-V141 HydrophobicContact CH2-CB 4.47Å; W85-V141 HydrophobicContact CH2-CG1 3.59Å; W85-V141 HydrophobicContact CZ2-CB 3.97Å; W85-V141 HydrophobicContact CZ2-CG1 3.28Å; W85-V141 HydrophobicContact CZ3-CG1 4.15Å; W85-V141 PolarHBondContact N-O 2.85Å; W85-V141 PolarHBondContact O-N 3.4Å; D87-V141 HydrophobicContact CB-CG2 4.26Å; L90-V141 HydrophobicContact CD1-CG2 4.23Å; I110-V141 HydrophobicContact CD1-CG1 4.27Å; L133-V141 HydrophobicContact CD1-CG1 3.37Å; L133-V141 HydrophobicContact CG-CG1 4.5Å; V135-V141 HydrophobicContact CG1-CG2 4.23Å; V135-V141 HydrophobicContact CG2-CG2 4.23Å; G139-V141 PolarHBondContact O-N 3.19Å
142	V	97.1	Very high	95.3	Very high	23 Å²	23	37.3 Å²	37.3	14%	0.139	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125	176.1	-179.2	0	0	0	0	109.1	K82 Q83 E84 V134	K82-V142 HydrophobicContact CG-CG1 4.38Å; Q83-V142 WeakPolarHBondContact O-CA 3.32Å; E84-V142 HydrophobicContact CB-CG2 4.35Å; E84-V142 HydrophobicContact CG-CG2 3.98Å; V134-V142 PolarHBondContact N-O 3.38Å; V134-V142 PolarHBondContact O-N 2.89Å
143	W	96.2	Very high	95.2	Very high	6 Å²	6	32.8 Å²	32.8	2%	0.023	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132	174	-174.1	47.9	0	0	0	110.2	Q83 W85 T107 L112 V127 Y130 T131 L133 P145	Q83-W143 HydrophobicContact CG-CE3 4.36Å; Q83-W143 PolarHBondContact N-O 3.38Å; Q83-W143 PolarHBondContact O-N 3.33Å; W85-W143 HydrophobicContact CH2-CB 3.92Å; W85-W143 HydrophobicContact CZ3-CB 3.89Å; T107-W143 HydrophobicContact CG2-CD2 4.35Å; T107-W143 HydrophobicContact CG2-CG 4.38Å; T107-W143 HydrophobicContact CG2-CZ2 4.17Å; L112-W143 HydrophobicContact CD1-CD2 3.85Å; L112-W143 HydrophobicContact CD1-CE3 3.5Å; L112-W143 VanDerWaalsContact CD1-CE3 3.5Å; L112-W143 HydrophobicContact CD1-CG 4.44Å; L112-W143 HydrophobicContact CD1-CH2 4.37Å; L112-W143 HydrophobicContact CD1-CZ3 3.77Å; L112-W143 HydrophobicContact CD2-CE3 4.34Å; L112-W143 HydrophobicContact CD2-CH2 3.77Å; L112-W143 HydrophobicContact CD2-CZ2 4.4Å; L112-W143 HydrophobicContact CD2-CZ3 3.73Å; L112-W143 HydrophobicContact CG-CE3 4.35Å; L112-W143 HydrophobicContact CG-CZ3 4.14Å; V127-W143 HydrophobicContact CG2-CH2 3.96Å; Y130-W143 HydrophobicContact CD1-CH2 4.45Å; Y130-W143 HydrophobicContact CD1-CZ2 4.06Å; Y130-W143 HydrophobicContact CE1-CH2 4.45Å; Y130-W143 HydrophobicContact CE1-CZ2 4.5Å; T131-W143 PolarHBondContact O-NE1 2.84Å; T131-W143 PolarHBondContact OG1-NE1 2.92Å; L133-W143 HydrophobicContact CB-CB 4.12Å; L133-W143 HydrophobicContact CB-CG 4.32Å; W143-P145 HydrophobicContact CD2-CB 4.35Å; W143-P145 HydrophobicContact CD2-CG 3.84Å; W143-P145 HydrophobicContact CE3-CG 3.96Å; W143-P145 HydrophobicContact CH2-CB 4.13Å; W143-P145 HydrophobicContact CH2-CG 3.69Å; W143-P145 HydrophobicContact CZ2-CB 3.5Å; W143-P145 HydrophobicContact CZ2-CG 3.52Å; W143-P145 HydrophobicContact CZ3-CG 3.9Å
144	L	94.1	Very high	95	Very high	77 Å²	77	38.9 Å²	38.9	40%	0.403	20%	0.199	S	C	.	.			trans	-136.4	77.7	-177.9	-173.3	70.8	0	0	0	108.8	W80 K82	W80-L144 HydrophobicContact CB-CD1 3.78Å; W80-L144 HydrophobicContact CB-CG 4.18Å; W80-L144 HydrophobicContact CE3-CD2 4.34Å; K82-L144 VanDerWaalsContact CA-CD1 3.46Å; K82-L144 HydrophobicContact CB-CD1 3.52Å; K82-L144 HydrophobicContact CG-CD1 4.09Å
145	P	94	Very high	94.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.188	C	C	.	.			trans	-81.7	141.1	177.1	36.5	-37.6	0	0	0	110.7	L81 V127 W143	L81-P145 WeakPolarHBondContact O-CD 3.49Å; V127-P145 HydrophobicContact CB-CB 4.46Å; V127-P145 HydrophobicContact CG1-CB 3.65Å; V127-P145 HydrophobicContact CG1-CG 4Å; V127-P145 HydrophobicContact CG2-CG 4.25Å; W143-P145 HydrophobicContact CD2-CB 4.35Å; W143-P145 HydrophobicContact CD2-CG 3.84Å; W143-P145 HydrophobicContact CE3-CG 3.96Å; W143-P145 HydrophobicContact CH2-CB 4.13Å; W143-P145 HydrophobicContact CH2-CG 3.69Å; W143-P145 HydrophobicContact CZ2-CB 3.5Å; W143-P145 HydrophobicContact CZ2-CG 3.52Å; W143-P145 HydrophobicContact CZ3-CG 3.9Å
146	P	93.3	Very high	94.5	Very high	45 Å²	45	43.5 Å²	43.5	29%	0.292	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.3	167.5	31.7	-31.7	0	0	0	109.6	V127 V129 T131	V127-P146 WeakPolarHBondContact CG1-O 3.43Å; V129-P146 HydrophobicContact CB-CG 4.36Å; T131-P146 HydrophobicContact CG2-CG 4.38Å
147	A	92.4	Very high	94.1	Very high	1 Å²	1	39 Å²	39	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	134	-177.8	0	0	0	0	0	111.1	V79 V127 Y149	V79-A147 HydrophobicContact CG2-CB 4.32Å; V79-A147 PolarHBondContact N-O 2.94Å; V79-A147 PolarHBondContact O-N 3.3Å; V127-A147 HydrophobicContact CG1-CB 3.71Å; A147-Y149 HydrophobicContact CB-CD2 3.96Å; A147-Y149 HydrophobicContact CB-CE1 4.29Å; A147-Y149 HydrophobicContact CB-CE2 3.43Å; A147-Y149 VanDerWaalsContact CB-CE2 3.43Å
148	I	93.6	Very high	93.7	Very high	90 Å²	90	41.7 Å²	41.7	46%	0.462	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	110.3	164.6	-59.2	174.8	0	0	0	107.3	I66 T76 T77 S128	I66-I148 HydrophobicContact CD1-CG2 4.14Å; T76-I148 HydrophobicContact CG2-CG2 3.76Å; T77-I148 CarbonylContact O-C 3.57Å; T77-I148 VanDerWaalsContact O-CA 3.31Å; T77-I148 WeakPolarHBondContact O-CA 3.49Å; S128-I148 PolarHBondContact OG-N 3.47Å
149	Y	93.9	Very high	93.4	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.4	179.4	-75.2	-55.3	0	0	0	111.2	T76 T77 V79 L117 A147 F171	T76-Y149 WeakPolarHBondContact CA-O 3.27Å; T77-Y149 PolarHBondContact N-O 2.9Å; T77-Y149 PolarHBondContact O-N 3.33Å; V79-Y149 HydrophobicContact CG2-CD2 3.41Å; V79-Y149 VanDerWaalsContact CG2-CD2 3.41Å; V79-Y149 HydrophobicContact CG2-CE2 3.63Å; L117-Y149 HydrophobicContact CB-CD1 3.9Å; L117-Y149 HydrophobicContact CB-CE1 3.99Å; L117-Y149 HydrophobicContact CD2-CD1 3.9Å; L117-Y149 HydrophobicContact CD2-CG 4.05Å; A147-Y149 HydrophobicContact CB-CD2 3.96Å; A147-Y149 HydrophobicContact CB-CE1 4.29Å; A147-Y149 HydrophobicContact CB-CE2 3.43Å; A147-Y149 VanDerWaalsContact CB-CE2 3.43Å; Y149-F171 HydrophobicContact CD2-CE1 4.18Å; Y149-F171 HydrophobicContact CD2-CZ 4.1Å; Y149-F171 AromaticContact CE2-CE1 3.56Å; Y149-F171 HydrophobicContact CE2-CE1 3.56Å; Y149-F171 AromaticContact CE2-CZ 3.81Å; Y149-F171 HydrophobicContact CE2-CZ 3.81Å; Y149-F171 AromaticContact CZ-CE1 3.79Å
150	K	95.1	Very high	93.1	Very high	75 Å²	75	40.1 Å²	40.1	33%	0.326	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	105.2	166.7	-64	-172.7	-165.1	153.3	0	109	I74 M75 T76 N120 A121 D122	I74-K150 HydrophobicContact CG2-CB 3.9Å; I74-K150 HydrophobicContact CG2-CG 4.43Å; M75-K150 WeakPolarHBondContact O-CA 3.5Å; T76-K150 HydrophobicContact CG2-CG 4.19Å; N120-K150 WeakPolarHBondContact CA-O 3.39Å; A121-K150 PolarHBondContact N-O 3.25Å; D122-K150 HydrophobicContact CB-CB 4.22Å; D122-K150 HydrophobicContact CB-CD 4Å; D122-K150 IonicContact OD1-NZ 3.26Å; D122-K150 PolarHBondContact OD1-NZ 3.48Å; D122-K150 WeakPolarHBondContact OD2-CE 3.47Å; D122-K150 IonicContact OD2-NZ 3.87Å; D122-K150 PolarHBondContact OD2-NZ 3.38Å
151	S	95.4	Very high	92.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144.4	-177.7	62.2	0	0	0	0	111.6	I74 M75 N119 L169	I74-S151 WeakPolarHBondContact CA-O 3.41Å; M75-S151 VanDerWaalsContact CE-OG 3.27Å; M75-S151 WeakPolarHBondContact CE-OG 3.36Å; M75-S151 PolarHBondContact N-O 3.44Å; M75-S151 PolarHBondContact O-N 3.01Å; M75-S151 PolarHBondContact O-OG 2.88Å; N119-S151 CarbonylContact O-C 3.59Å; N119-S151 WeakPolarHBondContact O-CA 3.22Å; S151-L169 WeakPolarHBondContact OG-CD2 3.48Å
152	T	94.7	Very high	92.4	Very high	67 Å²	67	44.2 Å²	44.2	41%	0.411	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126	170	-48.2	0	0	0	0	109.3	N119	N119-T152 PolarHBondContact ND2-O 3.18Å; N119-T152 PolarHBondContact O-N 2.9Å
153	C	93.6	Very high	92.1	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.02	21%	0.208	C	C	.	.			trans	-131.6	123.9	176.5	175.8	0	0	0	0	110.5	Q73 M75 I155 C167	Q73-C153 WeakPolarHBondContact CB-O 3.47Å; Q73-C153 PolarHBondContact O-N 2.9Å; M75-C153 HydrophobicContact CB-CB 4.36Å; C153-I155 PolarHBondContact O-N 3Å; C153-C167 HydrophobicContact CB-CB 3.59Å; C153-C167 WeakPolarHBondContact CB-SG 3.23Å; C153-C167 WeakPolarHBondContact SG-CA 3.39Å; C153-C167 WeakPolarHBondContact SG-CB 3.46Å; C153-C167 CovalentContact SG-SG 2.02Å; C153-C167 PolarHBondContact SG-SG 3.32Å
154	K	91.9	Very high	91.9	Very high	128 Å²	128	47 Å²	47	56%	0.557	23%	0.225	S	C	*	.			trans	-73	122.3	174.2	-176.6	-176.1	175.8	-173	0	109.5
155	I	91.8	Very high	91.9	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.041	21%	0.207	C	C	.	.			trans	-94.3	128.5	-178.1	-54.4	-60.3	0	0	0	110.7	V68 E70 Q73 C153 V157 P286	V68-I155 HydrophobicContact CG1-CD1 4.07Å; E70-I155 HydrophobicContact CB-CG1 4.43Å; E70-I155 HydrophobicContact CB-CG2 4.33Å; E70-I155 HydrophobicContact CG-CG2 4.27Å; Q73-I155 HydrophobicContact CG-CG1 4.43Å; C153-I155 PolarHBondContact O-N 3Å; I155-V157 HydrophobicContact CG2-CG1 3.85Å; I155-P286 HydrophobicContact CB-CG 4.5Å
156	E	90.6	Very high	92	Very high	134 Å²	134	47.7 Å²	47.7	63%	0.626	23%	0.23	S	C	*	.			trans	-93.9	104.1	174.4	-64.6	-172.5	178.1	0	0	110.4	Q165	E156-Q165 PolarHBondContact O-NE2 3.41Å
157	V	90.3	Very high	92.1	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.042	22%	0.216	C	C	.	.			trans	-93	0.5	-169.8	-60	0	0	0	0	114.2	I155 Y159 F160 V285 P286 D291 P293	I155-V157 HydrophobicContact CG2-CG1 3.85Å; V157-Y159 VanDerWaalsContact C-N 3.28Å; V157-Y159 PolarHBondContact O-N 3.3Å; V157-F160 WeakPolarHBondContact O-CB 3.5Å; V157-F160 PolarHBondContact O-N 2.83Å; V157-V285 HydrophobicContact CB-CG1 4.02Å; V157-V285 HydrophobicContact CG1-CG1 3.79Å; V157-V285 HydrophobicContact CG2-CG1 4.17Å; V157-P286 HydrophobicContact CG1-CG 3.86Å; V157-D291 WeakPolarHBondContact CG2-O 3.37Å; V157-P293 HydrophobicContact CB-CB 4.5Å; V157-P293 WeakPolarHBondContact O-CA 3.37Å; V157-P293 WeakPolarHBondContact O-CB 3.39Å
158	K	87.2	Confident	92.3	Very high	91 Å²	91	47 Å²	47	40%	0.396	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-43.6	-171.6	-176.3	175.5	179.1	-178.4	0	113.1	L294	K158-L294 PolarHBondContact O-N 3.19Å; K158-L294 VanDerWaalsContact O-N 3.15Å
159	Y	87.8	Confident	92.5	Very high	59 Å²	59	42.8 Å²	42.8	23%	0.231	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	18.4	-176.2	-62.2	-64.3	0	0	0	114.3	V157 F162 P475 Q478	V157-Y159 VanDerWaalsContact C-N 3.28Å; V157-Y159 PolarHBondContact O-N 3.3Å; Y159-F162 CarbonylContact O-C 3.57Å; Y159-F162 WeakPolarHBondContact O-CA 3.41Å; Y159-F162 PolarHBondContact O-N 2.81Å; Y159-P475 HydrophobicContact CD1-CB 4.08Å; Y159-P475 HydrophobicContact CD1-CG 3.98Å; Y159-P475 HydrophobicContact CE1-CB 4.48Å; Y159-P475 HydrophobicContact CE1-CG 4.2Å; Y159-Q478 PolarHBondContact OH-OE1 2.93Å
160	F	88.3	Confident	92.5	Very high	12 Å²	12	45.9 Å²	45.9	5%	0.053	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	132	176.8	-179.7	-88.9	0	0	0	111.8	V157 Y235 I281 I284 P293 I295	V157-F160 WeakPolarHBondContact O-CB 3.5Å; V157-F160 PolarHBondContact O-N 2.83Å; F160-Y235 HydrophobicContact CE1-CD1 4.13Å; F160-Y235 HydrophobicContact CE1-CE1 4.49Å; F160-Y235 HydrophobicContact CE2-CE1 4.34Å; F160-Y235 AromaticContact CZ-CD1 3.6Å; F160-Y235 HydrophobicContact CZ-CD1 3.6Å; F160-Y235 AromaticContact CZ-CE1 3.59Å; F160-Y235 HydrophobicContact CZ-CE1 3.59Å; F160-Y235 HydrophobicContact CZ-CG 4.16Å; F160-I281 HydrophobicContact CD1-CD1 4.1Å; F160-I281 HydrophobicContact CE1-CD1 3.66Å; F160-I281 HydrophobicContact CZ-CD1 4.46Å; F160-I284 HydrophobicContact CE2-CG2 4.43Å; F160-I284 HydrophobicContact CZ-CG2 4.05Å; F160-P293 HydrophobicContact CB-CB 4.33Å; F160-I295 HydrophobicContact CD1-CG2 4Å
161	P	90.3	Very high	92.6	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.032	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.4	16	3.1	39.7	-38.1	0	0	0	114.8	D163 R230 P232 Y235 I240	P161-D163 VanDerWaalsContact C-N 3.28Å; P161-D163 PolarHBondContact O-N 2.9Å; P161-R230 WeakPolarHBondContact O-CD 3.4Å; P161-P232 HydrophobicContact CB-CB 4.48Å; P161-P232 HydrophobicContact CG-CB 4.28Å; P161-Y235 HydrophobicContact CB-CD2 4.03Å; P161-Y235 HydrophobicContact CB-CG 3.88Å; P161-I240 HydrophobicContact CG-CD1 4.13Å
162	F	89	Confident	92.5	Very high	88 Å²	88	43.9 Å²	43.9	39%	0.386	21%	0.207	S	C	.	.	S	Bend	trans	-96.9	36.1	178.9	-54.3	-74.3	0	0	0	111.7	Y159 P232 I240	Y159-F162 CarbonylContact O-C 3.57Å; Y159-F162 WeakPolarHBondContact O-CA 3.41Å; Y159-F162 PolarHBondContact O-N 2.81Å; F162-P232 HydrophobicContact CD1-CB 3.62Å; F162-P232 HydrophobicContact CD1-CG 3.76Å; F162-P232 HydrophobicContact CE1-CB 3.5Å; F162-P232 VanDerWaalsContact CE1-CB 3.5Å; F162-P232 HydrophobicContact CE1-CG 3.65Å; F162-P232 HydrophobicContact CZ-CB 4.36Å; F162-I240 HydrophobicContact CE2-CD1 3.85Å; F162-I240 HydrophobicContact CZ-CD1 3.96Å
163	D	90.4	Very high	92.4	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.027	19%	0.188	C	C	.	.			trans	-89.4	151.3	-171.4	53.4	-49.5	0	0	0	113.2	P161 Q165 R230	P161-D163 VanDerWaalsContact C-N 3.28Å; P161-D163 PolarHBondContact O-N 2.9Å; D163-Q165 PolarHBondContact OD2-NE2 2.87Å; D163-R230 PolarHBondContact O-N 3.32Å; D163-R230 IonicContact OD1-CZ 3.79Å; D163-R230 IonicContact OD1-NE 3.59Å; D163-R230 PolarHBondContact OD1-NE 2.96Å; D163-R230 IonicContact OD1-NH2 3.91Å; D163-R230 IonicContact OD2-CZ 3.63Å; D163-R230 IonicContact OD2-NE 2.69Å; D163-R230 IonicContact OD2-NH2 2.65Å; D163-R230 PolarHBondContact OD2-NH2 2.88Å
164	Q	92	Very high	92.3	Very high	81 Å²	81	47.8 Å²	47.8	38%	0.379	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.3	162.2	-74.4	-177	-26.4	0	0	107.9	I228 K229	Q164-I228 CarbonylContact C-O 3.56Å; Q164-I228 WeakPolarHBondContact CA-O 3.48Å; Q164-K229 HydrophobicContact CG-CB 4.14Å; Q164-K229 HydrophobicContact CG-CD 4.46Å; Q164-K229 HydrophobicContact CG-CG 4.06Å
165	Q	94.8	Very high	92.2	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	144	178.3	-56	-59.8	-25.5	0	0	109.6	E156 D163 W201 I227 I228	E156-Q165 PolarHBondContact O-NE2 3.41Å; D163-Q165 PolarHBondContact OD2-NE2 2.87Å; Q165-W201 HydrophobicContact CB-CZ3 4.35Å; Q165-W201 HydrophobicContact CG-CH2 3.58Å; Q165-W201 HydrophobicContact CG-CZ3 3.71Å; Q165-I227 WeakPolarHBondContact O-CA 3.35Å; Q165-I228 HydrophobicContact CB-CD1 4.2Å; Q165-I228 HydrophobicContact CB-CG1 3.77Å; Q165-I228 PolarHBondContact N-O 3.48Å; Q165-I228 PolarHBondContact O-N 2.89Å
166	N	95.8	Very high	92.3	Very high	91 Å²	91	47 Å²	47	49%	0.487	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	94.5	173.6	-174.4	2.7	0	0	0	108.9	F226	N166-F226 WeakPolarHBondContact CA-O 3.34Å
167	C	96.4	Very high	92.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	154	178.2	-62.1	0	0	0	0	110.7	M75 C153 D225 F226	M75-C167 HydrophobicContact CE-CB 3.19Å; M75-C167 HydrophobicContact SD-CB 3.56Å; M75-C167 VanDerWaalsContact SD-CB 3.56Å; C153-C167 HydrophobicContact CB-CB 3.59Å; C153-C167 WeakPolarHBondContact CB-SG 3.23Å; C153-C167 WeakPolarHBondContact SG-CA 3.39Å; C153-C167 WeakPolarHBondContact SG-CB 3.46Å; C153-C167 CovalentContact SG-SG 2.02Å; C153-C167 PolarHBondContact SG-SG 3.32Å; C167-D225 CarbonylContact O-C 3.56Å; C167-F226 HydrophobicContact CB-CB 4.21Å; C167-F226 PolarHBondContact N-O 3.44Å; C167-F226 WeakPolarHBondContact O-CA 3.47Å; C167-F226 WeakPolarHBondContact O-CB 3.4Å; C167-F226 PolarHBondContact O-N 3.25Å
168	T	96.6	Very high	92.5	Very high	31 Å²	31	45.4 Å²	45.4	19%	0.19	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.5	-176.3	68.7	0	0	0	0	111.6	N119 T223 Y224 D225	N119-T168 PolarHBondContact ND2-O 3.35Å; T168-T223 HydrophobicContact CG2-CG2 4.34Å; T168-Y224 CarbonylContact C-O 3.57Å; T168-Y224 WeakPolarHBondContact CA-O 3.42Å; T168-D225 WeakPolarHBondContact CG2-OD1 3.32Å
169	L	96.1	Very high	92.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115	165.7	-64.7	-178.2	0	0	0	108.5	L60 M75 L117 S151 F171 T223 Y224 F226	L60-L169 HydrophobicContact CD2-CD1 4.45Å; M75-L169 HydrophobicContact CE-CD2 4.33Å; L117-L169 HydrophobicContact CD1-CB 3.93Å; L117-L169 HydrophobicContact CD1-CD2 3.84Å; L117-L169 HydrophobicContact CD1-CG 4.49Å; L117-L169 HydrophobicContact CD2-CD2 4.28Å; S151-L169 WeakPolarHBondContact OG-CD2 3.48Å; L169-F171 HydrophobicContact CB-CD2 4.47Å; L169-F171 HydrophobicContact CB-CE2 3.75Å; L169-F171 HydrophobicContact CB-CZ 4.21Å; L169-F171 HydrophobicContact CD1-CE2 4.35Å; L169-F171 HydrophobicContact CD1-CZ 4.31Å; L169-T223 VanDerWaalsContact O-CA 3.3Å; L169-T223 WeakPolarHBondContact O-CA 3.41Å; L169-Y224 PolarHBondContact N-O 3.22Å; L169-Y224 PolarHBondContact O-N 3.29Å; L169-F226 HydrophobicContact CB-CE2 4.29Å; L169-F226 HydrophobicContact CD1-CD2 4.47Å; L169-F226 HydrophobicContact CD1-CE2 3.44Å; L169-F226 VanDerWaalsContact CD1-CE2 3.44Å; L169-F226 HydrophobicContact CD1-CZ 3.62Å; L169-F226 HydrophobicContact CG-CD2 4.23Å; L169-F226 HydrophobicContact CG-CE2 3.61Å; L169-F226 HydrophobicContact CG-CZ 4.25Å
170	K	95.1	Very high	92.9	Very high	75 Å²	75	45.4 Å²	45.4	33%	0.326	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	108.1	-178.6	-61.1	-166.4	174.2	-170.3	0	111.3	L117 Y118 N119 T223	L117-K170 WeakPolarHBondContact CA-O 3.48Å; Y118-K170 PolarHBondContact N-O 3.35Å; N119-K170 WeakPolarHBondContact OD1-CB 3.43Å; N119-K170 PolarHBondContact OD1-N 2.85Å; K170-T223 HydrophobicContact CG-CG2 3.99Å
171	F	95.8	Very high	93.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.1	177.5	-64.7	-76.8	0	0	0	111.3	L60 L81 I115 V116 L117 Y149 L169 V222 Y224	L60-F171 HydrophobicContact CD1-CE2 3.79Å; L60-F171 HydrophobicContact CD1-CZ 3.87Å; L81-F171 HydrophobicContact CD2-CD1 3.88Å; L81-F171 HydrophobicContact CD2-CE1 3.88Å; L81-F171 HydrophobicContact CD2-CZ 4.5Å; I115-F171 HydrophobicContact CG2-CB 3.94Å; I115-F171 HydrophobicContact CG2-CD1 4.31Å; V116-F171 WeakPolarHBondContact O-CA 3.5Å; L117-F171 HydrophobicContact CB-CE1 4.49Å; L117-F171 HydrophobicContact CD1-CE1 4.37Å; L117-F171 HydrophobicContact CD1-CZ 4.45Å; Y149-F171 HydrophobicContact CD2-CE1 4.18Å; Y149-F171 HydrophobicContact CD2-CZ 4.1Å; Y149-F171 AromaticContact CE2-CE1 3.56Å; Y149-F171 HydrophobicContact CE2-CE1 3.56Å; Y149-F171 AromaticContact CE2-CZ 3.81Å; Y149-F171 HydrophobicContact CE2-CZ 3.81Å; Y149-F171 AromaticContact CZ-CE1 3.79Å; L169-F171 HydrophobicContact CB-CD2 4.47Å; L169-F171 HydrophobicContact CB-CE2 3.75Å; L169-F171 HydrophobicContact CB-CZ 4.21Å; L169-F171 HydrophobicContact CD1-CE2 4.35Å; L169-F171 HydrophobicContact CD1-CZ 4.31Å; F171-V222 PolarHBondContact N-O 3.26Å; F171-V222 PolarHBondContact O-N 2.95Å; F171-Y224 AromaticContact CD2-CD2 3.96Å; F171-Y224 HydrophobicContact CD2-CD2 3.96Å; F171-Y224 HydrophobicContact CD2-CE2 4.27Å; F171-Y224 AromaticContact CE2-CD2 3.96Å; F171-Y224 HydrophobicContact CE2-CD2 3.96Å; F171-Y224 HydrophobicContact CE2-CE2 4.43Å
172	R	93.6	Very high	93.4	Very high	33 Å²	33	45.9 Å²	45.9	13%	0.125	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	156.5	173.4	169.9	179.1	-178.4	178.1	4.6	110.4	V116 Y118 D177 M183 Y219 V220 D221	V116-R172 WeakPolarHBondContact CG2-O 3.34Å; V116-R172 PolarHBondContact N-O 3.35Å; V116-R172 PolarHBondContact O-N 3.46Å; V116-R172 VanDerWaalsContact O-N 3.08Å; Y118-R172 HydrophobicContact CD2-CB 3.59Å; Y118-R172 HydrophobicContact CD2-CG 4.21Å; Y118-R172 HydrophobicContact CE2-CB 3.46Å; Y118-R172 VanDerWaalsContact CE2-CB 3.46Å; Y118-R172 HydrophobicContact CE2-CG 3.59Å; R172-D177 IonicContact NH2-OD1 3.81Å; R172-M183 HydrophobicContact CB-CE 4.05Å; R172-M183 HydrophobicContact CG-CE 4.09Å; R172-Y219 VanDerWaalsContact NH1-CE2 3.29Å; R172-V220 WeakPolarHBondContact CD-O 3.21Å; R172-V220 WeakPolarHBondContact CG-O 3.48Å; R172-D221 HydrophobicContact CB-CB 4.3Å
173	S	93.4	Very high	93.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137	169.7	41.8	0	0	0	0	112	D114 Y118 Y176 I181	D114-S173 WeakPolarHBondContact O-CA 3.23Å; Y118-S173 PolarHBondContact OH-O 3.3Å; Y118-S173 VanDerWaalsContact OH-O 3.06Å; S173-Y176 WeakPolarHBondContact CB-O 3.34Å; S173-Y176 PolarHBondContact OG-O 2.86Å; S173-I181 VanDerWaalsContact CB-CD1 3.44Å; S173-I181 WeakPolarHBondContact OG-CD1 3.03Å
174	W	90.4	Very high	93.9	Very high	150 Å²	150	43.8 Å²	43.8	57%	0.568	22%	0.218	S	C	*	.	S	Bend	trans	-80.6	-36.3	176.6	-172.1	-95.2	0	0	0	112.8	D114 V116 Y118	D114-W174 PolarHBondContact O-N 3.36Å; D114-W174 WeakPolarHBondContact OD2-CA 3.33Å; D114-W174 WeakPolarHBondContact OD2-CB 3.43Å; D114-W174 PolarHBondContact OD2-N 2.84Å; V116-W174 HydrophobicContact CG2-CB 4.07Å; V116-W174 HydrophobicContact CG2-CE3 4.15Å; Y118-W174 HydrophobicContact CE1-CE3 4.1Å; Y118-W174 AromaticContact CE1-CZ3 4Å; Y118-W174 HydrophobicContact CE1-CZ3 4Å; Y118-W174 HydrophobicContact CE2-CE3 4.21Å; Y118-W174 AromaticContact CZ-CE3 3.76Å
175	T	91.5	Very high	94.1	Very high	86 Å²	86	41.7 Å²	41.7	53%	0.528	21%	0.209	S	C	.	.	S	Bend	trans	-99.2	-36.5	-173.3	52.5	0	0	0	0	114	D114	D114-T175 PolarHBondContact OD1-OG1 2.81Å; D114-T175 WeakPolarHBondContact OD2-CB 3.31Å; D114-T175 WeakPolarHBondContact OD2-CG2 3.44Å; D114-T175 PolarHBondContact OD2-N 2.94Å; D114-T175 PolarHBondContact OD2-OG1 2.85Å
176	Y	92.9	Very high	94.1	Very high	35 Å²	35	45.4 Å²	45.4	14%	0.137	23%	0.228	C	C	.	.			trans	-100.6	145.1	-174.2	-60.7	-70.6	0	0	0	112.4	R45 W111 S173 E180 I181	R45-Y176 HydrophobicContact CB-CE1 4.43Å; W111-Y176 HydrophobicContact CZ2-CD2 4.38Å; W111-Y176 AromaticContact CZ2-CE2 3.75Å; W111-Y176 HydrophobicContact CZ2-CE2 3.75Å; W111-Y176 AromaticContact NE1-CE2 3.82Å; W111-Y176 AromaticContact NE1-CZ 3.61Å; W111-Y176 PolarHBondContact NE1-OH 2.98Å; S173-Y176 WeakPolarHBondContact CB-O 3.34Å; S173-Y176 PolarHBondContact OG-O 2.86Å; Y176-E180 HydrophobicContact CD1-CB 4.28Å; Y176-E180 WeakPolarHBondContact CD1-OE2 3.29Å; Y176-I181 HydrophobicContact CD2-CG2 4.32Å; Y176-I181 HydrophobicContact CG-CG2 3.97Å
177	D	91.8	Very high	94	Very high	65 Å²	65	42.9 Å²	42.9	35%	0.348	22%	0.215	S	C	.	.			trans	-100.6	172.7	175.8	-69.4	-32.1	0	0	0	112.4	R172 T179 E180 I181	R172-D177 IonicContact NH2-OD1 3.81Å; D177-T179 PolarHBondContact O-N 2.84Å; D177-E180 PolarHBondContact O-N 2.66Å; D177-I181 PolarHBondContact O-N 3.24Å
178	H	92.8	Very high	93.8	Very high	41 Å²	41	47.5 Å²	47.5	19%	0.19	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-19.6	175.9	-169.2	-122.8	0	0	0	113.9	L53 E180 I181 D182 R210 P217 S218 V220	L53-H178 VanDerWaalsContact CD2-O 3.27Å; L53-H178 WeakPolarHBondContact CD2-O 3.15Å; H178-E180 VanDerWaalsContact C-N 3.31Å; H178-I181 CarbonylContact C-O 3.51Å; H178-I181 WeakPolarHBondContact CA-O 3.5Å; H178-D182 IonicContact CD2-OD1 3.03Å; H178-D182 IonicContact NE2-OD1 3.75Å; H178-D182 PolarHBondContact NE2-OD1 3.25Å; H178-D182 VanDerWaalsContact NE2-OD1 3.12Å; H178-R210 PolarHBondContact NE2-NH2 3.12Å; H178-P217 WeakPolarHBondContact CB-O 3.27Å; H178-S218 WeakPolarHBondContact CB-O 3.36Å; H178-S218 PolarHBondContact N-O 3.15Å; H178-V220 HydrophobicContact CB-CB 3.98Å; H178-V220 HydrophobicContact CB-CG1 3.7Å
179	T	90.5	Very high	93.8	Very high	90 Å²	90	49.9 Å²	49.9	55%	0.552	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.5	176.8	70	0	0	0	0	114.2	L53 D177	L53-T179 WeakPolarHBondContact CD2-O 3.42Å; D177-T179 PolarHBondContact O-N 2.84Å
180	E	92.9	Very high	93.7	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.28	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-36.7	-178.3	-62.4	-176.5	110	0	0	112.4	R45 I54 Y176 D177 H178	R45-E180 IonicContact NE-OE1 2.79Å; I54-E180 PolarHBondContact N-O 2.95Å; Y176-E180 HydrophobicContact CD1-CB 4.28Å; Y176-E180 WeakPolarHBondContact CD1-OE2 3.29Å; D177-E180 PolarHBondContact O-N 2.66Å; H178-E180 VanDerWaalsContact C-N 3.31Å
181	I	94.3	Very high	93.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.8	177.4	69.8	164.1	0	0	0	110.7	I54 I56 S173 Y176 D177 H178	I54-I181 HydrophobicContact CB-CG2 4.36Å; I54-I181 WeakPolarHBondContact O-CA 3.32Å; I56-I181 HydrophobicContact CD1-CB 4.04Å; I56-I181 HydrophobicContact CD1-CD1 3.86Å; I56-I181 HydrophobicContact CD1-CG2 4.22Å; S173-I181 VanDerWaalsContact CB-CD1 3.44Å; S173-I181 WeakPolarHBondContact OG-CD1 3.03Å; Y176-I181 HydrophobicContact CD2-CG2 4.32Å; Y176-I181 HydrophobicContact CG-CG2 3.97Å; D177-I181 PolarHBondContact O-N 3.24Å; H178-I181 CarbonylContact C-O 3.51Å; H178-I181 WeakPolarHBondContact CA-O 3.5Å
182	D	94.9	Very high	93.4	Very high	28 Å²	28	51 Å²	51	15%	0.15	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.3	173	-171.8	34.5	0	0	0	109.8	I54 S55 I56 H178 R210	I54-D182 PolarHBondContact O-N 3.38Å; S55-D182 CarbonylContact C-O 3.56Å; S55-D182 WeakPolarHBondContact CA-O 3.27Å; I56-D182 PolarHBondContact N-O 3.14Å; H178-D182 IonicContact CD2-OD1 3.03Å; H178-D182 IonicContact NE2-OD1 3.75Å; H178-D182 PolarHBondContact NE2-OD1 3.25Å; H178-D182 VanDerWaalsContact NE2-OD1 3.12Å; D182-R210 IonicContact OD1-CZ 3.6Å; D182-R210 IonicContact OD1-NE 3.18Å; D182-R210 IonicContact OD1-NH2 3.69Å; D182-R210 PolarHBondContact OD1-NH2 3.2Å; D182-R210 IonicContact OD2-NH2 2.65Å
183	M	94.8	Very high	93.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.2	176.9	-69.9	-171	-78.1	0	0	109.8	L58 R172 R210 V220 V222	L58-M183 HydrophobicContact CD1-CB 4.05Å; L58-M183 HydrophobicContact CD1-CG 4.06Å; L58-M183 HydrophobicContact CD1-SD 3.93Å; R172-M183 HydrophobicContact CB-CE 4.05Å; R172-M183 HydrophobicContact CG-CE 4.09Å; M183-R210 WeakPolarHBondContact O-CD 3.4Å; M183-R210 PolarHBondContact O-NE 3.43Å; M183-V220 HydrophobicContact CB-CG2 4.15Å; M183-V220 HydrophobicContact CE-CB 4.18Å; M183-V220 HydrophobicContact CE-CG1 3.59Å; M183-V220 HydrophobicContact CE-CG2 4.07Å; M183-V220 WeakPolarHBondContact CE-O 3.29Å; M183-V222 HydrophobicContact CB-CG2 3.88Å
184	V	95.5	Very high	93	Very high	48 Å²	48	61 Å²	61	29%	0.291	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.8	-176.4	-176.8	0	0	0	0	109.5	I56 K57 L58	I56-V184 PolarHBondContact O-N 2.87Å; K57-V184 CarbonylContact C-O 3.44Å; K57-V184 VanDerWaalsContact CA-O 3.29Å; K57-V184 WeakPolarHBondContact CA-O 3.47Å; K57-V184 HydrophobicContact CG-CB 4.48Å; L58-V184 PolarHBondContact N-O 3.35Å
185	L	95.7	Very high	93.1	Very high	37 Å²	37	56.6 Å²	56.6	19%	0.194	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.4	175.7	-174.1	66.2	0	0	0	109.7	T187 G208 V222 Y224	L185-T187 WeakPolarHBondContact CD1-O 3.5Å; L185-T187 VanDerWaalsContact CD2-O 3.28Å; L185-T187 WeakPolarHBondContact CD2-O 3.36Å; L185-T187 WeakPolarHBondContact CG-O 3.25Å; L185-G208 VanDerWaalsContact CD2-O 3.28Å; L185-G208 WeakPolarHBondContact CD2-O 3.34Å; L185-V222 HydrophobicContact CD1-CG1 3.96Å; L185-Y224 HydrophobicContact CD1-CE1 4.02Å; L185-Y224 HydrophobicContact CD1-CE2 4.45Å; L185-Y224 WeakPolarHBondContact CD1-OH 3.43Å
186	M	94.4	Very high	93.1	Very high	81 Å²	81	56.1 Å²	56.1	40%	0.399	31%	0.309	S	S	.	.	S	Bend	trans	-77.3	-37.9	-178.8	-166.6	176.8	125.6	0	0	112.2	L58 Q59	L58-M186 WeakPolarHBondContact O-CB 3.13Å; L58-M186 PolarHBondContact O-N 3.46Å; Q59-M186 HydrophobicContact CB-CB 4.08Å; Q59-M186 HydrophobicContact CB-SD 4.43Å
187	T	94	Very high	93.1	Very high	38 Å²	38	59 Å²	59	23%	0.233	33%	0.331	C	S	.	.	S	Bend	trans	-134.2	139.9	178.4	54.1	0	0	0	0	110.2	L185 T189	L185-T187 WeakPolarHBondContact CD1-O 3.5Å; L185-T187 VanDerWaalsContact CD2-O 3.28Å; L185-T187 WeakPolarHBondContact CD2-O 3.36Å; L185-T187 WeakPolarHBondContact CG-O 3.25Å; T187-T189 PolarHBondContact O-N 3.12Å; T187-T189 PolarHBondContact OG1-O 3.47Å
188	P	93.9	Very high	93.2	Very high	98 Å²	98	57.3 Å²	57.3	64%	0.636	32%	0.322	S	S	*	.	S	Bend	trans	-66.6	-18	-177	28.3	-35.8	0	0	0	113.5	G208	P188-G208 PolarHBondContact O-N 3.29Å
189	T	94.6	Very high	93.1	Very high	82 Å²	82	58.6 Å²	58.6	50%	0.503	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-124.4	150.8	176.4	54.9	0	0	0	0	110.2	T187 L206	T187-T189 PolarHBondContact O-N 3.12Å; T187-T189 PolarHBondContact OG1-O 3.47Å; T189-L206 WeakPolarHBondContact CA-O 3.44Å
190	A	94.9	Very high	93.2	Very high	7 Å²	7	57.3 Å²	57.3	6%	0.058	33%	0.334	C	S	.	.			trans	-69.4	144.5	170.1	0	0	0	0	0	110.6	L60 L206 Y224	L60-A190 HydrophobicContact CB-CB 4.18Å; L60-A190 HydrophobicContact CD2-CB 4.03Å; L60-A190 WeakPolarHBondContact O-CA 3.45Å; L60-A190 WeakPolarHBondContact O-CB 3.4Å; A190-L206 HydrophobicContact CB-CB 3.93Å; A190-L206 HydrophobicContact CB-CD1 4.2Å; A190-L206 PolarHBondContact N-O 3.4Å; A190-Y224 HydrophobicContact CB-CD1 3.94Å; A190-Y224 HydrophobicContact CB-CE1 4.07Å
191	S	94.1	Very high	93.3	Very high	17 Å²	17	54.5 Å²	54.5	12%	0.119	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-79.4	144.9	175.6	50.8	0	0	0	0	111.2	L60 S61 L62	L60-S191 PolarHBondContact O-N 3.43Å; L60-S191 PolarHBondContact O-OG 3.27Å; S61-S191 WeakPolarHBondContact CA-O 3.33Å; S61-S191 WeakPolarHBondContact CA-OG 3.37Å; S61-S191 WeakPolarHBondContact CB-OG 3.5Å; S61-S191 PolarHBondContact OG-OG 2.9Å; L62-S191 PolarHBondContact N-O 2.9Å
192	M	91.1	Very high	93.3	Very high	73 Å²	73	57.9 Å²	57.9	36%	0.36	34%	0.34	S	S	.	.			trans	-124.4	26.9	177.2	-65.1	-171.7	-112.4	0	0	111.2	D194 F195 I203 L206	M192-D194 VanDerWaalsContact C-N 3.29Å; M192-D194 PolarHBondContact O-N 3.47Å; M192-F195 HydrophobicContact CB-CB 3.95Å; M192-F195 VanDerWaalsContact O-CB 3.23Å; M192-F195 WeakPolarHBondContact O-CB 3.3Å; M192-F195 PolarHBondContact O-N 3.18Å; M192-I203 HydrophobicContact CE-CG2 4.07Å; M192-I203 HydrophobicContact SD-CB 4.41Å; M192-I203 HydrophobicContact SD-CD1 4.31Å; M192-I203 HydrophobicContact SD-CG2 3.95Å; M192-L206 HydrophobicContact CE-CB 4.15Å; M192-L206 HydrophobicContact CE-CD1 3.56Å; M192-L206 HydrophobicContact CE-CG 3.73Å; M192-L206 HydrophobicContact CG-CD1 3.68Å; M192-L206 HydrophobicContact SD-CD1 3.55Å; M192-L206 VanDerWaalsContact SD-CD1 3.55Å; M192-L206 HydrophobicContact SD-CG 4.25Å
193	D	88.3	Confident	93.3	Very high	151 Å²	151	58.1 Å²	58.1	81%	0.807	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-31	-171.1	-59.6	-23.9	0	0	0	113.2
194	D	89.1	Confident	93.2	Very high	95 Å²	95	62.1 Å²	62.1	51%	0.508	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	39.6	177.7	-161.1	19.1	0	0	0	111.2	W80 M192	W80-D194 WeakPolarHBondContact CH2-OD2 3.36Å; M192-D194 VanDerWaalsContact C-N 3.29Å; M192-D194 PolarHBondContact O-N 3.47Å
195	F	92.4	Very high	93.2	Very high	56 Å²	56	61.5 Å²	61.5	25%	0.246	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-85.3	124.6	-175.5	175.6	-112.9	0	0	0	112.4	L62 A63 M192 P197 I203	L62-F195 HydrophobicContact CD2-CD2 3.98Å; L62-F195 HydrophobicContact CD2-CE2 3.91Å; L62-F195 HydrophobicContact CG-CD2 4.11Å; L62-F195 HydrophobicContact CG-CE2 4.38Å; A63-F195 WeakPolarHBondContact O-CA 3.47Å; M192-F195 HydrophobicContact CB-CB 3.95Å; M192-F195 VanDerWaalsContact O-CB 3.23Å; M192-F195 WeakPolarHBondContact O-CB 3.3Å; M192-F195 PolarHBondContact O-N 3.18Å; F195-P197 HydrophobicContact CE1-CB 4.17Å; F195-I203 HydrophobicContact CD2-CD1 4.22Å; F195-I203 HydrophobicContact CE1-CD1 4.17Å; F195-I203 HydrophobicContact CE2-CD1 3.42Å; F195-I203 VanDerWaalsContact CE2-CD1 3.42Å; F195-I203 HydrophobicContact CE2-CG1 4.48Å; F195-I203 HydrophobicContact CZ-CD1 3.39Å; F195-I203 HydrophobicContact CZ-CG1 4.02Å
196	T	92.8	Very high	93.2	Very high	77 Å²	77	60 Å²	60	47%	0.472	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-91.2	120.9	167.3	-58.9	0	0	0	0	110.1	A63	A63-T196 PolarHBondContact O-N 3.26Å
197	P	92.1	Very high	93.3	Very high	94 Å²	94	57.5 Å²	57.5	61%	0.61	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-65.3	141.9	-177.2	27.1	-34.4	0	0	0	112.2	F195	F195-P197 HydrophobicContact CE1-CB 4.17Å
198	N	93.2	Very high	93.4	Very high	30 Å²	30	56.3 Å²	56.3	16%	0.16	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-86.9	146.7	177.3	-172.9	40.1	0	0	0	111.9	E200 W201 K231	N198-E200 VanDerWaalsContact C-N 3.32Å; N198-E200 PolarHBondContact O-N 3.46Å; N198-W201 PolarHBondContact ND2-N 3.38Å; N198-W201 VanDerWaalsContact ND2-N 3.19Å; N198-K231 PolarHBondContact O-NZ 3.49Å
199	G	92.1	Very high	93.5	Very high	68 Å²	68	56.3 Å²	56.3	70%	0.701	33%	0.329	S	S	*	.	S	Bend	trans	-73	-22.8	-178.5	0	0	0	0	0	114.1	K231	G199-K231 WeakPolarHBondContact O-CD 3.4Å
200	E	92.1	Very high	93.5	Very high	63 Å²	63	57.5 Å²	57.5	29%	0.294	32%	0.324	S	S	.	.	S	Bend	trans	-113.2	-29.6	-174.2	-174.7	176.4	-179.5	0	0	113.8	N198 R230 K231 Y235	N198-E200 VanDerWaalsContact C-N 3.32Å; N198-E200 PolarHBondContact O-N 3.46Å; E200-R230 HydrophobicContact CG-CG 4.46Å; E200-R230 IonicContact OE1-NH1 3.73Å; E200-R230 PolarHBondContact OE1-NH1 2.92Å; E200-K231 WeakPolarHBondContact O-CB 3.38Å; E200-K231 PolarHBondContact O-N 3.31Å; E200-Y235 WeakPolarHBondContact OE1-CE2 3.42Å; E200-Y235 PolarHBondContact OE1-OH 2.99Å
201	W	95	Very high	93.4	Very high	1 Å²	1	59.6 Å²	59.6	0%	0.004	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.7	-173.2	-65.3	93.2	0	0	0	110.9	L65 V68 Q165 N198 I228 R230	L65-W201 HydrophobicContact CD2-CB 3.77Å; L65-W201 HydrophobicContact CD2-CG 4.3Å; V68-W201 HydrophobicContact CB-CZ2 4.19Å; V68-W201 HydrophobicContact CG1-CZ2 4.16Å; Q165-W201 HydrophobicContact CB-CZ3 4.35Å; Q165-W201 HydrophobicContact CG-CH2 3.58Å; Q165-W201 HydrophobicContact CG-CZ3 3.71Å; N198-W201 PolarHBondContact ND2-N 3.38Å; N198-W201 VanDerWaalsContact ND2-N 3.19Å; W201-I228 HydrophobicContact CD2-CD1 4Å; W201-I228 HydrophobicContact CE3-CB 4.06Å; W201-I228 HydrophobicContact CE3-CD1 3.69Å; W201-I228 HydrophobicContact CE3-CG1 3.73Å; W201-I228 HydrophobicContact CZ3-CD1 4.03Å; W201-I228 HydrophobicContact CZ3-CG1 3.97Å; W201-R230 HydrophobicContact CE3-CB 4.07Å; W201-R230 HydrophobicContact CH2-CB 4.17Å; W201-R230 HydrophobicContact CZ3-CB 3.82Å
202	D	94.6	Very high	93.3	Very high	72 Å²	72	61.4 Å²	61.4	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.8	168.7	-72.3	-38.8	0	0	0	110.2	I228 K229 K231	D202-I228 CarbonylContact O-C 3.6Å; D202-I228 VanDerWaalsContact O-CA 3.27Å; D202-I228 WeakPolarHBondContact O-CA 3.38Å; D202-K229 PolarHBondContact N-O 3.48Å; D202-K229 PolarHBondContact O-N 2.83Å; D202-K231 WeakPolarHBondContact OD1-CE 3.46Å; D202-K231 IonicContact OD1-NZ 3.12Å; D202-K231 PolarHBondContact OD1-NZ 3.41Å; D202-K231 WeakPolarHBondContact OD2-CE 3.42Å; D202-K231 IonicContact OD2-NZ 3.66Å
203	I	94.3	Very high	93.3	Very high	32 Å²	32	60.5 Å²	60.5	16%	0.164	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	117.6	175.9	-56.3	-178.2	0	0	0	108	L62 M192 F195 L206 I228	L62-I203 HydrophobicContact CD2-CD1 3.18Å; M192-I203 HydrophobicContact CE-CG2 4.07Å; M192-I203 HydrophobicContact SD-CB 4.41Å; M192-I203 HydrophobicContact SD-CD1 4.31Å; M192-I203 HydrophobicContact SD-CG2 3.95Å; F195-I203 HydrophobicContact CD2-CD1 4.22Å; F195-I203 HydrophobicContact CE1-CD1 4.17Å; F195-I203 HydrophobicContact CE2-CD1 3.42Å; F195-I203 VanDerWaalsContact CE2-CD1 3.42Å; F195-I203 HydrophobicContact CE2-CG1 4.48Å; F195-I203 HydrophobicContact CZ-CD1 3.39Å; F195-I203 HydrophobicContact CZ-CG1 4.02Å; I203-L206 HydrophobicContact CD1-CD1 4.49Å; I203-L206 HydrophobicContact CG2-CD1 3.97Å; I203-L206 HydrophobicContact CG2-CD2 3.66Å; I203-L206 HydrophobicContact CG2-CG 3.52Å; I203-I228 HydrophobicContact CG1-CG2 4.3Å
204	V	93.6	Very high	93.2	Very high	84 Å²	84	59.4 Å²	59.4	51%	0.509	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-47.1	179.5	-177.1	0	0	0	0	110.2	I227 K229	V204-I227 HydrophobicContact CB-CG2 4.21Å; V204-I227 WeakPolarHBondContact CB-O 3.49Å; V204-I227 PolarHBondContact N-O 3.07Å; V204-K229 HydrophobicContact CG2-CB 3.76Å
205	A	94.1	Very high	93.2	Very high	36 Å²	36	63.3 Å²	63.3	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	147.3	179.4	0	0	0	0	0	111.6	I227	A205-I227 HydrophobicContact CB-CB 4.36Å; A205-I227 HydrophobicContact CB-CD1 4.25Å; A205-I227 PolarHBondContact N-O 3.47Å; A205-I227 PolarHBondContact O-N 3.39Å
206	L	95.8	Very high	93.1	Very high	6 Å²	6	63.4 Å²	63.4	3%	0.031	36%	0.362	C	S	.	.			trans	-128.8	66.6	176	-61.8	-179.8	0	0	0	112.4	L62 T189 A190 M192 I203 D225 F226	L62-L206 HydrophobicContact CB-CD1 4.28Å; L62-L206 HydrophobicContact CD2-CD1 3.81Å; T189-L206 WeakPolarHBondContact CA-O 3.44Å; A190-L206 HydrophobicContact CB-CB 3.93Å; A190-L206 HydrophobicContact CB-CD1 4.2Å; A190-L206 PolarHBondContact N-O 3.4Å; M192-L206 HydrophobicContact CE-CB 4.15Å; M192-L206 HydrophobicContact CE-CD1 3.56Å; M192-L206 HydrophobicContact CE-CG 3.73Å; M192-L206 HydrophobicContact CG-CD1 3.68Å; M192-L206 HydrophobicContact SD-CD1 3.55Å; M192-L206 VanDerWaalsContact SD-CD1 3.55Å; M192-L206 HydrophobicContact SD-CG 4.25Å; I203-L206 HydrophobicContact CD1-CD1 4.49Å; I203-L206 HydrophobicContact CG2-CD1 3.97Å; I203-L206 HydrophobicContact CG2-CD2 3.66Å; I203-L206 HydrophobicContact CG2-CG 3.52Å; L206-D225 VanDerWaalsContact CA-O 3.32Å; L206-D225 WeakPolarHBondContact CA-O 3.4Å; L206-F226 HydrophobicContact CD2-CB 4.16Å; L206-F226 HydrophobicContact CD2-CD1 3.4Å; L206-F226 VanDerWaalsContact CD2-CD1 3.4Å; L206-F226 HydrophobicContact CD2-CD2 4.28Å; L206-F226 HydrophobicContact CD2-CE1 3.76Å; L206-F226 HydrophobicContact CD2-CG 3.7Å; L206-F226 HydrophobicContact CD2-CZ 4.32Å
207	P	97.2	Very high	92.7	Very high	28 Å²	28	64.3 Å²	64.3	18%	0.182	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-74	142.4	177.1	31.5	-33.1	0	0	0	111.3	Y224 D225	P207-Y224 WeakPolarHBondContact O-CA 3.5Å; P207-D225 WeakPolarHBondContact CD-O 3.4Å; P207-D225 HydrophobicContact CG-CB 4.01Å; P207-D225 PolarHBondContact O-N 3.04Å
208	G	96.1	Very high	92.6	Very high	12 Å²	12	61.1 Å²	61.1	12%	0.124	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.5	168.8	0	0	0	0	0	110.1	L185 P188 T223	L185-G208 VanDerWaalsContact CD2-O 3.28Å; L185-G208 WeakPolarHBondContact CD2-O 3.34Å; P188-G208 PolarHBondContact O-N 3.29Å; G208-T223 WeakPolarHBondContact CA-O 3.25Å
209	R	95.4	Very high	92.5	Very high	99 Å²	99	62.4 Å²	62.4	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.7	172.8	71.7	-178	-177.3	-72.4	3.5	111	T223 D225	R209-T223 PolarHBondContact N-O 3.25Å; R209-T223 PolarHBondContact O-N 2.94Å; R209-D225 IonicContact CZ-OD1 2.81Å; R209-D225 IonicContact CZ-OD2 2.81Å; R209-D225 IonicContact NH1-OD1 2.8Å; R209-D225 PolarHBondContact NH1-OD1 3.37Å; R209-D225 IonicContact NH1-OD2 3.87Å; R209-D225 PolarHBondContact NH1-OD2 2.97Å; R209-D225 IonicContact NH2-OD1 3.19Å
210	R	95	Very high	92.6	Very high	107 Å²	107	59.2 Å²	59.2	40%	0.404	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.4	170.3	177.4	-179.7	177.6	-100.3	4.2	108.2	H178 D182 M183 D221	H178-R210 PolarHBondContact NE2-NH2 3.12Å; D182-R210 IonicContact OD1-CZ 3.6Å; D182-R210 IonicContact OD1-NE 3.18Å; D182-R210 IonicContact OD1-NH2 3.69Å; D182-R210 PolarHBondContact OD1-NH2 3.2Å; D182-R210 IonicContact OD2-NH2 2.65Å; M183-R210 WeakPolarHBondContact O-CD 3.4Å; M183-R210 PolarHBondContact O-NE 3.43Å; R210-D221 WeakPolarHBondContact CA-O 3.4Å
211	T	93.3	Very high	92.7	Very high	51 Å²	51	56.4 Å²	56.4	31%	0.313	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.6	176.3	-30.4	0	0	0	0	109.5	D221	T211-D221 WeakPolarHBondContact CB-OD1 3.34Å; T211-D221 PolarHBondContact N-O 3.32Å; T211-D221 PolarHBondContact N-OD1 3.4Å; T211-D221 PolarHBondContact O-N 3.2Å; T211-D221 PolarHBondContact OG1-OD1 3.45Å
212	V	92.6	Very high	92.8	Very high	55 Å²	55	56.3 Å²	56.3	33%	0.333	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.8	169.3	178.3	0	0	0	0	106.5	P214 V220	V212-P214 WeakPolarHBondContact O-CD 3.47Å; V212-V220 HydrophobicContact CG2-CG2 4.36Å
213	N	89.4	Confident	92.9	Very high	53 Å²	53	52.9 Å²	52.9	28%	0.283	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.8	179.2	-171.4	-9.2	0	0	0	109.6	Q215 D216 Y219	N213-Q215 PolarHBondContact O-N 2.9Å; N213-Q215 PolarHBondContact OD1-N 3.31Å; N213-Q215 VanDerWaalsContact OD1-N 3.09Å; N213-D216 HydrophobicContact CB-CB 4.29Å; N213-D216 CarbonylContact O-C 3.55Å; N213-D216 VanDerWaalsContact O-C 3.29Å; N213-D216 PolarHBondContact O-N 2.99Å; N213-Y219 HydrophobicContact CB-CD1 3.9Å; N213-Y219 HydrophobicContact CB-CG 3.96Å
214	P	87.3	Confident	93	Very high	128 Å²	128	51.4 Å²	51.4	83%	0.831	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24.6	178.9	-22.3	34.2	0	0	0	113.8	V212	V212-P214 WeakPolarHBondContact O-CD 3.47Å
215	Q	88.5	Confident	93.2	Very high	177 Å²	177	48.1 Å²	48.1	83%	0.827	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-21.6	-178.8	-63.7	165.9	-10.3	0	0	112.5	N213	N213-Q215 PolarHBondContact O-N 2.9Å; N213-Q215 PolarHBondContact OD1-N 3.31Å; N213-Q215 VanDerWaalsContact OD1-N 3.09Å
216	D	90.1	Very high	93.3	Very high	58 Å²	58	46.5 Å²	46.5	31%	0.31	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	94.5	178.6	179.4	7.1	0	0	0	109.1	N213 S218 Y219	N213-D216 HydrophobicContact CB-CB 4.29Å; N213-D216 CarbonylContact O-C 3.55Å; N213-D216 VanDerWaalsContact O-C 3.29Å; N213-D216 PolarHBondContact O-N 2.99Å; D216-S218 VanDerWaalsContact CG-OG 3.29Å; D216-S218 PolarHBondContact O-N 3.2Å; D216-S218 VanDerWaalsContact O-N 3.09Å; D216-S218 WeakPolarHBondContact OD1-CB 3.5Å; D216-S218 PolarHBondContact OD1-N 3.37Å; D216-S218 VanDerWaalsContact OD1-N 3.11Å; D216-S218 PolarHBondContact OD1-OG 2.77Å; D216-S218 PolarHBondContact OD2-OG 2.83Å; D216-Y219 VanDerWaalsContact O-CB 3.3Å; D216-Y219 WeakPolarHBondContact O-CB 3.44Å; D216-Y219 PolarHBondContact O-N 3.39Å
217	P	84.9	Confident	93.3	Very high	96 Å²	96	48.2 Å²	48.2	62%	0.623	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	-8.2	-176.4	29.6	-35.6	0	0	0	113.3	H178	H178-P217 WeakPolarHBondContact CB-O 3.27Å
218	S	89.3	Confident	93.2	Very high	27 Å²	27	46.9 Å²	46.9	19%	0.189	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-16.7	172.7	75.9	0	0	0	0	112.7	H178 D216	H178-S218 WeakPolarHBondContact CB-O 3.36Å; H178-S218 PolarHBondContact N-O 3.15Å; D216-S218 VanDerWaalsContact CG-OG 3.29Å; D216-S218 PolarHBondContact O-N 3.2Å; D216-S218 VanDerWaalsContact O-N 3.09Å; D216-S218 WeakPolarHBondContact OD1-CB 3.5Å; D216-S218 PolarHBondContact OD1-N 3.37Å; D216-S218 VanDerWaalsContact OD1-N 3.11Å; D216-S218 PolarHBondContact OD1-OG 2.77Å; D216-S218 PolarHBondContact OD2-OG 2.83Å
219	Y	91.4	Very high	93.1	Very high	58 Å²	58	50.5 Å²	50.5	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	118.7	-171.2	-170	-81.1	0	0	0	112.1	R172 N213 D216 D221	R172-Y219 VanDerWaalsContact NH1-CE2 3.29Å; N213-Y219 HydrophobicContact CB-CD1 3.9Å; N213-Y219 HydrophobicContact CB-CG 3.96Å; D216-Y219 VanDerWaalsContact O-CB 3.3Å; D216-Y219 WeakPolarHBondContact O-CB 3.44Å; D216-Y219 PolarHBondContact O-N 3.39Å; Y219-D221 HydrophobicContact CE1-CB 4.1Å; Y219-D221 PolarHBondContact OH-OD2 3.18Å
220	V	93.9	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.9	166	58.2	0	0	0	0	108.8	R172 H178 M183 V212	R172-V220 WeakPolarHBondContact CD-O 3.21Å; R172-V220 WeakPolarHBondContact CG-O 3.48Å; H178-V220 HydrophobicContact CB-CB 3.98Å; H178-V220 HydrophobicContact CB-CG1 3.7Å; M183-V220 HydrophobicContact CB-CG2 4.15Å; M183-V220 HydrophobicContact CE-CB 4.18Å; M183-V220 HydrophobicContact CE-CG1 3.59Å; M183-V220 HydrophobicContact CE-CG2 4.07Å; M183-V220 WeakPolarHBondContact CE-O 3.29Å; V212-V220 HydrophobicContact CG2-CG2 4.36Å
221	D	94.7	Very high	92.9	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158.8	171.1	84.5	-4.9	0	0	0	111.5	R172 R210 T211 Y219 T223	R172-D221 HydrophobicContact CB-CB 4.3Å; R210-D221 WeakPolarHBondContact CA-O 3.4Å; T211-D221 WeakPolarHBondContact CB-OD1 3.34Å; T211-D221 PolarHBondContact N-O 3.32Å; T211-D221 PolarHBondContact N-OD1 3.4Å; T211-D221 PolarHBondContact O-N 3.2Å; T211-D221 PolarHBondContact OG1-OD1 3.45Å; Y219-D221 HydrophobicContact CE1-CB 4.1Å; Y219-D221 PolarHBondContact OH-OD2 3.18Å; D221-T223 PolarHBondContact OD2-OG1 3.03Å
222	V	96.6	Very high	92.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.3	167.1	176.3	0	0	0	0	107.4	L58 F171 M183 L185 Y224	L58-V222 HydrophobicContact CD1-CB 4.19Å; L58-V222 HydrophobicContact CD1-CG2 3.88Å; F171-V222 PolarHBondContact N-O 3.26Å; F171-V222 PolarHBondContact O-N 2.95Å; M183-V222 HydrophobicContact CB-CG2 3.88Å; L185-V222 HydrophobicContact CD1-CG1 3.96Å; V222-Y224 HydrophobicContact CG1-CD2 4.33Å; V222-Y224 HydrophobicContact CG1-CE2 3.75Å
223	T	96.6	Very high	92.7	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.9	-179.4	-59.1	0	0	0	0	110.4	T168 L169 K170 G208 R209 D221	T168-T223 HydrophobicContact CG2-CG2 4.34Å; L169-T223 VanDerWaalsContact O-CA 3.3Å; L169-T223 WeakPolarHBondContact O-CA 3.41Å; K170-T223 HydrophobicContact CG-CG2 3.99Å; G208-T223 WeakPolarHBondContact CA-O 3.25Å; R209-T223 PolarHBondContact N-O 3.25Å; R209-T223 PolarHBondContact O-N 2.94Å; D221-T223 PolarHBondContact OD2-OG1 3.03Å
224	Y	97.4	Very high	92.8	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.7	167.8	-69.6	-89.4	0	0	0	109.6	Q59 L60 T168 L169 F171 L185 A190 P207 V222	Q59-Y224 WeakPolarHBondContact CA-OH 3.4Å; L60-Y224 HydrophobicContact CB-CD1 4.02Å; L60-Y224 HydrophobicContact CB-CD2 3.98Å; L60-Y224 HydrophobicContact CB-CE1 3.63Å; L60-Y224 HydrophobicContact CB-CE2 3.61Å; L60-Y224 HydrophobicContact CB-CG 4.16Å; L60-Y224 VanDerWaalsContact CB-CZ 3.41Å; L60-Y224 HydrophobicContact CD2-CD1 4.15Å; L60-Y224 HydrophobicContact CD2-CD2 4.2Å; L60-Y224 HydrophobicContact CD2-CG 3.91Å; L60-Y224 HydrophobicContact CG-CD2 4.47Å; L60-Y224 PolarHBondContact N-OH 3.09Å; T168-Y224 CarbonylContact C-O 3.57Å; T168-Y224 WeakPolarHBondContact CA-O 3.42Å; L169-Y224 PolarHBondContact N-O 3.22Å; L169-Y224 PolarHBondContact O-N 3.29Å; F171-Y224 AromaticContact CD2-CD2 3.96Å; F171-Y224 HydrophobicContact CD2-CD2 3.96Å; F171-Y224 HydrophobicContact CD2-CE2 4.27Å; F171-Y224 AromaticContact CE2-CD2 3.96Å; F171-Y224 HydrophobicContact CE2-CD2 3.96Å; F171-Y224 HydrophobicContact CE2-CE2 4.43Å; L185-Y224 HydrophobicContact CD1-CE1 4.02Å; L185-Y224 HydrophobicContact CD1-CE2 4.45Å; L185-Y224 WeakPolarHBondContact CD1-OH 3.43Å; A190-Y224 HydrophobicContact CB-CD1 3.94Å; A190-Y224 HydrophobicContact CB-CE1 4.07Å; P207-Y224 WeakPolarHBondContact O-CA 3.5Å; V222-Y224 HydrophobicContact CG1-CD2 4.33Å; V222-Y224 HydrophobicContact CG1-CE2 3.75Å
225	D	96.8	Very high	93	Very high	15 Å²	15	45.5 Å²	45.5	8%	0.08	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.4	174.6	-58.9	-42.3	0	0	0	110.5	C167 T168 L206 P207 R209	C167-D225 CarbonylContact O-C 3.56Å; T168-D225 WeakPolarHBondContact CG2-OD1 3.32Å; L206-D225 VanDerWaalsContact CA-O 3.32Å; L206-D225 WeakPolarHBondContact CA-O 3.4Å; P207-D225 WeakPolarHBondContact CD-O 3.4Å; P207-D225 HydrophobicContact CG-CB 4.01Å; P207-D225 PolarHBondContact O-N 3.04Å; R209-D225 IonicContact CZ-OD1 2.81Å; R209-D225 IonicContact CZ-OD2 2.81Å; R209-D225 IonicContact NH1-OD1 2.8Å; R209-D225 PolarHBondContact NH1-OD1 3.37Å; R209-D225 IonicContact NH1-OD2 3.87Å; R209-D225 PolarHBondContact NH1-OD2 2.97Å; R209-D225 IonicContact NH2-OD1 3.19Å
226	F	96.5	Very high	92.9	Very high	1 Å²	1	39 Å²	39	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	93.7	178.3	-75.3	-109.2	0	0	0	107.6	L60 L62 M75 T77 N166 C167 L169 L206 I228	L60-F226 HydrophobicContact CD2-CE2 4.24Å; L60-F226 HydrophobicContact CD2-CZ 3.9Å; L62-F226 HydrophobicContact CD1-CE1 3.99Å; L62-F226 HydrophobicContact CD1-CZ 4.49Å; L62-F226 HydrophobicContact CD2-CE1 3.98Å; M75-F226 HydrophobicContact CE-CB 4.33Å; M75-F226 HydrophobicContact CE-CD2 4.32Å; M75-F226 HydrophobicContact CE-CG 4.21Å; M75-F226 HydrophobicContact SD-CB 4.23Å; M75-F226 HydrophobicContact SD-CD1 4.37Å; M75-F226 HydrophobicContact SD-CG 4.28Å; T77-F226 HydrophobicContact CG2-CE1 4.12Å; N166-F226 WeakPolarHBondContact CA-O 3.34Å; C167-F226 HydrophobicContact CB-CB 4.21Å; C167-F226 PolarHBondContact N-O 3.44Å; C167-F226 WeakPolarHBondContact O-CA 3.47Å; C167-F226 WeakPolarHBondContact O-CB 3.4Å; C167-F226 PolarHBondContact O-N 3.25Å; L169-F226 HydrophobicContact CB-CE2 4.29Å; L169-F226 HydrophobicContact CD1-CD2 4.47Å; L169-F226 HydrophobicContact CD1-CE2 3.44Å; L169-F226 VanDerWaalsContact CD1-CE2 3.44Å; L169-F226 HydrophobicContact CD1-CZ 3.62Å; L169-F226 HydrophobicContact CG-CD2 4.23Å; L169-F226 HydrophobicContact CG-CE2 3.61Å; L169-F226 HydrophobicContact CG-CZ 4.25Å; L206-F226 HydrophobicContact CD2-CB 4.16Å; L206-F226 HydrophobicContact CD2-CD1 3.4Å; L206-F226 VanDerWaalsContact CD2-CD1 3.4Å; L206-F226 HydrophobicContact CD2-CD2 4.28Å; L206-F226 HydrophobicContact CD2-CE1 3.76Å; L206-F226 HydrophobicContact CD2-CG 3.7Å; L206-F226 HydrophobicContact CD2-CZ 4.32Å; F226-I228 HydrophobicContact CB-CG2 4.42Å; F226-I228 PolarHBondContact O-N 3.12Å
227	I	96.1	Very high	93	Very high	43 Å²	43	40.4 Å²	40.4	22%	0.221	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	102.2	174.2	-53	-179.8	0	0	0	107.1	Q165 V204 A205	Q165-I227 WeakPolarHBondContact O-CA 3.35Å; V204-I227 HydrophobicContact CB-CG2 4.21Å; V204-I227 WeakPolarHBondContact CB-O 3.49Å; V204-I227 PolarHBondContact N-O 3.07Å; A205-I227 HydrophobicContact CB-CB 4.36Å; A205-I227 HydrophobicContact CB-CD1 4.25Å; A205-I227 PolarHBondContact N-O 3.47Å; A205-I227 PolarHBondContact O-N 3.39Å
228	I	95.4	Very high	93.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145	-174.6	61	177.9	0	0	0	111	L65 V68 Q164 Q165 W201 D202 I203 F226	L65-I228 HydrophobicContact CD2-CD1 4.49Å; L65-I228 HydrophobicContact CD2-CG2 4.36Å; V68-I228 HydrophobicContact CG2-CD1 3.8Å; Q164-I228 CarbonylContact C-O 3.56Å; Q164-I228 WeakPolarHBondContact CA-O 3.48Å; Q165-I228 HydrophobicContact CB-CD1 4.2Å; Q165-I228 HydrophobicContact CB-CG1 3.77Å; Q165-I228 PolarHBondContact N-O 3.48Å; Q165-I228 PolarHBondContact O-N 2.89Å; W201-I228 HydrophobicContact CD2-CD1 4Å; W201-I228 HydrophobicContact CE3-CB 4.06Å; W201-I228 HydrophobicContact CE3-CD1 3.69Å; W201-I228 HydrophobicContact CE3-CG1 3.73Å; W201-I228 HydrophobicContact CZ3-CD1 4.03Å; W201-I228 HydrophobicContact CZ3-CG1 3.97Å; D202-I228 CarbonylContact O-C 3.6Å; D202-I228 VanDerWaalsContact O-CA 3.27Å; D202-I228 WeakPolarHBondContact O-CA 3.38Å; I203-I228 HydrophobicContact CG1-CG2 4.3Å; F226-I228 HydrophobicContact CB-CG2 4.42Å; F226-I228 PolarHBondContact O-N 3.12Å
229	K	94.1	Very high	93.1	Very high	87 Å²	87	38.9 Å²	38.9	38%	0.378	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.8	179.2	-175.4	174.9	-178.3	174.1	0	110	Q164 D202 V204	Q164-K229 HydrophobicContact CG-CB 4.14Å; Q164-K229 HydrophobicContact CG-CD 4.46Å; Q164-K229 HydrophobicContact CG-CG 4.06Å; D202-K229 PolarHBondContact N-O 3.48Å; D202-K229 PolarHBondContact O-N 2.83Å; V204-K229 HydrophobicContact CG2-CB 3.76Å
230	R	93.8	Very high	92.8	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.023	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	143.8	179	-167.1	-174.5	-59	-90.8	-0.2	111.8	E70 P161 D163 E200 W201 P232	E70-R230 IonicContact OE1-CZ 3.09Å; E70-R230 IonicContact OE1-NH1 2.67Å; E70-R230 PolarHBondContact OE1-NH1 3.46Å; E70-R230 IonicContact OE1-NH2 3.14Å; E70-R230 PolarHBondContact OE1-NH2 3.47Å; P161-R230 WeakPolarHBondContact O-CD 3.4Å; D163-R230 PolarHBondContact O-N 3.32Å; D163-R230 IonicContact OD1-CZ 3.79Å; D163-R230 IonicContact OD1-NE 3.59Å; D163-R230 PolarHBondContact OD1-NE 2.96Å; D163-R230 IonicContact OD1-NH2 3.91Å; D163-R230 IonicContact OD2-CZ 3.63Å; D163-R230 IonicContact OD2-NE 2.69Å; D163-R230 IonicContact OD2-NH2 2.65Å; D163-R230 PolarHBondContact OD2-NH2 2.88Å; E200-R230 HydrophobicContact CG-CG 4.46Å; E200-R230 IonicContact OE1-NH1 3.73Å; E200-R230 PolarHBondContact OE1-NH1 2.92Å; W201-R230 HydrophobicContact CE3-CB 4.07Å; W201-R230 HydrophobicContact CH2-CB 4.17Å; W201-R230 HydrophobicContact CZ3-CB 3.82Å; R230-P232 WeakPolarHBondContact O-CD 3.34Å
231	K	92.8	Very high	92.5	Very high	70 Å²	70	41.4 Å²	41.4	30%	0.304	21%	0.206	S	C	.	.			trans	-84.3	107	163.5	-67.6	174.9	-179.4	161.2	0	109.3	N198 G199 E200 D202 L233	N198-K231 PolarHBondContact O-NZ 3.49Å; G199-K231 WeakPolarHBondContact O-CD 3.4Å; E200-K231 WeakPolarHBondContact O-CB 3.38Å; E200-K231 PolarHBondContact O-N 3.31Å; D202-K231 WeakPolarHBondContact OD1-CE 3.46Å; D202-K231 IonicContact OD1-NZ 3.12Å; D202-K231 PolarHBondContact OD1-NZ 3.41Å; D202-K231 WeakPolarHBondContact OD2-CE 3.42Å; D202-K231 IonicContact OD2-NZ 3.66Å; K231-L233 VanDerWaalsContact C-N 3.31Å; K231-L233 PolarHBondContact O-N 2.85Å
232	P	91	Very high	92.3	Very high	41 Å²	41	42.9 Å²	42.9	27%	0.266	22%	0.216	S	C	.	.			trans	-81.8	-3.4	-166.5	33.2	-38.2	0	0	0	114.5	P161 F162 R230 F234 Y235 T236	P161-P232 HydrophobicContact CB-CB 4.48Å; P161-P232 HydrophobicContact CG-CB 4.28Å; F162-P232 HydrophobicContact CD1-CB 3.62Å; F162-P232 HydrophobicContact CD1-CG 3.76Å; F162-P232 HydrophobicContact CE1-CB 3.5Å; F162-P232 VanDerWaalsContact CE1-CB 3.5Å; F162-P232 HydrophobicContact CE1-CG 3.65Å; F162-P232 HydrophobicContact CZ-CB 4.36Å; R230-P232 WeakPolarHBondContact O-CD 3.34Å; P232-F234 PolarHBondContact O-N 2.98Å; P232-Y235 PolarHBondContact O-N 2.85Å; P232-T236 WeakPolarHBondContact O-CB 3.38Å; P232-T236 PolarHBondContact O-N 3.19Å; P232-T236 PolarHBondContact O-OG1 2.95Å
233	L	90.6	Very high	91.8	Very high	121 Å²	121	43 Å²	43	63%	0.634	22%	0.217	S	C	*	.	H	α-helix	trans	-59.3	-45.8	-165.6	-171.4	153	0	0	0	112.7	K231 Y235 T236 I237	K231-L233 VanDerWaalsContact C-N 3.31Å; K231-L233 PolarHBondContact O-N 2.85Å; L233-Y235 PolarHBondContact O-N 3.46Å; L233-T236 PolarHBondContact O-N 3.35Å; L233-I237 HydrophobicContact CD2-CD1 3.6Å; L233-I237 HydrophobicContact CD2-CG1 4.46Å; L233-I237 HydrophobicContact CG-CD1 4.26Å; L233-I237 PolarHBondContact O-N 3.22Å
234	F	91.9	Very high	91.3	Very high	128 Å²	128	46.4 Å²	46.4	56%	0.561	24%	0.238	S	C	*	.	H	α-helix	trans	-58.5	-48.3	178.9	177.5	-95.8	0	0	0	112	P232 N238	P232-F234 PolarHBondContact O-N 2.98Å; F234-N238 VanDerWaalsContact CD2-ND2 3.33Å; F234-N238 WeakPolarHBondContact CD2-ND2 3.47Å; F234-N238 WeakPolarHBondContact CE2-ND2 3.37Å; F234-N238 WeakPolarHBondContact O-CB 3.48Å; F234-N238 PolarHBondContact O-N 3.48Å; F234-N238 PolarHBondContact O-ND2 3.16Å
235	Y	90	Very high	90.9	Very high	22 Å²	22	51.1 Å²	51.1	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-70.4	-32.9	179.4	-64.3	-78.6	0	0	0	112.4	F160 P161 E200 P232 L233 L239 I240 I284	F160-Y235 HydrophobicContact CE1-CD1 4.13Å; F160-Y235 HydrophobicContact CE1-CE1 4.49Å; F160-Y235 HydrophobicContact CE2-CE1 4.34Å; F160-Y235 AromaticContact CZ-CD1 3.6Å; F160-Y235 HydrophobicContact CZ-CD1 3.6Å; F160-Y235 AromaticContact CZ-CE1 3.59Å; F160-Y235 HydrophobicContact CZ-CE1 3.59Å; F160-Y235 HydrophobicContact CZ-CG 4.16Å; P161-Y235 HydrophobicContact CB-CD2 4.03Å; P161-Y235 HydrophobicContact CB-CG 3.88Å; E200-Y235 WeakPolarHBondContact OE1-CE2 3.42Å; E200-Y235 PolarHBondContact OE1-OH 2.99Å; P232-Y235 PolarHBondContact O-N 2.85Å; L233-Y235 PolarHBondContact O-N 3.46Å; Y235-L239 HydrophobicContact CD1-CD1 3.74Å; Y235-L239 HydrophobicContact CE1-CD1 4.47Å; Y235-L239 WeakPolarHBondContact O-CA 3.25Å; Y235-L239 WeakPolarHBondContact O-CB 3.49Å; Y235-L239 PolarHBondContact O-N 3.04Å; Y235-I240 PolarHBondContact O-N 3.23Å; Y235-I240 VanDerWaalsContact O-N 3.12Å; Y235-I284 HydrophobicContact CE1-CD1 4.44Å; Y235-I284 HydrophobicContact CE1-CG2 4.31Å
236	T	88.1	Confident	90.5	Very high	40 Å²	40	51.4 Å²	51.4	25%	0.245	26%	0.264	C	S	.	.	I	π-helix	trans	-64.2	-47.7	177.2	-56.8	0	0	0	0	110.8	P232 L233 I240 I241	P232-T236 WeakPolarHBondContact O-CB 3.38Å; P232-T236 PolarHBondContact O-N 3.19Å; P232-T236 PolarHBondContact O-OG1 2.95Å; L233-T236 PolarHBondContact O-N 3.35Å; T236-I240 WeakPolarHBondContact O-CB 3.36Å; T236-I240 PolarHBondContact O-N 3.14Å; T236-I241 WeakPolarHBondContact O-CG1 3.45Å; T236-I241 PolarHBondContact O-N 3.22Å
237	I	91.6	Very high	90	Very high	88 Å²	88	51.8 Å²	51.8	45%	0.451	27%	0.266	S	S	.	.	I	π-helix	trans	-72.3	-43.4	-179.1	-64.3	176.8	0	0	0	111.7	L233 I241 P242	L233-I237 HydrophobicContact CD2-CD1 3.6Å; L233-I237 HydrophobicContact CD2-CG1 4.46Å; L233-I237 HydrophobicContact CG-CD1 4.26Å; L233-I237 PolarHBondContact O-N 3.22Å; I237-I241 HydrophobicContact CG1-CD1 4.47Å; I237-P242 VanDerWaalsContact O-CD 3.25Å; I237-P242 WeakPolarHBondContact O-CD 3.27Å
238	N	88.6	Confident	89.5	Confident	78 Å²	78	52.6 Å²	52.6	42%	0.417	28%	0.276	S	S	.	.	I	π-helix	trans	-92.4	-20.9	-169.8	-65.1	-35.2	0	0	0	114.6	F234	F234-N238 VanDerWaalsContact CD2-ND2 3.33Å; F234-N238 WeakPolarHBondContact CD2-ND2 3.47Å; F234-N238 WeakPolarHBondContact CE2-ND2 3.37Å; F234-N238 WeakPolarHBondContact O-CB 3.48Å; F234-N238 PolarHBondContact O-N 3.48Å; F234-N238 PolarHBondContact O-ND2 3.16Å
239	L	86.9	Confident	89.2	Confident	13 Å²	13	56 Å²	56	7%	0.068	29%	0.294	C	S	.	.	I	π-helix	trans	-115.1	-51	176.1	-78.9	106.8	0	0	0	113.1	Y235 C243 L280 I281	Y235-L239 HydrophobicContact CD1-CD1 3.74Å; Y235-L239 HydrophobicContact CE1-CD1 4.47Å; Y235-L239 WeakPolarHBondContact O-CA 3.25Å; Y235-L239 WeakPolarHBondContact O-CB 3.49Å; Y235-L239 PolarHBondContact O-N 3.04Å; L239-C243 VanDerWaalsContact O-CB 3.22Å; L239-C243 WeakPolarHBondContact O-CB 3.37Å; L239-C243 PolarHBondContact O-N 3.27Å; L239-L280 HydrophobicContact CD1-CD2 4.19Å; L239-L280 HydrophobicContact CD2-CD2 3.54Å; L239-L280 HydrophobicContact CG-CD2 4.03Å; L239-I281 HydrophobicContact CD2-CD1 4.17Å
240	I	85.8	Confident	88.8	Confident	26 Å²	26	52.4 Å²	52.4	13%	0.133	28%	0.28	C	S	.	.	I	π-helix	trans	-69.4	-50.8	-171.3	-58	-178.6	0	0	0	111.1	P161 F162 Y235 T236 C243 V244	P161-I240 HydrophobicContact CG-CD1 4.13Å; F162-I240 HydrophobicContact CE2-CD1 3.85Å; F162-I240 HydrophobicContact CZ-CD1 3.96Å; Y235-I240 PolarHBondContact O-N 3.23Å; Y235-I240 VanDerWaalsContact O-N 3.12Å; T236-I240 WeakPolarHBondContact O-CB 3.36Å; T236-I240 PolarHBondContact O-N 3.14Å; I240-C243 PolarHBondContact O-N 3.4Å; I240-V244 HydrophobicContact CG2-CG2 4.32Å; I240-V244 WeakPolarHBondContact O-CG2 3.45Å; I240-V244 PolarHBondContact O-N 3.22Å
241	I	87.8	Confident	88.5	Confident	85 Å²	85	53.7 Å²	53.7	44%	0.436	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-51.2	-178	-67.4	176.4	0	0	0	112.1	T236 I237 C243 V244 L245	T236-I241 WeakPolarHBondContact O-CG1 3.45Å; T236-I241 PolarHBondContact O-N 3.22Å; I237-I241 HydrophobicContact CG1-CD1 4.47Å; I241-C243 VanDerWaalsContact C-N 3.3Å; I241-C243 PolarHBondContact O-N 3.1Å; I241-V244 PolarHBondContact O-N 3.26Å; I241-L245 HydrophobicContact CG2-CD1 4.02Å; I241-L245 HydrophobicContact CG2-CG 4.48Å; I241-L245 WeakPolarHBondContact O-CG 3.47Å; I241-L245 PolarHBondContact O-N 2.69Å
242	P	90.3	Very high	88.3	Confident	35 Å²	35	54.9 Å²	54.9	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-39.1	176.7	-27	36.1	0	0	0	113.1	I237 L245 I246 F277	I237-P242 VanDerWaalsContact O-CD 3.25Å; I237-P242 WeakPolarHBondContact O-CD 3.27Å; P242-L245 PolarHBondContact O-N 3.23Å; P242-I246 WeakPolarHBondContact O-CD1 3.46Å; P242-I246 VanDerWaalsContact O-CG1 3.25Å; P242-I246 WeakPolarHBondContact O-CG1 3.42Å; P242-I246 PolarHBondContact O-N 3.17Å; P242-F277 HydrophobicContact CB-CE1 4.03Å; P242-F277 HydrophobicContact CB-CE2 4.39Å; P242-F277 HydrophobicContact CB-CZ 3.58Å; P242-F277 HydrophobicContact CG-CZ 4.46Å
243	C	86.2	Confident	88.3	Confident	4 Å²	4	53 Å²	53	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-43.9	177.9	-171.5	0	0	0	0	111.8	L239 I240 I241 I246 T247 Y298 L299	L239-C243 VanDerWaalsContact O-CB 3.22Å; L239-C243 WeakPolarHBondContact O-CB 3.37Å; L239-C243 PolarHBondContact O-N 3.27Å; I240-C243 PolarHBondContact O-N 3.4Å; I241-C243 VanDerWaalsContact C-N 3.3Å; I241-C243 PolarHBondContact O-N 3.1Å; C243-I246 PolarHBondContact O-N 2.85Å; C243-T247 WeakPolarHBondContact O-CG2 3.43Å; C243-T247 PolarHBondContact O-N 3.24Å; C243-T247 PolarHBondContact O-OG1 3.02Å; C243-Y298 VanDerWaalsContact SG-CE1 3.51Å; C243-L299 WeakPolarHBondContact SG-CD2 3.49Å
244	V	85.8	Confident	88.2	Confident	70 Å²	70	47.2 Å²	47.2	42%	0.424	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176.5	173.4	0	0	0	0	110.9	I240 I241 I246 T247 S248	I240-V244 HydrophobicContact CG2-CG2 4.32Å; I240-V244 WeakPolarHBondContact O-CG2 3.45Å; I240-V244 PolarHBondContact O-N 3.22Å; I241-V244 PolarHBondContact O-N 3.26Å; V244-I246 PolarHBondContact O-N 3.45Å; V244-T247 WeakPolarHBondContact CA-OG1 3.36Å; V244-T247 PolarHBondContact O-N 2.57Å; V244-T247 PolarHBondContact O-OG1 3.05Å; V244-S248 PolarHBondContact O-N 3.01Å
245	L	89.1	Confident	88.1	Confident	100 Å²	100	48 Å²	48	52%	0.524	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-45.4	176.8	-70.5	172.1	0	0	0	111.9	I241 P242 T247 S248 L249	I241-L245 HydrophobicContact CG2-CD1 4.02Å; I241-L245 HydrophobicContact CG2-CG 4.48Å; I241-L245 WeakPolarHBondContact O-CG 3.47Å; I241-L245 PolarHBondContact O-N 2.69Å; P242-L245 PolarHBondContact O-N 3.23Å; L245-T247 VanDerWaalsContact C-N 3.3Å; L245-T247 PolarHBondContact O-N 3.49Å; L245-S248 WeakPolarHBondContact O-CB 3.41Å; L245-S248 PolarHBondContact O-N 3.2Å; L245-S248 VanDerWaalsContact O-N 3.09Å; L245-S248 PolarHBondContact O-OG 3.09Å; L245-L249 PolarHBondContact O-N 3.41Å
246	I	88.7	Confident	88.1	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.108	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-39.7	177.4	-68.9	164.8	0	0	0	111.2	P242 C243 V244 S248 L249 A250 V270 A273 L274 F277	P242-I246 WeakPolarHBondContact O-CD1 3.46Å; P242-I246 VanDerWaalsContact O-CG1 3.25Å; P242-I246 WeakPolarHBondContact O-CG1 3.42Å; P242-I246 PolarHBondContact O-N 3.17Å; C243-I246 PolarHBondContact O-N 2.85Å; V244-I246 PolarHBondContact O-N 3.45Å; I246-S248 VanDerWaalsContact C-N 3.29Å; I246-S248 PolarHBondContact O-N 2.63Å; I246-L249 WeakPolarHBondContact O-CB 3.43Å; I246-L249 PolarHBondContact O-N 3.45Å; I246-A250 PolarHBondContact O-N 3.34Å; I246-A250 VanDerWaalsContact O-N 3.09Å; I246-V270 HydrophobicContact CG2-CG1 3.91Å; I246-A273 HydrophobicContact CD1-CB 3.99Å; I246-L274 HydrophobicContact CG2-CD2 3.73Å; I246-L274 HydrophobicContact CG2-CG 3.79Å; I246-F277 HydrophobicContact CD1-CD2 3.6Å; I246-F277 HydrophobicContact CD1-CE2 3.28Å; I246-F277 HydrophobicContact CD1-CZ 4.24Å
247	T	84.3	Confident	88.1	Confident	10 Å²	10	50.8 Å²	50.8	6%	0.061	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-31.9	175.9	53.6	0	0	0	0	112.9	C243 V244 L245 A250 Y298 T302	C243-T247 WeakPolarHBondContact O-CG2 3.43Å; C243-T247 PolarHBondContact O-N 3.24Å; C243-T247 PolarHBondContact O-OG1 3.02Å; V244-T247 WeakPolarHBondContact CA-OG1 3.36Å; V244-T247 PolarHBondContact O-N 2.57Å; V244-T247 PolarHBondContact O-OG1 3.05Å; L245-T247 VanDerWaalsContact C-N 3.3Å; L245-T247 PolarHBondContact O-N 3.49Å; T247-A250 WeakPolarHBondContact O-CB 3.32Å; T247-A250 PolarHBondContact O-N 3.26Å; T247-Y298 HydrophobicContact CG2-CE1 4.06Å; T247-Y298 WeakPolarHBondContact CG2-OH 3.27Å; T247-Y298 PolarHBondContact OG1-OH 3.19Å; T247-T302 HydrophobicContact CG2-CG2 3.31Å
248	S	86.9	Confident	87.9	Confident	59 Å²	59	47.1 Å²	47.1	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-68.4	-37.9	172.6	77.8	0	0	0	0	112.3	V244 L245 I246 A250 I251 L252	V244-S248 PolarHBondContact O-N 3.01Å; L245-S248 WeakPolarHBondContact O-CB 3.41Å; L245-S248 PolarHBondContact O-N 3.2Å; L245-S248 VanDerWaalsContact O-N 3.09Å; L245-S248 PolarHBondContact O-OG 3.09Å; I246-S248 VanDerWaalsContact C-N 3.29Å; I246-S248 PolarHBondContact O-N 2.63Å; S248-A250 VanDerWaalsContact C-N 3.31Å; S248-A250 PolarHBondContact O-N 3.23Å; S248-I251 PolarHBondContact O-N 3.43Å; S248-L252 PolarHBondContact O-N 3.13Å; S248-L252 VanDerWaalsContact O-N 3.13Å
249	L	88.9	Confident	87.9	Confident	72 Å²	72	48.3 Å²	48.3	38%	0.377	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-35.9	175.9	-67.8	175.1	0	0	0	112	L245 I246 I251 L252 V253 V270	L245-L249 PolarHBondContact O-N 3.41Å; I246-L249 WeakPolarHBondContact O-CB 3.43Å; I246-L249 PolarHBondContact O-N 3.45Å; L249-I251 VanDerWaalsContact C-N 3.27Å; L249-I251 PolarHBondContact O-N 3.19Å; L249-L252 HydrophobicContact CD2-CD2 4.31Å; L249-L252 WeakPolarHBondContact O-CB 3.36Å; L249-L252 PolarHBondContact O-N 3.21Å; L249-V253 PolarHBondContact O-N 3.36Å; L249-V270 HydrophobicContact CB-CG2 4.1Å
250	A	84.7	Confident	87.8	Confident	11 Å²	11	51.3 Å²	51.3	9%	0.091	28%	0.282	C	S	.	.	H	α-helix	trans	-58.5	-38.3	175.3	0	0	0	0	0	112.9	I246 T247 S248 V270 V306	I246-A250 PolarHBondContact O-N 3.34Å; I246-A250 VanDerWaalsContact O-N 3.09Å; T247-A250 WeakPolarHBondContact O-CB 3.32Å; T247-A250 PolarHBondContact O-N 3.26Å; S248-A250 VanDerWaalsContact C-N 3.31Å; S248-A250 PolarHBondContact O-N 3.23Å; A250-V270 HydrophobicContact CB-CG1 4.02Å; A250-V306 HydrophobicContact CB-CG2 3.67Å
251	I	88.5	Confident	87.8	Confident	34 Å²	34	52.6 Å²	52.6	17%	0.174	30%	0.301	C	S	.	.	H	α-helix	trans	-73.9	-38.9	177.6	-59.6	170.3	0	0	0	110.5	S248 L249 V253 F254 V461 C464	S248-I251 PolarHBondContact O-N 3.43Å; L249-I251 VanDerWaalsContact C-N 3.27Å; L249-I251 PolarHBondContact O-N 3.19Å; I251-V253 PolarHBondContact O-N 3.15Å; I251-V253 VanDerWaalsContact O-N 3.15Å; I251-F254 PolarHBondContact O-N 3.4Å; I251-V461 HydrophobicContact CG2-CG2 3.42Å; I251-V461 VanDerWaalsContact CG2-CG2 3.42Å; I251-C464 HydrophobicContact CD1-CB 3.79Å; I251-C464 HydrophobicContact CG1-CB 4.46Å
252	L	89.1	Confident	87.8	Confident	94 Å²	94	53.9 Å²	53.9	49%	0.492	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-23.2	-178.3	-168.1	67.1	0	0	0	113	S248 L249 F254 Y255	S248-L252 PolarHBondContact O-N 3.13Å; S248-L252 VanDerWaalsContact O-N 3.13Å; L249-L252 HydrophobicContact CD2-CD2 4.31Å; L249-L252 WeakPolarHBondContact O-CB 3.36Å; L249-L252 PolarHBondContact O-N 3.21Å; L252-F254 PolarHBondContact O-N 2.9Å; L252-Y255 VanDerWaalsContact O-CB 3.29Å; L252-Y255 WeakPolarHBondContact O-CB 3.44Å; L252-Y255 PolarHBondContact O-N 3.09Å
253	V	89.4	Confident	87.7	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-51.9	-41.2	174	175.5	0	0	0	0	112.3	L249 I251 Y255 L256 K263 L266 C267	L249-V253 PolarHBondContact O-N 3.36Å; I251-V253 PolarHBondContact O-N 3.15Å; I251-V253 VanDerWaalsContact O-N 3.15Å; V253-Y255 PolarHBondContact O-N 3.25Å; V253-L256 PolarHBondContact O-N 2.87Å; V253-K263 HydrophobicContact CG1-CG 3.76Å; V253-L266 HydrophobicContact CG2-CD2 3.72Å; V253-L266 HydrophobicContact CG2-CG 3.9Å; V253-C267 VanDerWaalsContact CG1-SG 3.5Å
254	F	88.8	Confident	87.9	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-75.3	-5	-179.4	-62.3	-75.6	0	0	0	113.5	I251 L252 S309 T312 D453 F456 L457 F460	I251-F254 PolarHBondContact O-N 3.4Å; L252-F254 PolarHBondContact O-N 2.9Å; F254-S309 VanDerWaalsContact CE2-OG 3.25Å; F254-S309 WeakPolarHBondContact CE2-OG 3.49Å; F254-S309 WeakPolarHBondContact CZ-OG 3.44Å; F254-T312 HydrophobicContact CE1-CG2 3.98Å; F254-D453 WeakPolarHBondContact CD1-OD1 3.41Å; F254-D453 VanDerWaalsContact O-OD2 3.05Å; F254-F456 HydrophobicContact CD1-CB 4.18Å; F254-F456 HydrophobicContact CE1-CB 3.97Å; F254-F456 HydrophobicContact CZ-CB 4.48Å; F254-L457 HydrophobicContact CB-CB 3.74Å; F254-L457 HydrophobicContact CB-CD1 4.15Å; F254-L457 HydrophobicContact CB-CG 4.16Å; F254-F460 HydrophobicContact CD2-CB 4.46Å; F254-F460 HydrophobicContact CD2-CD2 4.3Å; F254-F460 HydrophobicContact CD2-CG 4.49Å; F254-F460 HydrophobicContact CE1-CD2 4.26Å; F254-F460 HydrophobicContact CE1-CE2 4.26Å; F254-F460 HydrophobicContact CE2-CB 4.03Å; F254-F460 HydrophobicContact CE2-CD1 4.26Å; F254-F460 AromaticContact CE2-CD2 3.38Å; F254-F460 HydrophobicContact CE2-CD2 3.38Å; F254-F460 AromaticContact CE2-CE2 3.87Å; F254-F460 HydrophobicContact CE2-CE2 3.87Å; F254-F460 AromaticContact CE2-CG 3.63Å; F254-F460 HydrophobicContact CE2-CG 3.63Å; F254-F460 HydrophobicContact CE2-CZ 4.49Å; F254-F460 AromaticContact CZ-CD2 3.35Å; F254-F460 HydrophobicContact CZ-CD2 3.35Å; F254-F460 AromaticContact CZ-CE2 3.38Å; F254-F460 HydrophobicContact CZ-CE2 3.38Å; F254-F460 HydrophobicContact CZ-CG 4.06Å; F254-F460 HydrophobicContact CZ-CZ 4.08Å
255	Y	89.5	Confident	88.2	Confident	143 Å²	143	54.7 Å²	54.7	56%	0.561	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-91.2	-22.3	171.8	-164.5	-91.9	0	0	0	111.8	L252 V253 L457	L252-Y255 VanDerWaalsContact O-CB 3.29Å; L252-Y255 WeakPolarHBondContact O-CB 3.44Å; L252-Y255 PolarHBondContact O-N 3.09Å; V253-Y255 PolarHBondContact O-N 3.25Å; Y255-L457 HydrophobicContact CD2-CD1 4.28Å
256	L	89.9	Confident	88.3	Confident	54 Å²	54	52.5 Å²	52.5	28%	0.283	30%	0.295	S	S	.	.	S	Bend	trans	-76.3	125.4	-177.3	-166.6	73.9	0	0	0	110.4	V253 E262 K263	V253-L256 PolarHBondContact O-N 2.87Å; L256-E262 HydrophobicContact CD2-CB 4.27Å; L256-K263 HydrophobicContact CD2-CB 4.28Å
257	P	89.4	Confident	88.3	Confident	67 Å²	67	51.6 Å²	51.6	44%	0.435	29%	0.291	S	S	.	.			trans	-65	142.3	179.5	27.8	-34.2	0	0	0	111.2	D259 C260	P257-D259 PolarHBondContact O-N 3.4Å; P257-C260 PolarHBondContact O-N 2.97Å
258	S	88	Confident	88.6	Confident	12 Å²	12	55.8 Å²	55.8	8%	0.084	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-65.5	-19.3	-178.8	-54.2	0	0	0	0	113.6	C260	S258-C260 VanDerWaalsContact C-N 3.26Å; S258-C260 PolarHBondContact O-N 2.93Å
259	D	87.3	Confident	88.9	Confident	103 Å²	103	56 Å²	56	55%	0.551	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-66.7	-24.2	177.6	-66	-63.2	0	0	0	113	P257 G261 H320 K446	P257-D259 PolarHBondContact O-N 3.4Å; D259-G261 VanDerWaalsContact C-N 3.33Å; D259-G261 PolarHBondContact O-N 3.23Å; D259-H320 IonicContact OD1-CE1 3.24Å; D259-H320 PolarHBondContact OD1-CE1 3.03Å; D259-H320 IonicContact OD1-NE2 2.66Å; D259-H320 PolarHBondContact OD1-NE2 2.95Å; D259-H320 IonicContact OD2-NE2 2.84Å; D259-K446 IonicContact OD1-NZ 3.84Å; D259-K446 PolarHBondContact OD1-NZ 2.69Å; D259-K446 VanDerWaalsContact OD1-NZ 3.14Å
260	C	85	Confident	89	Confident	75 Å²	75	52.9 Å²	52.9	51%	0.507	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-77.3	-10.8	-175.2	-72	0	0	0	0	114.7	P257 S258 E262	P257-C260 PolarHBondContact O-N 2.97Å; S258-C260 VanDerWaalsContact C-N 3.26Å; S258-C260 PolarHBondContact O-N 2.93Å; C260-E262 PolarHBondContact O-N 2.95Å
261	G	85.1	Confident	89.3	Confident	53 Å²	53	54.5 Å²	54.5	55%	0.546	30%	0.304	S	S	.	.	S	Bend	trans	70	-24.1	-179.8	0	0	0	0	0	116.3	D259 K263	D259-G261 VanDerWaalsContact C-N 3.33Å; D259-G261 PolarHBondContact O-N 3.23Å; G261-K263 VanDerWaalsContact C-N 3.27Å; G261-K263 PolarHBondContact O-N 3.29Å
262	E	88.6	Confident	89.5	Confident	113 Å²	113	58.3 Å²	58.3	53%	0.528	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.3	-174.9	-67.6	-55.4	149.8	0	0	115.5	L256 C260 M264 T265 L266	L256-E262 HydrophobicContact CD2-CB 4.27Å; C260-E262 PolarHBondContact O-N 2.95Å; E262-M264 VanDerWaalsContact C-N 3.33Å; E262-M264 PolarHBondContact O-N 3.39Å; E262-T265 PolarHBondContact O-N 2.94Å; E262-T265 WeakPolarHBondContact OE2-CB 3.33Å; E262-T265 PolarHBondContact OE2-OG1 2.87Å; E262-T265 VanDerWaalsContact OE2-OG1 3.09Å; E262-L266 PolarHBondContact O-N 3.41Å; E262-L266 VanDerWaalsContact O-N 3.08Å
263	K	89.4	Confident	89.7	Confident	5 Å²	5	55.3 Å²	55.3	2%	0.022	31%	0.313	C	S	.	.	H	α-helix	trans	-58.8	-42.9	-177.4	-172.7	170.6	-175.6	160.8	0	112.6	V253 L256 G261 C267 D453	V253-K263 HydrophobicContact CG1-CG 3.76Å; L256-K263 HydrophobicContact CD2-CB 4.28Å; G261-K263 VanDerWaalsContact C-N 3.27Å; G261-K263 PolarHBondContact O-N 3.29Å; K263-C267 WeakPolarHBondContact O-CB 3.34Å; K263-C267 PolarHBondContact O-N 2.87Å; K263-D453 IonicContact NZ-OD1 2.87Å; K263-D453 PolarHBondContact NZ-OD1 3.2Å; K263-D453 IonicContact NZ-OD2 3.82Å; K263-D453 PolarHBondContact NZ-OD2 3.24Å
264	M	89.8	Confident	89.7	Confident	47 Å²	47	55.4 Å²	55.4	23%	0.232	31%	0.314	C	S	.	.	H	α-helix	trans	-71.8	-39.1	-179.9	-66.5	-56.4	-61.5	0	0	112.1	E262 C267 I268 I310 V314 L317	E262-M264 VanDerWaalsContact C-N 3.33Å; E262-M264 PolarHBondContact O-N 3.39Å; M264-C267 WeakPolarHBondContact O-CB 3.43Å; M264-C267 PolarHBondContact O-N 2.78Å; M264-I268 WeakPolarHBondContact O-CG1 3.39Å; M264-I268 PolarHBondContact O-N 3.44Å; M264-I310 HydrophobicContact CE-CG2 4.24Å; M264-V314 HydrophobicContact CE-CG2 3.44Å; M264-V314 VanDerWaalsContact CE-CG2 3.44Å; M264-V314 HydrophobicContact SD-CG2 3.91Å; M264-L317 HydrophobicContact CG-CD2 4.29Å
265	T	91.2	Very high	89.8	Confident	73 Å²	73	57.2 Å²	57.2	45%	0.448	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-47.1	177.3	-46.8	0	0	0	0	111.2	E262 I268 S269	E262-T265 PolarHBondContact O-N 2.94Å; E262-T265 WeakPolarHBondContact OE2-CB 3.33Å; E262-T265 PolarHBondContact OE2-OG1 2.87Å; E262-T265 VanDerWaalsContact OE2-OG1 3.09Å; T265-I268 PolarHBondContact O-N 3.31Å; T265-S269 WeakPolarHBondContact O-CB 3.22Å; T265-S269 PolarHBondContact O-N 3.05Å; T265-S269 PolarHBondContact O-OG 2.9Å
266	L	90.9	Very high	90	Very high	54 Å²	54	54.5 Å²	54.5	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-46.8	178.4	-178.6	63	0	0	0	111.3	V253 E262 I268 S269 V270	V253-L266 HydrophobicContact CG2-CD2 3.72Å; V253-L266 HydrophobicContact CG2-CG 3.9Å; E262-L266 PolarHBondContact O-N 3.41Å; E262-L266 VanDerWaalsContact O-N 3.08Å; L266-I268 PolarHBondContact O-N 3.44Å; L266-S269 PolarHBondContact O-N 3.35Å; L266-V270 HydrophobicContact CD1-CG2 4.34Å; L266-V270 WeakPolarHBondContact O-CB 3.15Å; L266-V270 VanDerWaalsContact O-CG2 3.27Å; L266-V270 WeakPolarHBondContact O-CG2 3.45Å; L266-V270 PolarHBondContact O-N 3.32Å
267	C	89.4	Confident	89.9	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.014	32%	0.318	C	S	.	.	H	α-helix	trans	-54.1	-51.8	176.2	-103.3	0	0	0	0	113.3	V253 K263 M264 V270 L271 I310	V253-C267 VanDerWaalsContact CG1-SG 3.5Å; K263-C267 WeakPolarHBondContact O-CB 3.34Å; K263-C267 PolarHBondContact O-N 2.87Å; M264-C267 WeakPolarHBondContact O-CB 3.43Å; M264-C267 PolarHBondContact O-N 2.78Å; C267-V270 PolarHBondContact O-N 3.25Å; C267-L271 PolarHBondContact O-N 2.76Å; C267-L271 VanDerWaalsContact O-N 3.1Å; C267-I310 HydrophobicContact CB-CG1 3.86Å
268	I	91.3	Very high	89.9	Confident	98 Å²	98	52.9 Å²	52.9	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-67.1	-41.3	-178.1	-67.7	164.7	0	0	0	110.5	M264 T265 L266 V270 L271 L272	M264-I268 WeakPolarHBondContact O-CG1 3.39Å; M264-I268 PolarHBondContact O-N 3.44Å; T265-I268 PolarHBondContact O-N 3.31Å; L266-I268 PolarHBondContact O-N 3.44Å; I268-V270 VanDerWaalsContact C-N 3.34Å; I268-V270 PolarHBondContact O-N 2.74Å; I268-L271 PolarHBondContact O-N 2.98Å; I268-L272 PolarHBondContact O-N 3.33Å
269	S	92.6	Very high	90	Very high	64 Å²	64	57.5 Å²	57.5	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-63.1	-40.2	178.5	-58.1	0	0	0	0	112.1	T265 L266 L272 A273	T265-S269 WeakPolarHBondContact O-CB 3.22Å; T265-S269 PolarHBondContact O-N 3.05Å; T265-S269 PolarHBondContact O-OG 2.9Å; L266-S269 PolarHBondContact O-N 3.35Å; S269-L272 PolarHBondContact O-N 3.01Å; S269-A273 WeakPolarHBondContact O-CB 3.25Å; S269-A273 PolarHBondContact O-N 3.37Å
270	V	91.9	Very high	90.2	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-43.7	174.5	166.9	0	0	0	0	111.3	I246 L249 A250 L266 C267 I268 L272 A273 L274 V306	I246-V270 HydrophobicContact CG2-CG1 3.91Å; L249-V270 HydrophobicContact CB-CG2 4.1Å; A250-V270 HydrophobicContact CB-CG1 4.02Å; L266-V270 HydrophobicContact CD1-CG2 4.34Å; L266-V270 WeakPolarHBondContact O-CB 3.15Å; L266-V270 VanDerWaalsContact O-CG2 3.27Å; L266-V270 WeakPolarHBondContact O-CG2 3.45Å; L266-V270 PolarHBondContact O-N 3.32Å; C267-V270 PolarHBondContact O-N 3.25Å; I268-V270 VanDerWaalsContact C-N 3.34Å; I268-V270 PolarHBondContact O-N 2.74Å; V270-L272 PolarHBondContact O-N 3.24Å; V270-A273 PolarHBondContact O-N 3.48Å; V270-L274 HydrophobicContact CG1-CD1 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.16Å; V270-L274 PolarHBondContact O-N 3.41Å; V270-V306 HydrophobicContact CG1-CG1 4.33Å; V270-V306 HydrophobicContact CG1-CG2 4.05Å
271	L	91.2	Very high	90.3	Very high	44 Å²	44	52.9 Å²	52.9	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-44.2	176.2	-178.5	64.9	0	0	0	111.6	C267 I268 L274 T275 M303 V306 I310	C267-L271 PolarHBondContact O-N 2.76Å; C267-L271 VanDerWaalsContact O-N 3.1Å; I268-L271 PolarHBondContact O-N 2.98Å; L271-L274 PolarHBondContact O-N 3.35Å; L271-T275 WeakPolarHBondContact O-CG2 3.26Å; L271-T275 PolarHBondContact O-N 3.18Å; L271-T275 PolarHBondContact O-OG1 3.24Å; L271-M303 HydrophobicContact CD1-CE 4.41Å; L271-M303 HydrophobicContact CD1-CG 3.97Å; L271-V306 HydrophobicContact CB-CG1 3.99Å; L271-V306 HydrophobicContact CD1-CG1 4.2Å; L271-I310 HydrophobicContact CB-CD1 4.22Å; L271-I310 HydrophobicContact CD2-CD1 3.8Å
272	L	92.8	Very high	90.4	Very high	114 Å²	114	54 Å²	54	60%	0.597	30%	0.301	S	S	*	.	H	α-helix	trans	-63.5	-41	177.3	-172.8	72.3	0	0	0	111.8	I268 S269 V270 L274 T275 V276	I268-L272 PolarHBondContact O-N 3.33Å; S269-L272 PolarHBondContact O-N 3.01Å; V270-L272 PolarHBondContact O-N 3.24Å; L272-L274 PolarHBondContact O-N 3.19Å; L272-T275 PolarHBondContact O-N 3.19Å; L272-T275 PolarHBondContact O-OG1 3.04Å; L272-V276 WeakPolarHBondContact O-CG2 3.38Å; L272-V276 PolarHBondContact O-N 2.96Å
273	A	92.2	Very high	90.4	Very high	31 Å²	31	55.4 Å²	55.4	26%	0.256	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-46	175.3	0	0	0	0	0	111	I246 S269 V270 T275 V276 F277	I246-A273 HydrophobicContact CD1-CB 3.99Å; S269-A273 WeakPolarHBondContact O-CB 3.25Å; S269-A273 PolarHBondContact O-N 3.37Å; V270-A273 PolarHBondContact O-N 3.48Å; A273-T275 PolarHBondContact O-N 3.27Å; A273-V276 PolarHBondContact O-N 3.36Å; A273-F277 VanDerWaalsContact O-CD2 3.26Å; A273-F277 WeakPolarHBondContact O-CD2 3.26Å; A273-F277 PolarHBondContact O-N 3.08Å
274	L	90.1	Very high	90.3	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-40.7	177.2	-72.9	174	0	0	0	112.8	I246 V270 L271 L272 F277 L278 L299 V306	I246-L274 HydrophobicContact CG2-CD2 3.73Å; I246-L274 HydrophobicContact CG2-CG 3.79Å; V270-L274 HydrophobicContact CG1-CD1 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.16Å; V270-L274 PolarHBondContact O-N 3.41Å; L271-L274 PolarHBondContact O-N 3.35Å; L272-L274 PolarHBondContact O-N 3.19Å; L274-F277 PolarHBondContact O-N 2.93Å; L274-L278 WeakPolarHBondContact O-CB 2.9Å; L274-L278 PolarHBondContact O-N 3.38Å; L274-L299 HydrophobicContact CD2-CD2 3.95Å; L274-V306 HydrophobicContact CD1-CB 4.26Å; L274-V306 HydrophobicContact CD1-CG2 3.67Å
275	T	90.8	Very high	90.2	Very high	40 Å²	40	55.6 Å²	55.6	25%	0.245	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-38.1	176.9	57.4	0	0	0	0	111.9	L271 L272 A273 L278 L279 M303	L271-T275 WeakPolarHBondContact O-CG2 3.26Å; L271-T275 PolarHBondContact O-N 3.18Å; L271-T275 PolarHBondContact O-OG1 3.24Å; L272-T275 PolarHBondContact O-N 3.19Å; L272-T275 PolarHBondContact O-OG1 3.04Å; A273-T275 PolarHBondContact O-N 3.27Å; T275-L278 PolarHBondContact O-N 3.29Å; T275-L279 WeakPolarHBondContact O-CG 3.2Å; T275-L279 PolarHBondContact O-N 3.09Å; T275-M303 HydrophobicContact CG2-CE 3.62Å; T275-M303 HydrophobicContact CG2-SD 4.26Å
276	V	92.5	Very high	90.1	Very high	85 Å²	85	52.4 Å²	52.4	52%	0.515	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-44.1	173.7	172	0	0	0	0	111.5	L272 A273 L278 L279 L280	L272-V276 WeakPolarHBondContact O-CG2 3.38Å; L272-V276 PolarHBondContact O-N 2.96Å; A273-V276 PolarHBondContact O-N 3.36Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 3.35Å; V276-L279 PolarHBondContact O-N 3.48Å; V276-L280 PolarHBondContact O-N 3.42Å
277	F	89.6	Confident	89.9	Confident	41 Å²	41	55.8 Å²	55.8	18%	0.18	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-37.2	175	-84.6	-76.7	0	0	0	112.5	P242 I246 A273 L274 L280 I281 L299	P242-F277 HydrophobicContact CB-CE1 4.03Å; P242-F277 HydrophobicContact CB-CE2 4.39Å; P242-F277 HydrophobicContact CB-CZ 3.58Å; P242-F277 HydrophobicContact CG-CZ 4.46Å; I246-F277 HydrophobicContact CD1-CD2 3.6Å; I246-F277 HydrophobicContact CD1-CE2 3.28Å; I246-F277 HydrophobicContact CD1-CZ 4.24Å; A273-F277 VanDerWaalsContact O-CD2 3.26Å; A273-F277 WeakPolarHBondContact O-CD2 3.26Å; A273-F277 PolarHBondContact O-N 3.08Å; L274-F277 PolarHBondContact O-N 2.93Å; F277-L280 PolarHBondContact O-N 3.37Å; F277-I281 PolarHBondContact O-N 2.94Å; F277-L299 HydrophobicContact CB-CD1 4.43Å; F277-L299 HydrophobicContact CB-CD2 4.18Å
278	L	88.3	Confident	89.7	Confident	47 Å²	47	57.8 Å²	57.8	25%	0.246	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-38	174.4	-174	65.5	0	0	0	112.3	L274 T275 V276 L280 I281 S282 L299 M300 M303	L274-L278 WeakPolarHBondContact O-CB 2.9Å; L274-L278 PolarHBondContact O-N 3.38Å; T275-L278 PolarHBondContact O-N 3.29Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 3.35Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L278-I281 HydrophobicContact CD1-CG2 4.08Å; L278-I281 WeakPolarHBondContact O-CG2 3.4Å; L278-S282 PolarHBondContact O-N 3.5Å; L278-L299 HydrophobicContact CD1-CB 4.29Å; L278-M300 HydrophobicContact CD1-SD 4.37Å; L278-M300 HydrophobicContact CD2-SD 3.87Å; L278-M303 HydrophobicContact CD2-SD 4.3Å
279	L	90.3	Very high	89.2	Confident	109 Å²	109	59 Å²	59	57%	0.571	34%	0.343	S	S	*	.	H	α-helix	trans	-70.9	-29.2	174.1	-68.7	177.4	0	0	0	112.7	T275 V276 S282 K283	T275-L279 WeakPolarHBondContact O-CG 3.2Å; T275-L279 PolarHBondContact O-N 3.09Å; V276-L279 PolarHBondContact O-N 3.48Å; L279-S282 PolarHBondContact O-OG 3.49Å; L279-S282 VanDerWaalsContact O-OG 3.04Å; L279-K283 WeakPolarHBondContact O-CG 3.36Å
280	L	90.5	Very high	88.6	Confident	74 Å²	74	61.3 Å²	61.3	39%	0.387	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-45.3	174.6	-174.1	150.2	0	0	0	110.5	L239 V276 F277 L278 S282 K283 I284	L239-L280 HydrophobicContact CD1-CD2 4.19Å; L239-L280 HydrophobicContact CD2-CD2 3.54Å; L239-L280 HydrophobicContact CG-CD2 4.03Å; V276-L280 PolarHBondContact O-N 3.42Å; F277-L280 PolarHBondContact O-N 3.37Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L280-S282 VanDerWaalsContact C-N 3.35Å; L280-S282 PolarHBondContact O-N 3.01Å; L280-K283 PolarHBondContact O-N 3.35Å; L280-I284 HydrophobicContact CD2-CD1 3.56Å; L280-I284 HydrophobicContact CG-CD1 4.5Å; L280-I284 PolarHBondContact O-N 3.41Å
281	I	88.3	Confident	87.8	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.036	37%	0.367	C	S	.	.	H	α-helix	trans	-66.6	-36.1	179.6	-166.5	66.9	0	0	0	112.3	F160 L239 F277 L278 K283 I284 V285 I295 L299	F160-I281 HydrophobicContact CD1-CD1 4.1Å; F160-I281 HydrophobicContact CE1-CD1 3.66Å; F160-I281 HydrophobicContact CZ-CD1 4.46Å; L239-I281 HydrophobicContact CD2-CD1 4.17Å; F277-I281 PolarHBondContact O-N 2.94Å; L278-I281 HydrophobicContact CD1-CG2 4.08Å; L278-I281 WeakPolarHBondContact O-CG2 3.4Å; I281-K283 PolarHBondContact O-N 3.31Å; I281-I284 PolarHBondContact O-N 3Å; I281-I284 VanDerWaalsContact O-N 3.13Å; I281-V285 HydrophobicContact CD1-CG2 3.73Å; I281-V285 HydrophobicContact CG1-CG2 3.84Å; I281-V285 PolarHBondContact O-N 2.95Å; I281-I295 HydrophobicContact CD1-CG2 3.79Å; I281-I295 HydrophobicContact CG1-CG2 3.97Å; I281-L299 HydrophobicContact CG2-CD1 4.14Å
282	S	86.6	Confident	87.4	Confident	75 Å²	75	66.4 Å²	66.4	52%	0.524	38%	0.379	S	S	.	.	H	α-helix	trans	-68	-16.6	177.8	70.4	0	0	0	0	113.8	L278 L279 L280	L278-S282 PolarHBondContact O-N 3.5Å; L279-S282 PolarHBondContact O-OG 3.49Å; L279-S282 VanDerWaalsContact O-OG 3.04Å; L280-S282 VanDerWaalsContact C-N 3.35Å; L280-S282 PolarHBondContact O-N 3.01Å
283	K	88.6	Confident	87.2	Confident	144 Å²	144	61.6 Å²	61.6	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-85.9	-23.4	172.8	-73.4	179	179.4	-179.3	0	113.6	R71 L279 L280 I281	R71-K283 WeakPolarHBondContact CD-O 3.18Å; L279-K283 WeakPolarHBondContact O-CG 3.36Å; L280-K283 PolarHBondContact O-N 3.35Å; I281-K283 PolarHBondContact O-N 3.31Å
284	I	88.3	Confident	86.9	Confident	42 Å²	42	61.2 Å²	61.2	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-91.4	-46.6	-177.7	-62.5	171	0	0	0	110.3	F160 Y235 L280 I281	F160-I284 HydrophobicContact CE2-CG2 4.43Å; F160-I284 HydrophobicContact CZ-CG2 4.05Å; Y235-I284 HydrophobicContact CE1-CD1 4.44Å; Y235-I284 HydrophobicContact CE1-CG2 4.31Å; L280-I284 HydrophobicContact CD2-CD1 3.56Å; L280-I284 HydrophobicContact CG-CD1 4.5Å; L280-I284 PolarHBondContact O-N 3.41Å; I281-I284 PolarHBondContact O-N 3Å; I281-I284 VanDerWaalsContact O-N 3.13Å
285	V	88.1	Confident	86.6	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	35%	0.35	C	S	.	.	S	Bend	trans	-79.8	140.9	-176.2	-179.5	0	0	0	0	109.9	V157 I281 P293	V157-V285 HydrophobicContact CB-CG1 4.02Å; V157-V285 HydrophobicContact CG1-CG1 3.79Å; V157-V285 HydrophobicContact CG2-CG1 4.17Å; I281-V285 HydrophobicContact CD1-CG2 3.73Å; I281-V285 HydrophobicContact CG1-CG2 3.84Å; I281-V285 PolarHBondContact O-N 2.95Å; V285-P293 HydrophobicContact CG1-CG 4.24Å; V285-P293 HydrophobicContact CG2-CG 4.36Å
286	P	88.8	Confident	86.4	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.039	34%	0.341	C	S	.	.			trans	-59.9	148.2	175.1	20.7	-31.5	0	0	0	112.4	E70 Q73 I155 V157 T288	E70-P286 WeakPolarHBondContact O-CB 3.3Å; E70-P286 WeakPolarHBondContact O-CD 2.95Å; E70-P286 VanDerWaalsContact O-CG 3.26Å; E70-P286 WeakPolarHBondContact O-CG 2.81Å; Q73-P286 HydrophobicContact CG-CB 4.23Å; I155-P286 HydrophobicContact CB-CG 4.5Å; V157-P286 HydrophobicContact CG1-CG 3.86Å; P286-T288 HydrophobicContact CB-CG2 4.16Å; P286-T288 HydrophobicContact CG-CG2 4.48Å; P286-T288 PolarHBondContact O-N 3.49Å
287	P	86.7	Confident	86.2	Confident	124 Å²	124	60 Å²	60	81%	0.805	34%	0.335	S	S	*	.			trans	-75.1	59.5	176.9	34.4	-37.2	0	0	0	111.4
288	T	85	Confident	86.1	Confident	45 Å²	45	58.2 Å²	58.2	28%	0.276	33%	0.327	S	S	.	.			trans	-102	143.3	177.6	54.2	0	0	0	0	111.1	P286	P286-T288 HydrophobicContact CB-CG2 4.16Å; P286-T288 HydrophobicContact CG-CG2 4.48Å; P286-T288 PolarHBondContact O-N 3.49Å
289	S	81.2	Confident	86.1	Confident	123 Å²	123	56.2 Å²	56.2	86%	0.86	32%	0.317	S	S	*	.	S	Bend	trans	-101.4	2.7	179.1	55.1	0	0	0	0	113.9
290	L	78.9	Confident	86	Confident	113 Å²	113	55.6 Å²	55.6	59%	0.592	31%	0.312	S	S	*	.	S	Bend	trans	-65.4	-45.7	-177.1	-67.7	172.5	0	0	0	111.7
291	D	75.3	Confident	86	Confident	77 Å²	77	55 Å²	55	41%	0.412	31%	0.306	S	S	.	.			trans	-150.2	141.7	178.4	-88.5	-50.7	0	0	0	110	V157	V157-D291 WeakPolarHBondContact CG2-O 3.37Å
292	V	83.3	Confident	86	Confident	80 Å²	80	54.8 Å²	54.8	49%	0.485	31%	0.305	S	S	.	.			trans	-88.1	131	172.9	-177.5	0	0	0	0	108.7	K297	V292-K297 HydrophobicContact CB-CG 4.14Å; V292-K297 HydrophobicContact CG1-CG 3.89Å; V292-K297 VanDerWaalsContact O-CE 3.29Å; V292-K297 WeakPolarHBondContact O-CE 3.32Å
293	P	88.4	Confident	86.2	Confident	14 Å²	14	53.8 Å²	53.8	9%	0.091	29%	0.293	C	S	.	.			trans	-60.2	147.1	179	26.5	-36.4	0	0	0	111.2	V157 F160 V285 I295 G296 K297	V157-P293 HydrophobicContact CB-CB 4.5Å; V157-P293 WeakPolarHBondContact O-CA 3.37Å; V157-P293 WeakPolarHBondContact O-CB 3.39Å; F160-P293 HydrophobicContact CB-CB 4.33Å; V285-P293 HydrophobicContact CG1-CG 4.24Å; V285-P293 HydrophobicContact CG2-CG 4.36Å; P293-I295 VanDerWaalsContact C-N 3.28Å; P293-I295 HydrophobicContact CB-CG2 4.25Å; P293-I295 PolarHBondContact O-N 3.45Å; P293-G296 WeakPolarHBondContact O-CA 3.4Å; P293-G296 PolarHBondContact O-N 3.26Å; P293-K297 PolarHBondContact O-N 2.94Å
294	L	84.9	Confident	86.3	Confident	22 Å²	22	50.6 Å²	50.6	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-54.8	-43.3	-178.8	-169.9	65.6	0	0	0	112.9	K158 G296 K297 Y298 L471 F472 P475	K158-L294 PolarHBondContact O-N 3.19Å; K158-L294 VanDerWaalsContact O-N 3.15Å; L294-G296 VanDerWaalsContact C-N 3.28Å; L294-G296 PolarHBondContact O-N 3.1Å; L294-K297 WeakPolarHBondContact O-CB 3.28Å; L294-K297 PolarHBondContact O-N 3.33Å; L294-Y298 PolarHBondContact O-N 3.46Å; L294-L471 HydrophobicContact CD1-CB 4.42Å; L294-L471 HydrophobicContact CD1-CD2 4.31Å; L294-L471 WeakPolarHBondContact CD1-O 3.39Å; L294-L471 WeakPolarHBondContact CD2-O 3.45Å; L294-F472 HydrophobicContact CD2-CD1 4.33Å; L294-P475 HydrophobicContact CD2-CG 3.34Å
295	I	84.7	Confident	86.4	Confident	9 Å²	9	49.6 Å²	49.6	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-35.5	176.3	-172.5	62.2	0	0	0	112.1	F160 I281 P293 Y298 L299	F160-I295 HydrophobicContact CD1-CG2 4Å; I281-I295 HydrophobicContact CD1-CG2 3.79Å; I281-I295 HydrophobicContact CG1-CG2 3.97Å; P293-I295 VanDerWaalsContact C-N 3.28Å; P293-I295 HydrophobicContact CB-CG2 4.25Å; P293-I295 PolarHBondContact O-N 3.45Å; I295-Y298 HydrophobicContact CD1-CD1 4.3Å; I295-Y298 PolarHBondContact O-N 2.99Å; I295-L299 HydrophobicContact CG1-CD1 4.33Å; I295-L299 WeakPolarHBondContact O-CB 3.13Å; I295-L299 WeakPolarHBondContact O-CG 3.28Å; I295-L299 PolarHBondContact O-N 3.09Å
296	G	87.3	Confident	86.5	Confident	5 Å²	5	49.2 Å²	49.2	5%	0.052	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-43.2	174.5	0	0	0	0	0	111.6	P293 L294 Y298 L299 M300	P293-G296 WeakPolarHBondContact O-CA 3.4Å; P293-G296 PolarHBondContact O-N 3.26Å; L294-G296 VanDerWaalsContact C-N 3.28Å; L294-G296 PolarHBondContact O-N 3.1Å; G296-Y298 VanDerWaalsContact C-N 3.31Å; G296-Y298 PolarHBondContact O-N 3.47Å; G296-L299 PolarHBondContact O-N 2.77Å; G296-M300 WeakPolarHBondContact O-CB 3.08Å; G296-M300 VanDerWaalsContact O-CG 3.25Å; G296-M300 WeakPolarHBondContact O-CG 3.39Å; G296-M300 PolarHBondContact O-N 3.05Å
297	K	87.5	Confident	86.7	Confident	90 Å²	90	52 Å²	52	39%	0.391	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-41.6	173.1	-67.2	179.2	-179.2	170.2	0	111.5	V292 P293 L294 F301	V292-K297 HydrophobicContact CB-CG 4.14Å; V292-K297 HydrophobicContact CG1-CG 3.89Å; V292-K297 VanDerWaalsContact O-CE 3.29Å; V292-K297 WeakPolarHBondContact O-CE 3.32Å; P293-K297 PolarHBondContact O-N 2.94Å; L294-K297 WeakPolarHBondContact O-CB 3.28Å; L294-K297 PolarHBondContact O-N 3.33Å; K297-F301 WeakPolarHBondContact O-CB 3.49Å; K297-F301 PolarHBondContact O-N 3.34Å
298	Y	87.9	Confident	86.9	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-50.6	176.3	-177.1	-112.7	0	0	0	112.3	C243 T247 L294 I295 G296 M300 F301 T302 T468 L471 F472	C243-Y298 VanDerWaalsContact SG-CE1 3.51Å; T247-Y298 HydrophobicContact CG2-CE1 4.06Å; T247-Y298 WeakPolarHBondContact CG2-OH 3.27Å; T247-Y298 PolarHBondContact OG1-OH 3.19Å; L294-Y298 PolarHBondContact O-N 3.46Å; I295-Y298 HydrophobicContact CD1-CD1 4.3Å; I295-Y298 PolarHBondContact O-N 2.99Å; G296-Y298 VanDerWaalsContact C-N 3.31Å; G296-Y298 PolarHBondContact O-N 3.47Å; Y298-M300 VanDerWaalsContact C-N 3.33Å; Y298-M300 PolarHBondContact O-N 3.41Å; Y298-F301 WeakPolarHBondContact O-CB 3.36Å; Y298-F301 PolarHBondContact O-N 2.81Å; Y298-T302 HydrophobicContact CD1-CG2 4.34Å; Y298-T302 HydrophobicContact CD2-CG2 4.21Å; Y298-T302 HydrophobicContact CE1-CG2 4.02Å; Y298-T302 HydrophobicContact CE2-CG2 3.85Å; Y298-T302 HydrophobicContact CG-CG2 4.43Å; Y298-T302 WeakPolarHBondContact O-CG2 3.48Å; Y298-T302 PolarHBondContact O-N 3.01Å; Y298-T302 PolarHBondContact O-OG1 2.76Å; Y298-T468 HydrophobicContact CE2-CG2 3.53Å; Y298-T468 VanDerWaalsContact OH-CG2 3.31Å; Y298-T468 WeakPolarHBondContact OH-CG2 3.46Å; Y298-L471 HydrophobicContact CD2-CD1 3.89Å; Y298-F472 HydrophobicContact CD1-CE2 4.2Å; Y298-F472 HydrophobicContact CD1-CZ 4.29Å; Y298-F472 AromaticContact CD2-CE2 3.83Å; Y298-F472 HydrophobicContact CD2-CE2 3.83Å; Y298-F472 HydrophobicContact CE1-CE2 4.36Å; Y298-F472 HydrophobicContact CE2-CE2 4.02Å; Y298-F472 AromaticContact CG-CE2 3.92Å; Y298-F472 HydrophobicContact CG-CE2 3.92Å; Y298-F472 HydrophobicContact CG-CZ 4.22Å
299	L	87.9	Confident	87.2	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-43.6	176.9	-76.9	170.3	0	0	0	111.7	C243 L274 F277 L278 I281 I295 G296 T302 M303	C243-L299 WeakPolarHBondContact SG-CD2 3.49Å; L274-L299 HydrophobicContact CD2-CD2 3.95Å; F277-L299 HydrophobicContact CB-CD1 4.43Å; F277-L299 HydrophobicContact CB-CD2 4.18Å; L278-L299 HydrophobicContact CD1-CB 4.29Å; I281-L299 HydrophobicContact CG2-CD1 4.14Å; I295-L299 HydrophobicContact CG1-CD1 4.33Å; I295-L299 WeakPolarHBondContact O-CB 3.13Å; I295-L299 WeakPolarHBondContact O-CG 3.28Å; I295-L299 PolarHBondContact O-N 3.09Å; G296-L299 PolarHBondContact O-N 2.77Å; L299-T302 WeakPolarHBondContact CA-OG1 3.33Å; L299-T302 PolarHBondContact O-N 3.23Å; L299-T302 PolarHBondContact O-OG1 3.12Å; L299-M303 WeakPolarHBondContact O-CB 3.33Å; L299-M303 PolarHBondContact O-N 2.91Å
300	M	88.3	Confident	87.7	Confident	95 Å²	95	45.8 Å²	45.8	47%	0.468	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-45.2	176.1	-71.6	-63.3	-65.8	0	0	112.4	L278 G296 Y298 T302 M303 V304	L278-M300 HydrophobicContact CD1-SD 4.37Å; L278-M300 HydrophobicContact CD2-SD 3.87Å; G296-M300 WeakPolarHBondContact O-CB 3.08Å; G296-M300 VanDerWaalsContact O-CG 3.25Å; G296-M300 WeakPolarHBondContact O-CG 3.39Å; G296-M300 PolarHBondContact O-N 3.05Å; Y298-M300 VanDerWaalsContact C-N 3.33Å; Y298-M300 PolarHBondContact O-N 3.41Å; M300-T302 VanDerWaalsContact C-N 3.33Å; M300-T302 PolarHBondContact O-N 2.84Å; M300-M303 PolarHBondContact O-N 3.23Å; M300-V304 WeakPolarHBondContact O-CG2 3.46Å; M300-V304 PolarHBondContact O-N 2.92Å
301	F	89.6	Confident	88.4	Confident	63 Å²	63	44.8 Å²	44.8	28%	0.276	24%	0.236	S	C	.	.	H	α-helix	trans	-57.5	-46.3	174.6	169.7	-103.7	0	0	0	111.5	K297 Y298 V304 L305 V463 L471	K297-F301 WeakPolarHBondContact O-CB 3.49Å; K297-F301 PolarHBondContact O-N 3.34Å; Y298-F301 WeakPolarHBondContact O-CB 3.36Å; Y298-F301 PolarHBondContact O-N 2.81Å; F301-V304 PolarHBondContact O-N 2.84Å; F301-L305 WeakPolarHBondContact O-CB 3.21Å; F301-L305 PolarHBondContact O-N 3.01Å; F301-V463 HydrophobicContact CE2-CG1 4.36Å; F301-V463 HydrophobicContact CZ-CG1 3.89Å; F301-L471 HydrophobicContact CB-CD1 4.49Å
302	T	88.4	Confident	89.1	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-67.6	-36.6	179.8	63.2	0	0	0	0	112.4	T247 Y298 L299 M300 L305 V306	T247-T302 HydrophobicContact CG2-CG2 3.31Å; Y298-T302 HydrophobicContact CD1-CG2 4.34Å; Y298-T302 HydrophobicContact CD2-CG2 4.21Å; Y298-T302 HydrophobicContact CE1-CG2 4.02Å; Y298-T302 HydrophobicContact CE2-CG2 3.85Å; Y298-T302 HydrophobicContact CG-CG2 4.43Å; Y298-T302 WeakPolarHBondContact O-CG2 3.48Å; Y298-T302 PolarHBondContact O-N 3.01Å; Y298-T302 PolarHBondContact O-OG1 2.76Å; L299-T302 WeakPolarHBondContact CA-OG1 3.33Å; L299-T302 PolarHBondContact O-N 3.23Å; L299-T302 PolarHBondContact O-OG1 3.12Å; M300-T302 VanDerWaalsContact C-N 3.33Å; M300-T302 PolarHBondContact O-N 2.84Å; T302-L305 WeakPolarHBondContact O-CB 3.44Å; T302-L305 PolarHBondContact O-N 3.29Å; T302-V306 WeakPolarHBondContact O-CB 3.48Å; T302-V306 VanDerWaalsContact O-CG2 3.32Å; T302-V306 WeakPolarHBondContact O-CG2 3.5Å; T302-V306 PolarHBondContact O-N 2.75Å
303	M	90.6	Very high	89.5	Confident	54 Å²	54	38.3 Å²	38.3	27%	0.266	20%	0.2	S	C	.	.	H	α-helix	trans	-64	-42.5	176.2	-173.6	175.8	177.9	0	0	111.7	L271 T275 L278 L299 M300 T307	L271-M303 HydrophobicContact CD1-CE 4.41Å; L271-M303 HydrophobicContact CD1-CG 3.97Å; T275-M303 HydrophobicContact CG2-CE 3.62Å; T275-M303 HydrophobicContact CG2-SD 4.26Å; L278-M303 HydrophobicContact CD2-SD 4.3Å; L299-M303 WeakPolarHBondContact O-CB 3.33Å; L299-M303 PolarHBondContact O-N 2.91Å; M300-M303 PolarHBondContact O-N 3.23Å; M303-T307 WeakPolarHBondContact O-CB 3.04Å; M303-T307 PolarHBondContact O-N 3.35Å; M303-T307 PolarHBondContact O-OG1 3.39Å
304	V	91.8	Very high	89.7	Confident	77 Å²	77	41.1 Å²	41.1	47%	0.467	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-45.3	173.2	172.1	0	0	0	0	110.5	M300 F301 V306 T307 F308	M300-V304 WeakPolarHBondContact O-CG2 3.46Å; M300-V304 PolarHBondContact O-N 2.92Å; F301-V304 PolarHBondContact O-N 2.84Å; V304-V306 PolarHBondContact O-N 2.89Å; V304-T307 WeakPolarHBondContact O-CB 3.38Å; V304-T307 PolarHBondContact O-N 2.72Å; V304-F308 HydrophobicContact CG1-CD2 3.78Å; V304-F308 HydrophobicContact CG1-CE2 3.43Å; V304-F308 VanDerWaalsContact CG1-CE2 3.43Å; V304-F308 VanDerWaalsContact O-CD2 3.23Å; V304-F308 WeakPolarHBondContact O-CD2 3.38Å; V304-F308 PolarHBondContact O-N 3Å
305	L	89.8	Confident	90.1	Very high	21 Å²	21	43.6 Å²	43.6	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-46.8	178	-167.2	76.5	0	0	0	112.1	F301 T302 T307 F308 S309 F460 V463 C464	F301-L305 WeakPolarHBondContact O-CB 3.21Å; F301-L305 PolarHBondContact O-N 3.01Å; T302-L305 WeakPolarHBondContact O-CB 3.44Å; T302-L305 PolarHBondContact O-N 3.29Å; L305-T307 VanDerWaalsContact C-N 3.32Å; L305-T307 PolarHBondContact O-N 2.67Å; L305-F308 PolarHBondContact O-N 2.65Å; L305-S309 PolarHBondContact O-N 2.99Å; L305-F460 HydrophobicContact CD1-CD1 3.46Å; L305-F460 VanDerWaalsContact CD1-CD1 3.46Å; L305-F460 HydrophobicContact CD1-CE1 3.52Å; L305-F460 HydrophobicContact CD2-CD1 4.19Å; L305-F460 HydrophobicContact CG-CD1 3.61Å; L305-F460 HydrophobicContact CG-CE1 3.71Å; L305-F460 WeakPolarHBondContact O-CE1 3.32Å; L305-V463 HydrophobicContact CD1-CB 4.43Å; L305-V463 HydrophobicContact CD1-CG1 3.68Å; L305-C464 HydrophobicContact CD2-CB 4.15Å
306	V	90.7	Very high	90.5	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-38.6	177.2	170.7	0	0	0	0	111.1	A250 V270 L271 L274 T302 V304 F308 S309 I310	A250-V306 HydrophobicContact CB-CG2 3.67Å; V270-V306 HydrophobicContact CG1-CG1 4.33Å; V270-V306 HydrophobicContact CG1-CG2 4.05Å; L271-V306 HydrophobicContact CB-CG1 3.99Å; L271-V306 HydrophobicContact CD1-CG1 4.2Å; L274-V306 HydrophobicContact CD1-CB 4.26Å; L274-V306 HydrophobicContact CD1-CG2 3.67Å; T302-V306 WeakPolarHBondContact O-CB 3.48Å; T302-V306 VanDerWaalsContact O-CG2 3.32Å; T302-V306 WeakPolarHBondContact O-CG2 3.5Å; T302-V306 PolarHBondContact O-N 2.75Å; V304-V306 PolarHBondContact O-N 2.89Å; V306-F308 PolarHBondContact O-N 3.18Å; V306-S309 WeakPolarHBondContact O-CA 3.3Å; V306-S309 WeakPolarHBondContact O-CB 2.96Å; V306-S309 PolarHBondContact O-N 2.87Å; V306-S309 VanDerWaalsContact O-N 3.12Å; V306-I310 HydrophobicContact CG1-CD1 4.12Å; V306-I310 HydrophobicContact CG1-CG1 4.46Å; V306-I310 WeakPolarHBondContact O-CG1 3.31Å; V306-I310 PolarHBondContact O-N 2.98Å
307	T	91.7	Very high	90.7	Very high	65 Å²	65	45.4 Å²	45.4	40%	0.399	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-45.4	176.3	-56.5	0	0	0	0	111.4	M303 V304 L305 S309 I310 V311	M303-T307 WeakPolarHBondContact O-CB 3.04Å; M303-T307 PolarHBondContact O-N 3.35Å; M303-T307 PolarHBondContact O-OG1 3.39Å; V304-T307 WeakPolarHBondContact O-CB 3.38Å; V304-T307 PolarHBondContact O-N 2.72Å; L305-T307 VanDerWaalsContact C-N 3.32Å; L305-T307 PolarHBondContact O-N 2.67Å; T307-S309 VanDerWaalsContact C-N 3.31Å; T307-S309 PolarHBondContact O-N 3.03Å; T307-I310 PolarHBondContact O-N 3.44Å; T307-V311 WeakPolarHBondContact O-CG2 3Å; T307-V311 PolarHBondContact O-N 3.22Å
308	F	92.1	Very high	91	Very high	129 Å²	129	45.5 Å²	45.5	57%	0.566	25%	0.247	S	C	*	.	H	α-helix	trans	-63.5	-37.3	173.1	-73.5	-58.6	0	0	0	112.4	V304 L305 V306 I310 V311 T312 F460	V304-F308 HydrophobicContact CG1-CD2 3.78Å; V304-F308 HydrophobicContact CG1-CE2 3.43Å; V304-F308 VanDerWaalsContact CG1-CE2 3.43Å; V304-F308 VanDerWaalsContact O-CD2 3.23Å; V304-F308 WeakPolarHBondContact O-CD2 3.38Å; V304-F308 PolarHBondContact O-N 3Å; L305-F308 PolarHBondContact O-N 2.65Å; V306-F308 PolarHBondContact O-N 3.18Å; F308-I310 VanDerWaalsContact C-N 3.34Å; F308-I310 PolarHBondContact O-N 3.01Å; F308-V311 PolarHBondContact O-N 3.13Å; F308-T312 WeakPolarHBondContact O-CB 3.34Å; F308-T312 PolarHBondContact O-N 3.23Å; F308-T312 PolarHBondContact O-OG1 3.17Å; F308-F460 HydrophobicContact CB-CE1 4.39Å; F308-F460 HydrophobicContact CB-CZ 4.06Å
309	S	90.8	Very high	91.1	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-39	175.4	170.7	0	0	0	0	112.8	F254 L305 V306 T307 T312 S313	F254-S309 VanDerWaalsContact CE2-OG 3.25Å; F254-S309 WeakPolarHBondContact CE2-OG 3.49Å; F254-S309 WeakPolarHBondContact CZ-OG 3.44Å; L305-S309 PolarHBondContact O-N 2.99Å; V306-S309 WeakPolarHBondContact O-CA 3.3Å; V306-S309 WeakPolarHBondContact O-CB 2.96Å; V306-S309 PolarHBondContact O-N 2.87Å; V306-S309 VanDerWaalsContact O-N 3.12Å; T307-S309 VanDerWaalsContact C-N 3.31Å; T307-S309 PolarHBondContact O-N 3.03Å; S309-T312 PolarHBondContact O-N 3.26Å; S309-S313 VanDerWaalsContact O-CB 3.3Å; S309-S313 WeakPolarHBondContact O-CB 3.49Å; S309-S313 PolarHBondContact O-N 2.93Å; S309-S313 PolarHBondContact O-OG 3.27Å
310	I	91.8	Very high	91.3	Very high	30 Å²	30	46.4 Å²	46.4	15%	0.154	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-49.3	175.1	-66.6	166.5	0	0	0	110.4	M264 C267 L271 V306 T307 F308 T312 S313 V314	M264-I310 HydrophobicContact CE-CG2 4.24Å; C267-I310 HydrophobicContact CB-CG1 3.86Å; L271-I310 HydrophobicContact CB-CD1 4.22Å; L271-I310 HydrophobicContact CD2-CD1 3.8Å; V306-I310 HydrophobicContact CG1-CD1 4.12Å; V306-I310 HydrophobicContact CG1-CG1 4.46Å; V306-I310 WeakPolarHBondContact O-CG1 3.31Å; V306-I310 PolarHBondContact O-N 2.98Å; T307-I310 PolarHBondContact O-N 3.44Å; F308-I310 VanDerWaalsContact C-N 3.34Å; F308-I310 PolarHBondContact O-N 3.01Å; I310-T312 VanDerWaalsContact C-N 3.33Å; I310-T312 PolarHBondContact O-N 3.07Å; I310-S313 PolarHBondContact O-N 3.04Å; I310-S313 VanDerWaalsContact O-N 3.16Å; I310-V314 WeakPolarHBondContact O-CG2 3.35Å; I310-V314 PolarHBondContact O-N 3Å
311	V	93.1	Very high	91.4	Very high	92 Å²	92	48.1 Å²	48.1	56%	0.558	26%	0.26	S	S	*	.	H	α-helix	trans	-59.4	-45.5	179.5	174.7	0	0	0	0	111	T307 F308 V314 C315	T307-V311 WeakPolarHBondContact O-CG2 3Å; T307-V311 PolarHBondContact O-N 3.22Å; F308-V311 PolarHBondContact O-N 3.13Å; V311-V314 PolarHBondContact O-N 3.22Å; V311-C315 PolarHBondContact O-N 3.09Å; V311-C315 VanDerWaalsContact O-N 3.07Å
312	T	91.7	Very high	91.6	Very high	21 Å²	21	48.2 Å²	48.2	13%	0.129	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-40.6	176.1	-67	0	0	0	0	112	F254 F308 S309 I310 V314 C315 V316 F456	F254-T312 HydrophobicContact CE1-CG2 3.98Å; F308-T312 WeakPolarHBondContact O-CB 3.34Å; F308-T312 PolarHBondContact O-N 3.23Å; F308-T312 PolarHBondContact O-OG1 3.17Å; S309-T312 PolarHBondContact O-N 3.26Å; I310-T312 VanDerWaalsContact C-N 3.33Å; I310-T312 PolarHBondContact O-N 3.07Å; T312-V314 PolarHBondContact O-N 2.85Å; T312-C315 WeakPolarHBondContact O-CB 3.35Å; T312-C315 PolarHBondContact O-N 2.76Å; T312-C315 VanDerWaalsContact O-N 3.12Å; T312-V316 HydrophobicContact CG2-CG2 4.4Å; T312-V316 WeakPolarHBondContact O-CG2 3.43Å; T312-V316 PolarHBondContact O-N 3.2Å; T312-F456 HydrophobicContact CG2-CB 4.03Å; T312-F456 HydrophobicContact CG2-CD1 3.86Å; T312-F456 HydrophobicContact CG2-CD2 3.24Å; T312-F456 HydrophobicContact CG2-CE1 4.09Å; T312-F456 HydrophobicContact CG2-CE2 3.5Å; T312-F456 HydrophobicContact CG2-CG 3.44Å; T312-F456 VanDerWaalsContact CG2-CG 3.44Å; T312-F456 HydrophobicContact CG2-CZ 3.93Å
313	S	91.2	Very high	91.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-40.6	177.5	-66.7	0	0	0	0	112.2	S309 I310 C315 V316 L317	S309-S313 VanDerWaalsContact O-CB 3.3Å; S309-S313 WeakPolarHBondContact O-CB 3.49Å; S309-S313 PolarHBondContact O-N 2.93Å; S309-S313 PolarHBondContact O-OG 3.27Å; I310-S313 PolarHBondContact O-N 3.04Å; I310-S313 VanDerWaalsContact O-N 3.16Å; S313-C315 VanDerWaalsContact C-N 3.32Å; S313-C315 PolarHBondContact O-N 2.93Å; S313-V316 PolarHBondContact O-N 2.59Å; S313-L317 WeakPolarHBondContact O-CB 3.46Å; S313-L317 PolarHBondContact O-N 2.81Å
314	V	92.8	Very high	91.5	Very high	73 Å²	73	48.9 Å²	48.9	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-40.6	172.5	173.9	0	0	0	0	111	M264 I310 V311 T312 L317 N318	M264-V314 HydrophobicContact CE-CG2 3.44Å; M264-V314 VanDerWaalsContact CE-CG2 3.44Å; M264-V314 HydrophobicContact SD-CG2 3.91Å; I310-V314 WeakPolarHBondContact O-CG2 3.35Å; I310-V314 PolarHBondContact O-N 3Å; V311-V314 PolarHBondContact O-N 3.22Å; T312-V314 PolarHBondContact O-N 2.85Å; V314-L317 PolarHBondContact O-N 2.82Å; V314-N318 WeakPolarHBondContact O-CB 3.4Å; V314-N318 PolarHBondContact O-N 3.27Å
315	C	92.5	Very high	91.4	Very high	74 Å²	74	50.5 Å²	50.5	50%	0.5	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-45.8	176.1	-171.4	0	0	0	0	112	V311 T312 S313 L317 N318 V319	V311-C315 PolarHBondContact O-N 3.09Å; V311-C315 VanDerWaalsContact O-N 3.07Å; T312-C315 WeakPolarHBondContact O-CB 3.35Å; T312-C315 PolarHBondContact O-N 2.76Å; T312-C315 VanDerWaalsContact O-N 3.12Å; S313-C315 VanDerWaalsContact C-N 3.32Å; S313-C315 PolarHBondContact O-N 2.93Å; C315-L317 VanDerWaalsContact C-N 3.34Å; C315-L317 PolarHBondContact O-N 3.27Å; C315-N318 WeakPolarHBondContact O-CB 3.49Å; C315-N318 PolarHBondContact O-N 3.17Å; C315-V319 WeakPolarHBondContact O-CG2 3.36Å; C315-V319 PolarHBondContact O-N 2.81Å
316	V	92.8	Very high	91.4	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-42.9	176.4	171.1	0	0	0	0	110.9	T312 S313 V319 H320 A449 V452 D453	T312-V316 HydrophobicContact CG2-CG2 4.4Å; T312-V316 WeakPolarHBondContact O-CG2 3.43Å; T312-V316 PolarHBondContact O-N 3.2Å; S313-V316 PolarHBondContact O-N 2.59Å; V316-V319 PolarHBondContact O-N 3.33Å; V316-H320 WeakPolarHBondContact O-CB 3.49Å; V316-H320 PolarHBondContact O-N 2.85Å; V316-A449 HydrophobicContact CG1-CB 4.22Å; V316-V452 HydrophobicContact CG2-CB 4.33Å; V316-V452 HydrophobicContact CG2-CG1 3.71Å; V316-D453 HydrophobicContact CG1-CB 4.28Å
317	L	92.2	Very high	91.5	Very high	50 Å²	50	57.4 Å²	57.4	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-40.5	178.1	-168.3	68.4	0	0	0	111.7	M264 S313 V314 C315 V319 H320 H321	M264-L317 HydrophobicContact CG-CD2 4.29Å; S313-L317 WeakPolarHBondContact O-CB 3.46Å; S313-L317 PolarHBondContact O-N 2.81Å; V314-L317 PolarHBondContact O-N 2.82Å; C315-L317 VanDerWaalsContact C-N 3.34Å; C315-L317 PolarHBondContact O-N 3.27Å; L317-V319 PolarHBondContact O-N 3.34Å; L317-H320 WeakPolarHBondContact O-CB 3.47Å; L317-H320 PolarHBondContact O-N 2.78Å; L317-H321 PolarHBondContact O-CD2 3.46Å; L317-H321 PolarHBondContact O-N 2.83Å
318	N	93.1	Very high	91.3	Very high	92 Å²	92	60.7 Å²	60.7	49%	0.492	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-45.9	173.7	-178.3	-2.7	0	0	0	111.1	V314 C315 H320 R322	V314-N318 WeakPolarHBondContact O-CB 3.4Å; V314-N318 PolarHBondContact O-N 3.27Å; C315-N318 WeakPolarHBondContact O-CB 3.49Å; C315-N318 PolarHBondContact O-N 3.17Å; N318-H320 VanDerWaalsContact C-N 3.33Å; N318-H320 PolarHBondContact O-N 3.19Å; N318-R322 WeakPolarHBondContact O-CG 3.42Å
319	V	91.6	Very high	91.2	Very high	19 Å²	19	55.6 Å²	55.6	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-64.4	-38	177.1	176	0	0	0	0	111.9	C315 V316 L317 H321 R322 W445 V448 A449	C315-V319 WeakPolarHBondContact O-CG2 3.36Å; C315-V319 PolarHBondContact O-N 2.81Å; V316-V319 PolarHBondContact O-N 3.33Å; L317-V319 PolarHBondContact O-N 3.34Å; V319-H321 PolarHBondContact O-N 2.98Å; V319-R322 PolarHBondContact O-N 3.06Å; V319-W445 HydrophobicContact CG1-CE3 3.83Å; V319-W445 HydrophobicContact CG1-CZ3 4.11Å; V319-V448 HydrophobicContact CG1-CG1 4.03Å; V319-A449 HydrophobicContact CB-CB 4.46Å; V319-A449 HydrophobicContact CG1-CB 4.18Å
320	H	91.6	Very high	91.2	Very high	9 Å²	9	57 Å²	57	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-39	-179.4	-178.8	-98.7	0	0	0	113.4	D259 V316 L317 N318 R322 A449	D259-H320 IonicContact OD1-CE1 3.24Å; D259-H320 PolarHBondContact OD1-CE1 3.03Å; D259-H320 IonicContact OD1-NE2 2.66Å; D259-H320 PolarHBondContact OD1-NE2 2.95Å; D259-H320 IonicContact OD2-NE2 2.84Å; V316-H320 WeakPolarHBondContact O-CB 3.49Å; V316-H320 PolarHBondContact O-N 2.85Å; L317-H320 WeakPolarHBondContact O-CB 3.47Å; L317-H320 PolarHBondContact O-N 2.78Å; N318-H320 VanDerWaalsContact C-N 3.33Å; N318-H320 PolarHBondContact O-N 3.19Å; H320-R322 VanDerWaalsContact C-N 3.33Å; H320-R322 PolarHBondContact O-N 3.3Å; H320-A449 HydrophobicContact CB-CB 3.82Å
321	H	90.9	Very high	91.1	Very high	131 Å²	131	60.8 Å²	60.8	61%	0.606	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	17.4	-178.5	-72.1	-77.4	0	0	0	114	L317 V319	L317-H321 PolarHBondContact O-CD2 3.46Å; L317-H321 PolarHBondContact O-N 2.83Å; V319-H321 PolarHBondContact O-N 2.98Å
322	R	92.6	Very high	91	Very high	65 Å²	65	64.2 Å²	64.2	25%	0.245	36%	0.359	C	S	.	.			trans	-75.1	134.1	174.2	-72.6	-179.4	-178.4	-169.5	-1.8	111.3	N318 V319 H320 H327 W445	N318-R322 WeakPolarHBondContact O-CG 3.42Å; V319-R322 PolarHBondContact O-N 3.06Å; H320-R322 VanDerWaalsContact C-N 3.33Å; H320-R322 PolarHBondContact O-N 3.3Å; R322-H327 HydrophobicContact CB-CB 4.48Å; R322-H327 HydrophobicContact CG-CB 4.5Å; R322-W445 HydrophobicContact CB-CD2 3.82Å; R322-W445 HydrophobicContact CB-CE3 4.22Å; R322-W445 HydrophobicContact CB-CG 4Å
323	S	89.1	Confident	91	Very high	32 Å²	32	63.8 Å²	63.8	22%	0.224	36%	0.357	C	S	.	.			trans	-110.5	155.6	175.8	67.8	0	0	0	0	111.8	S325 T326 H327	S323-S325 PolarHBondContact O-N 2.92Å; S323-S325 PolarHBondContact OG-OG 2.8Å; S323-T326 PolarHBondContact O-N 2.88Å; S323-T326 PolarHBondContact O-OG1 2.65Å; S323-T326 WeakPolarHBondContact OG-CG2 3.29Å; S323-T326 PolarHBondContact OG-N 2.81Å; S323-T326 PolarHBondContact OG-OG1 2.69Å; S323-H327 PolarHBondContact O-N 2.69Å
324	P	89	Confident	90.7	Very high	38 Å²	38	67.9 Å²	67.9	25%	0.247	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.4	174.5	-19.2	30.3	0	0	0	112.7	T326 D438 V441 V442	P324-T326 VanDerWaalsContact C-N 3.29Å; P324-T326 PolarHBondContact O-N 3.25Å; P324-D438 HydrophobicContact CG-CB 4.2Å; P324-D438 WeakPolarHBondContact CG-O 3.37Å; P324-V441 HydrophobicContact CB-CG1 4.24Å; P324-V441 HydrophobicContact CG-CB 3.9Å; P324-V441 HydrophobicContact CG-CG1 3.87Å; P324-V442 HydrophobicContact CG-CG2 4.03Å
325	S	87.9	Confident	90.5	Very high	110 Å²	110	73 Å²	73	77%	0.769	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-23.8	178.5	55.5	0	0	0	0	114.3	S323	S323-S325 PolarHBondContact O-N 2.92Å; S323-S325 PolarHBondContact OG-OG 2.8Å
326	T	90.8	Very high	90.4	Very high	93 Å²	93	71.9 Å²	71.9	57%	0.571	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-33.3	-176.6	57.4	0	0	0	0	113	S323 P324	S323-T326 PolarHBondContact O-N 2.88Å; S323-T326 PolarHBondContact O-OG1 2.65Å; S323-T326 WeakPolarHBondContact OG-CG2 3.29Å; S323-T326 PolarHBondContact OG-N 2.81Å; S323-T326 PolarHBondContact OG-OG1 2.69Å; P324-T326 VanDerWaalsContact C-N 3.29Å; P324-T326 PolarHBondContact O-N 3.25Å
327	H	91.6	Very high	90.2	Very high	79 Å²	79	73.8 Å²	73.8	37%	0.366	39%	0.386	S	S	.	.			trans	-136.4	136.1	-171.9	-68.1	79.8	0	0	0	112.2	R322 S323 W445	R322-H327 HydrophobicContact CB-CB 4.48Å; R322-H327 HydrophobicContact CG-CB 4.5Å; S323-H327 PolarHBondContact O-N 2.69Å; H327-W445 HydrophobicContact CB-CZ2 4.26Å
328	T	88.8	Confident	89.9	Confident	133 Å²	133	72.3 Å²	72.3	82%	0.816	38%	0.378	S	S	*	.			trans	-95	135.1	172.6	55.8	0	0	0	0	111	A330	T328-A330 PolarHBondContact O-N 3.32Å
329	M	89.4	Confident	89.5	Confident	23 Å²	23	74.1 Å²	74.1	11%	0.113	38%	0.384	C	S	.	.			trans	-75.9	111.9	176	-81.2	-172.4	118.1	0	0	111.1	K334 L338 D444 W445 V448	M329-K334 HydrophobicContact CB-CG 4.47Å; M329-K334 HydrophobicContact SD-CG 4.49Å; M329-L338 HydrophobicContact CE-CD1 4.49Å; M329-D444 HydrophobicContact CE-CB 3.99Å; M329-D444 HydrophobicContact SD-CB 3.92Å; M329-W445 HydrophobicContact CB-CZ2 4.2Å; M329-W445 HydrophobicContact CE-CD2 4.07Å; M329-W445 HydrophobicContact CE-CE3 4.25Å; M329-W445 HydrophobicContact CE-CG 4.37Å; M329-W445 HydrophobicContact CG-CD2 4Å; M329-W445 HydrophobicContact CG-CH2 4.01Å; M329-W445 HydrophobicContact CG-CZ2 3.32Å; M329-V448 HydrophobicContact CE-CG2 3.68Å
330	A	90.7	Very high	89.2	Confident	32 Å²	32	79.9 Å²	79.9	26%	0.264	41%	0.407	S	S	.	.			trans	-64	144.1	175.8	0	0	0	0	0	112	T328 W332 V333 K334	T328-A330 PolarHBondContact O-N 3.32Å; A330-W332 VanDerWaalsContact CB-CD1 3.49Å; A330-W332 HydrophobicContact CB-CG 4.4Å; A330-W332 PolarHBondContact O-N 3.12Å; A330-W332 VanDerWaalsContact O-N 3.15Å; A330-V333 HydrophobicContact CB-CG2 4.21Å; A330-V333 WeakPolarHBondContact O-CB 3.1Å; A330-V333 PolarHBondContact O-N 2.94Å; A330-K334 PolarHBondContact O-N 2.85Å
331	P	89.8	Confident	89	Confident	110 Å²	110	81.1 Å²	81.1	71%	0.714	41%	0.414	S	S	*	.	H	α-helix	trans	-59.5	-30.9	-176.6	-25.9	34.3	0	0	0	114.4	K334 R335	P331-K334 PolarHBondContact O-N 2.93Å; P331-R335 PolarHBondContact O-N 2.02Å; P331-R335 VanDerWaalsContact O-N 3.16Å
332	W	91.4	Very high	88.9	Confident	163 Å²	163	75.1 Å²	75.1	62%	0.617	39%	0.386	S	S	*	.	H	α-helix	trans	-69.1	-35.7	178	71.2	-96.5	0	0	0	112.1	A330 K334 R335 C336 F337	A330-W332 VanDerWaalsContact CB-CD1 3.49Å; A330-W332 HydrophobicContact CB-CG 4.4Å; A330-W332 PolarHBondContact O-N 3.12Å; A330-W332 VanDerWaalsContact O-N 3.15Å; W332-K334 VanDerWaalsContact C-N 3.35Å; W332-R335 PolarHBondContact O-N 3.37Å; W332-C336 WeakPolarHBondContact O-CB 3.4Å; W332-C336 PolarHBondContact O-N 3.1Å; W332-C336 PolarHBondContact O-SG 3.22Å; W332-F337 AromaticContact CZ3-CE2 3.97Å; W332-F337 HydrophobicContact CZ3-CE2 3.97Å
333	V	90.6	Very high	88.5	Confident	13 Å²	13	76.9 Å²	76.9	8%	0.079	41%	0.405	C	S	.	.	H	α-helix	trans	-63	-45.2	176.9	177.7	0	0	0	0	109.6	A330 R335 C336 F337 V448	A330-V333 HydrophobicContact CB-CG2 4.21Å; A330-V333 WeakPolarHBondContact O-CB 3.1Å; A330-V333 PolarHBondContact O-N 2.94Å; V333-R335 PolarHBondContact O-N 2.93Å; V333-C336 PolarHBondContact O-N 3.5Å; V333-F337 HydrophobicContact CG1-CD2 3.92Å; V333-F337 WeakPolarHBondContact O-CB 3.4Å; V333-F337 PolarHBondContact O-N 3.45Å; V333-V448 HydrophobicContact CG1-CG1 4.29Å; V333-V448 HydrophobicContact CG1-CG2 4.35Å
334	K	86.6	Confident	88.5	Confident	85 Å²	85	82.6 Å²	82.6	37%	0.37	43%	0.426	S	S	.	.	I	π-helix	trans	-58.4	-49.5	176.2	-64.5	-170.5	176	-169.4	0	111.3	M329 A330 P331 W332 C336 L338 H339	M329-K334 HydrophobicContact CB-CG 4.47Å; M329-K334 HydrophobicContact SD-CG 4.49Å; A330-K334 PolarHBondContact O-N 2.85Å; P331-K334 PolarHBondContact O-N 2.93Å; W332-K334 VanDerWaalsContact C-N 3.35Å; K334-C336 PolarHBondContact O-N 3.48Å; K334-L338 HydrophobicContact CB-CD1 4.04Å; K334-L338 HydrophobicContact CG-CD1 3.96Å; K334-L338 WeakPolarHBondContact O-CB 3.37Å; K334-L338 PolarHBondContact O-N 3.23Å; K334-L338 VanDerWaalsContact O-N 3.09Å; K334-H339 PolarHBondContact O-CD2 2.76Å
335	R	87.8	Confident	88.4	Confident	182 Å²	182	81.8 Å²	81.8	69%	0.687	42%	0.419	S	S	*	.	I	π-helix	trans	-66	-38.5	-178.6	-171.2	171.8	-94.4	170	-6.8	112.8	P331 W332 V333 K340	P331-R335 PolarHBondContact O-N 2.02Å; P331-R335 VanDerWaalsContact O-N 3.16Å; W332-R335 PolarHBondContact O-N 3.37Å; V333-R335 PolarHBondContact O-N 2.93Å; R335-K340 PolarHBondContact O-N 3.01Å
336	C	89.8	Confident	88.4	Confident	49 Å²	49	85.5 Å²	85.5	33%	0.331	42%	0.422	S	S	.	.	I	π-helix	trans	-79	-56.2	-178.9	-69	0	0	0	0	112.8	W332 V333 K334 K340 L341	W332-C336 WeakPolarHBondContact O-CB 3.4Å; W332-C336 PolarHBondContact O-N 3.1Å; W332-C336 PolarHBondContact O-SG 3.22Å; V333-C336 PolarHBondContact O-N 3.5Å; K334-C336 PolarHBondContact O-N 3.48Å; C336-K340 PolarHBondContact O-N 3.17Å; C336-L341 WeakPolarHBondContact O-CB 3.26Å; C336-L341 PolarHBondContact O-N 3.37Å
337	F	89.6	Confident	88	Confident	41 Å²	41	83.3 Å²	83.3	18%	0.18	41%	0.406	C	S	.	.	I	π-helix	trans	-89.4	-22.7	-169.9	-67.4	-79.8	0	0	0	114.5	W332 V333 L341 P342 V448 V451 V452	W332-F337 AromaticContact CZ3-CE2 3.97Å; W332-F337 HydrophobicContact CZ3-CE2 3.97Å; V333-F337 HydrophobicContact CG1-CD2 3.92Å; V333-F337 WeakPolarHBondContact O-CB 3.4Å; V333-F337 PolarHBondContact O-N 3.45Å; F337-L341 HydrophobicContact CD1-CD1 3.34Å; F337-L341 HydrophobicContact CE1-CD1 3.42Å; F337-L341 VanDerWaalsContact CE1-CD1 3.42Å; F337-L341 HydrophobicContact CG-CD1 4.05Å; F337-L341 HydrophobicContact CZ-CD1 4.21Å; F337-P342 WeakPolarHBondContact O-CD 3.47Å; F337-P342 WeakPolarHBondContact O-CG 3.27Å; F337-V448 HydrophobicContact CB-CB 4.44Å; F337-V448 HydrophobicContact CB-CG1 3.92Å; F337-V448 HydrophobicContact CB-CG2 3.98Å; F337-V448 HydrophobicContact CG-CG1 4.09Å; F337-V451 HydrophobicContact CD1-CG1 4.44Å; F337-V452 HydrophobicContact CD1-CG2 3.67Å; F337-V452 HydrophobicContact CE1-CG2 3.48Å; F337-V452 VanDerWaalsContact CE1-CG2 3.48Å; F337-V452 HydrophobicContact CZ-CG2 4.26Å
338	L	85.8	Confident	87.2	Confident	19 Å²	19	88.9 Å²	88.9	10%	0.099	43%	0.429	C	S	.	.	I	π-helix	trans	-93.5	-25.4	176.4	-56.6	176.9	0	0	0	113.3	M329 K334 Y447 V448	M329-L338 HydrophobicContact CE-CD1 4.49Å; K334-L338 HydrophobicContact CB-CD1 4.04Å; K334-L338 HydrophobicContact CG-CD1 3.96Å; K334-L338 WeakPolarHBondContact O-CB 3.37Å; K334-L338 PolarHBondContact O-N 3.23Å; K334-L338 VanDerWaalsContact O-N 3.09Å; L338-Y447 HydrophobicContact CD2-CD1 3.63Å; L338-Y447 HydrophobicContact CD2-CE1 4.31Å; L338-V448 HydrophobicContact CD2-CG2 3.62Å; L338-V448 HydrophobicContact CG-CG2 4.18Å
339	H	84.2	Confident	86.5	Confident	130 Å²	130	88.7 Å²	88.7	60%	0.602	41%	0.413	S	S	*	.	I	π-helix	trans	-116	-57.6	-175.1	-67.1	-77.3	0	0	0	114	K334 T343	K334-H339 PolarHBondContact O-CD2 2.76Å; H339-T343 PolarHBondContact O-OG1 2.98Å
340	K	86.4	Confident	85.2	Confident	141 Å²	141	92.7 Å²	92.7	61%	0.613	44%	0.441	S	S	*	.	I	π-helix	trans	-75.5	-47.5	-172.5	-71.7	-166.1	174.5	-169.3	0	114.2	R335 C336 T343 F344	R335-K340 PolarHBondContact O-N 3.01Å; C336-K340 PolarHBondContact O-N 3.17Å; K340-T343 PolarHBondContact O-OG1 3.11Å; K340-F344 PolarHBondContact O-N 3Å
341	L	86.8	Confident	83.4	Confident	35 Å²	35	93.4 Å²	93.4	18%	0.183	45%	0.452	C	S	.	.	H	α-helix	trans	-69.9	-41.9	-177.4	-85.7	159.6	0	0	0	113.7	C336 F337 T343 F344 L345 V451 L455	C336-L341 WeakPolarHBondContact O-CB 3.26Å; C336-L341 PolarHBondContact O-N 3.37Å; F337-L341 HydrophobicContact CD1-CD1 3.34Å; F337-L341 HydrophobicContact CE1-CD1 3.42Å; F337-L341 VanDerWaalsContact CE1-CD1 3.42Å; F337-L341 HydrophobicContact CG-CD1 4.05Å; F337-L341 HydrophobicContact CZ-CD1 4.21Å; L341-T343 VanDerWaalsContact C-N 3.31Å; L341-T343 PolarHBondContact O-N 3.37Å; L341-F344 PolarHBondContact O-N 3.47Å; L341-L345 WeakPolarHBondContact O-CB 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.06Å; L341-L345 PolarHBondContact O-N 2.92Å; L341-V451 HydrophobicContact CB-CG1 3.79Å; L341-L455 HydrophobicContact CD2-CD1 4.01Å; L341-L455 HydrophobicContact CD2-CD2 4.12Å
342	P	88.1	Confident	81.4	Confident	4 Å²	4	94.4 Å²	94.4	3%	0.026	46%	0.458	C	S	.	.	H	α-helix	trans	-63	-37.5	177.4	-26	36.5	0	0	0	112.9	F337 L345 F346 M347 Y447 V451	F337-P342 WeakPolarHBondContact O-CD 3.47Å; F337-P342 WeakPolarHBondContact O-CG 3.27Å; P342-L345 CarbonylContact O-C 3.57Å; P342-L345 PolarHBondContact O-N 2.92Å; P342-F346 PolarHBondContact O-N 3Å; P342-M347 HydrophobicContact CB-CB 4.23Å; P342-M347 PolarHBondContact O-N 2.94Å; P342-Y447 HydrophobicContact CB-CE1 4.44Å; P342-Y447 WeakPolarHBondContact CB-OH 3.27Å; P342-Y447 HydrophobicContact CG-CE1 3.89Å; P342-V451 HydrophobicContact CG-CG1 4.15Å; P342-V451 HydrophobicContact CG-CG2 3.81Å
343	T	84.9	Confident	78.7	Confident	102 Å²	102	92.7 Å²	92.7	63%	0.626	46%	0.461	S	S	*	.	H	α-helix	trans	-67.6	-36.7	175.4	43.3	0	0	0	0	112	H339 K340 L341	H339-T343 PolarHBondContact O-OG1 2.98Å; K340-T343 PolarHBondContact O-OG1 3.11Å; L341-T343 VanDerWaalsContact C-N 3.31Å; L341-T343 PolarHBondContact O-N 3.37Å
344	F	89.4	Confident	76.1	Confident	152 Å²	152	96.5 Å²	96.5	67%	0.667	49%	0.488	S	S	*	.	H	α-helix	trans	-67.5	-38.3	172.6	-178.9	-100.3	0	0	0	113.2	K340 L341 F346	K340-F344 PolarHBondContact O-N 3Å; L341-F344 PolarHBondContact O-N 3.47Å; F344-F346 VanDerWaalsContact C-N 3.31Å; F344-F346 PolarHBondContact O-N 2.85Å
345	L	86.3	Confident	73.7	Confident	21 Å²	21	96.4 Å²	96.4	11%	0.11	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	7.8	-179.7	-65.4	173.2	0	0	0	113.7	L341 P342 M347 V451 R454 L455	L341-L345 WeakPolarHBondContact O-CB 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.06Å; L341-L345 PolarHBondContact O-N 2.92Å; P342-L345 CarbonylContact O-C 3.57Å; P342-L345 PolarHBondContact O-N 2.92Å; L345-M347 HydrophobicContact CB-CG 4.01Å; L345-M347 PolarHBondContact O-N 2.86Å; L345-V451 HydrophobicContact CD1-CG1 4.24Å; L345-R454 HydrophobicContact CD1-CB 4.35Å; L345-L455 HydrophobicContact CD1-CB 4.04Å; L345-L455 HydrophobicContact CD2-CD1 4.48Å
346	F	86.8	Confident	71.5	Confident	189 Å²	189	94.6 Å²	94.6	83%	0.829	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	31.2	-176.7	-59.3	-77.6	0	0	0	115	P342 F344	P342-F346 PolarHBondContact O-N 3Å; F344-F346 VanDerWaalsContact C-N 3.31Å; F344-F346 PolarHBondContact O-N 2.85Å
347	M	83.6	Confident	68.9	Low	46 Å²	46	96.2 Å²	96.2	23%	0.227	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-87.2	126	175.4	-52.6	-161.5	98.9	0	0	110.4	P342 L345 V451 R454	P342-M347 HydrophobicContact CB-CB 4.23Å; P342-M347 PolarHBondContact O-N 2.94Å; L345-M347 HydrophobicContact CB-CG 4.01Å; L345-M347 PolarHBondContact O-N 2.86Å; M347-V451 HydrophobicContact SD-CG2 4.32Å; M347-R454 HydrophobicContact CE-CB 4.13Å; M347-R454 HydrophobicContact CE-CG 3.42Å; M347-R454 VanDerWaalsContact CE-CG 3.42Å; M347-R454 HydrophobicContact SD-CB 3.95Å; M347-R454 HydrophobicContact SD-CG 3.83Å
348	K	75.6	Confident	66.3	Low	197 Å²	197	104 Å²	104	86%	0.857	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-91.5	127.2	168.7	-70.1	-178.2	-179.2	176.6	0	108.6	P350	K348-P350 WeakPolarHBondContact O-CD 3.36Å
349	R	73.9	Confident	64	Low	129 Å²	129	106.6 Å²	106.6	49%	0.487	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-60.9	126	173.1	-171.5	172.9	175.6	151.8	3.1	108.1	G351 D444 Y447	R349-G351 VanDerWaalsContact C-N 3.31Å; R349-G351 PolarHBondContact O-N 3.03Å; R349-D444 IonicContact CZ-OD1 3.24Å; R349-D444 VanDerWaalsContact CZ-OD1 3.24Å; R349-D444 IonicContact NH1-OD1 3.13Å; R349-D444 PolarHBondContact NH1-OD1 2.79Å; R349-D444 VanDerWaalsContact NH1-OD1 3.13Å; R349-D444 IonicContact NH2-OD1 2.63Å; R349-D444 PolarHBondContact NH2-OD1 2.88Å; R349-Y447 HydrophobicContact CB-CE2 4.41Å; R349-Y447 HydrophobicContact CG-CE2 4.32Å
350	P	60.8	Low	61.9	Low	106 Å²	106	109.2 Å²	109.2	69%	0.688	58%	0.581	S	S	*	*			trans	-62.7	101.3	164.2	-4.8	18.2	0	0	0	105.9	K348	K348-P350 WeakPolarHBondContact O-CD 3.36Å
351	G	53.2	Low	59.3	Low	48 Å²	48	109.9 Å²	109.9	50%	0.495	59%	0.591	S	S	.	*			trans	-82.8	149.3	174	0	0	0	0	0	109.2	R349 D353	R349-G351 VanDerWaalsContact C-N 3.31Å; R349-G351 PolarHBondContact O-N 3.03Å; G351-D353 PolarHBondContact O-N 2.8Å
352	P	46.9	Very low	57	Low	130 Å²	130	113.7 Å²	113.7	84%	0.844	62%	0.617	S	S	*	*	S	Bend	trans	-57	133.5	160.8	26	-30.8	0	0	0	107.3	S354	P352-S354 PolarHBondContact O-N 2.93Å
353	D	35.1	Very low	54.1	Low	127 Å²	127	119.1 Å²	119.1	68%	0.679	66%	0.655	S	S	*	*			trans	-45	126.1	-171.3	-78.4	-48.6	0	0	0	112.6	G351 S355 L356	G351-D353 PolarHBondContact O-N 2.8Å; D353-S355 WeakPolarHBondContact CB-OG 3.33Å; D353-S355 PolarHBondContact O-N 3.22Å; D353-L356 PolarHBondContact O-N 2.87Å
354	S	36.9	Very low	51.6	Low	94 Å²	94	124 Å²	124	66%	0.657	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	18.1	163.1	59.5	0	0	0	0	114.7	P352	P352-S354 PolarHBondContact O-N 2.93Å
355	S	35.4	Very low	48.8	Very low	82 Å²	82	121.8 Å²	121.8	57%	0.573	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-27.2	173.6	59.5	0	0	0	0	112.8	D353	D353-S355 WeakPolarHBondContact CB-OG 3.33Å; D353-S355 PolarHBondContact O-N 3.22Å
356	L	41.6	Very low	46.2	Very low	144 Å²	144	129.3 Å²	129.3	75%	0.754	71%	0.705	S	S	*	*	S	Bend	trans	-86.1	-27.3	-179.3	-80.7	157.5	0	0	0	113.9	D353 R358	D353-L356 PolarHBondContact O-N 2.87Å; L356-R358 VanDerWaalsContact C-N 3.26Å; L356-R358 PolarHBondContact O-N 2.86Å
357	A	36.4	Very low	43.4	Very low	84 Å²	84	126.8 Å²	126.8	69%	0.694	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-7.9	-179.9	0	0	0	0	0	114.3
358	R	34.9	Very low	40.7	Very low	203 Å²	203	130.3 Å²	130.3	77%	0.766	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-5.7	178.7	-145.1	177.2	-69.1	166	0.8	113.5	L356	L356-R358 VanDerWaalsContact C-N 3.26Å; L356-R358 PolarHBondContact O-N 2.86Å
359	A	37.6	Very low	38.5	Very low	74 Å²	74	130.1 Å²	130.1	61%	0.612	73%	0.729	S	S	*	*	S	Bend	trans	-90.9	-10.8	179.3	0	0	0	0	0	114.4
360	F	39.2	Very low	36.3	Very low	186 Å²	186	130.2 Å²	130.2	82%	0.816	75%	0.746	S	S	*	*			trans	-132.2	72.8	-178.8	-69.2	-79.1	0	0	0	111.7	P362	F360-P362 WeakPolarHBondContact O-CD 3.45Å
361	L	31.1	Very low	34.6	Very low	155 Å²	155	135 Å²	135	81%	0.812	76%	0.756	S	S	*	*			trans	-89.4	117.2	157.8	-77.9	169.2	0	0	0	108.8	S363	L361-S363 PolarHBondContact O-N 2.87Å
362	P	38.8	Very low	33.4	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	77%	0.766	S	S	*	*			trans	-77.2	117.4	160.4	28.3	-23.3	0	0	0	108.2	F360 K364	F360-P362 WeakPolarHBondContact O-CD 3.45Å; P362-K364 PolarHBondContact O-N 2.82Å
363	S	28.6	Very low	32.3	Very low	117 Å²	117	137.4 Å²	137.4	82%	0.818	77%	0.768	S	S	*	*			trans	-59.1	115.2	172.7	-176.4	0	0	0	0	110.1	L361 S365	L361-S363 PolarHBondContact O-N 2.87Å; S363-S365 PolarHBondContact O-N 3.17Å
364	K	31.6	Very low	31.8	Very low	205 Å²	205	137 Å²	137	89%	0.891	77%	0.77	S	S	*	*			trans	-81.6	103.3	169.1	-75.7	-175.7	179.4	179.4	0	108.9	P362	P362-K364 PolarHBondContact O-N 2.82Å
365	S	30.1	Very low	31.2	Very low	106 Å²	106	138.8 Å²	138.8	74%	0.741	78%	0.777	S	S	*	*			trans	-92.9	122.7	160.9	57.7	0	0	0	0	110.2	S363	S363-S365 PolarHBondContact O-N 3.17Å
366	H	31.8	Very low	30.7	Very low	179 Å²	179	139.8 Å²	139.8	83%	0.829	78%	0.784	S	S	*	*			trans	-45.5	131	176.3	-95.4	-101	0	0	0	114.1
367	V	27.4	Very low	29.9	Very low	135 Å²	135	138.8 Å²	138.8	82%	0.818	78%	0.784	S	S	*	*			trans	-87.9	114.5	161.2	173.3	0	0	0	0	107.8
368	T	28.7	Very low	29.5	Very low	121 Å²	121	140.1 Å²	140.1	74%	0.742	79%	0.788	S	S	*	*			trans	-122.8	115.7	167	-35.3	0	0	0	0	107.7
369	K	27.6	Very low	29.3	Very low	192 Å²	192	136.8 Å²	136.8	84%	0.835	79%	0.793	S	S	*	*			trans	-73.3	145.5	170.3	-73.9	179.7	175.6	175.8	0	109.7
370	P	27.8	Very low	29	Very low	131 Å²	131	138.9 Å²	138.9	85%	0.851	80%	0.803	S	S	*	*				-135	168.9	123.9	29.5	-12.6	0	0	0	113.4
371	K	26.6	Very low	28.5	Very low	206 Å²	206	139.4 Å²	139.4	90%	0.896	81%	0.805	S	S	*	*			trans	-101	135.5	-164.8	-149.9	-178.9	-173.4	-177.1	0	110.8
372	A	27.6	Very low	28.4	Very low	86 Å²	86	139.5 Å²	139.5	71%	0.711	81%	0.806	S	S	*	*			trans	52.1	120	149.9	0	0	0	0	0	122.2
373	T	24.6	Very low	27.9	Very low	143 Å²	143	144.9 Å²	144.9	88%	0.877	81%	0.813	S	S	*	*				-165	152.3	112	-1.9	0	0	0	0	112.5
374	T	24.4	Very low	28	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	81%	0.808	S	S	*	*			trans	-43.2	138.4	179.2	40	0	0	0	0	118.7
375	T	23.8	Very low	27.9	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	81%	0.807	S	S	*	*				167.8	130.4	107.2	36.2	0	0	0	0	112.9
376	S	24.1	Very low	27.8	Very low	104 Å²	104	141 Å²	141	73%	0.727	81%	0.809	S	S	*	*			trans	29.5	138.3	146.6	61.3	0	0	0	0	123.9
377	T	25.2	Very low	27.8	Very low	123 Å²	123	140.7 Å²	140.7	76%	0.755	81%	0.81	S	S	*	*			trans	111.2	109.3	137.9	-23.3	0	0	0	0	117.9
378	S	28.1	Very low	28.1	Very low	111 Å²	111	145 Å²	145	78%	0.776	81%	0.814	S	S	*	*			trans	39.2	144.2	142.8	-44.8	0	0	0	0	123.3
379	P	31.8	Very low	28.1	Very low	133 Å²	133	148.3 Å²	148.3	86%	0.864	82%	0.818	S	S	*	*			trans	-98.7	140	-169.5	37.4	-29	0	0	0	113.6
380	S	30	Very low	28.4	Very low	119 Å²	119	145.4 Å²	145.4	83%	0.832	82%	0.816	S	S	*	*			trans	-124.5	122.1	165.3	57.9	0	0	0	0	111.5
381	K	29.6	Very low	28.7	Very low	197 Å²	197	146.1 Å²	146.1	86%	0.857	81%	0.813	S	S	*	*			trans	-41.5	144.5	168.4	-63.9	167.2	174.1	174.2	0	113.4
382	L	28.8	Very low	29.5	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	81%	0.805	S	S	*	*			trans	-165.2	117.1	132	-114.3	129	0	0	0	111.7
383	Y	28.9	Very low	29.8	Very low	227 Å²	227	141.5 Å²	141.5	89%	0.89	80%	0.803	S	S	*	*			trans	38.6	134.6	143.4	-75.4	-101.7	0	0	0	120.2
384	G	30.1	Very low	30.3	Very low	69 Å²	69	140.5 Å²	140.5	71%	0.711	80%	0.802	S	S	*	*			cis	-169.6	155.5	21.2	0	0	0	0	0	113.7
385	N	30	Very low	30.8	Very low	165 Å²	165	139.7 Å²	139.7	88%	0.882	81%	0.807	S	S	*	*			trans	-61.4	148.6	179.9	-74.5	-2.9	0	0	0	114
386	S	27	Very low	31.3	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	81%	0.808	S	S	*	*				-162.5	96.5	112.5	-165.6	0	0	0	0	110.5
387	M	32	Very low	32.4	Very low	172 Å²	172	138.9 Å²	138.9	85%	0.847	81%	0.811	S	S	*	*	S	Bend	trans	-126.5	125.1	159.3	-166.6	178.2	-85.3	0	0	105.1	F389	M387-F389 PolarHBondContact O-N 3.13Å; M387-F389 VanDerWaalsContact O-N 3.09Å
388	Y	33.1	Very low	32.8	Very low	227 Å²	227	143.2 Å²	143.2	89%	0.89	82%	0.819	S	S	*	*			trans	-55.5	112.5	-178.9	-68.9	-92.5	0	0	0	110.1
389	F	29.6	Very low	33.2	Very low	190 Å²	190	143.1 Å²	143.1	83%	0.833	82%	0.818	S	S	*	*			trans	-119.8	117.2	170.9	-138.6	-88.8	0	0	0	108.8	M387	M387-F389 PolarHBondContact O-N 3.13Å; M387-F389 VanDerWaalsContact O-N 3.09Å
390	V	34.1	Very low	33.7	Very low	131 Å²	131	142.8 Å²	142.8	79%	0.794	82%	0.816	S	S	*	*			trans	-64.1	129.2	171.4	175.3	0	0	0	0	108.2	P392	V390-P392 WeakPolarHBondContact O-CD 3.46Å
391	N	32.8	Very low	34.4	Very low	145 Å²	145	142 Å²	142	78%	0.775	82%	0.817	S	S	*	*			trans	-81.1	127.7	-173.8	-160.4	9.8	0	0	0	110.9
392	P	45	Very low	35.2	Very low	115 Å²	115	136 Å²	136	75%	0.747	81%	0.811	S	S	*	*			trans	-116.2	111.2	161	32.6	-16.7	0	0	0	109.8	V390	V390-P392 WeakPolarHBondContact O-CD 3.46Å
393	A	33.7	Very low	36.1	Very low	80 Å²	80	133.2 Å²	133.2	66%	0.661	80%	0.804	S	S	*	*			trans	-136	97.7	166.8	0	0	0	0	0	110.9
394	S	35.3	Very low	36.6	Very low	122 Å²	122	133.2 Å²	133.2	85%	0.853	80%	0.803	S	S	*	*			trans	17.4	115.4	134.1	51.3	0	0	0	0	119.4
395	A	33.1	Very low	37.3	Very low	102 Å²	102	137.2 Å²	137.2	84%	0.843	81%	0.808	S	S	*	*			trans	-114	132.7	148.8	0	0	0	0	0	109.2
396	A	34.8	Very low	38.1	Very low	99 Å²	99	136.3 Å²	136.3	82%	0.818	80%	0.797	S	S	*	*			trans	-75.9	167.4	-177.7	0	0	0	0	0	112.8
397	P	46.8	Very low	38.9	Very low	120 Å²	120	140.2 Å²	140.2	78%	0.779	79%	0.794	S	S	*	*			trans	-97.6	156.5	-150.7	37.5	-34.1	0	0	0	115.2
398	K	33.7	Very low	39.6	Very low	213 Å²	213	139.2 Å²	139.2	93%	0.926	79%	0.791	S	S	*	*			trans	-137.7	119	143.7	-76.8	-173.3	178.8	176.1	0	108.5
399	S	36.5	Very low	40.2	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	79%	0.786	S	S	*	*			trans	-71.5	157.2	175.6	46.5	0	0	0	0	111.3
400	P	42	Very low	41.2	Very low	126 Å²	126	131.7 Å²	131.7	82%	0.818	76%	0.764	S	S	*	*				-131.8	147.3	80.9	24.5	-5.5	0	0	0	115
401	A	45.9	Very low	42.1	Very low	103 Å²	103	129.3 Å²	129.3	85%	0.851	75%	0.753	S	S	*	*			trans	25.8	119.3	147.8	0	0	0	0	0	120.3
402	G	47.2	Very low	43.3	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	74%	0.736	S	S	*	*			trans	122.9	122.8	155.5	0	0	0	0	0	113.5
403	S	45.8	Very low	43.9	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	73%	0.733	S	S	*	*			trans	87.6	45.6	168.5	-53.4	0	0	0	0	118.9
404	R	40.8	Very low	45.3	Very low	228 Å²	228	130.6 Å²	130.6	86%	0.86	73%	0.732	S	S	*	*	S	Bend	trans	-83.6	-9	165.2	-99	-178.6	158.7	177.1	-6.6	115.2
405	D	45.4	Very low	47	Very low	152 Å²	152	134.1 Å²	134.1	81%	0.813	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-6.4	179.5	-62.8	-27.7	0	0	0	114.3
406	F	45.8	Very low	49	Very low	147 Å²	147	134.9 Å²	134.9	65%	0.645	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-33.6	179.9	-169	-104.1	0	0	0	113.6	R409 S410	F406-R409 PolarHBondContact O-N 3.43Å; F406-S410 PolarHBondContact O-N 3.06Å
407	W	43.7	Very low	51	Low	195 Å²	195	134.7 Å²	134.7	74%	0.739	70%	0.698	S	S	*	*	H	α-helix	trans	-78.3	-28.1	-172.5	-77.3	93.6	0	0	0	114.6	R409 S411	W407-R409 VanDerWaalsContact C-N 3.35Å; W407-S411 PolarHBondContact O-N 2.58Å
408	L	46.3	Very low	52.8	Low	150 Å²	150	132 Å²	132	79%	0.785	68%	0.679	S	S	*	*	H	α-helix	trans	-74.5	-25.5	172.6	-88	131.3	0	0	0	112.8
409	R	46	Very low	55.2	Low	206 Å²	206	127.8 Å²	127.8	78%	0.777	66%	0.663	S	S	*	*	H	α-helix	trans	-82.2	-27.5	177	-149.3	172.8	-178	-171.3	-0.1	112.6	F406 W407 R413	F406-R409 PolarHBondContact O-N 3.43Å; W407-R409 VanDerWaalsContact C-N 3.35Å; R409-R413 PolarHBondContact O-N 2.92Å
410	S	49.8	Very low	57.6	Low	54 Å²	54	128 Å²	128	38%	0.378	65%	0.651	S	S	.	*	H	α-helix	trans	-78.1	-37.6	176.1	-170.5	0	0	0	0	113	F406 G412 R413 F414	F406-S410 PolarHBondContact O-N 3.06Å; S410-G412 PolarHBondContact O-N 3.08Å; S410-R413 PolarHBondContact O-N 2.88Å; S410-F414 WeakPolarHBondContact O-CB 3.39Å; S410-F414 PolarHBondContact O-N 2.98Å
411	S	53.5	Low	59.9	Low	80 Å²	80	124.7 Å²	124.7	56%	0.559	64%	0.635	S	S	*	*	H	α-helix	trans	-66	-37	176.8	-179.6	0	0	0	0	113.1	W407 R415	W407-S411 PolarHBondContact O-N 2.58Å; S411-R415 WeakPolarHBondContact O-CB 3.39Å; S411-R415 PolarHBondContact O-N 2.97Å
412	G	57.5	Low	61.8	Low	41 Å²	41	125 Å²	125	42%	0.423	62%	0.622	S	S	.	*	H	α-helix	trans	-65.7	-43.3	172.9	0	0	0	0	0	112.8	S410 R415 Q416	S410-G412 PolarHBondContact O-N 3.08Å; G412-R415 PolarHBondContact O-N 3.02Å; G412-Q416 WeakPolarHBondContact O-CB 3.24Å; G412-Q416 PolarHBondContact O-N 3.38Å
413	R	58.7	Low	63.9	Low	182 Å²	182	128.1 Å²	128.1	69%	0.687	62%	0.617	S	S	*	*	H	α-helix	trans	-63.9	-46.6	174.5	-104	-178.2	176.6	179.9	-3	112.6	R409 S410 R415 Q416 D417	R409-R413 PolarHBondContact O-N 2.92Å; S410-R413 PolarHBondContact O-N 2.88Å; R413-R415 VanDerWaalsContact C-N 3.31Å; R413-R415 PolarHBondContact O-N 3.06Å; R413-Q416 CarbonylContact O-C 3.58Å; R413-Q416 WeakPolarHBondContact O-CA 3.44Å; R413-Q416 WeakPolarHBondContact O-CB 3.33Å; R413-Q416 PolarHBondContact O-N 2.93Å; R413-D417 VanDerWaalsContact O-CG 3.31Å; R413-D417 PolarHBondContact O-N 3.32Å
414	F	63.5	Low	66.1	Low	144 Å²	144	125 Å²	125	63%	0.632	60%	0.6	S	S	*	*	H	α-helix	trans	-62.4	-38.7	177.7	-177.6	-102.4	0	0	0	112.2	S410 Q416 V418	S410-F414 WeakPolarHBondContact O-CB 3.39Å; S410-F414 PolarHBondContact O-N 2.98Å; F414-Q416 VanDerWaalsContact C-N 3.3Å; F414-Q416 PolarHBondContact O-N 3.14Å; F414-V418 HydrophobicContact CD1-CG2 4.29Å; F414-V418 HydrophobicContact CE1-CG2 3.96Å; F414-V418 HydrophobicContact CE2-CG2 4.19Å; F414-V418 HydrophobicContact CZ-CG2 3.91Å; F414-V418 WeakPolarHBondContact O-CB 3.34Å; F414-V418 WeakPolarHBondContact O-CG2 3.23Å; F414-V418 PolarHBondContact O-N 2.97Å
415	R	69.8	Low	68.6	Low	197 Å²	197	118.8 Å²	118.8	74%	0.743	59%	0.587	S	S	*	*	H	α-helix	trans	-66.3	-34.4	173.9	-167.2	-179.4	-122.9	-167.3	-0.5	111.8	S411 G412 R413 Q419	S411-R415 WeakPolarHBondContact O-CB 3.39Å; S411-R415 PolarHBondContact O-N 2.97Å; G412-R415 PolarHBondContact O-N 3.02Å; R413-R415 VanDerWaalsContact C-N 3.31Å; R413-R415 PolarHBondContact O-N 3.06Å; R415-Q419 WeakPolarHBondContact O-CB 3.43Å; R415-Q419 PolarHBondContact O-N 2.89Å
416	Q	74.7	Confident	70.8	Confident	118 Å²	118	115.2 Å²	115.2	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-71.5	-44.8	176.7	-154.9	167.2	5	0	0	111.3	G412 R413 F414 V418 Q419 E420	G412-Q416 WeakPolarHBondContact O-CB 3.24Å; G412-Q416 PolarHBondContact O-N 3.38Å; R413-Q416 CarbonylContact O-C 3.58Å; R413-Q416 WeakPolarHBondContact O-CA 3.44Å; R413-Q416 WeakPolarHBondContact O-CB 3.33Å; R413-Q416 PolarHBondContact O-N 2.93Å; F414-Q416 VanDerWaalsContact C-N 3.3Å; F414-Q416 PolarHBondContact O-N 3.14Å; Q416-V418 PolarHBondContact O-N 3.28Å; Q416-Q419 WeakPolarHBondContact O-CB 3.47Å; Q416-Q419 PolarHBondContact O-N 2.84Å; Q416-E420 WeakPolarHBondContact O-CG 3.15Å; Q416-E420 PolarHBondContact O-N 2.86Å
417	D	77.8	Confident	73.2	Confident	95 Å²	95	115 Å²	115	51%	0.508	57%	0.573	S	S	.	*	H	α-helix	trans	-62.4	-40.3	175.2	-66.8	-16.8	0	0	0	112.1	R413 A421	R413-D417 VanDerWaalsContact O-CG 3.31Å; R413-D417 PolarHBondContact O-N 3.32Å; D417-A421 WeakPolarHBondContact O-CB 3.47Å; D417-A421 PolarHBondContact O-N 3.18Å
418	V	84.6	Confident	75.5	Confident	63 Å²	63	110.3 Å²	110.3	38%	0.382	56%	0.562	S	S	.	*	H	α-helix	trans	-70.8	-36.2	176.1	172.5	0	0	0	0	111.5	F414 Q416 A421 L422	F414-V418 HydrophobicContact CD1-CG2 4.29Å; F414-V418 HydrophobicContact CE1-CG2 3.96Å; F414-V418 HydrophobicContact CE2-CG2 4.19Å; F414-V418 HydrophobicContact CZ-CG2 3.91Å; F414-V418 WeakPolarHBondContact O-CB 3.34Å; F414-V418 WeakPolarHBondContact O-CG2 3.23Å; F414-V418 PolarHBondContact O-N 2.97Å; Q416-V418 PolarHBondContact O-N 3.28Å; V418-A421 PolarHBondContact O-N 2.95Å; V418-L422 HydrophobicContact CG1-CD1 4.04Å; V418-L422 WeakPolarHBondContact O-CB 3.41Å; V418-L422 WeakPolarHBondContact O-CD1 3.43Å; V418-L422 WeakPolarHBondContact O-CG 3.31Å; V418-L422 PolarHBondContact O-N 2.81Å
419	Q	84.6	Confident	77.8	Confident	125 Å²	125	105.9 Å²	105.9	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-65.8	-43.4	174.9	-169.1	81.7	10.3	0	0	111	R415 Q416 L422 E423	R415-Q419 WeakPolarHBondContact O-CB 3.43Å; R415-Q419 PolarHBondContact O-N 2.89Å; Q416-Q419 WeakPolarHBondContact O-CB 3.47Å; Q416-Q419 PolarHBondContact O-N 2.84Å; Q419-L422 PolarHBondContact O-N 2.95Å; Q419-E423 WeakPolarHBondContact O-CB 3.33Å; Q419-E423 PolarHBondContact O-N 2.9Å
420	E	86.9	Confident	80	Confident	112 Å²	112	100.7 Å²	100.7	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-38.8	174.8	-74.7	177.5	-166.8	0	0	111.8	Q416 E423 G424	Q416-E420 WeakPolarHBondContact O-CG 3.15Å; Q416-E420 PolarHBondContact O-N 2.86Å; E420-E423 PolarHBondContact O-N 2.79Å; E420-G424 PolarHBondContact O-N 2.93Å
421	A	88.9	Confident	82.1	Confident	58 Å²	58	103.3 Å²	103.3	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-66.1	-40.7	174.4	0	0	0	0	0	112.6	D417 V418 G424 V425	D417-A421 WeakPolarHBondContact O-CB 3.47Å; D417-A421 PolarHBondContact O-N 3.18Å; V418-A421 PolarHBondContact O-N 2.95Å; A421-G424 PolarHBondContact O-N 2.97Å; A421-V425 WeakPolarHBondContact O-CG2 3.33Å; A421-V425 PolarHBondContact O-N 2.9Å
422	L	87.5	Confident	83.9	Confident	110 Å²	110	104.8 Å²	104.8	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-64.1	-40.8	174.2	-80.6	159.3	0	0	0	111.7	V418 Q419 V425 S426	V418-L422 HydrophobicContact CG1-CD1 4.04Å; V418-L422 WeakPolarHBondContact O-CB 3.41Å; V418-L422 WeakPolarHBondContact O-CD1 3.43Å; V418-L422 WeakPolarHBondContact O-CG 3.31Å; V418-L422 PolarHBondContact O-N 2.81Å; Q419-L422 PolarHBondContact O-N 2.95Å; L422-V425 PolarHBondContact O-N 2.93Å; L422-S426 WeakPolarHBondContact O-CB 3.4Å; L422-S426 PolarHBondContact O-N 2.89Å
423	E	89.9	Confident	85.6	Confident	137 Å²	137	108 Å²	108	64%	0.64	54%	0.539	S	S	*	.	H	α-helix	trans	-65.3	-40.3	174.5	-169.6	171.2	-175	0	0	111.3	Q419 E420 S426 F427	Q419-E423 WeakPolarHBondContact O-CB 3.33Å; Q419-E423 PolarHBondContact O-N 2.9Å; E420-E423 PolarHBondContact O-N 2.79Å; E423-S426 PolarHBondContact O-N 3.37Å; E423-F427 VanDerWaalsContact O-CB 3.32Å; E423-F427 WeakPolarHBondContact O-CB 3.46Å; E423-F427 PolarHBondContact O-N 3.41Å
424	G	92.1	Very high	87.1	Confident	31 Å²	31	102.7 Å²	102.7	32%	0.32	52%	0.524	S	S	.	.	H	α-helix	trans	-60.6	-45.4	173	0	0	0	0	0	113.1	E420 A421 F427 I428	E420-G424 PolarHBondContact O-N 2.93Å; A421-G424 PolarHBondContact O-N 2.97Å; G424-F427 PolarHBondContact O-N 2.61Å; G424-I428 WeakPolarHBondContact O-CD1 3.45Å; G424-I428 WeakPolarHBondContact O-CG1 3.38Å; G424-I428 PolarHBondContact O-N 2.75Å
425	V	93.4	Very high	88.3	Confident	97 Å²	97	100.5 Å²	100.5	59%	0.588	52%	0.519	S	S	*	.	H	α-helix	trans	-65.7	-41.2	175.6	173.7	0	0	0	0	111.3	A421 L422 F427 I428 A429	A421-V425 WeakPolarHBondContact O-CG2 3.33Å; A421-V425 PolarHBondContact O-N 2.9Å; L422-V425 PolarHBondContact O-N 2.93Å; V425-F427 VanDerWaalsContact C-N 3.33Å; V425-F427 PolarHBondContact O-N 3.34Å; V425-I428 PolarHBondContact O-N 3.01Å; V425-A429 WeakPolarHBondContact O-CB 3.4Å; V425-A429 PolarHBondContact O-N 3.07Å
426	S	92.1	Very high	89.4	Confident	77 Å²	77	96.4 Å²	96.4	54%	0.538	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-40.1	175.2	-172.5	0	0	0	0	111.8	L422 E423 Q430	L422-S426 WeakPolarHBondContact O-CB 3.4Å; L422-S426 PolarHBondContact O-N 2.89Å; E423-S426 PolarHBondContact O-N 3.37Å; S426-Q430 WeakPolarHBondContact O-CB 3.44Å; S426-Q430 PolarHBondContact O-N 3.18Å
427	F	95.1	Very high	90.1	Very high	142 Å²	142	95.5 Å²	95.5	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-65.7	-45.8	176.1	178	-93.9	0	0	0	111.4	E423 G424 V425 A429 Q430 H431	E423-F427 VanDerWaalsContact O-CB 3.32Å; E423-F427 WeakPolarHBondContact O-CB 3.46Å; E423-F427 PolarHBondContact O-N 3.41Å; G424-F427 PolarHBondContact O-N 2.61Å; V425-F427 VanDerWaalsContact C-N 3.33Å; V425-F427 PolarHBondContact O-N 3.34Å; F427-A429 PolarHBondContact O-N 3.06Å; F427-Q430 PolarHBondContact O-N 3.29Å; F427-H431 VanDerWaalsContact O-CB 3.25Å; F427-H431 WeakPolarHBondContact O-CB 3.39Å; F427-H431 PolarHBondContact O-N 3.03Å
428	I	93.6	Very high	90.6	Very high	97 Å²	97	94.9 Å²	94.9	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-46.9	176.3	-68	161.9	0	0	0	110.2	G424 V425 Q430 H431 M432	G424-I428 WeakPolarHBondContact O-CD1 3.45Å; G424-I428 WeakPolarHBondContact O-CG1 3.38Å; G424-I428 PolarHBondContact O-N 2.75Å; V425-I428 PolarHBondContact O-N 3.01Å; I428-Q430 VanDerWaalsContact C-N 3.34Å; I428-Q430 PolarHBondContact O-N 2.87Å; I428-H431 PolarHBondContact O-N 3.25Å; I428-M432 HydrophobicContact CG2-CG 4.26Å; I428-M432 HydrophobicContact CG2-SD 3.91Å; I428-M432 WeakPolarHBondContact O-CB 3.39Å; I428-M432 VanDerWaalsContact O-CG 3.26Å; I428-M432 WeakPolarHBondContact O-CG 3.19Å; I428-M432 PolarHBondContact O-N 3.36Å
429	A	93.3	Very high	90.9	Very high	57 Å²	57	96.9 Å²	96.9	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-41.8	178.5	0	0	0	0	0	112.1	V425 F427 K433	V425-A429 WeakPolarHBondContact O-CB 3.4Å; V425-A429 PolarHBondContact O-N 3.07Å; F427-A429 PolarHBondContact O-N 3.06Å; A429-K433 WeakPolarHBondContact O-CB 3.49Å; A429-K433 PolarHBondContact O-N 2.66Å
430	Q	93.1	Very high	91	Very high	98 Å²	98	93.6 Å²	93.6	46%	0.458	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-38.4	177.5	-168.7	65.4	34.1	0	0	112	S426 F427 I428 K433 N434	S426-Q430 WeakPolarHBondContact O-CB 3.44Å; S426-Q430 PolarHBondContact O-N 3.18Å; F427-Q430 PolarHBondContact O-N 3.29Å; I428-Q430 VanDerWaalsContact C-N 3.34Å; I428-Q430 PolarHBondContact O-N 2.87Å; Q430-K433 PolarHBondContact O-N 2.95Å; Q430-N434 PolarHBondContact NE2-OD1 3.16Å; Q430-N434 WeakPolarHBondContact O-CB 3.11Å; Q430-N434 PolarHBondContact O-N 3.13Å; Q430-N434 PolarHBondContact O-OD1 3.07Å
431	H	93.4	Very high	91.2	Very high	108 Å²	108	90.1 Å²	90.1	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-47.7	176.8	-175.1	65.5	0	0	0	111.1	F427 I428 K433 N434 D435	F427-H431 VanDerWaalsContact O-CB 3.25Å; F427-H431 WeakPolarHBondContact O-CB 3.39Å; F427-H431 PolarHBondContact O-N 3.03Å; I428-H431 PolarHBondContact O-N 3.25Å; H431-K433 VanDerWaalsContact C-N 3.29Å; H431-K433 PolarHBondContact O-N 2.72Å; H431-N434 PolarHBondContact O-N 3.11Å; H431-D435 WeakPolarHBondContact O-CB 3.42Å; H431-D435 PolarHBondContact O-N 3.11Å
432	M	91.8	Very high	91.2	Very high	111 Å²	111	89 Å²	89	55%	0.547	47%	0.474	S	S	.	.	H	α-helix	trans	-57.9	-42.1	173.7	-71.8	-178.5	71.8	0	0	111.5	I428 D435 D436	I428-M432 HydrophobicContact CG2-CG 4.26Å; I428-M432 HydrophobicContact CG2-SD 3.91Å; I428-M432 WeakPolarHBondContact O-CB 3.39Å; I428-M432 VanDerWaalsContact O-CG 3.26Å; I428-M432 WeakPolarHBondContact O-CG 3.19Å; I428-M432 PolarHBondContact O-N 3.36Å; M432-D435 PolarHBondContact O-N 2.69Å; M432-D436 WeakPolarHBondContact O-CB 3.17Å; M432-D436 VanDerWaalsContact O-CG 3.32Å; M432-D436 PolarHBondContact O-N 2.82Å
433	K	92.3	Very high	91.3	Very high	110 Å²	110	89 Å²	89	48%	0.478	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-44.4	177	-176	-178.6	176.7	-172.8	0	112.6	A429 Q430 H431 D435 D436 E437	A429-K433 WeakPolarHBondContact O-CB 3.49Å; A429-K433 PolarHBondContact O-N 2.66Å; Q430-K433 PolarHBondContact O-N 2.95Å; H431-K433 VanDerWaalsContact C-N 3.29Å; H431-K433 PolarHBondContact O-N 2.72Å; K433-D435 VanDerWaalsContact C-N 3.33Å; K433-D436 PolarHBondContact O-N 3.3Å; K433-E437 VanDerWaalsContact CE-OE1 3.27Å; K433-E437 WeakPolarHBondContact CE-OE1 3.14Å; K433-E437 WeakPolarHBondContact O-CG 3.39Å; K433-E437 PolarHBondContact O-N 2.84Å
434	N	90.8	Very high	91.4	Very high	70 Å²	70	83.5 Å²	83.5	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-66.4	-38.3	178.2	-67.8	-6.1	0	0	0	111.1	Q430 H431 E437 D438	Q430-N434 PolarHBondContact NE2-OD1 3.16Å; Q430-N434 WeakPolarHBondContact O-CB 3.11Å; Q430-N434 PolarHBondContact O-N 3.13Å; Q430-N434 PolarHBondContact O-OD1 3.07Å; H431-N434 PolarHBondContact O-N 3.11Å; N434-E437 PolarHBondContact O-N 2.89Å; N434-D438 WeakPolarHBondContact O-CB 3.32Å; N434-D438 PolarHBondContact O-N 2.94Å
435	D	89.6	Confident	91.3	Very high	97 Å²	97	82.3 Å²	82.3	52%	0.519	43%	0.432	S	S	.	.	H	α-helix	trans	-66	-41.3	176.6	-156.4	45.1	0	0	0	111.3	H431 M432 K433 D438 Q439	H431-D435 WeakPolarHBondContact O-CB 3.42Å; H431-D435 PolarHBondContact O-N 3.11Å; M432-D435 PolarHBondContact O-N 2.69Å; K433-D435 VanDerWaalsContact C-N 3.33Å; D435-D438 PolarHBondContact O-N 3.26Å; D435-Q439 VanDerWaalsContact O-CB 3.25Å; D435-Q439 WeakPolarHBondContact O-CB 3.19Å; D435-Q439 PolarHBondContact O-N 3.28Å
436	D	91.2	Very high	91.2	Very high	111 Å²	111	81.4 Å²	81.4	59%	0.594	42%	0.42	S	S	*	.	H	α-helix	trans	-62.3	-41	172	-76.7	-20	0	0	0	112	M432 K433 S440	M432-D436 WeakPolarHBondContact O-CB 3.17Å; M432-D436 VanDerWaalsContact O-CG 3.32Å; M432-D436 PolarHBondContact O-N 2.82Å; K433-D436 PolarHBondContact O-N 3.3Å; D436-S440 WeakPolarHBondContact O-CB 3.49Å; D436-S440 PolarHBondContact O-N 3.05Å
437	E	89.8	Confident	91.2	Very high	100 Å²	100	78.8 Å²	78.8	47%	0.467	40%	0.399	S	S	.	.	H	α-helix	trans	-64	-46.3	175.6	-77.4	-179	-170	0	0	111.2	K433 N434 S440 V441	K433-E437 VanDerWaalsContact CE-OE1 3.27Å; K433-E437 WeakPolarHBondContact CE-OE1 3.14Å; K433-E437 WeakPolarHBondContact O-CG 3.39Å; K433-E437 PolarHBondContact O-N 2.84Å; N434-E437 PolarHBondContact O-N 2.89Å; E437-S440 PolarHBondContact O-N 3.42Å; E437-S440 PolarHBondContact O-OG 3.05Å; E437-V441 WeakPolarHBondContact O-CG2 3.31Å; E437-V441 PolarHBondContact O-N 3.02Å
438	D	89.6	Confident	91	Very high	82 Å²	82	72.2 Å²	72.2	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-63.4	-43.1	177.3	-80	-21.8	0	0	0	111.7	P324 N434 D435 S440 V441 V442	P324-D438 HydrophobicContact CG-CB 4.2Å; P324-D438 WeakPolarHBondContact CG-O 3.37Å; N434-D438 WeakPolarHBondContact O-CB 3.32Å; N434-D438 PolarHBondContact O-N 2.94Å; D435-D438 PolarHBondContact O-N 3.26Å; D438-S440 VanDerWaalsContact C-N 3.33Å; D438-S440 PolarHBondContact O-N 2.91Å; D438-V441 PolarHBondContact O-N 2.82Å; D438-V442 WeakPolarHBondContact O-CG2 3.47Å; D438-V442 PolarHBondContact O-N 3.43Å
439	Q	89	Confident	90.9	Very high	104 Å²	104	67.6 Å²	67.6	49%	0.486	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-42	175.9	-174	69.8	-8.9	0	0	111.4	D435 V441 V442 E443	D435-Q439 VanDerWaalsContact O-CB 3.25Å; D435-Q439 WeakPolarHBondContact O-CB 3.19Å; D435-Q439 PolarHBondContact O-N 3.28Å; Q439-V441 VanDerWaalsContact C-N 3.27Å; Q439-V441 PolarHBondContact O-N 2.87Å; Q439-V442 PolarHBondContact O-N 2.86Å; Q439-E443 WeakPolarHBondContact O-CG 3.36Å; Q439-E443 PolarHBondContact O-N 2.88Å
440	S	88.6	Confident	90.8	Very high	57 Å²	57	69.5 Å²	69.5	40%	0.399	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-34.6	177.4	79.2	0	0	0	0	112.9	D436 E437 D438 D444	D436-S440 WeakPolarHBondContact O-CB 3.49Å; D436-S440 PolarHBondContact O-N 3.05Å; E437-S440 PolarHBondContact O-N 3.42Å; E437-S440 PolarHBondContact O-OG 3.05Å; D438-S440 VanDerWaalsContact C-N 3.33Å; D438-S440 PolarHBondContact O-N 2.91Å; S440-D444 PolarHBondContact O-N 2.79Å
441	V	89.8	Confident	90.8	Very high	39 Å²	39	64.9 Å²	64.9	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-74.5	-36.6	176.9	176	0	0	0	0	111.2	P324 E437 D438 Q439 D444 W445	P324-V441 HydrophobicContact CB-CG1 4.24Å; P324-V441 HydrophobicContact CG-CB 3.9Å; P324-V441 HydrophobicContact CG-CG1 3.87Å; E437-V441 WeakPolarHBondContact O-CG2 3.31Å; E437-V441 PolarHBondContact O-N 3.02Å; D438-V441 PolarHBondContact O-N 2.82Å; Q439-V441 VanDerWaalsContact C-N 3.27Å; Q439-V441 PolarHBondContact O-N 2.87Å; V441-D444 WeakPolarHBondContact O-CB 3.36Å; V441-D444 PolarHBondContact O-N 2.85Å; V441-W445 VanDerWaalsContact O-CD1 3.26Å; V441-W445 PolarHBondContact O-N 3.39Å
442	V	90	Very high	90.7	Very high	34 Å²	34	60.5 Å²	60.5	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-45.1	171.6	173.9	0	0	0	0	110.6	P324 D438 Q439 D444 W445 K446	P324-V442 HydrophobicContact CG-CG2 4.03Å; D438-V442 WeakPolarHBondContact O-CG2 3.47Å; D438-V442 PolarHBondContact O-N 3.43Å; Q439-V442 PolarHBondContact O-N 2.86Å; V442-D444 VanDerWaalsContact C-N 3.31Å; V442-D444 PolarHBondContact O-N 2.91Å; V442-W445 WeakPolarHBondContact O-CB 3.4Å; V442-W445 PolarHBondContact O-N 3.18Å; V442-W445 VanDerWaalsContact O-N 3.13Å; V442-K446 WeakPolarHBondContact O-CG 3.29Å; V442-K446 PolarHBondContact O-N 3.17Å
443	E	89.1	Confident	90.7	Very high	111 Å²	111	55.6 Å²	55.6	52%	0.519	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-39.3	175.6	-72.7	-177.9	-179.3	0	0	112.2	Q439 W445 K446 Y447	Q439-E443 WeakPolarHBondContact O-CG 3.36Å; Q439-E443 PolarHBondContact O-N 2.88Å; E443-W445 PolarHBondContact O-N 2.94Å; E443-K446 PolarHBondContact O-N 2.99Å; E443-Y447 WeakPolarHBondContact O-CB 3.43Å; E443-Y447 PolarHBondContact O-N 3.05Å
444	D	91	Very high	90.7	Very high	21 Å²	21	53.2 Å²	53.2	11%	0.112	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-43.6	172.2	-92.6	-9.7	0	0	0	111.7	M329 R349 S440 V441 V442 Y447 V448	M329-D444 HydrophobicContact CE-CB 3.99Å; M329-D444 HydrophobicContact SD-CB 3.92Å; R349-D444 IonicContact CZ-OD1 3.24Å; R349-D444 VanDerWaalsContact CZ-OD1 3.24Å; R349-D444 IonicContact NH1-OD1 3.13Å; R349-D444 PolarHBondContact NH1-OD1 2.79Å; R349-D444 VanDerWaalsContact NH1-OD1 3.13Å; R349-D444 IonicContact NH2-OD1 2.63Å; R349-D444 PolarHBondContact NH2-OD1 2.88Å; S440-D444 PolarHBondContact O-N 2.79Å; V441-D444 WeakPolarHBondContact O-CB 3.36Å; V441-D444 PolarHBondContact O-N 2.85Å; V442-D444 VanDerWaalsContact C-N 3.31Å; V442-D444 PolarHBondContact O-N 2.91Å; D444-Y447 PolarHBondContact O-N 3.44Å; D444-V448 WeakPolarHBondContact O-CG2 3.42Å; D444-V448 PolarHBondContact O-N 3.25Å
445	W	91.8	Very high	90.8	Very high	6 Å²	6	52.1 Å²	52.1	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-43.3	175.4	-81.5	115.1	0	0	0	112.7	V319 R322 H327 M329 V441 V442 E443 Y447 V448 A449	V319-W445 HydrophobicContact CG1-CE3 3.83Å; V319-W445 HydrophobicContact CG1-CZ3 4.11Å; R322-W445 HydrophobicContact CB-CD2 3.82Å; R322-W445 HydrophobicContact CB-CE3 4.22Å; R322-W445 HydrophobicContact CB-CG 4Å; H327-W445 HydrophobicContact CB-CZ2 4.26Å; M329-W445 HydrophobicContact CB-CZ2 4.2Å; M329-W445 HydrophobicContact CE-CD2 4.07Å; M329-W445 HydrophobicContact CE-CE3 4.25Å; M329-W445 HydrophobicContact CE-CG 4.37Å; M329-W445 HydrophobicContact CG-CD2 4Å; M329-W445 HydrophobicContact CG-CH2 4.01Å; M329-W445 HydrophobicContact CG-CZ2 3.32Å; V441-W445 VanDerWaalsContact O-CD1 3.26Å; V441-W445 PolarHBondContact O-N 3.39Å; V442-W445 WeakPolarHBondContact O-CB 3.4Å; V442-W445 PolarHBondContact O-N 3.18Å; V442-W445 VanDerWaalsContact O-N 3.13Å; E443-W445 PolarHBondContact O-N 2.94Å; W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.17Å; W445-V448 PolarHBondContact O-N 3.04Å; W445-A449 PolarHBondContact O-N 3.22Å
446	K	91.1	Very high	90.9	Very high	77 Å²	77	50.7 Å²	50.7	34%	0.335	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-41.5	174.8	-69.2	-170.9	175.2	-158.2	0	111.5	D259 V442 E443 A449 M450	D259-K446 IonicContact OD1-NZ 3.84Å; D259-K446 PolarHBondContact OD1-NZ 2.69Å; D259-K446 VanDerWaalsContact OD1-NZ 3.14Å; V442-K446 WeakPolarHBondContact O-CG 3.29Å; V442-K446 PolarHBondContact O-N 3.17Å; E443-K446 PolarHBondContact O-N 2.99Å; K446-A449 PolarHBondContact O-N 3.05Å; K446-M450 PolarHBondContact O-N 2.64Å
447	Y	90.9	Very high	91	Very high	22 Å²	22	46.4 Å²	46.4	9%	0.086	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-42.2	175.7	-172.6	-99.5	0	0	0	111.9	L338 P342 R349 E443 D444 W445 A449 M450 V451	L338-Y447 HydrophobicContact CD2-CD1 3.63Å; L338-Y447 HydrophobicContact CD2-CE1 4.31Å; P342-Y447 HydrophobicContact CB-CE1 4.44Å; P342-Y447 WeakPolarHBondContact CB-OH 3.27Å; P342-Y447 HydrophobicContact CG-CE1 3.89Å; R349-Y447 HydrophobicContact CB-CE2 4.41Å; R349-Y447 HydrophobicContact CG-CE2 4.32Å; E443-Y447 WeakPolarHBondContact O-CB 3.43Å; E443-Y447 PolarHBondContact O-N 3.05Å; D444-Y447 PolarHBondContact O-N 3.44Å; W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.17Å; Y447-A449 VanDerWaalsContact C-N 3.33Å; Y447-A449 PolarHBondContact O-N 3.06Å; Y447-M450 WeakPolarHBondContact O-CB 3.46Å; Y447-M450 PolarHBondContact O-N 2.99Å; Y447-V451 HydrophobicContact CD1-CG2 3.97Å; Y447-V451 HydrophobicContact CE1-CG2 3.65Å; Y447-V451 VanDerWaalsContact O-CG2 3.27Å; Y447-V451 WeakPolarHBondContact O-CG2 3.16Å; Y447-V451 PolarHBondContact O-N 3.05Å
448	V	92	Very high	91.1	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-57.8	-46.4	172.8	170.9	0	0	0	0	110.8	V319 M329 V333 F337 L338 D444 W445 M450 V451 V452	V319-V448 HydrophobicContact CG1-CG1 4.03Å; M329-V448 HydrophobicContact CE-CG2 3.68Å; V333-V448 HydrophobicContact CG1-CG1 4.29Å; V333-V448 HydrophobicContact CG1-CG2 4.35Å; F337-V448 HydrophobicContact CB-CB 4.44Å; F337-V448 HydrophobicContact CB-CG1 3.92Å; F337-V448 HydrophobicContact CB-CG2 3.98Å; F337-V448 HydrophobicContact CG-CG1 4.09Å; L338-V448 HydrophobicContact CD2-CG2 3.62Å; L338-V448 HydrophobicContact CG-CG2 4.18Å; D444-V448 WeakPolarHBondContact O-CG2 3.42Å; D444-V448 PolarHBondContact O-N 3.25Å; W445-V448 PolarHBondContact O-N 3.04Å; V448-M450 VanDerWaalsContact C-N 3.33Å; V448-M450 PolarHBondContact O-N 2.72Å; V448-V451 PolarHBondContact O-N 2.85Å; V448-V452 HydrophobicContact CG1-CG2 4.34Å; V448-V452 VanDerWaalsContact O-CG2 3.25Å; V448-V452 WeakPolarHBondContact O-CG2 3.37Å; V448-V452 PolarHBondContact O-N 2.83Å
449	A	91.9	Very high	91.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-43.5	177.1	0	0	0	0	0	111.8	V316 V319 H320 W445 K446 Y447 V451 V452 D453	V316-A449 HydrophobicContact CG1-CB 4.22Å; V319-A449 HydrophobicContact CB-CB 4.46Å; V319-A449 HydrophobicContact CG1-CB 4.18Å; H320-A449 HydrophobicContact CB-CB 3.82Å; W445-A449 PolarHBondContact O-N 3.22Å; K446-A449 PolarHBondContact O-N 3.05Å; Y447-A449 VanDerWaalsContact C-N 3.33Å; Y447-A449 PolarHBondContact O-N 3.06Å; A449-V451 PolarHBondContact O-N 3.24Å; A449-V452 PolarHBondContact O-N 3.09Å; A449-D453 WeakPolarHBondContact O-CB 3.44Å; A449-D453 PolarHBondContact O-N 3.17Å
450	M	90.8	Very high	91.4	Very high	97 Å²	97	44.4 Å²	44.4	48%	0.478	22%	0.216	S	C	.	.	H	α-helix	trans	-62	-41.7	176.5	-171.9	-174.8	-62.3	0	0	112.6	K446 Y447 V448 D453 R454	K446-M450 PolarHBondContact O-N 2.64Å; Y447-M450 WeakPolarHBondContact O-CB 3.46Å; Y447-M450 PolarHBondContact O-N 2.99Å; V448-M450 VanDerWaalsContact C-N 3.33Å; V448-M450 PolarHBondContact O-N 2.72Å; M450-D453 WeakPolarHBondContact O-CB 3.24Å; M450-D453 PolarHBondContact O-N 3.23Å; M450-R454 WeakPolarHBondContact O-CG 3.29Å; M450-R454 PolarHBondContact O-N 3.42Å; M450-R454 VanDerWaalsContact O-N 3.09Å
451	V	92	Very high	91.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-42.2	178	173.1	0	0	0	0	111	F337 L341 P342 L345 M347 Y447 V448 A449 D453 R454 L455	F337-V451 HydrophobicContact CD1-CG1 4.44Å; L341-V451 HydrophobicContact CB-CG1 3.79Å; P342-V451 HydrophobicContact CG-CG1 4.15Å; P342-V451 HydrophobicContact CG-CG2 3.81Å; L345-V451 HydrophobicContact CD1-CG1 4.24Å; M347-V451 HydrophobicContact SD-CG2 4.32Å; Y447-V451 HydrophobicContact CD1-CG2 3.97Å; Y447-V451 HydrophobicContact CE1-CG2 3.65Å; Y447-V451 VanDerWaalsContact O-CG2 3.27Å; Y447-V451 WeakPolarHBondContact O-CG2 3.16Å; Y447-V451 PolarHBondContact O-N 3.05Å; V448-V451 PolarHBondContact O-N 2.85Å; A449-V451 PolarHBondContact O-N 3.24Å; V451-D453 VanDerWaalsContact C-N 3.33Å; V451-R454 PolarHBondContact O-N 3.45Å; V451-L455 PolarHBondContact O-N 3.36Å
452	V	92.1	Very high	91.7	Very high	17 Å²	17	48.2 Å²	48.2	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-44.3	175.3	175.9	0	0	0	0	110.3	V316 F337 V448 A449 R454 L455 F456	V316-V452 HydrophobicContact CG2-CB 4.33Å; V316-V452 HydrophobicContact CG2-CG1 3.71Å; F337-V452 HydrophobicContact CD1-CG2 3.67Å; F337-V452 HydrophobicContact CE1-CG2 3.48Å; F337-V452 VanDerWaalsContact CE1-CG2 3.48Å; F337-V452 HydrophobicContact CZ-CG2 4.26Å; V448-V452 HydrophobicContact CG1-CG2 4.34Å; V448-V452 VanDerWaalsContact O-CG2 3.25Å; V448-V452 WeakPolarHBondContact O-CG2 3.37Å; V448-V452 PolarHBondContact O-N 2.83Å; A449-V452 PolarHBondContact O-N 3.09Å; V452-R454 VanDerWaalsContact C-N 3.29Å; V452-R454 PolarHBondContact O-N 2.98Å; V452-L455 WeakPolarHBondContact O-CB 3.46Å; V452-L455 PolarHBondContact O-N 3.21Å; V452-F456 HydrophobicContact CG1-CD2 3.63Å; V452-F456 HydrophobicContact CG1-CE2 3.52Å; V452-F456 WeakPolarHBondContact O-CD2 3.5Å; V452-F456 PolarHBondContact O-N 2.94Å
453	D	92.4	Very high	91.8	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.043	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-43.1	178.5	-148.7	31.5	0	0	0	112	F254 K263 V316 A449 M450 V451 F456 L457	F254-D453 WeakPolarHBondContact CD1-OD1 3.41Å; F254-D453 VanDerWaalsContact O-OD2 3.05Å; K263-D453 IonicContact NZ-OD1 2.87Å; K263-D453 PolarHBondContact NZ-OD1 3.2Å; K263-D453 IonicContact NZ-OD2 3.82Å; K263-D453 PolarHBondContact NZ-OD2 3.24Å; V316-D453 HydrophobicContact CG1-CB 4.28Å; A449-D453 WeakPolarHBondContact O-CB 3.44Å; A449-D453 PolarHBondContact O-N 3.17Å; M450-D453 WeakPolarHBondContact O-CB 3.24Å; M450-D453 PolarHBondContact O-N 3.23Å; V451-D453 VanDerWaalsContact C-N 3.33Å; D453-F456 PolarHBondContact O-N 2.99Å; D453-L457 WeakPolarHBondContact O-CB 3.23Å; D453-L457 PolarHBondContact O-N 3.35Å
454	R	91.6	Very high	91.9	Very high	59 Å²	59	44.2 Å²	44.2	22%	0.223	21%	0.21	C	C	.	.	H	α-helix	trans	-72.4	-35.3	-179	-65.4	-84.1	179.7	-162.6	-4.4	112.7	L345 M347 M450 V451 V452 L457 W458	L345-R454 HydrophobicContact CD1-CB 4.35Å; M347-R454 HydrophobicContact CE-CB 4.13Å; M347-R454 HydrophobicContact CE-CG 3.42Å; M347-R454 VanDerWaalsContact CE-CG 3.42Å; M347-R454 HydrophobicContact SD-CB 3.95Å; M347-R454 HydrophobicContact SD-CG 3.83Å; M450-R454 WeakPolarHBondContact O-CG 3.29Å; M450-R454 PolarHBondContact O-N 3.42Å; M450-R454 VanDerWaalsContact O-N 3.09Å; V451-R454 PolarHBondContact O-N 3.45Å; V452-R454 VanDerWaalsContact C-N 3.29Å; V452-R454 PolarHBondContact O-N 2.98Å; R454-L457 WeakPolarHBondContact O-CB 3.49Å; R454-L457 PolarHBondContact O-N 3.07Å; R454-W458 PolarHBondContact O-N 3.05Å
455	L	92.4	Very high	91.8	Very high	48 Å²	48	46.9 Å²	46.9	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-59.2	-51.6	171.1	178.2	65.5	0	0	0	110.2	L341 L345 V451 V452 L457 W458 V459	L341-L455 HydrophobicContact CD2-CD1 4.01Å; L341-L455 HydrophobicContact CD2-CD2 4.12Å; L345-L455 HydrophobicContact CD1-CB 4.04Å; L345-L455 HydrophobicContact CD2-CD1 4.48Å; V451-L455 PolarHBondContact O-N 3.36Å; V452-L455 WeakPolarHBondContact O-CB 3.46Å; V452-L455 PolarHBondContact O-N 3.21Å; L455-L457 VanDerWaalsContact C-N 3.34Å; L455-L457 PolarHBondContact O-N 3.23Å; L455-W458 PolarHBondContact O-N 3.14Å; L455-V459 WeakPolarHBondContact O-CG2 3.28Å; L455-V459 PolarHBondContact O-N 3.07Å; L455-V459 VanDerWaalsContact O-N 3.15Å
456	F	92.4	Very high	91.8	Very high	66 Å²	66	51.2 Å²	51.2	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-65.8	-37	179.9	-77.5	-67.5	0	0	0	112	F254 T312 V452 D453 W458 V459 F460	F254-F456 HydrophobicContact CD1-CB 4.18Å; F254-F456 HydrophobicContact CE1-CB 3.97Å; F254-F456 HydrophobicContact CZ-CB 4.48Å; T312-F456 HydrophobicContact CG2-CB 4.03Å; T312-F456 HydrophobicContact CG2-CD1 3.86Å; T312-F456 HydrophobicContact CG2-CD2 3.24Å; T312-F456 HydrophobicContact CG2-CE1 4.09Å; T312-F456 HydrophobicContact CG2-CE2 3.5Å; T312-F456 HydrophobicContact CG2-CG 3.44Å; T312-F456 VanDerWaalsContact CG2-CG 3.44Å; T312-F456 HydrophobicContact CG2-CZ 3.93Å; V452-F456 HydrophobicContact CG1-CD2 3.63Å; V452-F456 HydrophobicContact CG1-CE2 3.52Å; V452-F456 WeakPolarHBondContact O-CD2 3.5Å; V452-F456 PolarHBondContact O-N 2.94Å; D453-F456 PolarHBondContact O-N 2.99Å; F456-W458 VanDerWaalsContact C-N 3.34Å; F456-W458 PolarHBondContact O-N 3.14Å; F456-V459 PolarHBondContact O-N 2.82Å; F456-F460 HydrophobicContact CB-CD2 4.14Å; F456-F460 HydrophobicContact CB-CE2 4.34Å; F456-F460 HydrophobicContact CD1-CE2 4.13Å; F456-F460 WeakPolarHBondContact O-CB 3.36Å; F456-F460 VanDerWaalsContact O-CD2 3.22Å; F456-F460 WeakPolarHBondContact O-CD2 3.27Å; F456-F460 PolarHBondContact O-N 2.68Å
457	L	92.9	Very high	91.6	Very high	22 Å²	22	48.2 Å²	48.2	12%	0.115	24%	0.241	C	C	.	.	H	α-helix	trans	-50.5	-53.1	172.1	-174.1	156.1	0	0	0	111.3	F254 Y255 D453 R454 L455 V459 F460 V461	F254-L457 HydrophobicContact CB-CB 3.74Å; F254-L457 HydrophobicContact CB-CD1 4.15Å; F254-L457 HydrophobicContact CB-CG 4.16Å; Y255-L457 HydrophobicContact CD2-CD1 4.28Å; D453-L457 WeakPolarHBondContact O-CB 3.23Å; D453-L457 PolarHBondContact O-N 3.35Å; R454-L457 WeakPolarHBondContact O-CB 3.49Å; R454-L457 PolarHBondContact O-N 3.07Å; L455-L457 VanDerWaalsContact C-N 3.34Å; L455-L457 PolarHBondContact O-N 3.23Å; L457-V459 PolarHBondContact O-N 3.22Å; L457-F460 PolarHBondContact O-N 3.12Å; L457-V461 HydrophobicContact CD2-CG2 3.89Å; L457-V461 WeakPolarHBondContact O-CB 3.47Å; L457-V461 WeakPolarHBondContact O-CG2 3.25Å; L457-V461 PolarHBondContact O-N 3.48Å
458	W	92.2	Very high	91.4	Very high	156 Å²	156	48.9 Å²	48.9	59%	0.591	25%	0.247	S	C	*	.	H	α-helix	trans	-64.6	-39.5	-179.4	-76.4	111.5	0	0	0	113	R454 L455 F456 F462	R454-W458 PolarHBondContact O-N 3.05Å; L455-W458 PolarHBondContact O-N 3.14Å; F456-W458 VanDerWaalsContact C-N 3.34Å; F456-W458 PolarHBondContact O-N 3.14Å; W458-F462 WeakPolarHBondContact O-CB 3.28Å; W458-F462 PolarHBondContact O-N 3.02Å
459	V	92.2	Very high	91.1	Very high	70 Å²	70	52.3 Å²	52.3	42%	0.424	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-49.1	175.5	173.1	0	0	0	0	110.7	L455 F456 L457 F462 V463	L455-V459 WeakPolarHBondContact O-CG2 3.28Å; L455-V459 PolarHBondContact O-N 3.07Å; L455-V459 VanDerWaalsContact O-N 3.15Å; F456-V459 PolarHBondContact O-N 2.82Å; L457-V459 PolarHBondContact O-N 3.22Å; V459-F462 PolarHBondContact O-N 2.91Å; V459-V463 HydrophobicContact CG1-CG2 4.44Å; V459-V463 WeakPolarHBondContact O-CB 3.44Å; V459-V463 VanDerWaalsContact O-CG2 3.27Å; V459-V463 WeakPolarHBondContact O-CG2 3.43Å; V459-V463 PolarHBondContact O-N 3.41Å
460	F	92.4	Very high	90.8	Very high	18 Å²	18	54.5 Å²	54.5	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-39.1	-179.5	-85.2	-79.9	0	0	0	112.4	F254 L305 F308 F456 L457 C464	F254-F460 HydrophobicContact CD2-CB 4.46Å; F254-F460 HydrophobicContact CD2-CD2 4.3Å; F254-F460 HydrophobicContact CD2-CG 4.49Å; F254-F460 HydrophobicContact CE1-CD2 4.26Å; F254-F460 HydrophobicContact CE1-CE2 4.26Å; F254-F460 HydrophobicContact CE2-CB 4.03Å; F254-F460 HydrophobicContact CE2-CD1 4.26Å; F254-F460 AromaticContact CE2-CD2 3.38Å; F254-F460 HydrophobicContact CE2-CD2 3.38Å; F254-F460 AromaticContact CE2-CE2 3.87Å; F254-F460 HydrophobicContact CE2-CE2 3.87Å; F254-F460 AromaticContact CE2-CG 3.63Å; F254-F460 HydrophobicContact CE2-CG 3.63Å; F254-F460 HydrophobicContact CE2-CZ 4.49Å; F254-F460 AromaticContact CZ-CD2 3.35Å; F254-F460 HydrophobicContact CZ-CD2 3.35Å; F254-F460 AromaticContact CZ-CE2 3.38Å; F254-F460 HydrophobicContact CZ-CE2 3.38Å; F254-F460 HydrophobicContact CZ-CG 4.06Å; F254-F460 HydrophobicContact CZ-CZ 4.08Å; L305-F460 HydrophobicContact CD1-CD1 3.46Å; L305-F460 VanDerWaalsContact CD1-CD1 3.46Å; L305-F460 HydrophobicContact CD1-CE1 3.52Å; L305-F460 HydrophobicContact CD2-CD1 4.19Å; L305-F460 HydrophobicContact CG-CD1 3.61Å; L305-F460 HydrophobicContact CG-CE1 3.71Å; L305-F460 WeakPolarHBondContact O-CE1 3.32Å; F308-F460 HydrophobicContact CB-CE1 4.39Å; F308-F460 HydrophobicContact CB-CZ 4.06Å; F456-F460 HydrophobicContact CB-CD2 4.14Å; F456-F460 HydrophobicContact CB-CE2 4.34Å; F456-F460 HydrophobicContact CD1-CE2 4.13Å; F456-F460 WeakPolarHBondContact O-CB 3.36Å; F456-F460 VanDerWaalsContact O-CD2 3.22Å; F456-F460 WeakPolarHBondContact O-CD2 3.27Å; F456-F460 PolarHBondContact O-N 2.68Å; L457-F460 PolarHBondContact O-N 3.12Å; F460-C464 WeakPolarHBondContact O-CB 3.26Å; F460-C464 PolarHBondContact O-N 3.25Å
461	V	92.3	Very high	90.5	Very high	42 Å²	42	51.8 Å²	51.8	26%	0.255	28%	0.278	S	S	.	.	H	α-helix	trans	-57.8	-50.7	172.4	168	0	0	0	0	110.2	I251 L457 C464 V465	I251-V461 HydrophobicContact CG2-CG2 3.42Å; I251-V461 VanDerWaalsContact CG2-CG2 3.42Å; L457-V461 HydrophobicContact CD2-CG2 3.89Å; L457-V461 WeakPolarHBondContact O-CB 3.47Å; L457-V461 WeakPolarHBondContact O-CG2 3.25Å; L457-V461 PolarHBondContact O-N 3.48Å; V461-C464 PolarHBondContact O-N 3.49Å; V461-V465 HydrophobicContact CG1-CG2 4.34Å; V461-V465 WeakPolarHBondContact O-CB 3.47Å; V461-V465 VanDerWaalsContact O-CG2 3.28Å; V461-V465 WeakPolarHBondContact O-CG2 3.16Å; V461-V465 PolarHBondContact O-N 2.91Å
462	F	92.6	Very high	89.9	Confident	133 Å²	133	54.1 Å²	54.1	58%	0.583	29%	0.288	S	S	*	.	H	α-helix	trans	-62.6	-46.9	-178.7	-177.3	-105.2	0	0	0	112.1	W458 V459 C464 V465 L466	W458-F462 WeakPolarHBondContact O-CB 3.28Å; W458-F462 PolarHBondContact O-N 3.02Å; V459-F462 PolarHBondContact O-N 2.91Å; F462-C464 VanDerWaalsContact C-N 3.33Å; F462-C464 PolarHBondContact O-N 3.06Å; F462-V465 PolarHBondContact O-N 3.09Å; F462-L466 HydrophobicContact CD1-CD1 3.81Å; F462-L466 HydrophobicContact CD1-CG 4.42Å; F462-L466 HydrophobicContact CD2-CD1 4.45Å; F462-L466 HydrophobicContact CD2-CG 4.44Å; F462-L466 HydrophobicContact CE1-CD1 3.21Å; F462-L466 HydrophobicContact CE1-CG 4.16Å; F462-L466 HydrophobicContact CE2-CD1 3.94Å; F462-L466 HydrophobicContact CE2-CG 4.16Å; F462-L466 HydrophobicContact CG-CD1 4.4Å; F462-L466 HydrophobicContact CZ-CD1 3.31Å; F462-L466 HydrophobicContact CZ-CG 4.04Å; F462-L466 WeakPolarHBondContact O-CB 3.35Å; F462-L466 WeakPolarHBondContact O-CG 3.41Å; F462-L466 PolarHBondContact O-N 3.35Å
463	V	92.2	Very high	89.2	Confident	54 Å²	54	57.2 Å²	57.2	33%	0.327	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-40.1	177.5	171.6	0	0	0	0	111.3	F301 L305 V459 G467	F301-V463 HydrophobicContact CE2-CG1 4.36Å; F301-V463 HydrophobicContact CZ-CG1 3.89Å; L305-V463 HydrophobicContact CD1-CB 4.43Å; L305-V463 HydrophobicContact CD1-CG1 3.68Å; V459-V463 HydrophobicContact CG1-CG2 4.44Å; V459-V463 WeakPolarHBondContact O-CB 3.44Å; V459-V463 VanDerWaalsContact O-CG2 3.27Å; V459-V463 WeakPolarHBondContact O-CG2 3.43Å; V459-V463 PolarHBondContact O-N 3.41Å; V463-G467 PolarHBondContact O-N 3.49Å
464	C	90.1	Very high	88.3	Confident	8 Å²	8	59.8 Å²	59.8	5%	0.054	32%	0.321	C	S	.	.	H	α-helix	trans	-69.3	-44	178.4	-170.7	0	0	0	0	112	I251 L305 F460 V461 F462 G467 T468	I251-C464 HydrophobicContact CD1-CB 3.79Å; I251-C464 HydrophobicContact CG1-CB 4.46Å; L305-C464 HydrophobicContact CD2-CB 4.15Å; F460-C464 WeakPolarHBondContact O-CB 3.26Å; F460-C464 PolarHBondContact O-N 3.25Å; V461-C464 PolarHBondContact O-N 3.49Å; F462-C464 VanDerWaalsContact C-N 3.33Å; F462-C464 PolarHBondContact O-N 3.06Å; C464-G467 PolarHBondContact O-N 3.48Å; C464-T468 WeakPolarHBondContact O-CB 3.23Å; C464-T468 VanDerWaalsContact O-CG2 3.27Å; C464-T468 WeakPolarHBondContact O-CG2 3.41Å; C464-T468 PolarHBondContact O-N 3.34Å; C464-T468 PolarHBondContact O-OG1 3.48Å
465	V	89.8	Confident	87	Confident	76 Å²	76	57.8 Å²	57.8	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-45.3	177	173.2	0	0	0	0	111	V461 F462 T468 V469	V461-V465 HydrophobicContact CG1-CG2 4.34Å; V461-V465 WeakPolarHBondContact O-CB 3.47Å; V461-V465 VanDerWaalsContact O-CG2 3.28Å; V461-V465 WeakPolarHBondContact O-CG2 3.16Å; V461-V465 PolarHBondContact O-N 2.91Å; F462-V465 PolarHBondContact O-N 3.09Å; V465-T468 WeakPolarHBondContact CA-OG1 3.36Å; V465-T468 PolarHBondContact O-OG1 2.6Å; V465-V469 HydrophobicContact CG1-CG2 4.41Å; V465-V469 WeakPolarHBondContact O-CB 3.36Å; V465-V469 VanDerWaalsContact O-CG2 3.23Å; V465-V469 WeakPolarHBondContact O-CG2 3.47Å; V465-V469 PolarHBondContact O-N 2.94Å
466	L	90.7	Very high	85.6	Confident	97 Å²	97	61.1 Å²	61.1	51%	0.508	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-39.8	175.5	-73	-173.2	0	0	0	112.6	F462 G470	F462-L466 HydrophobicContact CD1-CD1 3.81Å; F462-L466 HydrophobicContact CD1-CG 4.42Å; F462-L466 HydrophobicContact CD2-CD1 4.45Å; F462-L466 HydrophobicContact CD2-CG 4.44Å; F462-L466 HydrophobicContact CE1-CD1 3.21Å; F462-L466 HydrophobicContact CE1-CG 4.16Å; F462-L466 HydrophobicContact CE2-CD1 3.94Å; F462-L466 HydrophobicContact CE2-CG 4.16Å; F462-L466 HydrophobicContact CG-CD1 4.4Å; F462-L466 HydrophobicContact CZ-CD1 3.31Å; F462-L466 HydrophobicContact CZ-CG 4.04Å; F462-L466 WeakPolarHBondContact O-CB 3.35Å; F462-L466 WeakPolarHBondContact O-CG 3.41Å; F462-L466 PolarHBondContact O-N 3.35Å; L466-G470 WeakPolarHBondContact O-CA 3.43Å; L466-G470 PolarHBondContact O-N 3.03Å
467	G	88.2	Confident	84.2	Confident	15 Å²	15	64 Å²	64	16%	0.155	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-45.7	178	0	0	0	0	0	112.3	V463 C464 L471	V463-G467 PolarHBondContact O-N 3.49Å; C464-G467 PolarHBondContact O-N 3.48Å; G467-L471 WeakPolarHBondContact O-CB 3.47Å; G467-L471 WeakPolarHBondContact O-CD1 3.48Å; G467-L471 VanDerWaalsContact O-CG 3.27Å; G467-L471 WeakPolarHBondContact O-CG 3.27Å; G467-L471 PolarHBondContact O-N 3.05Å
468	T	86.4	Confident	82.5	Confident	36 Å²	36	67.3 Å²	67.3	22%	0.221	36%	0.361	C	S	.	.	H	α-helix	trans	-62	-51.9	175.8	47.1	0	0	0	0	111.2	Y298 C464 V465 L471 F472	Y298-T468 HydrophobicContact CE2-CG2 3.53Å; Y298-T468 VanDerWaalsContact OH-CG2 3.31Å; Y298-T468 WeakPolarHBondContact OH-CG2 3.46Å; C464-T468 WeakPolarHBondContact O-CB 3.23Å; C464-T468 VanDerWaalsContact O-CG2 3.27Å; C464-T468 WeakPolarHBondContact O-CG2 3.41Å; C464-T468 PolarHBondContact O-N 3.34Å; C464-T468 PolarHBondContact O-OG1 3.48Å; V465-T468 WeakPolarHBondContact CA-OG1 3.36Å; V465-T468 PolarHBondContact O-OG1 2.6Å; T468-L471 PolarHBondContact O-N 2.86Å; T468-F472 WeakPolarHBondContact O-CD2 3.29Å; T468-F472 PolarHBondContact O-N 2.84Å
469	V	86.3	Confident	80.6	Confident	75 Å²	75	63.4 Å²	63.4	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-50.2	178	174.6	0	0	0	0	110.2	V465 L471 F472 L473	V465-V469 HydrophobicContact CG1-CG2 4.41Å; V465-V469 WeakPolarHBondContact O-CB 3.36Å; V465-V469 VanDerWaalsContact O-CG2 3.23Å; V465-V469 WeakPolarHBondContact O-CG2 3.47Å; V465-V469 PolarHBondContact O-N 2.94Å; V469-L471 VanDerWaalsContact C-N 3.26Å; V469-L471 PolarHBondContact O-N 2.94Å; V469-F472 PolarHBondContact O-N 2.97Å; V469-L473 HydrophobicContact CG1-CB 4.47Å; V469-L473 HydrophobicContact CG1-CD1 4.12Å; V469-L473 WeakPolarHBondContact O-CB 3.33Å; V469-L473 PolarHBondContact O-N 3.01Å
470	G	85.6	Confident	78.3	Confident	48 Å²	48	67 Å²	67	50%	0.495	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-33.5	-178.4	0	0	0	0	0	114.2	L466 P474	L466-G470 WeakPolarHBondContact O-CA 3.43Å; L466-G470 PolarHBondContact O-N 3.03Å; G470-P474 WeakPolarHBondContact O-CD 3.19Å
471	L	83	Confident	75.8	Confident	39 Å²	39	70.7 Å²	70.7	20%	0.204	39%	0.39	C	S	.	.	H	α-helix	trans	-82.7	-39.8	178.4	-70.7	169.6	0	0	0	113	L294 Y298 F301 G467 T468 V469	L294-L471 HydrophobicContact CD1-CB 4.42Å; L294-L471 HydrophobicContact CD1-CD2 4.31Å; L294-L471 WeakPolarHBondContact CD1-O 3.39Å; L294-L471 WeakPolarHBondContact CD2-O 3.45Å; Y298-L471 HydrophobicContact CD2-CD1 3.89Å; F301-L471 HydrophobicContact CB-CD1 4.49Å; G467-L471 WeakPolarHBondContact O-CB 3.47Å; G467-L471 WeakPolarHBondContact O-CD1 3.48Å; G467-L471 VanDerWaalsContact O-CG 3.27Å; G467-L471 WeakPolarHBondContact O-CG 3.27Å; G467-L471 PolarHBondContact O-N 3.05Å; T468-L471 PolarHBondContact O-N 2.86Å; V469-L471 VanDerWaalsContact C-N 3.26Å; V469-L471 PolarHBondContact O-N 2.94Å
472	F	79.3	Confident	73.4	Confident	49 Å²	49	71.4 Å²	71.4	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-92.1	-10.9	-175.4	-73.5	-77.6	0	0	0	114.9	L294 Y298 T468 V469 P475 L476	L294-F472 HydrophobicContact CD2-CD1 4.33Å; Y298-F472 HydrophobicContact CD1-CE2 4.2Å; Y298-F472 HydrophobicContact CD1-CZ 4.29Å; Y298-F472 AromaticContact CD2-CE2 3.83Å; Y298-F472 HydrophobicContact CD2-CE2 3.83Å; Y298-F472 HydrophobicContact CE1-CE2 4.36Å; Y298-F472 HydrophobicContact CE2-CE2 4.02Å; Y298-F472 AromaticContact CG-CE2 3.92Å; Y298-F472 HydrophobicContact CG-CE2 3.92Å; Y298-F472 HydrophobicContact CG-CZ 4.22Å; T468-F472 WeakPolarHBondContact O-CD2 3.29Å; T468-F472 PolarHBondContact O-N 2.84Å; V469-F472 PolarHBondContact O-N 2.97Å; F472-P475 WeakPolarHBondContact O-CD 3.37Å; F472-L476 WeakPolarHBondContact O-CD1 3.47Å
473	L	77.2	Confident	70.9	Confident	83 Å²	83	69.9 Å²	69.9	44%	0.435	41%	0.406	S	S	.	.	H	α-helix	trans	-70.5	-45.2	178.8	-165.4	98.4	0	0	0	113.9	V469 L476 F477	V469-L473 HydrophobicContact CG1-CB 4.47Å; V469-L473 HydrophobicContact CG1-CD1 4.12Å; V469-L473 WeakPolarHBondContact O-CB 3.33Å; V469-L473 PolarHBondContact O-N 3.01Å; L473-L476 PolarHBondContact O-N 2.72Å; L473-F477 HydrophobicContact CD1-CE2 3.84Å; L473-F477 HydrophobicContact CD2-CD2 4.25Å; L473-F477 HydrophobicContact CD2-CE2 3.77Å; L473-F477 HydrophobicContact CG-CD2 3.91Å; L473-F477 HydrophobicContact CG-CE2 3.5Å; L473-F477 VanDerWaalsContact CG-CE2 3.5Å; L473-F477 WeakPolarHBondContact O-CD2 3.22Å; L473-F477 PolarHBondContact O-N 3.47Å
474	P	73.8	Confident	68.3	Low	62 Å²	62	75.5 Å²	75.5	40%	0.403	43%	0.429	S	S	.	.	H	α-helix	trans	-58.7	-41.7	-178.8	-20.3	30.7	0	0	0	115.4	G470 L476 F477 Q478	G470-P474 WeakPolarHBondContact O-CD 3.19Å; P474-L476 VanDerWaalsContact C-N 3.34Å; P474-L476 PolarHBondContact O-N 3.44Å; P474-F477 PolarHBondContact O-N 3.31Å; P474-Q478 PolarHBondContact O-N 2.81Å
475	P	65.7	Low	65.5	Low	16 Å²	16	77.7 Å²	77.7	10%	0.104	45%	0.453	C	S	.	.	H	α-helix	trans	-64.4	-33.2	176.9	-18	26.9	0	0	0	114.4	Y159 L294 F472 F477 T479	Y159-P475 HydrophobicContact CD1-CB 4.08Å; Y159-P475 HydrophobicContact CD1-CG 3.98Å; Y159-P475 HydrophobicContact CE1-CB 4.48Å; Y159-P475 HydrophobicContact CE1-CG 4.2Å; L294-P475 HydrophobicContact CD2-CG 3.34Å; F472-P475 WeakPolarHBondContact O-CD 3.37Å; P475-F477 VanDerWaalsContact C-N 3.32Å; P475-T479 PolarHBondContact O-N 3.33Å; P475-T479 PolarHBondContact O-OG1 3.28Å
476	L	62.6	Low	63	Low	119 Å²	119	80 Å²	80	62%	0.623	47%	0.47	S	S	*	.	H	α-helix	trans	-68	-33.5	179.7	-74.3	168.1	0	0	0	111.9	F472 L473 P474 T479	F472-L476 WeakPolarHBondContact O-CD1 3.47Å; L473-L476 PolarHBondContact O-N 2.72Å; P474-L476 VanDerWaalsContact C-N 3.34Å; P474-L476 PolarHBondContact O-N 3.44Å; L476-T479 PolarHBondContact O-OG1 3.49Å; L476-T479 VanDerWaalsContact O-OG1 3.1Å
477	F	62.8	Low	60.7	Low	125 Å²	125	84.5 Å²	84.5	55%	0.548	48%	0.482	S	S	.	.	H	α-helix	trans	-81.6	-33.1	177.4	-72.6	-64	0	0	0	113.1	L473 P474 P475 Q480	L473-F477 HydrophobicContact CD1-CE2 3.84Å; L473-F477 HydrophobicContact CD2-CD2 4.25Å; L473-F477 HydrophobicContact CD2-CE2 3.77Å; L473-F477 HydrophobicContact CG-CD2 3.91Å; L473-F477 HydrophobicContact CG-CE2 3.5Å; L473-F477 VanDerWaalsContact CG-CE2 3.5Å; L473-F477 WeakPolarHBondContact O-CD2 3.22Å; L473-F477 PolarHBondContact O-N 3.47Å; P474-F477 PolarHBondContact O-N 3.31Å; P475-F477 VanDerWaalsContact C-N 3.32Å; F477-Q480 PolarHBondContact O-N 2.95Å
478	Q	56.6	Low	58.1	Low	93 Å²	93	88.7 Å²	88.7	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-75	-24.2	179.1	-79.1	-175.1	-24.8	0	0	114.2	Y159 P474 Q480 T481 A482	Y159-Q478 PolarHBondContact OH-OE1 2.93Å; P474-Q478 PolarHBondContact O-N 2.81Å; Q478-Q480 PolarHBondContact O-N 2.8Å; Q478-T481 WeakPolarHBondContact CA-OG1 3.35Å; Q478-T481 PolarHBondContact O-N 3.19Å; Q478-T481 PolarHBondContact O-OG1 3.07Å; Q478-T481 VanDerWaalsContact O-OG1 3.12Å; Q478-A482 PolarHBondContact O-N 3.49Å
479	T	52.3	Low	55.8	Low	74 Å²	74	91.1 Å²	91.1	45%	0.454	54%	0.538	S	S	.	.	H	α-helix	trans	-64.9	-20.3	172.3	25	0	0	0	0	112.8	P475 L476	P475-T479 PolarHBondContact O-N 3.33Å; P475-T479 PolarHBondContact O-OG1 3.28Å; L476-T479 PolarHBondContact O-OG1 3.49Å; L476-T479 VanDerWaalsContact O-OG1 3.1Å
480	Q	43.7	Very low	53.4	Low	144 Å²	144	96.7 Å²	96.7	67%	0.673	56%	0.559	S	S	*	*	H	α-helix	trans	-84.3	-26.1	172.2	-79.7	-179.6	-29	0	0	113.8	F477 Q478 S483	F477-Q480 PolarHBondContact O-N 2.95Å; Q478-Q480 PolarHBondContact O-N 2.8Å; Q480-S483 PolarHBondContact O-OG 3.27Å
481	T	40.4	Very low	51	Low	96 Å²	96	100.4 Å²	100.4	59%	0.589	58%	0.577	S	S	*	*	H	α-helix	trans	-90.4	-23.7	-176.5	55.9	0	0	0	0	113.6	Q478 S483 E484	Q478-T481 WeakPolarHBondContact CA-OG1 3.35Å; Q478-T481 PolarHBondContact O-N 3.19Å; Q478-T481 PolarHBondContact O-OG1 3.07Å; Q478-T481 VanDerWaalsContact O-OG1 3.12Å; T481-S483 PolarHBondContact O-N 2.96Å; T481-E484 PolarHBondContact O-N 3.5Å
482	A	42.7	Very low	48.7	Very low	57 Å²	57	110.5 Å²	110.5	47%	0.471	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-2.7	-179.1	0	0	0	0	0	114.6	Q478 E484	Q478-A482 PolarHBondContact O-N 3.49Å; A482-E484 VanDerWaalsContact C-N 3.3Å
483	S	39.3	Very low	47.1	Very low	101 Å²	101	113.6 Å²	113.6	71%	0.706	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-6.4	172.5	54.2	0	0	0	0	114	Q480 T481	Q480-S483 PolarHBondContact O-OG 3.27Å; T481-S483 PolarHBondContact O-N 2.96Å
484	E	37.3	Very low	45.6	Very low	172 Å²	172	115.2 Å²	115.2	80%	0.804	66%	0.663	S	S	*	*	S	Bend	trans	-105.4	96.7	171.2	-71.1	-176.1	162.6	0	0	109	T481 A482	T481-E484 PolarHBondContact O-N 3.5Å; A482-E484 VanDerWaalsContact C-N 3.3Å
485	G	31.7	Very low	44	Very low	55 Å²	55	118.1 Å²	118.1	57%	0.567	68%	0.677	S	S	*	*			trans	-71.7	154.7	-176.3	0	0	0	0	0	114.1	Y487	G485-Y487 VanDerWaalsContact C-N 3.31Å; G485-Y487 PolarHBondContact O-N 3.26Å; G485-Y487 VanDerWaalsContact O-N 3.14Å
486	P	37.7	Very low	42.7	Very low	125 Å²	125	124.1 Å²	124.1	81%	0.812	71%	0.711	S	S	*	*	S	Bend	trans	-87.9	47.1	-177.1	37.2	-36	0	0	0	113.6
487	Y	41.8	Very low	41.5	Very low	191 Å²	191	124.4 Å²	124.4	75%	0.749	72%	0.716	S	S	*	*			trans	-113.1	16.5	178	-81.8	-74.8	0	0	0	114.7	G485	G485-Y487 VanDerWaalsContact C-N 3.31Å; G485-Y487 PolarHBondContact O-N 3.26Å; G485-Y487 VanDerWaalsContact O-N 3.14Å
488	A	35	Very low	40	Very low	103 Å²	103	124.4 Å²	124.4	85%	0.851	73%	0.728	S	S	*	*			trans	-107.4	59.9	174.2	0	0	0	0	0	111.6
489	A	37	Very low	38.9	Very low	86 Å²	86	126.6 Å²	126.6	71%	0.711	75%	0.748	S	S	*	*			trans	-161.8	60.2	168	0	0	0	0	0	112.5
490	Q	36.1	Very low	37.8	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	77%	0.771	S	S	*	*			trans	-157.7	71.2	156.6	-128.7	110	27.2	0	0	110.6
491	C	35	Very low	37.3	Very low	127 Å²	127	129.6 Å²	129.6	86%	0.858	78%	0.779	S	S	*	*			trans	-143.4	91.8	156.7	-81.1	0	0	0	0	105.5
492	D	34.3	Very low	37.1	Very low	250 Å²	250	132.6 Å²	132.6	100%	1.337	80%	0.797	S	S	*	*			trans	-152.4	0	149.9	-90.7	-26.2	0	0	0	107.6

Retrieved 492 of 492 residues in 1387.5 ms (Link to these results)

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