A0A5K4F5Q2_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F5Q2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 374 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	69.1	Low	83.1	Confident	209 Å²	209	121.6 Å²	121.6	100%	1.03	62%	0.617	S	S	*	*				0	-43.6	0	-77.9	175.2	76.1	0	0	113.4	F3 I4 T5	M1-F3 VanDerWaalsContact C-N 3.35Å; M1-F3 PolarHBondContact O-N 2.71Å; M1-I4 PolarHBondContact O-N 3.45Å; M1-T5 PolarHBondContact O-N 2.73Å; M1-T5 PolarHBondContact O-OG1 2.95Å
2	Y	78.4	Confident	83.1	Confident	192 Å²	192	118.8 Å²	118.8	75%	0.753	60%	0.603	S	S	*	*	H	α-helix	trans	-57.6	-35.5	-177	-116.5	-90.3	0	0	0	116.2	T5 I6	Y2-T5 WeakPolarHBondContact CA-OG1 3.15Å; Y2-T5 PolarHBondContact O-OG1 3.14Å; Y2-I6 HydrophobicContact CD1-CD1 4.39Å; Y2-I6 WeakPolarHBondContact O-CG1 3.41Å; Y2-I6 PolarHBondContact O-N 3.13Å
3	F	77.2	Confident	82.7	Confident	168 Å²	168	120.4 Å²	120.4	74%	0.737	60%	0.599	S	S	*	*	H	α-helix	trans	-70.6	-35.1	-177.6	-134.7	-89.3	0	0	0	112.8	M1 I6 I7	M1-F3 VanDerWaalsContact C-N 3.35Å; M1-F3 PolarHBondContact O-N 2.71Å; F3-I6 PolarHBondContact O-N 2.77Å; F3-I7 HydrophobicContact CD1-CD1 3.94Å; F3-I7 HydrophobicContact CE1-CD1 4.32Å; F3-I7 WeakPolarHBondContact O-CG1 3.32Å; F3-I7 PolarHBondContact O-N 3.22Å
4	I	85.1	Confident	82.4	Confident	125 Å²	125	118.4 Å²	118.4	64%	0.641	59%	0.591	S	S	*	*	H	α-helix	trans	-70.3	-39.8	-180	-62.4	172.6	0	0	0	110.1	M1 I6 I7 L8	M1-I4 PolarHBondContact O-N 3.45Å; I4-I6 PolarHBondContact O-N 3.14Å; I4-I7 PolarHBondContact O-N 3.07Å; I4-L8 WeakPolarHBondContact O-CB 3.4Å; I4-L8 PolarHBondContact O-N 2.71Å
5	T	84.4	Confident	81.7	Confident	87 Å²	87	118.7 Å²	118.7	53%	0.534	59%	0.587	S	S	.	*	H	α-helix	trans	-65.2	-36	177.7	39.3	0	0	0	0	113	M1 Y2 S9	M1-T5 PolarHBondContact O-N 2.73Å; M1-T5 PolarHBondContact O-OG1 2.95Å; Y2-T5 WeakPolarHBondContact CA-OG1 3.15Å; Y2-T5 PolarHBondContact O-OG1 3.14Å; T5-S9 WeakPolarHBondContact O-CB 3.25Å; T5-S9 PolarHBondContact O-N 2.05Å
6	I	87.3	Confident	80.8	Confident	97 Å²	97	117.4 Å²	117.4	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-69.2	-45	177.1	-66.6	167.2	0	0	0	110.8	Y2 F3 I4 L8 S9 L10	Y2-I6 HydrophobicContact CD1-CD1 4.39Å; Y2-I6 WeakPolarHBondContact O-CG1 3.41Å; Y2-I6 PolarHBondContact O-N 3.13Å; F3-I6 PolarHBondContact O-N 2.77Å; I4-I6 PolarHBondContact O-N 3.14Å; I6-L8 PolarHBondContact O-N 2.79Å; I6-S9 PolarHBondContact O-N 3.01Å; I6-L10 WeakPolarHBondContact O-CB 3.33Å; I6-L10 PolarHBondContact O-N 2.81Å
7	I	88.6	Confident	79.5	Confident	94 Å²	94	117.5 Å²	117.5	48%	0.482	58%	0.579	S	S	.	*	H	α-helix	trans	-63.1	-43.8	177.9	-66.1	171.1	0	0	0	110.5	F3 I4 S9 L10 V11	F3-I7 HydrophobicContact CD1-CD1 3.94Å; F3-I7 HydrophobicContact CE1-CD1 4.32Å; F3-I7 WeakPolarHBondContact O-CG1 3.32Å; F3-I7 PolarHBondContact O-N 3.22Å; I4-I7 PolarHBondContact O-N 3.07Å; I7-S9 PolarHBondContact O-N 3.47Å; I7-L10 PolarHBondContact O-N 2.8Å; I7-V11 HydrophobicContact CG2-CG2 4.26Å; I7-V11 WeakPolarHBondContact O-CB 2.98Å; I7-V11 VanDerWaalsContact O-CG2 3.29Å; I7-V11 WeakPolarHBondContact O-CG2 3.08Å; I7-V11 PolarHBondContact O-N 2.97Å
8	L	86.8	Confident	78.2	Confident	111 Å²	111	117.5 Å²	117.5	58%	0.581	58%	0.582	S	S	*	*	H	α-helix	trans	-62.9	-42.5	178.7	-150.6	89.3	0	0	0	111.6	I4 I6 L10 V11 I12	I4-L8 WeakPolarHBondContact O-CB 3.4Å; I4-L8 PolarHBondContact O-N 2.71Å; I6-L8 PolarHBondContact O-N 2.79Å; L8-L10 VanDerWaalsContact C-N 3.34Å; L8-L10 PolarHBondContact O-N 2.9Å; L8-V11 PolarHBondContact O-N 3.1Å; L8-I12 HydrophobicContact CD2-CD1 4.13Å; L8-I12 HydrophobicContact CG-CD1 4.21Å; L8-I12 WeakPolarHBondContact O-CB 3.29Å; L8-I12 WeakPolarHBondContact O-CD1 3.39Å; L8-I12 WeakPolarHBondContact O-CG1 3.48Å; L8-I12 PolarHBondContact O-N 3.31Å
9	S	85.1	Confident	76.8	Confident	76 Å²	76	119.2 Å²	119.2	53%	0.531	59%	0.586	S	S	.	*	H	α-helix	trans	-60.7	-42.5	174.7	169.2	0	0	0	0	111.9	T5 I6 I7 I12 Y13	T5-S9 WeakPolarHBondContact O-CB 3.25Å; T5-S9 PolarHBondContact O-N 2.05Å; I6-S9 PolarHBondContact O-N 3.01Å; I7-S9 PolarHBondContact O-N 3.47Å; S9-I12 PolarHBondContact O-N 2.99Å; S9-Y13 VanDerWaalsContact O-CB 3.27Å; S9-Y13 WeakPolarHBondContact O-CB 3.49Å; S9-Y13 PolarHBondContact O-N 3.15Å
10	L	86.9	Confident	75.1	Confident	103 Å²	103	118.1 Å²	118.1	54%	0.539	58%	0.581	S	S	.	*	H	α-helix	trans	-71.6	-36.5	-178.8	-152.7	139.1	0	0	0	111.7	I6 I7 L8 Y13 L14	I6-L10 WeakPolarHBondContact O-CB 3.33Å; I6-L10 PolarHBondContact O-N 2.81Å; I7-L10 PolarHBondContact O-N 2.8Å; L8-L10 VanDerWaalsContact C-N 3.34Å; L8-L10 PolarHBondContact O-N 2.9Å; L10-Y13 PolarHBondContact O-N 2.84Å; L10-L14 HydrophobicContact CD2-CD1 3.73Å; L10-L14 HydrophobicContact CD2-CG 4.4Å; L10-L14 WeakPolarHBondContact O-CB 3.21Å; L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.49Å
11	V	85.4	Confident	73.5	Confident	76 Å²	76	121.1 Å²	121.1	46%	0.461	59%	0.591	S	S	.	*	H	α-helix	trans	-66	-46	171.7	172.5	0	0	0	0	110.7	I7 L8 Y13 L14 F15	I7-V11 HydrophobicContact CG2-CG2 4.26Å; I7-V11 WeakPolarHBondContact O-CB 2.98Å; I7-V11 VanDerWaalsContact O-CG2 3.29Å; I7-V11 WeakPolarHBondContact O-CG2 3.08Å; I7-V11 PolarHBondContact O-N 2.97Å; L8-V11 PolarHBondContact O-N 3.1Å; V11-Y13 VanDerWaalsContact C-N 3.31Å; V11-Y13 PolarHBondContact O-N 3.26Å; V11-L14 PolarHBondContact O-N 3.1Å; V11-F15 WeakPolarHBondContact O-CB 3.32Å; V11-F15 PolarHBondContact O-N 3.21Å
12	I	82.8	Confident	72.1	Confident	87 Å²	87	117.1 Å²	117.1	45%	0.446	57%	0.573	S	S	.	*	H	α-helix	trans	-62.5	-40.4	175.8	-69.2	164.4	0	0	0	110.3	L8 S9 F15 L16	L8-I12 HydrophobicContact CD2-CD1 4.13Å; L8-I12 HydrophobicContact CG-CD1 4.21Å; L8-I12 WeakPolarHBondContact O-CB 3.29Å; L8-I12 WeakPolarHBondContact O-CD1 3.39Å; L8-I12 WeakPolarHBondContact O-CG1 3.48Å; L8-I12 PolarHBondContact O-N 3.31Å; S9-I12 PolarHBondContact O-N 2.99Å; I12-F15 PolarHBondContact O-N 3.18Å; I12-L16 HydrophobicContact CG2-CD1 3.72Å; I12-L16 HydrophobicContact CG2-CG 4.16Å; I12-L16 VanDerWaalsContact O-CB 3.3Å; I12-L16 WeakPolarHBondContact O-CB 3.39Å; I12-L16 VanDerWaalsContact O-CG 3.24Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 2.93Å
13	Y	78.5	Confident	70.5	Confident	140 Å²	140	112.6 Å²	112.6	55%	0.549	57%	0.569	S	S	.	*	H	α-helix	trans	-66.2	-42.6	177.2	-164.7	-94.3	0	0	0	111.6	S9 L10 V11 F15 L16 F17	S9-Y13 VanDerWaalsContact O-CB 3.27Å; S9-Y13 WeakPolarHBondContact O-CB 3.49Å; S9-Y13 PolarHBondContact O-N 3.15Å; L10-Y13 PolarHBondContact O-N 2.84Å; V11-Y13 VanDerWaalsContact C-N 3.31Å; V11-Y13 PolarHBondContact O-N 3.26Å; Y13-F15 VanDerWaalsContact C-N 3.35Å; Y13-L16 PolarHBondContact O-N 2.89Å; Y13-F17 AromaticContact CD1-CD2 3.68Å; Y13-F17 HydrophobicContact CD1-CD2 3.68Å; Y13-F17 HydrophobicContact CD1-CE2 4.04Å; Y13-F17 AromaticContact CE1-CD2 3.35Å; Y13-F17 HydrophobicContact CE1-CD2 3.35Å; Y13-F17 AromaticContact CE1-CE2 3.24Å; Y13-F17 HydrophobicContact CE1-CE2 3.24Å; Y13-F17 HydrophobicContact CE1-CG 4.33Å; Y13-F17 HydrophobicContact CE1-CZ 4.1Å; Y13-F17 HydrophobicContact CE2-CD2 4.27Å; Y13-F17 AromaticContact CE2-CE2 3.87Å; Y13-F17 HydrophobicContact CE2-CE2 3.87Å; Y13-F17 HydrophobicContact CG-CD2 4.29Å; Y13-F17 AromaticContact CZ-CD2 3.7Å; Y13-F17 AromaticContact CZ-CE2 3.15Å; Y13-F17 WeakPolarHBondContact O-CB 3.3Å; Y13-F17 PolarHBondContact O-N 3.18Å; Y13-F17 WeakPolarHBondContact OH-CE2 3.26Å
14	L	78.5	Confident	69.2	Low	93 Å²	93	106.6 Å²	106.6	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-38.8	172.4	-78.8	165.6	0	0	0	111.8	L10 V11 N18	L10-L14 HydrophobicContact CD2-CD1 3.73Å; L10-L14 HydrophobicContact CD2-CG 4.4Å; L10-L14 WeakPolarHBondContact O-CB 3.21Å; L10-L14 WeakPolarHBondContact O-CG 3.35Å; L10-L14 PolarHBondContact O-N 3.49Å; V11-L14 PolarHBondContact O-N 3.1Å; L14-N18 WeakPolarHBondContact O-CB 3.45Å; L14-N18 PolarHBondContact O-N 3.36Å; L14-N18 PolarHBondContact O-ND2 3.49Å
15	F	71.5	Confident	68.9	Low	123 Å²	123	105 Å²	105	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-48.8	175.2	-126.7	-102.1	0	0	0	110.2	V11 I12 Y13 F17 N18 F19	V11-F15 WeakPolarHBondContact O-CB 3.32Å; V11-F15 PolarHBondContact O-N 3.21Å; I12-F15 PolarHBondContact O-N 3.18Å; Y13-F15 VanDerWaalsContact C-N 3.35Å; F15-F17 PolarHBondContact O-N 2.9Å; F15-N18 CarbonylContact O-C 3.45Å; F15-N18 PolarHBondContact O-N 3.31Å; F15-N18 VanDerWaalsContact O-N 3.17Å; F15-F19 AromaticContact CD1-CD2 3.41Å; F15-F19 HydrophobicContact CD1-CD2 3.41Å; F15-F19 VanDerWaalsContact CD1-CD2 3.41Å; F15-F19 AromaticContact CD1-CE2 3.31Å; F15-F19 HydrophobicContact CD1-CE2 3.31Å; F15-F19 HydrophobicContact CD1-CZ 4.41Å; F15-F19 AromaticContact CE1-CD2 3.75Å; F15-F19 HydrophobicContact CE1-CD2 3.75Å; F15-F19 AromaticContact CE1-CE2 3.09Å; F15-F19 HydrophobicContact CE1-CE2 3.09Å; F15-F19 AromaticContact CE1-CZ 3.91Å; F15-F19 HydrophobicContact CE1-CZ 3.91Å; F15-F19 HydrophobicContact CG-CD2 4.22Å; F15-F19 HydrophobicContact CG-CE2 4.28Å; F15-F19 AromaticContact CZ-CE2 3.9Å; F15-F19 HydrophobicContact CZ-CE2 3.9Å; F15-F19 WeakPolarHBondContact O-CB 3.41Å; F15-F19 VanDerWaalsContact O-CD2 3.29Å; F15-F19 WeakPolarHBondContact O-CD2 3.48Å; F15-F19 PolarHBondContact O-N 2.94Å
16	L	66.8	Low	69.1	Low	97 Å²	97	101.7 Å²	101.7	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-61.9	-42	176.5	-72.6	171.1	0	0	0	110.8	I12 Y13 N18 F19 I20	I12-L16 HydrophobicContact CG2-CD1 3.72Å; I12-L16 HydrophobicContact CG2-CG 4.16Å; I12-L16 VanDerWaalsContact O-CB 3.3Å; I12-L16 WeakPolarHBondContact O-CB 3.39Å; I12-L16 VanDerWaalsContact O-CG 3.24Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 2.93Å; Y13-L16 PolarHBondContact O-N 2.89Å; L16-N18 VanDerWaalsContact C-N 3.35Å; L16-N18 PolarHBondContact O-N 2.92Å; L16-F19 PolarHBondContact O-N 3.1Å; L16-I20 WeakPolarHBondContact O-CB 3.33Å; L16-I20 WeakPolarHBondContact O-CD1 3.49Å; L16-I20 WeakPolarHBondContact O-CG1 3.23Å; L16-I20 PolarHBondContact O-N 2.84Å
17	F	59.9	Low	69.3	Low	119 Å²	119	100.1 Å²	100.1	52%	0.522	52%	0.515	S	S	.	.	H	α-helix	trans	-65.8	-35.4	174.2	-100.5	-96.6	0	0	0	113	Y13 F15 I20	Y13-F17 AromaticContact CD1-CD2 3.68Å; Y13-F17 HydrophobicContact CD1-CD2 3.68Å; Y13-F17 HydrophobicContact CD1-CE2 4.04Å; Y13-F17 AromaticContact CE1-CD2 3.35Å; Y13-F17 HydrophobicContact CE1-CD2 3.35Å; Y13-F17 AromaticContact CE1-CE2 3.24Å; Y13-F17 HydrophobicContact CE1-CE2 3.24Å; Y13-F17 HydrophobicContact CE1-CG 4.33Å; Y13-F17 HydrophobicContact CE1-CZ 4.1Å; Y13-F17 HydrophobicContact CE2-CD2 4.27Å; Y13-F17 AromaticContact CE2-CE2 3.87Å; Y13-F17 HydrophobicContact CE2-CE2 3.87Å; Y13-F17 HydrophobicContact CG-CD2 4.29Å; Y13-F17 AromaticContact CZ-CD2 3.7Å; Y13-F17 AromaticContact CZ-CE2 3.15Å; Y13-F17 WeakPolarHBondContact O-CB 3.3Å; Y13-F17 PolarHBondContact O-N 3.18Å; Y13-F17 WeakPolarHBondContact OH-CE2 3.26Å; F15-F17 PolarHBondContact O-N 2.9Å; F17-I20 CarbonylContact O-C 3.6Å
18	N	55.5	Low	69.3	Low	118 Å²	118	102 Å²	102	63%	0.631	52%	0.518	S	S	*	.	H	α-helix	trans	-75	-31.3	175.9	-76.7	-23.3	0	0	0	112.8	L14 F15 L16	L14-N18 WeakPolarHBondContact O-CB 3.45Å; L14-N18 PolarHBondContact O-N 3.36Å; L14-N18 PolarHBondContact O-ND2 3.49Å; F15-N18 CarbonylContact O-C 3.45Å; F15-N18 PolarHBondContact O-N 3.31Å; F15-N18 VanDerWaalsContact O-N 3.17Å; L16-N18 VanDerWaalsContact C-N 3.35Å; L16-N18 PolarHBondContact O-N 2.92Å
19	F	50.8	Low	69.5	Low	150 Å²	150	97.3 Å²	97.3	66%	0.658	49%	0.494	S	S	*	.	H	α-helix	trans	-86.4	-27.5	179	-90.2	-87.2	0	0	0	113.2	F15 L16 K21	F15-F19 AromaticContact CD1-CD2 3.41Å; F15-F19 HydrophobicContact CD1-CD2 3.41Å; F15-F19 VanDerWaalsContact CD1-CD2 3.41Å; F15-F19 AromaticContact CD1-CE2 3.31Å; F15-F19 HydrophobicContact CD1-CE2 3.31Å; F15-F19 HydrophobicContact CD1-CZ 4.41Å; F15-F19 AromaticContact CE1-CD2 3.75Å; F15-F19 HydrophobicContact CE1-CD2 3.75Å; F15-F19 AromaticContact CE1-CE2 3.09Å; F15-F19 HydrophobicContact CE1-CE2 3.09Å; F15-F19 AromaticContact CE1-CZ 3.91Å; F15-F19 HydrophobicContact CE1-CZ 3.91Å; F15-F19 HydrophobicContact CG-CD2 4.22Å; F15-F19 HydrophobicContact CG-CE2 4.28Å; F15-F19 AromaticContact CZ-CE2 3.9Å; F15-F19 HydrophobicContact CZ-CE2 3.9Å; F15-F19 WeakPolarHBondContact O-CB 3.41Å; F15-F19 VanDerWaalsContact O-CD2 3.29Å; F15-F19 WeakPolarHBondContact O-CD2 3.48Å; F15-F19 PolarHBondContact O-N 2.94Å; L16-F19 PolarHBondContact O-N 3.1Å; F19-K21 PolarHBondContact O-N 2.84Å
20	I	43.7	Very low	69.3	Low	97 Å²	97	103.7 Å²	103.7	50%	0.497	51%	0.512	S	S	.	.			trans	-74.1	61.7	155	-47.6	159.1	0	0	0	106.2	L16 F17 I22	L16-I20 WeakPolarHBondContact O-CB 3.33Å; L16-I20 WeakPolarHBondContact O-CD1 3.49Å; L16-I20 WeakPolarHBondContact O-CG1 3.23Å; L16-I20 PolarHBondContact O-N 2.84Å; F17-I20 CarbonylContact O-C 3.6Å; I20-I22 HydrophobicContact CG2-CB 4.35Å; I20-I22 HydrophobicContact CG2-CD1 4.44Å; I20-I22 HydrophobicContact CG2-CG1 3.38Å; I20-I22 PolarHBondContact O-N 3.35Å
21	K	40.5	Very low	68.4	Low	182 Å²	182	102.6 Å²	102.6	79%	0.791	51%	0.507	S	S	*	.			trans	-52.3	89.6	132.3	-83.6	-177.7	177.6	177.7	0	103	F19 S23	F19-K21 PolarHBondContact O-N 2.84Å; K21-S23 PolarHBondContact O-N 3.28Å
22	I	39.9	Very low	67.1	Low	125 Å²	125	104.1 Å²	104.1	64%	0.641	51%	0.512	S	S	*	.			trans	-52.4	102	160.2	-57.3	174.8	0	0	0	100.1	I20 S24	I20-I22 HydrophobicContact CG2-CB 4.35Å; I20-I22 HydrophobicContact CG2-CD1 4.44Å; I20-I22 HydrophobicContact CG2-CG1 3.38Å; I20-I22 PolarHBondContact O-N 3.35Å; I22-S24 PolarHBondContact O-N 3.5Å
23	S	45.8	Very low	66	Low	96 Å²	96	105.7 Å²	105.7	67%	0.671	51%	0.513	S	S	*	.			trans	-66.5	78	165	61	0	0	0	0	102	K21 T25	K21-S23 PolarHBondContact O-N 3.28Å; S23-T25 PolarHBondContact O-N 3.23Å
24	S	50.3	Low	64.8	Low	43 Å²	43	103.6 Å²	103.6	30%	0.301	52%	0.518	S	S	.	.			trans	-74.9	81.6	-177.8	52.5	0	0	0	0	103	I22 I125	I22-S24 PolarHBondContact O-N 3.5Å; S24-I125 WeakPolarHBondContact O-CG1 3.41Å; S24-I125 WeakPolarHBondContact O-CG2 3.29Å; S24-I125 WeakPolarHBondContact OG-CD1 3.35Å; S24-I125 VanDerWaalsContact OG-CG1 3.28Å; S24-I125 WeakPolarHBondContact OG-CG1 3.34Å; S24-I125 WeakPolarHBondContact OG-CG2 3.41Å
25	T	77.5	Confident	63.7	Low	90 Å²	90	102.7 Å²	102.7	55%	0.552	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-67.2	153.5	178	47	0	0	0	0	107.9	S23 N27	S23-T25 PolarHBondContact O-N 3.23Å; T25-N27 PolarHBondContact O-N 2.96Å
26	L	89.4	Confident	63	Low	18 Å²	18	101.7 Å²	101.7	9%	0.094	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-57.3	129.4	166.7	-72.9	153.6	0	0	0	108.8	W89 I124 S126 P133 I135 L142	L26-W89 HydrophobicContact CD1-CB 4.01Å; L26-W89 HydrophobicContact CD1-CG 4.5Å; L26-I124 HydrophobicContact CD1-CB 4.16Å; L26-I124 HydrophobicContact CD2-CB 4.36Å; L26-I124 HydrophobicContact CD2-CG2 3.92Å; L26-I124 WeakPolarHBondContact CG-O 3.09Å; L26-S126 WeakPolarHBondContact CA-OG 3.48Å; L26-P133 HydrophobicContact CD2-CB 4.2Å; L26-P133 HydrophobicContact CD2-CG 3.75Å; L26-I135 HydrophobicContact CB-CB 4.3Å; L26-I135 HydrophobicContact CB-CD1 4.15Å; L26-I135 HydrophobicContact CB-CG1 3.86Å; L26-I135 HydrophobicContact CB-CG2 3.64Å; L26-I135 HydrophobicContact CD1-CG2 3.46Å; L26-I135 VanDerWaalsContact CD1-CG2 3.46Å; L26-I135 HydrophobicContact CG-CG2 4.04Å; L26-L142 HydrophobicContact CD1-CD1 3.88Å; L26-L142 HydrophobicContact CD2-CD1 3.86Å
27	N	90.6	Very high	62.5	Low	64 Å²	64	100.2 Å²	100.2	34%	0.342	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-73.7	159	171.5	-67.4	-22.6	0	0	0	110	T25 S126 N131 C134 I135	T25-N27 PolarHBondContact O-N 2.96Å; N27-S126 PolarHBondContact N-OG 3.19Å; N27-N131 WeakPolarHBondContact CB-OD1 3.48Å; N27-N131 VanDerWaalsContact CG-OD1 3.25Å; N27-N131 PolarHBondContact ND2-OD1 3.04Å; N27-C134 CarbonylContact O-C 3.34Å; N27-C134 VanDerWaalsContact O-CA 3.3Å; N27-C134 WeakPolarHBondContact O-CA 3.31Å; N27-C134 VanDerWaalsContact O-CB 3.31Å; N27-C134 WeakPolarHBondContact O-CB 3.26Å; N27-I135 WeakPolarHBondContact O-CG1 3.43Å; N27-I135 PolarHBondContact O-N 3.38Å
28	Y	90.2	Very high	62.3	Low	134 Å²	134	99.2 Å²	99.2	53%	0.525	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-77.2	142.1	175.6	-63.5	-69.3	0	0	0	111.9	N131 I135 N137	Y28-N131 PolarHBondContact O-ND2 3.07Å; Y28-N131 VanDerWaalsContact O-ND2 3.15Å; Y28-I135 CarbonylContact C-O 3.51Å; Y28-I135 VanDerWaalsContact CA-O 3.28Å; Y28-I135 WeakPolarHBondContact CA-O 3.46Å; Y28-I135 HydrophobicContact CD1-CD1 4.05Å; Y28-I135 HydrophobicContact CD1-CG1 3.84Å; Y28-I135 HydrophobicContact CE1-CD1 3.7Å; Y28-I135 HydrophobicContact CE1-CG1 4.03Å; Y28-N137 HydrophobicContact CD1-CB 3.58Å; Y28-N137 HydrophobicContact CE1-CB 3.86Å; Y28-N137 HydrophobicContact CG-CB 4.28Å
29	C	89.3	Confident	62.4	Low	13 Å²	13	99.4 Å²	99.4	9%	0.088	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-68.6	152.9	169.6	-53	0	0	0	0	110.1	D31 C134 I135	C29-D31 PolarHBondContact O-N 3.02Å; C29-C134 WeakPolarHBondContact CA-SG 3.32Å; C29-C134 HydrophobicContact CB-CB 4.05Å; C29-C134 WeakPolarHBondContact CB-SG 3.05Å; C29-C134 WeakPolarHBondContact SG-CB 3.28Å; C29-C134 CovalentContact SG-SG 2.04Å; C29-C134 PolarHBondContact SG-SG 2.86Å; C29-I135 PolarHBondContact N-O 3.27Å; C29-I135 VanDerWaalsContact SG-C 3.53Å
30	K	81.5	Confident	63.1	Low	210 Å²	210	97 Å²	97	91%	0.913	50%	0.5	S	S	*	.	S	Bend	trans	-68.2	-21.1	178	-69.6	-179.2	179.4	175.6	0	113.5
31	D	68.8	Low	64.5	Low	80 Å²	80	98.5 Å²	98.5	43%	0.428	51%	0.51	S	S	.	.			trans	-92.1	129.3	-176	-168.5	12.8	0	0	0	111.5	C29 R33 M136	C29-D31 PolarHBondContact O-N 3.02Å; D31-R33 IonicContact OD2-CZ 2.66Å; D31-R33 IonicContact OD2-NE 3.83Å; D31-R33 PolarHBondContact OD2-NE 3.33Å; D31-R33 IonicContact OD2-NH2 3.36Å; D31-R33 PolarHBondContact OD2-NH2 3.06Å; D31-M136 WeakPolarHBondContact O-CE 3.45Å
32	N	57.4	Low	66.3	Low	107 Å²	107	96.1 Å²	96.1	57%	0.572	51%	0.506	S	S	*	.			trans	-111.9	75.2	179.4	-82.6	-18.9	0	0	0	109.8
33	R	58.6	Low	68.3	Low	121 Å²	121	93.2 Å²	93.2	46%	0.457	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-69.7	149.2	167	-60.9	178.6	-147.2	158	8.2	110.2	D31 M136 N138	D31-R33 IonicContact OD2-CZ 2.66Å; D31-R33 IonicContact OD2-NE 3.83Å; D31-R33 PolarHBondContact OD2-NE 3.33Å; D31-R33 IonicContact OD2-NH2 3.36Å; D31-R33 PolarHBondContact OD2-NH2 3.06Å; R33-M136 HydrophobicContact CB-CE 3.65Å; R33-M136 HydrophobicContact CG-CE 3.8Å; R33-N138 PolarHBondContact O-ND2 2.94Å
34	S	55.2	Low	70.3	Confident	95 Å²	95	90 Å²	90	66%	0.664	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-71.8	157.8	178.5	54.5	0	0	0	0	111.9
35	L	54.4	Low	72.2	Confident	75 Å²	75	92.1 Å²	92.1	39%	0.393	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-54.9	144.1	172.2	-76.1	162.6	0	0	0	111.2	N138 T139	L35-N138 WeakPolarHBondContact CD2-O 3.35Å; L35-N138 HydrophobicContact CG-CB 4.48Å; L35-T139 HydrophobicContact CD2-CG2 4.16Å
36	V	57	Low	72.8	Confident	102 Å²	102	92.6 Å²	92.6	62%	0.618	47%	0.469	S	S	*	.	S	Bend	trans	-75.8	-26.9	176.3	-179.4	0	0	0	0	111.6
37	Y	56.2	Low	72.9	Confident	65 Å²	65	91.9 Å²	91.9	26%	0.255	47%	0.465	S	S	.	.	S	Bend	trans	-125.7	119.4	-178.5	-57.8	-76.8	0	0	0	109.6	C47 L50	Y37-C47 HydrophobicContact CD1-CB 4.35Å; Y37-C47 HydrophobicContact CD2-CB 4.21Å; Y37-C47 HydrophobicContact CG-CB 4.12Å; Y37-L50 WeakPolarHBondContact OH-CD2 3.48Å
38	N	55.8	Low	73.1	Confident	99 Å²	99	92.7 Å²	92.7	53%	0.529	46%	0.464	S	S	.	.			trans	-84.8	164.4	173.4	-76.6	-35.1	0	0	0	110.6	N40 E43	N38-N40 PolarHBondContact O-N 3.3Å; N38-E43 WeakPolarHBondContact CA-OE2 3.48Å; N38-E43 WeakPolarHBondContact CB-OE2 3.4Å; N38-E43 PolarHBondContact N-OE2 3.48Å
39	N	57.9	Low	73.4	Confident	121 Å²	121	92.2 Å²	92.2	65%	0.647	46%	0.464	S	S	*	.	S	Bend	trans	-66.5	16.2	-174.2	-86.9	-16.3	0	0	0	116.4	S80	N39-S80 WeakPolarHBondContact OD1-CB 3.32Å; N39-S80 PolarHBondContact OD1-OG 2.86Å
40	N	65.7	Low	73.6	Confident	99 Å²	99	94.3 Å²	94.3	53%	0.529	47%	0.474	S	S	.	.			trans	-76.1	135.5	175.3	-64.6	-27	0	0	0	109.8	N38 N42 E43 L44	N38-N40 PolarHBondContact O-N 3.3Å; N40-N42 VanDerWaalsContact C-N 3.26Å; N40-N42 PolarHBondContact O-N 2.99Å; N40-N42 VanDerWaalsContact O-N 3.12Å; N40-E43 HydrophobicContact CB-CG 4.31Å; N40-E43 PolarHBondContact ND2-OE1 2.91Å; N40-E43 PolarHBondContact O-N 2.87Å; N40-L44 PolarHBondContact O-N 3.03Å; N40-L44 VanDerWaalsContact O-N 3.07Å
41	N	73.2	Confident	74.3	Confident	129 Å²	129	84.4 Å²	84.4	69%	0.69	43%	0.432	S	S	*	.	H	α-helix	trans	-51.6	-41.3	-175.6	-71.9	-11.6	0	0	0	113.7	E43 L44 D45	N41-E43 VanDerWaalsContact C-N 3.35Å; N41-E43 PolarHBondContact O-N 3.23Å; N41-L44 PolarHBondContact O-N 3.22Å; N41-D45 PolarHBondContact O-N 2.81Å
42	N	77.8	Confident	75.6	Confident	133 Å²	133	84.1 Å²	84.1	71%	0.711	43%	0.429	S	S	*	.	H	α-helix	trans	-64.6	-37.8	178.7	-68.5	-6.9	0	0	0	112.6	N40 L44 E46	N40-N42 VanDerWaalsContact C-N 3.26Å; N40-N42 PolarHBondContact O-N 2.99Å; N40-N42 VanDerWaalsContact O-N 3.12Å; N42-L44 VanDerWaalsContact C-N 3.35Å; N42-E46 WeakPolarHBondContact O-CG 3.16Å; N42-E46 PolarHBondContact O-N 3.37Å
43	E	82.4	Confident	77.5	Confident	63 Å²	63	82.3 Å²	82.3	29%	0.294	43%	0.425	S	S	.	.	H	α-helix	trans	-71.5	-34.3	178.3	-68.2	175.7	-139.9	0	0	111.2	N38 N40 N41 E46 C47	N38-E43 WeakPolarHBondContact CA-OE2 3.48Å; N38-E43 WeakPolarHBondContact CB-OE2 3.4Å; N38-E43 PolarHBondContact N-OE2 3.48Å; N40-E43 HydrophobicContact CB-CG 4.31Å; N40-E43 PolarHBondContact ND2-OE1 2.91Å; N40-E43 PolarHBondContact O-N 2.87Å; N41-E43 VanDerWaalsContact C-N 3.35Å; N41-E43 PolarHBondContact O-N 3.23Å; E43-E46 PolarHBondContact O-N 3.34Å; E43-C47 PolarHBondContact O-N 3.49Å
44	L	87.6	Confident	79.3	Confident	28 Å²	28	77.4 Å²	77.4	15%	0.147	41%	0.408	C	S	.	.	H	α-helix	trans	-65	-45.4	176	-172.5	69.7	0	0	0	111.7	N40 N41 N42 E46 C47 Y48 C79	N40-L44 PolarHBondContact O-N 3.03Å; N40-L44 VanDerWaalsContact O-N 3.07Å; N41-L44 PolarHBondContact O-N 3.22Å; N42-L44 VanDerWaalsContact C-N 3.35Å; L44-E46 VanDerWaalsContact C-N 3.34Å; L44-E46 PolarHBondContact O-N 2.76Å; L44-C47 WeakPolarHBondContact O-CB 3.47Å; L44-C47 PolarHBondContact O-N 2.99Å; L44-Y48 HydrophobicContact CD1-CD2 4.5Å; L44-Y48 HydrophobicContact CD1-CE2 3.85Å; L44-Y48 HydrophobicContact CD2-CE2 4.01Å; L44-Y48 HydrophobicContact CG-CD2 4.06Å; L44-Y48 HydrophobicContact CG-CE2 3.6Å; L44-Y48 VanDerWaalsContact O-CD2 3.28Å; L44-Y48 WeakPolarHBondContact O-CD2 3.35Å; L44-Y48 PolarHBondContact O-N 2.98Å; L44-C79 HydrophobicContact CD1-CB 3.73Å
45	D	88.8	Confident	81.3	Confident	88 Å²	88	72.9 Å²	72.9	47%	0.471	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-40	176.8	-76.2	-17.2	0	0	0	112.1	N41 C47 Y48 K49	N41-D45 PolarHBondContact O-N 2.81Å; D45-C47 VanDerWaalsContact C-N 3.34Å; D45-Y48 PolarHBondContact O-N 3.25Å; D45-K49 VanDerWaalsContact O-CG 3.32Å; D45-K49 WeakPolarHBondContact O-CG 3.37Å; D45-K49 PolarHBondContact O-N 3.4Å
46	E	91.1	Very high	83.3	Confident	101 Å²	101	73.6 Å²	73.6	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-65.2	-37.4	174.5	-70.7	-57.8	124.5	0	0	112.1	N42 E43 L44 K49 L50	N42-E46 WeakPolarHBondContact O-CG 3.16Å; N42-E46 PolarHBondContact O-N 3.37Å; E43-E46 PolarHBondContact O-N 3.34Å; L44-E46 VanDerWaalsContact C-N 3.34Å; L44-E46 PolarHBondContact O-N 2.76Å; E46-K49 PolarHBondContact O-N 3.09Å; E46-K49 IonicContact OE1-NZ 3.12Å; E46-K49 PolarHBondContact OE1-NZ 2.97Å; E46-L50 WeakPolarHBondContact O-CB 3.22Å; E46-L50 PolarHBondContact O-N 3.31Å
47	C	92.2	Very high	85	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.02	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-47.8	173.3	175.6	0	0	0	0	111.9	Y37 E43 L44 D45 K49 L50 Q51 C79	Y37-C47 HydrophobicContact CD1-CB 4.35Å; Y37-C47 HydrophobicContact CD2-CB 4.21Å; Y37-C47 HydrophobicContact CG-CB 4.12Å; E43-C47 PolarHBondContact O-N 3.49Å; L44-C47 WeakPolarHBondContact O-CB 3.47Å; L44-C47 PolarHBondContact O-N 2.99Å; D45-C47 VanDerWaalsContact C-N 3.34Å; C47-K49 PolarHBondContact O-N 3.07Å; C47-L50 WeakPolarHBondContact O-CB 3.48Å; C47-L50 PolarHBondContact O-N 3.2Å; C47-Q51 PolarHBondContact O-N 2.87Å; C47-C79 VanDerWaalsContact C-SG 3.53Å; C47-C79 HydrophobicContact CB-CB 4.02Å; C47-C79 WeakPolarHBondContact CB-SG 3.46Å; C47-C79 WeakPolarHBondContact SG-CA 3.36Å; C47-C79 WeakPolarHBondContact SG-CB 3.22Å; C47-C79 CovalentContact SG-SG 2.05Å; C47-C79 PolarHBondContact SG-SG 3.19Å
48	Y	94.7	Very high	86.9	Confident	81 Å²	81	70 Å²	70	32%	0.318	36%	0.355	S	S	.	.	H	α-helix	trans	-65.1	-38.4	178.7	-73.1	-53.7	0	0	0	112.9	L44 D45 L50 Q51 L52 C79 N81	L44-Y48 HydrophobicContact CD1-CD2 4.5Å; L44-Y48 HydrophobicContact CD1-CE2 3.85Å; L44-Y48 HydrophobicContact CD2-CE2 4.01Å; L44-Y48 HydrophobicContact CG-CD2 4.06Å; L44-Y48 HydrophobicContact CG-CE2 3.6Å; L44-Y48 VanDerWaalsContact O-CD2 3.28Å; L44-Y48 WeakPolarHBondContact O-CD2 3.35Å; L44-Y48 PolarHBondContact O-N 2.98Å; D45-Y48 PolarHBondContact O-N 3.25Å; Y48-L50 VanDerWaalsContact C-N 3.33Å; Y48-L50 PolarHBondContact O-N 3.13Å; Y48-Q51 PolarHBondContact O-N 3.33Å; Y48-L52 WeakPolarHBondContact O-CB 3.25Å; Y48-L52 PolarHBondContact O-N 3.2Å; Y48-C79 HydrophobicContact CD1-CB 4.39Å; Y48-C79 VanDerWaalsContact CD1-SG 3.55Å; Y48-C79 HydrophobicContact CE1-CB 3.91Å; Y48-N81 VanDerWaalsContact OH-CG 3.26Å; Y48-N81 PolarHBondContact OH-ND2 3.49Å; Y48-N81 PolarHBondContact OH-OD1 3.41Å
49	K	95.2	Very high	88.8	Confident	123 Å²	123	65.6 Å²	65.6	54%	0.535	33%	0.331	S	S	.	.	H	α-helix	trans	-61.4	-42.5	172.7	-72.2	173.8	-163.7	166.6	0	111.4	D45 E46 C47 L52 S53	D45-K49 VanDerWaalsContact O-CG 3.32Å; D45-K49 WeakPolarHBondContact O-CG 3.37Å; D45-K49 PolarHBondContact O-N 3.4Å; E46-K49 PolarHBondContact O-N 3.09Å; E46-K49 IonicContact OE1-NZ 3.12Å; E46-K49 PolarHBondContact OE1-NZ 2.97Å; C47-K49 PolarHBondContact O-N 3.07Å; K49-L52 PolarHBondContact O-N 3.24Å; K49-S53 WeakPolarHBondContact O-CB 3.47Å; K49-S53 PolarHBondContact O-N 3.04Å
50	L	95.1	Very high	90.6	Very high	57 Å²	57	61.8 Å²	61.8	30%	0.298	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-48.4	176.7	179.1	62.9	0	0	0	111.5	Y37 E46 C47 Y48 L52 S53 L54	Y37-L50 WeakPolarHBondContact OH-CD2 3.48Å; E46-L50 WeakPolarHBondContact O-CB 3.22Å; E46-L50 PolarHBondContact O-N 3.31Å; C47-L50 WeakPolarHBondContact O-CB 3.48Å; C47-L50 PolarHBondContact O-N 3.2Å; Y48-L50 VanDerWaalsContact C-N 3.33Å; Y48-L50 PolarHBondContact O-N 3.13Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.29Å; L50-S53 WeakPolarHBondContact O-CB 3.45Å; L50-S53 PolarHBondContact O-N 3.32Å; L50-L54 HydrophobicContact CD1-CD1 3.95Å; L50-L54 HydrophobicContact CD1-CD2 4.47Å; L50-L54 HydrophobicContact CD1-CG 3.96Å; L50-L54 HydrophobicContact CG-CD1 3.91Å; L50-L54 HydrophobicContact CG-CG 4.32Å; L50-L54 WeakPolarHBondContact O-CB 3.23Å; L50-L54 WeakPolarHBondContact O-CG 3.28Å; L50-L54 PolarHBondContact O-N 3.36Å
51	Q	95.1	Very high	92.1	Very high	3 Å²	3	58.4 Å²	58.4	1%	0.014	29%	0.292	C	S	.	.	H	α-helix	trans	-53.4	-47.9	175.1	-80	-175.4	-13	0	0	111.4	C47 Y48 L54 A55 H77 C79 E82 P167	C47-Q51 PolarHBondContact O-N 2.87Å; Y48-Q51 PolarHBondContact O-N 3.33Å; Q51-L54 PolarHBondContact O-N 2.99Å; Q51-A55 VanDerWaalsContact O-CB 3.3Å; Q51-A55 WeakPolarHBondContact O-CB 3.49Å; Q51-A55 PolarHBondContact O-N 3.25Å; Q51-H77 HydrophobicContact CG-CB 4.17Å; Q51-H77 VanDerWaalsContact CG-O 3.28Å; Q51-H77 WeakPolarHBondContact CG-O 3.47Å; Q51-H77 PolarHBondContact NE2-O 3.47Å; Q51-C79 VanDerWaalsContact CD-SG 3.58Å; Q51-C79 PolarHBondContact NE2-SG 3.02Å; Q51-E82 PolarHBondContact NE2-OE1 2.88Å; Q51-E82 PolarHBondContact NE2-OE2 3.39Å; Q51-P167 HydrophobicContact CB-CB 4.07Å; Q51-P167 HydrophobicContact CB-CG 4.46Å
52	L	96.8	Very high	93.1	Very high	73 Å²	73	56.4 Å²	56.4	38%	0.382	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-44.3	178.8	-178.6	65.2	0	0	0	111.7	Y48 K49 L50 A55 K56 Y110	Y48-L52 WeakPolarHBondContact O-CB 3.25Å; Y48-L52 PolarHBondContact O-N 3.2Å; K49-L52 PolarHBondContact O-N 3.24Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.29Å; L52-A55 PolarHBondContact O-N 3.2Å; L52-K56 WeakPolarHBondContact O-CG 2.84Å; L52-K56 PolarHBondContact O-N 3.28Å; L52-Y110 HydrophobicContact CD1-CD1 3.34Å; L52-Y110 HydrophobicContact CD1-CE1 3.52Å
53	S	96.9	Very high	94	Very high	69 Å²	69	51.1 Å²	51.1	48%	0.483	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-47	177.7	-175.1	0	0	0	0	111.5	K49 L50 K56 Q57	K49-S53 WeakPolarHBondContact O-CB 3.47Å; K49-S53 PolarHBondContact O-N 3.04Å; L50-S53 WeakPolarHBondContact O-CB 3.45Å; L50-S53 PolarHBondContact O-N 3.32Å; S53-K56 WeakPolarHBondContact O-CB 3.5Å; S53-K56 PolarHBondContact O-N 3.32Å; S53-Q57 PolarHBondContact O-N 3.37Å
54	L	96.7	Very high	94.7	Very high	19 Å²	19	48.4 Å²	48.4	10%	0.099	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-37.8	178.2	-66.6	174.8	0	0	0	112.1	L50 Q51 K56 Q57 R58 I60 H77 I171	L50-L54 HydrophobicContact CD1-CD1 3.95Å; L50-L54 HydrophobicContact CD1-CD2 4.47Å; L50-L54 HydrophobicContact CD1-CG 3.96Å; L50-L54 HydrophobicContact CG-CD1 3.91Å; L50-L54 HydrophobicContact CG-CG 4.32Å; L50-L54 WeakPolarHBondContact O-CB 3.23Å; L50-L54 WeakPolarHBondContact O-CG 3.28Å; L50-L54 PolarHBondContact O-N 3.36Å; Q51-L54 PolarHBondContact O-N 2.99Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.41Å; L54-Q57 PolarHBondContact O-N 2.8Å; L54-R58 PolarHBondContact O-N 3.01Å; L54-I60 HydrophobicContact CD2-CD1 4.12Å; L54-H77 WeakPolarHBondContact CD1-CD2 3.38Å; L54-H77 VanDerWaalsContact CD1-CE1 3.41Å; L54-H77 WeakPolarHBondContact CD1-CE1 3.45Å; L54-H77 VanDerWaalsContact CD1-NE2 3.27Å; L54-H77 WeakPolarHBondContact CD1-NE2 3.45Å; L54-I171 HydrophobicContact CB-CD1 3.66Å; L54-I171 HydrophobicContact CB-CG1 3.9Å; L54-I171 HydrophobicContact CB-CG2 4.4Å; L54-I171 HydrophobicContact CD1-CD1 4.31Å
55	A	97.2	Very high	95	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-39.8	173.4	0	0	0	0	0	111.2	Q51 L52 R58 Y110 P167 F170 I171	Q51-A55 VanDerWaalsContact O-CB 3.3Å; Q51-A55 WeakPolarHBondContact O-CB 3.49Å; Q51-A55 PolarHBondContact O-N 3.25Å; L52-A55 PolarHBondContact O-N 3.2Å; A55-R58 PolarHBondContact O-N 3.21Å; A55-R58 PolarHBondContact O-NE 3Å; A55-R58 PolarHBondContact O-NH2 3.42Å; A55-Y110 HydrophobicContact CB-CD1 4.37Å; A55-Y110 HydrophobicContact CB-CD2 3.94Å; A55-Y110 HydrophobicContact CB-CE2 4.3Å; A55-Y110 HydrophobicContact CB-CG 3.98Å; A55-P167 HydrophobicContact CB-CB 3.96Å; A55-F170 HydrophobicContact CB-CB 4.23Å; A55-I171 HydrophobicContact CB-CG1 4.41Å
56	K	95.7	Very high	95.1	Very high	90 Å²	90	48.4 Å²	48.4	39%	0.391	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-39.9	173.1	-72.9	-178.2	176.4	-153.8	0	112.8	L52 S53 L54 R58 D111 H112	L52-K56 WeakPolarHBondContact O-CG 2.84Å; L52-K56 PolarHBondContact O-N 3.28Å; S53-K56 WeakPolarHBondContact O-CB 3.5Å; S53-K56 PolarHBondContact O-N 3.32Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.41Å; K56-R58 VanDerWaalsContact C-N 3.26Å; K56-R58 PolarHBondContact O-N 3.03Å; K56-D111 WeakPolarHBondContact CD-OD2 3.21Å; K56-D111 WeakPolarHBondContact CE-OD2 3.34Å; K56-D111 IonicContact NZ-OD2 2.74Å; K56-D111 PolarHBondContact NZ-OD2 3.3Å; K56-H112 PolarHBondContact O-CD2 3.41Å; K56-H112 PolarHBondContact O-NE2 3.42Å
57	Q	93.8	Very high	95	Very high	91 Å²	91	49.3 Å²	49.3	43%	0.425	24%	0.238	S	C	.	.	H	α-helix	trans	-63.5	-34.2	173.4	-178.8	-179.5	-11.3	0	0	111.7	S53 L54 H59	S53-Q57 PolarHBondContact O-N 3.37Å; L54-Q57 PolarHBondContact O-N 2.8Å; Q57-H59 PolarHBondContact O-N 3.24Å
58	R	95	Very high	95.1	Very high	1 Å²	1	54 Å²	54	0%	0.004	26%	0.26	C	S	.	.			trans	68	-50.1	174	-166.1	65.1	35	122.4	11.3	115.2	L54 A55 K56 F109 Y110 F170 W172	L54-R58 PolarHBondContact O-N 3.01Å; A55-R58 PolarHBondContact O-N 3.21Å; A55-R58 PolarHBondContact O-NE 3Å; A55-R58 PolarHBondContact O-NH2 3.42Å; K56-R58 VanDerWaalsContact C-N 3.26Å; K56-R58 PolarHBondContact O-N 3.03Å; R58-F109 PolarHBondContact NH1-O 3.49Å; R58-F109 PolarHBondContact NH2-O 2.91Å; R58-Y110 PolarHBondContact NH2-O 3.23Å; R58-F170 WeakPolarHBondContact CA-O 3.3Å; R58-F170 WeakPolarHBondContact CD-O 3.44Å; R58-F170 PolarHBondContact NE-O 3.17Å; R58-F170 VanDerWaalsContact NE-O 3.11Å; R58-W172 HydrophobicContact CG-CD2 3.99Å; R58-W172 HydrophobicContact CG-CE3 3.56Å; R58-W172 HydrophobicContact CG-CH2 3.99Å; R58-W172 HydrophobicContact CG-CZ2 4.37Å; R58-W172 HydrophobicContact CG-CZ3 3.55Å; R58-W172 WeakPolarHBondContact O-CB 3.33Å; R58-W172 PolarHBondContact O-N 3.02Å
59	H	95.6	Very high	95.1	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	108.5	-167.8	-55.5	-77.1	0	0	0	111.1	Q57 I61 F102 W172 H174 L274 I278	Q57-H59 PolarHBondContact O-N 3.24Å; H59-I61 HydrophobicContact CB-CD1 4.42Å; H59-F102 AromaticContact CE1-CE1 3.89Å; H59-W172 AromaticContact CE1-CE3 3.42Å; H59-W172 VanDerWaalsContact CE1-CE3 3.42Å; H59-W172 AromaticContact CE1-CZ3 3.49Å; H59-W172 VanDerWaalsContact CE1-CZ3 3.49Å; H59-W172 WeakPolarHBondContact CE1-CZ3 3.37Å; H59-W172 AromaticContact ND1-CE3 3.67Å; H59-H174 AromaticContact CG-NE2 3.84Å; H59-H174 AromaticContact ND1-CD2 3.94Å; H59-H174 AromaticContact ND1-CE1 3.93Å; H59-H174 AromaticContact ND1-NE2 2.98Å; H59-H174 PolarHBondContact ND1-NE2 2.96Å; H59-L274 WeakPolarHBondContact NE2-CD1 3.22Å; H59-I278 HydrophobicContact CB-CG1 4.49Å; H59-I278 VanDerWaalsContact CE1-CG1 3.49Å; H59-I278 WeakPolarHBondContact CE1-CG1 3.34Å
60	I	96	Very high	95	Very high	40 Å²	40	51.5 Å²	51.5	21%	0.205	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.7	170.8	-56.8	173.5	0	0	0	107.1	L54 I171 W172 Y173 H174	L54-I60 HydrophobicContact CD2-CD1 4.12Å; I60-I171 HydrophobicContact CD1-CG2 3.56Å; I60-I171 HydrophobicContact CG1-CG2 4.46Å; I60-W172 PolarHBondContact N-O 3.24Å; I60-Y173 HydrophobicContact CB-CD1 3.8Å; I60-Y173 HydrophobicContact CB-CE1 4Å; I60-Y173 HydrophobicContact CD1-CD1 4.18Å; I60-Y173 HydrophobicContact CD1-CE1 3.53Å; I60-Y173 HydrophobicContact CG1-CE1 4.38Å; I60-Y173 HydrophobicContact CG2-CD1 3.69Å; I60-Y173 HydrophobicContact CG2-CE1 3.78Å; I60-Y173 CarbonylContact O-C 3.53Å; I60-Y173 VanDerWaalsContact O-CA 3.22Å; I60-Y173 WeakPolarHBondContact O-CA 2.93Å; I60-H174 PolarHBondContact O-N 3.29Å
61	I	96.6	Very high	95	Very high	28 Å²	28	54.5 Å²	54.5	14%	0.144	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.4	-170.6	-61.3	162.9	0	0	0	108.9	H59 H174 I278 N281 Y334	H59-I61 HydrophobicContact CB-CD1 4.42Å; I61-H174 WeakPolarHBondContact CA-O 3.49Å; I61-H174 HydrophobicContact CG1-CB 3.94Å; I61-H174 HydrophobicContact CG2-CB 4.5Å; I61-I278 HydrophobicContact CD1-CG2 3.9Å; I61-I278 WeakPolarHBondContact CD1-O 3.26Å; I61-N281 HydrophobicContact CD1-CB 4.23Å; I61-Y334 WeakPolarHBondContact CG2-OH 3.43Å
62	K	95.9	Very high	95.1	Very high	88 Å²	88	54.5 Å²	54.5	38%	0.383	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	118.5	175.1	-173.8	170.1	177.5	179	0	109.2	I72 H174 I175 D176	K62-I72 HydrophobicContact CD-CD1 3.85Å; K62-H174 PolarHBondContact N-O 3.14Å; K62-I175 HydrophobicContact CB-CD1 3.67Å; K62-I175 HydrophobicContact CD-CD1 4.47Å; K62-I175 WeakPolarHBondContact O-CA 3.46Å; K62-D176 PolarHBondContact O-N 3.2Å
63	L	96.2	Very high	95	Very high	21 Å²	21	54.7 Å²	54.7	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	133.5	173.8	-63.1	178.2	0	0	0	110.2	D176 I178 F283 F286 L317 Y334	L63-D176 CarbonylContact C-O 3.6Å; L63-D176 VanDerWaalsContact CA-O 3.27Å; L63-D176 WeakPolarHBondContact CA-O 3.43Å; L63-I178 HydrophobicContact CD2-CD1 4.48Å; L63-F283 HydrophobicContact CD1-CD1 4.25Å; L63-F283 HydrophobicContact CD1-CE1 3.8Å; L63-F283 HydrophobicContact CD1-CZ 3.97Å; L63-F286 HydrophobicContact CD1-CE2 3.97Å; L63-F286 HydrophobicContact CD1-CZ 4.33Å; L63-L317 HydrophobicContact CB-CD1 3.93Å; L63-L317 HydrophobicContact CB-CD2 4.22Å; L63-L317 HydrophobicContact CD1-CD1 4.32Å; L63-Y334 HydrophobicContact CD2-CD2 4.17Å; L63-Y334 HydrophobicContact CD2-CE2 3.53Å
64	V	95.8	Very high	95	Very high	6 Å²	6	51.6 Å²	51.6	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	158.3	174.1	-58.1	0	0	0	0	110.3	T70 I72 F147 P149 I175 D176 Y177	V64-T70 HydrophobicContact CB-CG2 4.09Å; V64-T70 HydrophobicContact CG1-CG2 3.8Å; V64-I72 HydrophobicContact CG1-CD1 3.78Å; V64-F147 HydrophobicContact CG2-CE1 4.15Å; V64-P149 HydrophobicContact CG2-CB 3.94Å; V64-P149 HydrophobicContact CG2-CG 4.06Å; V64-I175 HydrophobicContact CG1-CG2 3.91Å; V64-D176 WeakPolarHBondContact CG2-O 3.49Å; V64-D176 PolarHBondContact N-O 2.96Å; V64-Y177 WeakPolarHBondContact O-CB 2.97Å
65	K	94.7	Very high	95	Very high	71 Å²	71	52.7 Å²	52.7	31%	0.309	26%	0.256	S	S	.	.			trans	-80.6	124.5	179.1	-175.7	-178	-175.4	-175	0	110.2	N67 Q68 P149 Q316	K65-N67 PolarHBondContact O-N 3.49Å; K65-Q68 HydrophobicContact CB-CB 4.33Å; K65-Q68 HydrophobicContact CD-CB 3.93Å; K65-Q68 VanDerWaalsContact CD-OE1 3.3Å; K65-Q68 HydrophobicContact CG-CB 4.28Å; K65-Q68 PolarHBondContact O-N 2.98Å; K65-P149 WeakPolarHBondContact O-CG 3.3Å; K65-Q316 WeakPolarHBondContact CD-O 3.09Å; K65-Q316 WeakPolarHBondContact CE-O 3.39Å; K65-Q316 VanDerWaalsContact CG-O 3.25Å; K65-Q316 WeakPolarHBondContact CG-O 3.32Å
66	Y	90.8	Very high	94.9	Very high	46 Å²	46	52.9 Å²	52.9	18%	0.18	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-42.6	-172.7	174.9	-116.2	0	0	0	116.1	P149 Y150 Y177 P180	Y66-P149 WeakPolarHBondContact O-CB 3.2Å; Y66-Y150 HydrophobicContact CE2-CD2 4.28Å; Y66-Y177 HydrophobicContact CD2-CD1 4.38Å; Y66-Y177 AromaticContact CD2-CD2 3.34Å; Y66-Y177 HydrophobicContact CD2-CD2 3.34Å; Y66-Y177 HydrophobicContact CD2-CE1 4.2Å; Y66-Y177 AromaticContact CD2-CE2 3.11Å; Y66-Y177 HydrophobicContact CD2-CE2 3.11Å; Y66-Y177 AromaticContact CD2-CG 3.99Å; Y66-Y177 HydrophobicContact CD2-CG 3.99Å; Y66-Y177 AromaticContact CD2-CZ 3.6Å; Y66-Y177 HydrophobicContact CE2-CD2 4.21Å; Y66-Y177 AromaticContact CE2-CE2 3.52Å; Y66-Y177 HydrophobicContact CE2-CE2 3.52Å; Y66-Y177 AromaticContact CE2-CZ 3.73Å; Y66-Y177 AromaticContact CG-CD2 3.93Å; Y66-Y177 HydrophobicContact CG-CD2 3.93Å; Y66-Y177 HydrophobicContact CG-CE2 4.05Å; Y66-P180 HydrophobicContact CD1-CG 3.63Å; Y66-P180 HydrophobicContact CE1-CG 3.68Å
67	N	89.3	Confident	94.8	Very high	119 Å²	119	50.3 Å²	50.3	64%	0.636	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.6	27.8	-172.6	-72.1	-24.2	0	0	0	113.3	K65	K65-N67 PolarHBondContact O-N 3.49Å
68	Q	93.2	Very high	94.7	Very high	103 Å²	103	47.1 Å²	47.1	48%	0.481	23%	0.232	S	C	.	.	S	Bend	trans	-145.5	126.4	-176.1	-173	174.7	-26.6	0	0	110.8	K65 P149	K65-Q68 HydrophobicContact CB-CB 4.33Å; K65-Q68 HydrophobicContact CD-CB 3.93Å; K65-Q68 VanDerWaalsContact CD-OE1 3.3Å; K65-Q68 HydrophobicContact CG-CB 4.28Å; K65-Q68 PolarHBondContact O-N 2.98Å; Q68-P149 WeakPolarHBondContact O-CG 3.41Å
69	F	94.9	Very high	94.6	Very high	104 Å²	104	47.2 Å²	47.2	46%	0.456	23%	0.233	S	C	.	.			trans	-61.8	141.4	168.9	-62.7	-79.2	0	0	0	110.1	K146 F147 D148	F69-K146 HydrophobicContact CB-CG 3.72Å; F69-K146 HydrophobicContact CD1-CD 4.17Å; F69-K146 HydrophobicContact CD1-CG 3.49Å; F69-K146 VanDerWaalsContact CD1-CG 3.49Å; F69-K146 HydrophobicContact CD2-CG 4.41Å; F69-K146 HydrophobicContact CE1-CD 4.41Å; F69-K146 HydrophobicContact CE1-CG 4.15Å; F69-K146 HydrophobicContact CG-CD 4.27Å; F69-K146 HydrophobicContact CG-CG 3.62Å; F69-F147 WeakPolarHBondContact CA-O 3.47Å; F69-D148 HydrophobicContact CD1-CB 4.06Å; F69-D148 HydrophobicContact CE1-CB 3.69Å
70	T	94.5	Very high	94.1	Very high	47 Å²	47	48.4 Å²	48.4	29%	0.288	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	158	-177.6	-168.2	0	0	0	0	111.1	V64 I72 F147	V64-T70 HydrophobicContact CB-CG2 4.09Å; V64-T70 HydrophobicContact CG1-CG2 3.8Å; T70-I72 HydrophobicContact CG2-CD1 3.98Å; T70-I72 HydrophobicContact CG2-CG1 4.03Å; T70-F147 HydrophobicContact CG2-CB 4.14Å; T70-F147 HydrophobicContact CG2-CD1 4.3Å; T70-F147 PolarHBondContact N-O 3.41Å; T70-F147 WeakPolarHBondContact O-CB 3.46Å; T70-F147 PolarHBondContact O-N 2.57Å
71	N	94.9	Very high	93.7	Very high	120 Å²	120	51 Å²	51	64%	0.642	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.9	175.3	-58.6	20.7	0	0	0	108.4	Y144 E145	N71-Y144 CarbonylContact C-O 3.53Å; N71-Y144 VanDerWaalsContact CA-O 3.29Å; N71-Y144 WeakPolarHBondContact CA-O 3.35Å; N71-E145 PolarHBondContact OD1-O 2.91Å
72	I	96.4	Very high	93.4	Very high	2 Å²	2	51 Å²	51	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.7	175.9	-63.3	-63.6	0	0	0	108.7	K62 V64 T70 L74 I143 Y144 F147 I175	K62-I72 HydrophobicContact CD-CD1 3.85Å; V64-I72 HydrophobicContact CG1-CD1 3.78Å; T70-I72 HydrophobicContact CG2-CD1 3.98Å; T70-I72 HydrophobicContact CG2-CG1 4.03Å; I72-L74 HydrophobicContact CG2-CD1 4.48Å; I72-L74 HydrophobicContact CG2-CD2 3.57Å; I72-L74 HydrophobicContact CG2-CG 3.8Å; I72-I143 CarbonylContact O-C 3.57Å; I72-I143 WeakPolarHBondContact O-CA 3.43Å; I72-Y144 PolarHBondContact N-O 2.95Å; I72-Y144 PolarHBondContact O-N 3.44Å; I72-F147 HydrophobicContact CB-CB 4.37Å; I72-F147 HydrophobicContact CB-CD2 4.14Å; I72-F147 HydrophobicContact CB-CG 4.4Å; I72-F147 HydrophobicContact CG1-CB 3.72Å; I72-F147 HydrophobicContact CG1-CD1 4.16Å; I72-F147 HydrophobicContact CG1-CD2 3.75Å; I72-F147 HydrophobicContact CG1-CE2 4.35Å; I72-F147 HydrophobicContact CG1-CG 3.62Å; I72-I175 HydrophobicContact CD1-CG2 4.11Å; I72-I175 HydrophobicContact CG1-CG2 4.33Å
73	Q	95.5	Very high	93.2	Very high	77 Å²	77	50.6 Å²	50.6	36%	0.36	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.4	170.4	-179.6	179.4	-26.8	0	0	106.7	E141 L142 I143	Q73-E141 PolarHBondContact NE2-OE2 3.43Å; Q73-L142 CarbonylContact C-O 3.08Å; Q73-L142 WeakPolarHBondContact CA-O 3.16Å; Q73-I143 HydrophobicContact CG-CG1 4.21Å
74	L	97.1	Very high	92.8	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.4	177	-50.2	-177	0	0	0	108.9	I72 W89 E141 L142 Y156 Y173 I175	I72-L74 HydrophobicContact CG2-CD1 4.48Å; I72-L74 HydrophobicContact CG2-CD2 3.57Å; I72-L74 HydrophobicContact CG2-CG 3.8Å; L74-W89 HydrophobicContact CB-CH2 3.71Å; L74-W89 HydrophobicContact CB-CZ2 4.2Å; L74-W89 HydrophobicContact CB-CZ3 4.29Å; L74-W89 HydrophobicContact CD1-CZ3 4.35Å; L74-W89 WeakPolarHBondContact O-CZ2 3.49Å; L74-E141 CarbonylContact O-C 3.52Å; L74-E141 WeakPolarHBondContact O-CA 3.41Å; L74-L142 HydrophobicContact CB-CB 4.34Å; L74-L142 HydrophobicContact CD1-CD2 4.19Å; L74-L142 PolarHBondContact N-O 2.77Å; L74-L142 PolarHBondContact O-N 2.74Å; L74-Y156 HydrophobicContact CD1-CD1 3.81Å; L74-Y156 HydrophobicContact CD1-CD2 4.26Å; L74-Y156 HydrophobicContact CD1-CG 3.66Å; L74-Y173 HydrophobicContact CB-CG 4.49Å; L74-Y173 HydrophobicContact CD1-CG 4.35Å; L74-Y173 HydrophobicContact CD2-CD1 4.04Å; L74-Y173 HydrophobicContact CD2-CG 4.21Å; L74-I175 HydrophobicContact CD1-CD1 4.49Å; L74-I175 HydrophobicContact CD1-CG1 4.19Å; L74-I175 HydrophobicContact CD2-CD1 3.55Å; L74-I175 HydrophobicContact CD2-CG1 4.08Å
75	T	95.1	Very high	92.5	Very high	43 Å²	43	59 Å²	59	26%	0.264	30%	0.299	S	S	.	.			trans	-77.5	129.8	-179.1	-58.8	0	0	0	0	110.6	E141 Y173	T75-E141 HydrophobicContact CG2-CG 4.34Å; T75-E141 WeakPolarHBondContact CG2-OE1 3.23Å; T75-E141 PolarHBondContact OG1-OE1 2.04Å; T75-Y173 WeakPolarHBondContact O-CE2 3.3Å; T75-Y173 PolarHBondContact O-OH 3.05Å
76	C	95.2	Very high	92.4	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.027	30%	0.299	C	S	.	.			trans	-89.2	104.6	161.4	-173.9	0	0	0	0	106.2	L78 W89 N140 C158	C76-L78 HydrophobicContact CB-CG 4.32Å; C76-L78 PolarHBondContact O-N 3.11Å; C76-L78 VanDerWaalsContact SG-CD2 3.57Å; C76-L78 WeakPolarHBondContact SG-CG 3.46Å; C76-W89 HydrophobicContact CB-CZ2 3.71Å; C76-N140 HydrophobicContact CB-CB 4.12Å; C76-N140 VanDerWaalsContact CB-O 3.3Å; C76-N140 WeakPolarHBondContact CB-O 3.2Å; C76-C158 HydrophobicContact CB-CB 3.71Å; C76-C158 WeakPolarHBondContact CB-SG 3.38Å; C76-C158 WeakPolarHBondContact SG-CB 3.27Å; C76-C158 CovalentContact SG-SG 2.03Å; C76-C158 PolarHBondContact SG-SG 2.76Å
77	H	94.3	Very high	92.6	Very high	36 Å²	36	57.5 Å²	57.5	17%	0.167	29%	0.294	C	S	.	.			trans	-71.1	79	-175.9	-70.3	-82.1	0	0	0	110.3	Q51 L54 T168 I171 Y173	Q51-H77 HydrophobicContact CG-CB 4.17Å; Q51-H77 VanDerWaalsContact CG-O 3.28Å; Q51-H77 WeakPolarHBondContact CG-O 3.47Å; Q51-H77 PolarHBondContact NE2-O 3.47Å; L54-H77 WeakPolarHBondContact CD1-CD2 3.38Å; L54-H77 VanDerWaalsContact CD1-CE1 3.41Å; L54-H77 WeakPolarHBondContact CD1-CE1 3.45Å; L54-H77 VanDerWaalsContact CD1-NE2 3.27Å; L54-H77 WeakPolarHBondContact CD1-NE2 3.45Å; H77-T168 WeakPolarHBondContact O-CG2 3.24Å; H77-I171 HydrophobicContact CB-CD1 4.24Å; H77-Y173 PolarHBondContact CD2-OH 3.37Å; H77-Y173 PolarHBondContact NE2-OH 3.27Å
78	L	92.4	Very high	92.9	Very high	23 Å²	23	55.1 Å²	55.1	12%	0.12	28%	0.279	C	S	.	.			trans	-100.3	139.9	176.6	-58.3	-178.8	0	0	0	110.4	C76 E82 R84 F87 N140 T168	C76-L78 HydrophobicContact CB-CG 4.32Å; C76-L78 PolarHBondContact O-N 3.11Å; C76-L78 VanDerWaalsContact SG-CD2 3.57Å; C76-L78 WeakPolarHBondContact SG-CG 3.46Å; L78-E82 WeakPolarHBondContact CA-OE2 3.25Å; L78-R84 HydrophobicContact CD1-CB 4.46Å; L78-R84 HydrophobicContact CD1-CG 3.86Å; L78-F87 HydrophobicContact CD1-CB 4.37Å; L78-F87 HydrophobicContact CD1-CD2 3.98Å; L78-F87 HydrophobicContact CD1-CG 4.16Å; L78-F87 HydrophobicContact CD2-CB 4.5Å; L78-F87 HydrophobicContact CD2-CD1 3.58Å; L78-F87 HydrophobicContact CD2-CD2 3.72Å; L78-F87 HydrophobicContact CD2-CE1 3.52Å; L78-F87 HydrophobicContact CD2-CE2 3.7Å; L78-F87 HydrophobicContact CD2-CG 3.67Å; L78-F87 HydrophobicContact CD2-CZ 3.59Å; L78-N140 HydrophobicContact CD1-CB 3.83Å; L78-T168 HydrophobicContact CD2-CG2 4.22Å
79	C	91.6	Very high	93.1	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.02	26%	0.256	C	S	.	.			trans	-86.9	155.4	172.2	-58.7	0	0	0	0	110.6	L44 C47 Y48 Q51 N81 E82	L44-C79 HydrophobicContact CD1-CB 3.73Å; C47-C79 VanDerWaalsContact C-SG 3.53Å; C47-C79 HydrophobicContact CB-CB 4.02Å; C47-C79 WeakPolarHBondContact CB-SG 3.46Å; C47-C79 WeakPolarHBondContact SG-CA 3.36Å; C47-C79 WeakPolarHBondContact SG-CB 3.22Å; C47-C79 CovalentContact SG-SG 2.05Å; C47-C79 PolarHBondContact SG-SG 3.19Å; Y48-C79 HydrophobicContact CD1-CB 4.39Å; Y48-C79 VanDerWaalsContact CD1-SG 3.55Å; Y48-C79 HydrophobicContact CE1-CB 3.91Å; Q51-C79 VanDerWaalsContact CD-SG 3.58Å; Q51-C79 PolarHBondContact NE2-SG 3.02Å; C79-N81 PolarHBondContact O-N 2.99Å; C79-N81 VanDerWaalsContact O-N 3.1Å; C79-E82 HydrophobicContact CB-CG 4.26Å; C79-E82 PolarHBondContact N-OE2 3.05Å; C79-E82 WeakPolarHBondContact O-CB 3.14Å; C79-E82 PolarHBondContact O-N 2.77Å
80	S	86.3	Confident	93.3	Very high	32 Å²	32	46.6 Å²	46.6	22%	0.224	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.7	-164.8	61.2	0	0	0	0	114.8	N39	N39-S80 WeakPolarHBondContact OD1-CB 3.32Å; N39-S80 PolarHBondContact OD1-OG 2.86Å
81	N	87.6	Confident	93.4	Very high	93 Å²	93	46.7 Å²	46.7	50%	0.497	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.9	175.1	65.3	-16.1	0	0	0	113.9	Y48 C79	Y48-N81 VanDerWaalsContact OH-CG 3.26Å; Y48-N81 PolarHBondContact OH-ND2 3.49Å; Y48-N81 PolarHBondContact OH-OD1 3.41Å; C79-N81 PolarHBondContact O-N 2.99Å; C79-N81 VanDerWaalsContact O-N 3.1Å
82	E	90.6	Very high	93.5	Very high	29 Å²	29	41 Å²	41	14%	0.136	21%	0.205	C	C	.	.	S	Bend	trans	-83.7	133	180	-62.4	178.9	150.1	0	0	110.9	Q51 L78 C79 R84 F87 H166	Q51-E82 PolarHBondContact NE2-OE1 2.88Å; Q51-E82 PolarHBondContact NE2-OE2 3.39Å; L78-E82 WeakPolarHBondContact CA-OE2 3.25Å; C79-E82 HydrophobicContact CB-CG 4.26Å; C79-E82 PolarHBondContact N-OE2 3.05Å; C79-E82 WeakPolarHBondContact O-CB 3.14Å; C79-E82 PolarHBondContact O-N 2.77Å; E82-R84 PolarHBondContact O-N 2.71Å; E82-F87 HydrophobicContact CB-CE2 4.12Å; E82-F87 HydrophobicContact CB-CZ 4.48Å; E82-H166 IonicContact OE1-CE1 3.65Å; E82-H166 PolarHBondContact OE1-CE1 3.49Å; E82-H166 IonicContact OE1-NE2 2.65Å; E82-H166 PolarHBondContact OE1-NE2 3.35Å; E82-H166 IonicContact OE2-CE1 3.44Å
83	N	90.3	Very high	93.5	Very high	79 Å²	79	41.2 Å²	41.2	42%	0.422	21%	0.207	S	C	.	.			trans	-75.6	109.1	179	-175	3.5	0	0	0	110.9	T85 H86 F87	N83-T85 PolarHBondContact ND2-OG1 2.72Å; N83-T85 VanDerWaalsContact ND2-OG1 3.08Å; N83-T85 PolarHBondContact O-N 3.02Å; N83-T85 VanDerWaalsContact O-N 3.14Å; N83-T85 PolarHBondContact OD1-N 2.81Å; N83-T85 PolarHBondContact OD1-OG1 2.9Å; N83-T85 VanDerWaalsContact OD1-OG1 3.08Å; N83-H86 PolarHBondContact ND2-CD2 2.88Å; N83-H86 PolarHBondContact ND2-NE2 3.34Å; N83-H86 WeakPolarHBondContact O-CB 3.35Å; N83-H86 PolarHBondContact O-N 2.93Å; N83-F87 VanDerWaalsContact O-CD2 3.31Å; N83-F87 WeakPolarHBondContact O-CD2 3.41Å
84	R	88	Confident	93.5	Very high	102 Å²	102	37.7 Å²	37.7	39%	0.385	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-53.9	-32.9	179.9	-69.9	170.9	-80.2	145.4	-3.4	114.1	L78 E82 H86 F87 N137 N138	L78-R84 HydrophobicContact CD1-CB 4.46Å; L78-R84 HydrophobicContact CD1-CG 3.86Å; E82-R84 PolarHBondContact O-N 2.71Å; R84-H86 PolarHBondContact O-N 3.12Å; R84-H86 VanDerWaalsContact O-N 3.12Å; R84-F87 PolarHBondContact O-N 2.8Å; R84-N137 PolarHBondContact NH1-O 3.15Å; R84-N137 PolarHBondContact NH1-OD1 3.23Å; R84-N138 VanDerWaalsContact CD-O 3.29Å; R84-N138 WeakPolarHBondContact CD-O 3.42Å
85	T	89.3	Confident	93.2	Very high	103 Å²	103	43 Å²	43	63%	0.632	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-67.8	-11.8	179	67.8	0	0	0	0	113.1	N83 F87	N83-T85 PolarHBondContact ND2-OG1 2.72Å; N83-T85 VanDerWaalsContact ND2-OG1 3.08Å; N83-T85 PolarHBondContact O-N 3.02Å; N83-T85 VanDerWaalsContact O-N 3.14Å; N83-T85 PolarHBondContact OD1-N 2.81Å; N83-T85 PolarHBondContact OD1-OG1 2.9Å; N83-T85 VanDerWaalsContact OD1-OG1 3.08Å; T85-F87 VanDerWaalsContact C-N 3.28Å
86	H	94	Very high	93.1	Very high	67 Å²	67	47 Å²	47	31%	0.31	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-85.3	0.3	174.6	-63.7	-173.5	0	0	0	113.2	N83 R84 S160 L161 Y162	N83-H86 PolarHBondContact ND2-CD2 2.88Å; N83-H86 PolarHBondContact ND2-NE2 3.34Å; N83-H86 WeakPolarHBondContact O-CB 3.35Å; N83-H86 PolarHBondContact O-N 2.93Å; R84-H86 PolarHBondContact O-N 3.12Å; R84-H86 VanDerWaalsContact O-N 3.12Å; H86-S160 WeakPolarHBondContact O-CA 3.42Å; H86-L161 WeakPolarHBondContact O-CG 3.47Å; H86-L161 PolarHBondContact O-N 3.45Å; H86-Y162 HydrophobicContact CB-CD2 3.63Å; H86-Y162 HydrophobicContact CB-CE2 3.85Å; H86-Y162 AromaticContact CD2-CD2 3.77Å; H86-Y162 AromaticContact CD2-CE2 3.36Å; H86-Y162 WeakPolarHBondContact CD2-CE2 3.19Å; H86-Y162 AromaticContact CG-CD2 3.44Å; H86-Y162 VanDerWaalsContact CG-CD2 3.44Å; H86-Y162 AromaticContact CG-CE2 3.52Å; H86-Y162 AromaticContact ND1-CD2 3.72Å; H86-Y162 AromaticContact NE2-CE2 3.9Å
87	F	94.5	Very high	92.8	Very high	18 Å²	18	48.3 Å²	48.3	8%	0.079	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.4	-175.5	-64.5	-92.9	0	0	0	111.4	L78 E82 N83 R84 T85 Q159 H166 T168	L78-F87 HydrophobicContact CD1-CB 4.37Å; L78-F87 HydrophobicContact CD1-CD2 3.98Å; L78-F87 HydrophobicContact CD1-CG 4.16Å; L78-F87 HydrophobicContact CD2-CB 4.5Å; L78-F87 HydrophobicContact CD2-CD1 3.58Å; L78-F87 HydrophobicContact CD2-CD2 3.72Å; L78-F87 HydrophobicContact CD2-CE1 3.52Å; L78-F87 HydrophobicContact CD2-CE2 3.7Å; L78-F87 HydrophobicContact CD2-CG 3.67Å; L78-F87 HydrophobicContact CD2-CZ 3.59Å; E82-F87 HydrophobicContact CB-CE2 4.12Å; E82-F87 HydrophobicContact CB-CZ 4.48Å; N83-F87 VanDerWaalsContact O-CD2 3.31Å; N83-F87 WeakPolarHBondContact O-CD2 3.41Å; R84-F87 PolarHBondContact O-N 2.8Å; T85-F87 VanDerWaalsContact C-N 3.28Å; F87-Q159 VanDerWaalsContact CA-O 3.29Å; F87-Q159 WeakPolarHBondContact CA-O 2.85Å; F87-H166 AromaticContact CE1-CE1 3.56Å; F87-H166 AromaticContact CE1-ND1 3.57Å; F87-H166 AromaticContact CZ-CE1 3.63Å; F87-H166 AromaticContact CZ-NE2 3.68Å; F87-T168 HydrophobicContact CE1-CG2 4.48Å
88	Q	95.5	Very high	92.5	Very high	68 Å²	68	53.1 Å²	53.1	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	143.5	179.2	-176.6	174.1	-1.5	0	0	110.7	F90 Q159 L161	Q88-F90 HydrophobicContact CB-CE2 3.87Å; Q88-F90 HydrophobicContact CB-CZ 4.36Å; Q88-F90 HydrophobicContact CG-CE2 3.95Å; Q88-F90 HydrophobicContact CG-CZ 4.1Å; Q88-Q159 PolarHBondContact N-O 3.04Å; Q88-Q159 PolarHBondContact O-N 2.66Å; Q88-L161 HydrophobicContact CB-CD1 4.34Å; Q88-L161 HydrophobicContact CB-CD2 3.98Å; Q88-L161 HydrophobicContact CB-CG 4.33Å
89	W	97.5	Very high	92.4	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.3	173.9	-77.3	98.9	0	0	0	112.1	L26 L74 C76 I124 N140 L142 I157 C158 Y173	L26-W89 HydrophobicContact CD1-CB 4.01Å; L26-W89 HydrophobicContact CD1-CG 4.5Å; L74-W89 HydrophobicContact CB-CH2 3.71Å; L74-W89 HydrophobicContact CB-CZ2 4.2Å; L74-W89 HydrophobicContact CB-CZ3 4.29Å; L74-W89 HydrophobicContact CD1-CZ3 4.35Å; L74-W89 WeakPolarHBondContact O-CZ2 3.49Å; C76-W89 HydrophobicContact CB-CZ2 3.71Å; W89-I124 HydrophobicContact CB-CB 4.43Å; W89-I124 HydrophobicContact CB-CD1 3.8Å; W89-I124 HydrophobicContact CB-CG1 4.18Å; W89-I124 PolarHBondContact O-N 3.01Å; W89-I124 VanDerWaalsContact O-N 3.14Å; W89-N140 PolarHBondContact NE1-O 3.02Å; W89-L142 HydrophobicContact CD2-CB 4Å; W89-L142 HydrophobicContact CD2-CD2 4.2Å; W89-L142 HydrophobicContact CE3-CD2 4.27Å; W89-L142 HydrophobicContact CG-CB 4.25Å; W89-L142 HydrophobicContact CG-CD2 4.39Å; W89-L142 HydrophobicContact CZ2-CB 4.07Å; W89-I157 WeakPolarHBondContact CA-O 3.5Å; W89-C158 HydrophobicContact CD2-CB 3.98Å; W89-C158 HydrophobicContact CE3-CB 4.08Å; W89-C158 HydrophobicContact CH2-CB 3.9Å; W89-C158 HydrophobicContact CZ2-CB 3.8Å; W89-C158 HydrophobicContact CZ3-CB 4.03Å; W89-Y173 HydrophobicContact CH2-CD2 4.05Å; W89-Y173 AromaticContact CH2-CE2 3.95Å; W89-Y173 HydrophobicContact CH2-CE2 3.95Å; W89-Y173 HydrophobicContact CZ3-CD2 4.1Å; W89-Y173 HydrophobicContact CZ3-CE2 4.41Å
90	F	97.9	Very high	92.5	Very high	27 Å²	27	58.7 Å²	58.7	12%	0.118	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	154.8	170.7	-65.3	-88.9	0	0	0	110.3	Q88 Y121 E122 P123 Y156 I157 Q159 L161	Q88-F90 HydrophobicContact CB-CE2 3.87Å; Q88-F90 HydrophobicContact CB-CZ 4.36Å; Q88-F90 HydrophobicContact CG-CE2 3.95Å; Q88-F90 HydrophobicContact CG-CZ 4.1Å; F90-Y121 HydrophobicContact CB-CD2 3.73Å; F90-Y121 HydrophobicContact CB-CE2 4.39Å; F90-Y121 HydrophobicContact CB-CG 4.05Å; F90-Y121 HydrophobicContact CD1-CD2 4.11Å; F90-Y121 HydrophobicContact CD1-CG 4.43Å; F90-Y121 HydrophobicContact CD2-CD2 4.23Å; F90-Y121 AromaticContact CG-CD2 3.76Å; F90-Y121 HydrophobicContact CG-CD2 3.76Å; F90-Y121 HydrophobicContact CG-CG 4.34Å; F90-E122 CarbonylContact C-O 3.5Å; F90-E122 WeakPolarHBondContact CA-O 3.34Å; F90-P123 HydrophobicContact CD1-CB 4.25Å; F90-P123 HydrophobicContact CE1-CB 4.05Å; F90-Y156 WeakPolarHBondContact O-CA 3.35Å; F90-I157 PolarHBondContact N-O 2.87Å; F90-I157 PolarHBondContact O-N 3.22Å; F90-Q159 HydrophobicContact CD2-CB 3.78Å; F90-Q159 HydrophobicContact CE2-CB 3.99Å; F90-L161 HydrophobicContact CE2-CD2 4.25Å; F90-L161 HydrophobicContact CZ-CD2 4.4Å
91	R	97.5	Very high	93	Very high	48 Å²	48	57.1 Å²	57.1	18%	0.181	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.1	170.5	69.4	-177	-176.5	176.6	2.8	112.1	T93 E122 I124 Y144 D152 T155 Y156	R91-T93 HydrophobicContact CG-CG2 3.99Å; R91-E122 HydrophobicContact CG-CB 4.33Å; R91-E122 PolarHBondContact N-O 3.13Å; R91-E122 WeakPolarHBondContact O-CB 3.35Å; R91-E122 PolarHBondContact O-N 3.4Å; R91-I124 HydrophobicContact CB-CD1 4.04Å; R91-I124 HydrophobicContact CB-CG1 4.05Å; R91-I124 HydrophobicContact CG-CD1 4.39Å; R91-I124 HydrophobicContact CG-CG1 3.95Å; R91-Y144 PolarHBondContact NH1-OH 2.88Å; R91-D152 IonicContact CZ-OD1 2.93Å; R91-D152 IonicContact NH1-OD1 2.77Å; R91-D152 PolarHBondContact NH1-OD1 3.07Å; R91-T155 CarbonylContact C-O 3.54Å; R91-T155 WeakPolarHBondContact CA-O 3.46Å; R91-Y156 HydrophobicContact CB-CD1 4.03Å; R91-Y156 HydrophobicContact CB-CE1 4Å; R91-Y156 HydrophobicContact CB-CG 4.31Å
92	I	97.8	Very high	93.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	106.6	162.1	-54.3	173.9	0	0	0	106.8	Y97 I101 L116 L120 Y121 G154 T155	I92-Y97 HydrophobicContact CG2-CD2 3.54Å; I92-Y97 HydrophobicContact CG2-CE2 3.91Å; I92-Y97 HydrophobicContact CG2-CG 4.47Å; I92-I101 HydrophobicContact CD1-CB 4.02Å; I92-I101 HydrophobicContact CD1-CD1 4.41Å; I92-I101 HydrophobicContact CD1-CG2 4.33Å; I92-I101 HydrophobicContact CG2-CB 4.46Å; I92-I101 HydrophobicContact CG2-CG2 3.63Å; I92-L116 HydrophobicContact CD1-CB 4.3Å; I92-L116 HydrophobicContact CD1-CD2 4.46Å; I92-L120 HydrophobicContact CD1-CB 4.17Å; I92-L120 HydrophobicContact CG1-CB 4.13Å; I92-L120 HydrophobicContact CG2-CB 3.92Å; I92-L120 HydrophobicContact CG2-CD1 4.44Å; I92-Y121 HydrophobicContact CD1-CD1 3.89Å; I92-Y121 HydrophobicContact CD1-CE1 3.85Å; I92-Y121 HydrophobicContact CG1-CD1 3.81Å; I92-Y121 HydrophobicContact CG1-CE1 4.19Å; I92-G154 CarbonylContact O-C 3.52Å; I92-G154 WeakPolarHBondContact O-CA 3.49Å; I92-T155 PolarHBondContact N-O 2.78Å; I92-T155 PolarHBondContact O-N 3.1Å
93	T	96.2	Very high	93.5	Very high	8 Å²	8	55 Å²	55	5%	0.049	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	145.5	-174.3	57.8	0	0	0	0	111.9	R91 K95 K96 E122 Q339	R91-T93 HydrophobicContact CG-CG2 3.99Å; T93-K95 VanDerWaalsContact C-N 3.35Å; T93-K96 VanDerWaalsContact OG1-CB 3.3Å; T93-K96 WeakPolarHBondContact OG1-CB 2.96Å; T93-E122 VanDerWaalsContact CG2-OE2 3.27Å; T93-E122 WeakPolarHBondContact CG2-OE2 3.16Å; T93-Q339 PolarHBondContact O-NE2 2.77Å
94	R	94.1	Very high	93.6	Very high	2 Å²	2	56 Å²	56	1%	0.008	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-33	173.2	-67	-62.7	-177.1	-85.5	-23.8	111.7	S153 G154 T155 D176 N335 K338	R94-S153 WeakPolarHBondContact CG-O 3.35Å; R94-S153 PolarHBondContact N-O 3.27Å; R94-G154 VanDerWaalsContact NH1-C 3.34Å; R94-G154 PolarHBondContact NH2-O 2.84Å; R94-T155 VanDerWaalsContact NH1-N 3.18Å; R94-T155 PolarHBondContact NH1-OG1 2.61Å; R94-T155 PolarHBondContact NH2-OG1 3.25Å; R94-D176 IonicContact CZ-OD2 3.99Å; R94-D176 IonicContact NE-OD2 3.18Å; R94-D176 PolarHBondContact NE-OD2 2.97Å; R94-D176 IonicContact NH2-OD2 2.93Å; R94-D176 PolarHBondContact NH2-OD2 3.13Å; R94-D176 VanDerWaalsContact NH2-OD2 3.13Å; R94-N335 WeakPolarHBondContact CB-ND2 3.21Å; R94-N335 VanDerWaalsContact CG-ND2 3.31Å; R94-N335 WeakPolarHBondContact CG-ND2 3.35Å; R94-K338 WeakPolarHBondContact O-CE 3.46Å; R94-K338 PolarHBondContact O-NZ 2.96Å
95	K	92.4	Very high	93.8	Very high	117 Å²	117	53.1 Å²	53.1	51%	0.509	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-39.3	-174.8	-174.9	179	179.9	-178	0	113	T93 Y150 N151	T93-K95 VanDerWaalsContact C-N 3.35Å; K95-Y150 HydrophobicContact CD-CE1 4.12Å; K95-N151 PolarHBondContact NZ-OD1 2.81Å
96	K	92	Very high	93.9	Very high	126 Å²	126	55.8 Å²	55.8	55%	0.548	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-39.1	-170.4	-170.7	179.1	177.5	-164.9	0	113.7	T93 E122	T93-K96 VanDerWaalsContact OG1-CB 3.3Å; T93-K96 WeakPolarHBondContact OG1-CB 2.96Å; K96-E122 WeakPolarHBondContact CD-OE1 3.13Å; K96-E122 WeakPolarHBondContact CE-OE1 3.49Å; K96-E122 IonicContact NZ-OE1 2.71Å; K96-E122 PolarHBondContact NZ-OE1 2.97Å
97	Y	88.7	Confident	93.8	Very high	32 Å²	32	57.2 Å²	57.2	13%	0.125	28%	0.281	C	S	.	.			trans	-110.3	122	-170.3	-52.3	-69.1	0	0	0	111.7	I92 L120 E122 Q339	I92-Y97 HydrophobicContact CG2-CD2 3.54Å; I92-Y97 HydrophobicContact CG2-CE2 3.91Å; I92-Y97 HydrophobicContact CG2-CG 4.47Å; Y97-L120 HydrophobicContact CD1-CD2 3.93Å; Y97-L120 HydrophobicContact CD2-CB 4.39Å; Y97-L120 HydrophobicContact CE1-CB 4.46Å; Y97-L120 HydrophobicContact CE1-CD2 3.74Å; Y97-L120 HydrophobicContact CE2-CB 4.01Å; Y97-L120 WeakPolarHBondContact CE2-O 3.48Å; Y97-L120 PolarHBondContact OH-O 3.5Å; Y97-E122 PolarHBondContact OH-OE1 2.92Å; Y97-Q339 PolarHBondContact O-NE2 3.44Å
98	N	88	Confident	93.7	Very high	137 Å²	137	59.9 Å²	59.9	73%	0.733	30%	0.299	S	S	*	.			trans	-110.2	50.4	174	-165.5	45.8	0	0	0	110.8	K338	N98-K338 WeakPolarHBondContact OD1-CB 3.32Å
99	Q	91.5	Very high	93.6	Very high	94 Å²	94	57.8 Å²	57.8	44%	0.439	29%	0.289	S	S	.	.	S	Bend	trans	-148.2	161.4	-177.5	65.3	-175.4	5.5	0	0	110.1	I101 L120 K338 Q339	Q99-I101 PolarHBondContact O-N 2.93Å; Q99-L120 VanDerWaalsContact NE2-CD2 3.28Å; Q99-K338 CarbonylContact C-O 3.59Å; Q99-Q339 WeakPolarHBondContact O-CA 3.35Å; Q99-Q339 WeakPolarHBondContact O-CG 3.45Å
100	T	93.5	Very high	93.5	Very high	48 Å²	48	60.4 Å²	60.4	29%	0.294	30%	0.299	S	S	.	.			trans	-55.9	139	173.6	-177.9	0	0	0	0	110.8	F102 Q339	T100-F102 PolarHBondContact OG1-N 3.22Å; T100-F102 PolarHBondContact OG1-O 2.94Å; T100-Q339 WeakPolarHBondContact CA-O 3.11Å
101	I	96	Very high	93.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.321	C	S	.	.			trans	-102.4	0.5	174.9	65.6	173.8	0	0	0	112	I92 Q99 L116 D117 L120 T155 Q339	I92-I101 HydrophobicContact CD1-CB 4.02Å; I92-I101 HydrophobicContact CD1-CD1 4.41Å; I92-I101 HydrophobicContact CD1-CG2 4.33Å; I92-I101 HydrophobicContact CG2-CB 4.46Å; I92-I101 HydrophobicContact CG2-CG2 3.63Å; Q99-I101 PolarHBondContact O-N 2.93Å; I101-L116 HydrophobicContact CB-CD2 4.32Å; I101-L116 HydrophobicContact CD1-CD2 3.73Å; I101-L116 HydrophobicContact CG1-CD2 3.77Å; I101-L116 CarbonylContact O-C 3.6Å; I101-L116 VanDerWaalsContact O-CA 3.28Å; I101-L116 WeakPolarHBondContact O-CA 3.19Å; I101-L116 WeakPolarHBondContact O-CD2 3.49Å; I101-D117 PolarHBondContact O-N 3.41Å; I101-L120 HydrophobicContact CB-CD1 4.4Å; I101-L120 HydrophobicContact CG2-CD1 3.94Å; I101-T155 HydrophobicContact CD1-CG2 4.4Å; I101-T155 WeakPolarHBondContact CD1-OG1 3.42Å; I101-Q339 HydrophobicContact CD1-CB 4.42Å; I101-Q339 HydrophobicContact CG1-CB 4.21Å; I101-Q339 HydrophobicContact CG2-CB 3.89Å; I101-Q339 HydrophobicContact CG2-CG 3.97Å; I101-Q339 PolarHBondContact N-O 3.24Å; I101-Q339 VanDerWaalsContact N-O 3.15Å
102	F	95.4	Very high	92.8	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133	-176.4	-57.6	-83.7	0	0	0	110.5	H59 T100 W114 I115 L116 W172 H174 L274 I278 Q339 L340 P341	H59-F102 AromaticContact CE1-CE1 3.89Å; T100-F102 PolarHBondContact OG1-N 3.22Å; T100-F102 PolarHBondContact OG1-O 2.94Å; F102-W114 HydrophobicContact CB-CE3 3.91Å; F102-W114 HydrophobicContact CB-CZ3 4.29Å; F102-I115 CarbonylContact C-O 3.4Å; F102-I115 WeakPolarHBondContact CA-O 3.39Å; F102-L116 HydrophobicContact CD1-CD2 3.7Å; F102-L116 HydrophobicContact CE1-CD2 3.52Å; F102-L116 HydrophobicContact CG-CD2 4.44Å; F102-L116 HydrophobicContact CZ-CD2 4.14Å; F102-W172 HydrophobicContact CD1-CH2 4.45Å; F102-W172 AromaticContact CD1-CZ3 3.84Å; F102-W172 HydrophobicContact CD1-CZ3 3.84Å; F102-W172 AromaticContact CE1-CE3 3.85Å; F102-W172 HydrophobicContact CE1-CE3 3.85Å; F102-W172 AromaticContact CE1-CZ3 3.55Å; F102-W172 HydrophobicContact CE1-CZ3 3.55Å; F102-H174 AromaticContact CZ-CE1 3.95Å; F102-L274 HydrophobicContact CB-CD2 3.91Å; F102-L274 HydrophobicContact CD1-CD1 4.47Å; F102-L274 HydrophobicContact CD1-CD2 4.06Å; F102-L274 HydrophobicContact CD2-CD2 4.32Å; F102-L274 HydrophobicContact CG-CD2 3.83Å; F102-I278 HydrophobicContact CE1-CD1 4.1Å; F102-I278 HydrophobicContact CE2-CD1 3.92Å; F102-I278 HydrophobicContact CZ-CD1 3.53Å; F102-Q339 WeakPolarHBondContact CD2-O 3.28Å; F102-L340 HydrophobicContact CE2-CD2 3.83Å; F102-P341 HydrophobicContact CB-CG 4.35Å
103	L	93.9	Very high	92.6	Very high	72 Å²	72	68.8 Å²	68.8	38%	0.377	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147	176	-59.7	176.8	0	0	0	109.7	W114 I115 D117	L103-W114 WeakPolarHBondContact O-CA 3.08Å; L103-I115 HydrophobicContact CB-CG1 4.15Å; L103-I115 PolarHBondContact N-O 3.5Å; L103-I115 PolarHBondContact O-N 3.04Å; L103-D117 HydrophobicContact CD1-CB 3.72Å; L103-D117 HydrophobicContact CG-CB 3.96Å
104	L	91.8	Very high	92.5	Very high	100 Å²	100	70 Å²	70	52%	0.524	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.1	172.4	-166	72.7	0	0	0	109.1	K113 W114	L104-K113 HydrophobicContact CD1-CB 3.76Å; L104-K113 HydrophobicContact CD1-CD 4.5Å; L104-W114 HydrophobicContact CB-CZ3 4.32Å; L104-W114 HydrophobicContact CD1-CD2 4.15Å; L104-W114 HydrophobicContact CD1-CE3 4.48Å; L104-W114 HydrophobicContact CD1-CZ2 4.16Å
105	N	91.4	Very high	92.6	Very high	43 Å²	43	71.5 Å²	71.5	23%	0.23	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	153.8	174.3	-159.4	-6.8	0	0	0	111.1	I107 F109 K113 I115	N105-I107 PolarHBondContact O-N 3.35Å; N105-F109 VanDerWaalsContact ND2-CE2 3.34Å; N105-F109 WeakPolarHBondContact ND2-CE2 3.32Å; N105-K113 VanDerWaalsContact CB-O 3.26Å; N105-K113 WeakPolarHBondContact CB-O 3.45Å; N105-K113 PolarHBondContact N-O 3.06Å; N105-I115 HydrophobicContact CB-CD1 4.03Å; N105-I115 HydrophobicContact CB-CG1 4.14Å; N105-I115 HydrophobicContact CB-CG2 3.98Å
106	N	91.6	Very high	92.8	Very high	158 Å²	158	66 Å²	66	85%	0.845	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	-22.6	174.8	-65.4	-15	0	0	0	112
107	I	92.5	Very high	93	Very high	98 Å²	98	61 Å²	61	50%	0.503	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.4	-177.9	-56.8	172	0	0	0	109.4	N105 F109	N105-I107 PolarHBondContact O-N 3.35Å; I107-F109 HydrophobicContact CB-CE2 3.84Å; I107-F109 HydrophobicContact CB-CZ 4.32Å; I107-F109 HydrophobicContact CG2-CD2 4.36Å; I107-F109 HydrophobicContact CG2-CE2 3.82Å; I107-F109 HydrophobicContact CG2-CZ 3.96Å; I107-F109 WeakPolarHBondContact O-CD2 3.45Å
108	T	92.8	Very high	93.3	Very high	74 Å²	74	64.8 Å²	64.8	45%	0.454	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.1	172.4	-54.5	0	0	0	0	110.4
109	F	93.7	Very high	93.7	Very high	24 Å²	24	65.1 Å²	65.1	11%	0.105	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.5	174.3	-71.8	-82.8	0	0	0	110.3	R58 N105 I107 D111 H112 I115 K165 F170	R58-F109 PolarHBondContact NH1-O 3.49Å; R58-F109 PolarHBondContact NH2-O 2.91Å; N105-F109 VanDerWaalsContact ND2-CE2 3.34Å; N105-F109 WeakPolarHBondContact ND2-CE2 3.32Å; I107-F109 HydrophobicContact CB-CE2 3.84Å; I107-F109 HydrophobicContact CB-CZ 4.32Å; I107-F109 HydrophobicContact CG2-CD2 4.36Å; I107-F109 HydrophobicContact CG2-CE2 3.82Å; I107-F109 HydrophobicContact CG2-CZ 3.96Å; I107-F109 WeakPolarHBondContact O-CD2 3.45Å; F109-D111 PolarHBondContact O-N 3.41Å; F109-H112 PolarHBondContact N-O 2.93Å; F109-H112 PolarHBondContact O-N 2.89Å; F109-I115 HydrophobicContact CD2-CG2 4.44Å; F109-K165 HydrophobicContact CE1-CB 4.15Å; F109-K165 HydrophobicContact CE1-CD 4.16Å; F109-K165 HydrophobicContact CE1-CG 3.86Å; F109-F170 HydrophobicContact CB-CD1 3.99Å; F109-F170 HydrophobicContact CB-CE1 3.48Å; F109-F170 VanDerWaalsContact CB-CE1 3.48Å; F109-F170 HydrophobicContact CB-CE2 4.3Å; F109-F170 HydrophobicContact CB-CZ 3.65Å; F109-F170 HydrophobicContact CD1-CE1 4.04Å; F109-F170 AromaticContact CD1-CE2 3.9Å; F109-F170 HydrophobicContact CD1-CE2 3.9Å; F109-F170 AromaticContact CD1-CZ 3.34Å; F109-F170 HydrophobicContact CD1-CZ 3.34Å; F109-F170 HydrophobicContact CD2-CE1 4.03Å; F109-F170 HydrophobicContact CD2-CZ 4.05Å; F109-F170 AromaticContact CE1-CZ 3.96Å; F109-F170 HydrophobicContact CE1-CZ 3.96Å; F109-F170 AromaticContact CG-CE1 3.57Å; F109-F170 HydrophobicContact CG-CE1 3.57Å; F109-F170 HydrophobicContact CG-CE2 4.24Å; F109-F170 AromaticContact CG-CZ 3.39Å; F109-F170 HydrophobicContact CG-CZ 3.39Å
110	Y	94.4	Very high	93.9	Very high	56 Å²	56	61.1 Å²	61.1	22%	0.22	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	61	-178.4	-43.4	-82.8	0	0	0	111.8	L52 A55 R58 H112 K165 P167 F170	L52-Y110 HydrophobicContact CD1-CD1 3.34Å; L52-Y110 HydrophobicContact CD1-CE1 3.52Å; A55-Y110 HydrophobicContact CB-CD1 4.37Å; A55-Y110 HydrophobicContact CB-CD2 3.94Å; A55-Y110 HydrophobicContact CB-CE2 4.3Å; A55-Y110 HydrophobicContact CB-CG 3.98Å; R58-Y110 PolarHBondContact NH2-O 3.23Å; Y110-H112 PolarHBondContact O-CD2 2.87Å; Y110-H112 PolarHBondContact O-N 2.9Å; Y110-K165 PolarHBondContact OH-O 3.23Å; Y110-P167 HydrophobicContact CE1-CG 4.32Å; Y110-P167 WeakPolarHBondContact OH-CA 3.38Å; Y110-P167 WeakPolarHBondContact OH-CD 3.32Å; Y110-P167 VanDerWaalsContact OH-CG 3.24Å; Y110-P167 WeakPolarHBondContact OH-CG 3.24Å; Y110-P167 VanDerWaalsContact OH-N 3.11Å; Y110-F170 HydrophobicContact CD2-CB 4.12Å; Y110-F170 AromaticContact CD2-CD2 3.73Å; Y110-F170 HydrophobicContact CD2-CD2 3.73Å; Y110-F170 HydrophobicContact CD2-CE2 4.29Å; Y110-F170 AromaticContact CD2-CG 3.94Å; Y110-F170 HydrophobicContact CD2-CG 3.94Å; Y110-F170 HydrophobicContact CE2-CB 4.4Å; Y110-F170 AromaticContact CE2-CD2 3.33Å; Y110-F170 HydrophobicContact CE2-CD2 3.33Å; Y110-F170 AromaticContact CE2-CE2 3.72Å; Y110-F170 HydrophobicContact CE2-CE2 3.72Å; Y110-F170 HydrophobicContact CE2-CG 4.02Å
111	D	90.6	Very high	94	Very high	110 Å²	110	60.5 Å²	60.5	59%	0.588	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	3.5	176.2	-47	-35.8	0	0	0	115.9	K56 F109	K56-D111 WeakPolarHBondContact CD-OD2 3.21Å; K56-D111 WeakPolarHBondContact CE-OD2 3.34Å; K56-D111 IonicContact NZ-OD2 2.74Å; K56-D111 PolarHBondContact NZ-OD2 3.3Å; F109-D111 PolarHBondContact O-N 3.41Å
112	H	91.3	Very high	94	Very high	52 Å²	52	62.3 Å²	62.3	24%	0.241	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.8	-179.8	-60.2	-75.3	0	0	0	113.7	K56 F109 Y110	K56-H112 PolarHBondContact O-CD2 3.41Å; K56-H112 PolarHBondContact O-NE2 3.42Å; F109-H112 PolarHBondContact N-O 2.93Å; F109-H112 PolarHBondContact O-N 2.89Å; Y110-H112 PolarHBondContact O-CD2 2.87Å; Y110-H112 PolarHBondContact O-N 2.9Å
113	K	92.7	Very high	94	Very high	90 Å²	90	65 Å²	65	39%	0.391	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-18.5	172.3	-70.5	-178.5	180	175	0	113.8	L104 N105	L104-K113 HydrophobicContact CD1-CB 3.76Å; L104-K113 HydrophobicContact CD1-CD 4.5Å; N105-K113 VanDerWaalsContact CB-O 3.26Å; N105-K113 WeakPolarHBondContact CB-O 3.45Å; N105-K113 PolarHBondContact N-O 3.06Å
114	W	94.5	Very high	94.1	Very high	33 Å²	33	61.8 Å²	61.8	13%	0.125	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132	179.8	-67.1	104.2	0	0	0	110.6	F102 L103 L104 W172 D270 E271 L274 P341	F102-W114 HydrophobicContact CB-CE3 3.91Å; F102-W114 HydrophobicContact CB-CZ3 4.29Å; L103-W114 WeakPolarHBondContact O-CA 3.08Å; L104-W114 HydrophobicContact CB-CZ3 4.32Å; L104-W114 HydrophobicContact CD1-CD2 4.15Å; L104-W114 HydrophobicContact CD1-CE3 4.48Å; L104-W114 HydrophobicContact CD1-CZ2 4.16Å; W114-W172 WeakPolarHBondContact O-CH2 3.34Å; W114-D270 PolarHBondContact NE1-O 2.94Å; W114-E271 HydrophobicContact CH2-CB 4.25Å; W114-E271 HydrophobicContact CH2-CG 4.14Å; W114-E271 HydrophobicContact CZ2-CB 3.75Å; W114-E271 HydrophobicContact CZ2-CG 4.08Å; W114-L274 HydrophobicContact CB-CD1 4.23Å; W114-L274 HydrophobicContact CB-CD2 4.22Å; W114-L274 HydrophobicContact CD2-CD2 3.52Å; W114-L274 HydrophobicContact CD2-CG 4.48Å; W114-L274 HydrophobicContact CE3-CD2 3.82Å; W114-L274 HydrophobicContact CG-CB 4.33Å; W114-L274 HydrophobicContact CG-CD1 4.19Å; W114-L274 HydrophobicContact CG-CD2 3.69Å; W114-L274 HydrophobicContact CG-CG 4.28Å; W114-L274 HydrophobicContact CZ2-CD2 4.46Å; W114-L274 HydrophobicContact CZ3-CD2 4.39Å; W114-P341 HydrophobicContact CH2-CG 4.42Å; W114-P341 HydrophobicContact CZ3-CG 4.4Å
115	I	95.6	Very high	94.2	Very high	33 Å²	33	60.7 Å²	60.7	17%	0.169	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	164.2	173.1	62.8	169.2	0	0	0	109.6	F102 L103 N105 F109 F170	F102-I115 CarbonylContact C-O 3.4Å; F102-I115 WeakPolarHBondContact CA-O 3.39Å; L103-I115 HydrophobicContact CB-CG1 4.15Å; L103-I115 PolarHBondContact N-O 3.5Å; L103-I115 PolarHBondContact O-N 3.04Å; N105-I115 HydrophobicContact CB-CD1 4.03Å; N105-I115 HydrophobicContact CB-CG1 4.14Å; N105-I115 HydrophobicContact CB-CG2 3.98Å; F109-I115 HydrophobicContact CD2-CG2 4.44Å; I115-F170 HydrophobicContact CG2-CE1 4.3Å
116	L	96.7	Very high	94.2	Very high	2 Å²	2	59 Å²	59	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	145.9	170.4	-67.6	172.7	0	0	0	110.9	I92 I101 F102 Q118 Y121 T155 I157 W172	I92-L116 HydrophobicContact CD1-CB 4.3Å; I92-L116 HydrophobicContact CD1-CD2 4.46Å; I101-L116 HydrophobicContact CB-CD2 4.32Å; I101-L116 HydrophobicContact CD1-CD2 3.73Å; I101-L116 HydrophobicContact CG1-CD2 3.77Å; I101-L116 CarbonylContact O-C 3.6Å; I101-L116 VanDerWaalsContact O-CA 3.28Å; I101-L116 WeakPolarHBondContact O-CA 3.19Å; I101-L116 WeakPolarHBondContact O-CD2 3.49Å; F102-L116 HydrophobicContact CD1-CD2 3.7Å; F102-L116 HydrophobicContact CE1-CD2 3.52Å; F102-L116 HydrophobicContact CG-CD2 4.44Å; F102-L116 HydrophobicContact CZ-CD2 4.14Å; L116-Q118 PolarHBondContact O-N 2.92Å; L116-Q118 VanDerWaalsContact O-N 3.1Å; L116-Y121 HydrophobicContact CB-CE1 3.96Å; L116-T155 HydrophobicContact CD1-CG2 3.68Å; L116-T155 HydrophobicContact CD2-CG2 4.43Å; L116-I157 HydrophobicContact CD1-CD1 3.22Å; L116-I157 HydrophobicContact CD1-CG1 3.82Å; L116-W172 HydrophobicContact CB-CZ2 4.5Å; L116-W172 HydrophobicContact CD1-CB 4.37Å; L116-W172 HydrophobicContact CD1-CD2 3.55Å; L116-W172 HydrophobicContact CD1-CE3 4.15Å; L116-W172 HydrophobicContact CD1-CG 3.63Å; L116-W172 HydrophobicContact CD1-CZ2 4.24Å; L116-W172 HydrophobicContact CD2-CD2 4.44Å; L116-W172 HydrophobicContact CD2-CE3 4.23Å; L116-W172 HydrophobicContact CD2-CZ3 4.32Å; L116-W172 HydrophobicContact CG-CD2 3.8Å; L116-W172 HydrophobicContact CG-CE3 4.02Å; L116-W172 HydrophobicContact CG-CG 4.41Å; L116-W172 HydrophobicContact CG-CH2 4.01Å; L116-W172 HydrophobicContact CG-CZ2 3.78Å; L116-W172 HydrophobicContact CG-CZ3 4.14Å
117	D	96.5	Very high	94.2	Very high	22 Å²	22	55.2 Å²	55.2	12%	0.118	28%	0.279	C	S	.	.			trans	-69.8	102.9	172.9	-173.1	-2.4	0	0	0	110.2	I101 L103 N119 L120	I101-D117 PolarHBondContact O-N 3.41Å; L103-D117 HydrophobicContact CD1-CB 3.72Å; L103-D117 HydrophobicContact CG-CB 3.96Å; D117-N119 PolarHBondContact O-N 3.39Å; D117-N119 VanDerWaalsContact OD1-CB 3.3Å; D117-N119 WeakPolarHBondContact OD1-CB 3.49Å; D117-N119 PolarHBondContact OD1-N 2.89Å; D117-N119 PolarHBondContact OD1-ND2 3.24Å; D117-L120 HydrophobicContact CB-CD1 3.94Å; D117-L120 HydrophobicContact CB-CG 3.99Å; D117-L120 WeakPolarHBondContact O-CB 3.38Å; D117-L120 PolarHBondContact O-N 2.99Å; D117-L120 VanDerWaalsContact O-N 3.11Å
118	Q	94.7	Very high	93.8	Very high	111 Å²	111	58 Å²	58	52%	0.519	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-65	-21.1	-178.2	-64.3	-177.9	4.7	0	0	112.7	L116 L120 Y121	L116-Q118 PolarHBondContact O-N 2.92Å; L116-Q118 VanDerWaalsContact O-N 3.1Å; Q118-L120 PolarHBondContact O-N 3.16Å; Q118-Y121 HydrophobicContact CG-CE1 4.3Å; Q118-Y121 HydrophobicContact CG-CE2 4.09Å; Q118-Y121 WeakPolarHBondContact O-CB 3.49Å; Q118-Y121 PolarHBondContact O-N 2.88Å; Q118-Y121 VanDerWaalsContact O-N 3.14Å
119	N	95.8	Very high	93.5	Very high	143 Å²	143	60.3 Å²	60.3	77%	0.765	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-66.3	-17.2	176.1	-58.2	-50.5	0	0	0	112.4	D117	D117-N119 PolarHBondContact O-N 3.39Å; D117-N119 VanDerWaalsContact OD1-CB 3.3Å; D117-N119 WeakPolarHBondContact OD1-CB 3.49Å; D117-N119 PolarHBondContact OD1-N 2.89Å; D117-N119 PolarHBondContact OD1-ND2 3.24Å
120	L	96.4	Very high	93.2	Very high	11 Å²	11	63.2 Å²	63.2	6%	0.058	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-94	-2.6	179.7	-50.6	-177.5	0	0	0	112.8	I92 Y97 Q99 I101 D117 Q118 E122	I92-L120 HydrophobicContact CD1-CB 4.17Å; I92-L120 HydrophobicContact CG1-CB 4.13Å; I92-L120 HydrophobicContact CG2-CB 3.92Å; I92-L120 HydrophobicContact CG2-CD1 4.44Å; Y97-L120 HydrophobicContact CD1-CD2 3.93Å; Y97-L120 HydrophobicContact CD2-CB 4.39Å; Y97-L120 HydrophobicContact CE1-CB 4.46Å; Y97-L120 HydrophobicContact CE1-CD2 3.74Å; Y97-L120 HydrophobicContact CE2-CB 4.01Å; Y97-L120 WeakPolarHBondContact CE2-O 3.48Å; Y97-L120 PolarHBondContact OH-O 3.5Å; Q99-L120 VanDerWaalsContact NE2-CD2 3.28Å; I101-L120 HydrophobicContact CB-CD1 4.4Å; I101-L120 HydrophobicContact CG2-CD1 3.94Å; D117-L120 HydrophobicContact CB-CD1 3.94Å; D117-L120 HydrophobicContact CB-CG 3.99Å; D117-L120 WeakPolarHBondContact O-CB 3.38Å; D117-L120 PolarHBondContact O-N 2.99Å; D117-L120 VanDerWaalsContact O-N 3.11Å; Q118-L120 PolarHBondContact O-N 3.16Å; L120-E122 PolarHBondContact O-N 2.86Å
121	Y	95.9	Very high	92.9	Very high	34 Å²	34	63 Å²	63	13%	0.133	33%	0.33	C	S	.	.			trans	-68.4	131.4	-176.4	-78	20.6	0	0	0	111	F90 I92 L116 Q118 I157 Q159	F90-Y121 HydrophobicContact CB-CD2 3.73Å; F90-Y121 HydrophobicContact CB-CE2 4.39Å; F90-Y121 HydrophobicContact CB-CG 4.05Å; F90-Y121 HydrophobicContact CD1-CD2 4.11Å; F90-Y121 HydrophobicContact CD1-CG 4.43Å; F90-Y121 HydrophobicContact CD2-CD2 4.23Å; F90-Y121 AromaticContact CG-CD2 3.76Å; F90-Y121 HydrophobicContact CG-CD2 3.76Å; F90-Y121 HydrophobicContact CG-CG 4.34Å; I92-Y121 HydrophobicContact CD1-CD1 3.89Å; I92-Y121 HydrophobicContact CD1-CE1 3.85Å; I92-Y121 HydrophobicContact CG1-CD1 3.81Å; I92-Y121 HydrophobicContact CG1-CE1 4.19Å; L116-Y121 HydrophobicContact CB-CE1 3.96Å; Q118-Y121 HydrophobicContact CG-CE1 4.3Å; Q118-Y121 HydrophobicContact CG-CE2 4.09Å; Q118-Y121 WeakPolarHBondContact O-CB 3.49Å; Q118-Y121 PolarHBondContact O-N 2.88Å; Q118-Y121 VanDerWaalsContact O-N 3.14Å; Y121-I157 HydrophobicContact CE1-CD1 3.77Å; Y121-I157 HydrophobicContact CE2-CD1 4.19Å; Y121-I157 WeakPolarHBondContact OH-CD1 3.47Å; Y121-Q159 VanDerWaalsContact CE2-OE1 3.29Å
122	E	94.9	Very high	93	Very high	39 Å²	39	58.7 Å²	58.7	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.2	171.1	-58.4	-177	153.5	0	0	108	F90 R91 T93 K96 Y97 L120 I124	F90-E122 CarbonylContact C-O 3.5Å; F90-E122 WeakPolarHBondContact CA-O 3.34Å; R91-E122 HydrophobicContact CG-CB 4.33Å; R91-E122 PolarHBondContact N-O 3.13Å; R91-E122 WeakPolarHBondContact O-CB 3.35Å; R91-E122 PolarHBondContact O-N 3.4Å; T93-E122 VanDerWaalsContact CG2-OE2 3.27Å; T93-E122 WeakPolarHBondContact CG2-OE2 3.16Å; K96-E122 WeakPolarHBondContact CD-OE1 3.13Å; K96-E122 WeakPolarHBondContact CE-OE1 3.49Å; K96-E122 IonicContact NZ-OE1 2.71Å; K96-E122 PolarHBondContact NZ-OE1 2.97Å; Y97-E122 PolarHBondContact OH-OE1 2.92Å; L120-E122 PolarHBondContact O-N 2.86Å; E122-I124 PolarHBondContact O-N 3.35Å
123	P	95.6	Very high	93.2	Very high	60 Å²	60	56.7 Å²	56.7	39%	0.39	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.5	171.3	27.5	-33.6	0	0	0	108.5	F90	F90-P123 HydrophobicContact CD1-CB 4.25Å; F90-P123 HydrophobicContact CE1-CB 4.05Å
124	I	95.8	Very high	93.3	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.281	C	S	.	.			trans	-81.3	138.5	177	-47.7	-177.4	0	0	0	108.4	L26 W89 R91 E122 P133 L142 Y156	L26-I124 HydrophobicContact CD1-CB 4.16Å; L26-I124 HydrophobicContact CD2-CB 4.36Å; L26-I124 HydrophobicContact CD2-CG2 3.92Å; L26-I124 WeakPolarHBondContact CG-O 3.09Å; W89-I124 HydrophobicContact CB-CB 4.43Å; W89-I124 HydrophobicContact CB-CD1 3.8Å; W89-I124 HydrophobicContact CB-CG1 4.18Å; W89-I124 PolarHBondContact O-N 3.01Å; W89-I124 VanDerWaalsContact O-N 3.14Å; R91-I124 HydrophobicContact CB-CD1 4.04Å; R91-I124 HydrophobicContact CB-CG1 4.05Å; R91-I124 HydrophobicContact CG-CD1 4.39Å; R91-I124 HydrophobicContact CG-CG1 3.95Å; E122-I124 PolarHBondContact O-N 3.35Å; I124-P133 HydrophobicContact CG2-CG 3.58Å; I124-L142 HydrophobicContact CD1-CD2 3.47Å; I124-L142 VanDerWaalsContact CD1-CD2 3.47Å; I124-L142 HydrophobicContact CG2-CD1 4.32Å; I124-Y156 HydrophobicContact CD1-CD1 3.37Å; I124-Y156 HydrophobicContact CD1-CE1 3.5Å
125	I	93.9	Very high	93.2	Very high	77 Å²	77	51.8 Å²	51.8	40%	0.395	28%	0.279	S	S	.	.			trans	-132.1	137.6	-171	-59.2	164.9	0	0	0	107.8	S24	S24-I125 WeakPolarHBondContact O-CG1 3.41Å; S24-I125 WeakPolarHBondContact O-CG2 3.29Å; S24-I125 WeakPolarHBondContact OG-CD1 3.35Å; S24-I125 VanDerWaalsContact OG-CG1 3.28Å; S24-I125 WeakPolarHBondContact OG-CG1 3.34Å; S24-I125 WeakPolarHBondContact OG-CG2 3.41Å
126	S	93.2	Very high	92.9	Very high	8 Å²	8	50.3 Å²	50.3	6%	0.056	27%	0.271	C	S	.	.			trans	-72.2	138.8	172.4	-61.4	0	0	0	0	111.2	L26 N27 I128 P133	L26-S126 WeakPolarHBondContact CA-OG 3.48Å; N27-S126 PolarHBondContact N-OG 3.19Å; S126-I128 PolarHBondContact O-N 3.38Å; S126-P133 WeakPolarHBondContact CA-O 3.27Å; S126-P133 VanDerWaalsContact CB-O 3.23Å; S126-P133 WeakPolarHBondContact CB-O 2.87Å; S126-P133 PolarHBondContact OG-O 3.22Å
127	N	89.9	Confident	92.3	Very high	79 Å²	79	53 Å²	53	42%	0.422	29%	0.286	S	S	.	.			trans	-67.1	127.3	164.2	-176.4	-23.9	0	0	0	109.4	T129 T130 N131 D132	N127-T129 PolarHBondContact O-N 3.49Å; N127-T129 PolarHBondContact OD1-N 3.2Å; N127-T129 PolarHBondContact OD1-OG1 3.32Å; N127-T130 WeakPolarHBondContact CB-OG1 3.36Å; N127-T130 PolarHBondContact O-N 3.07Å; N127-N131 VanDerWaalsContact O-CA 3.25Å; N127-N131 WeakPolarHBondContact O-CA 3.11Å; N127-N131 PolarHBondContact O-N 2.79Å; N127-D132 VanDerWaalsContact CB-O 3.3Å; N127-D132 WeakPolarHBondContact CB-O 3.04Å; N127-D132 PolarHBondContact N-O 3.45Å
128	I	85	Confident	91.7	Very high	157 Å²	157	54.3 Å²	54.3	81%	0.805	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.9	-177.6	-60	169.9	0	0	0	111.6	S126	S126-I128 PolarHBondContact O-N 3.38Å
129	T	86.3	Confident	91.3	Very high	121 Å²	121	49.7 Å²	49.7	74%	0.742	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-39.5	-174.4	60.4	0	0	0	0	112.9	N127	N127-T129 PolarHBondContact O-N 3.49Å; N127-T129 PolarHBondContact OD1-N 3.2Å; N127-T129 PolarHBondContact OD1-OG1 3.32Å
130	T	87.4	Confident	91.1	Very high	85 Å²	85	43.5 Å²	43.5	52%	0.521	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-13.5	-175.7	59.4	0	0	0	0	113.5	N127 D132	N127-T130 WeakPolarHBondContact CB-OG1 3.36Å; N127-T130 PolarHBondContact O-N 3.07Å; T130-D132 PolarHBondContact O-N 3.15Å; T130-D132 PolarHBondContact OG1-N 3.4Å
131	N	89.2	Confident	90.9	Very high	51 Å²	51	43.6 Å²	43.6	27%	0.273	24%	0.239	S	C	.	.			trans	57	28.6	-170	-157.6	55.3	0	0	0	113.3	N27 Y28 N127 P133 C134	N27-N131 WeakPolarHBondContact CB-OD1 3.48Å; N27-N131 VanDerWaalsContact CG-OD1 3.25Å; N27-N131 PolarHBondContact ND2-OD1 3.04Å; Y28-N131 PolarHBondContact O-ND2 3.07Å; Y28-N131 VanDerWaalsContact O-ND2 3.15Å; N127-N131 VanDerWaalsContact O-CA 3.25Å; N127-N131 WeakPolarHBondContact O-CA 3.11Å; N127-N131 PolarHBondContact O-N 2.79Å; N131-P133 CarbonylContact O-C 3.56Å; N131-C134 WeakPolarHBondContact O-CB 3.11Å
132	D	91.3	Very high	90.9	Very high	21 Å²	21	42 Å²	42	11%	0.112	23%	0.233	C	C	.	.			trans	-124.2	130.6	-174.8	-168.3	36.5	0	0	0	109.3	N127 T130 Y144 E145 K146	N127-D132 VanDerWaalsContact CB-O 3.3Å; N127-D132 WeakPolarHBondContact CB-O 3.04Å; N127-D132 PolarHBondContact N-O 3.45Å; T130-D132 PolarHBondContact O-N 3.15Å; T130-D132 PolarHBondContact OG1-N 3.4Å; D132-Y144 WeakPolarHBondContact OD1-CA 3.26Å; D132-E145 PolarHBondContact OD1-N 2.9Å; D132-K146 WeakPolarHBondContact OD2-CA 3.24Å; D132-K146 WeakPolarHBondContact OD2-CB 3.17Å; D132-K146 PolarHBondContact OD2-N 2.86Å
133	P	95.8	Very high	91	Very high	9 Å²	9	41.2 Å²	41.2	6%	0.058	23%	0.23	C	C	.	.	S	Bend	cis	-66.9	163.6	-9	31.3	-37.7	0	0	0	113.1	L26 I124 S126 N131 L142 I143 Y144	L26-P133 HydrophobicContact CD2-CB 4.2Å; L26-P133 HydrophobicContact CD2-CG 3.75Å; I124-P133 HydrophobicContact CG2-CG 3.58Å; S126-P133 WeakPolarHBondContact CA-O 3.27Å; S126-P133 VanDerWaalsContact CB-O 3.23Å; S126-P133 WeakPolarHBondContact CB-O 2.87Å; S126-P133 PolarHBondContact OG-O 3.22Å; N131-P133 CarbonylContact O-C 3.56Å; P133-L142 HydrophobicContact CB-CD1 3.89Å; P133-L142 HydrophobicContact CG-CD1 4.38Å; P133-I143 CarbonylContact C-O 3.59Å; P133-I143 WeakPolarHBondContact CA-O 3.42Å; P133-I143 VanDerWaalsContact CB-O 3.23Å; P133-I143 WeakPolarHBondContact CB-O 3.43Å; P133-Y144 HydrophobicContact CB-CD1 3.87Å; P133-Y144 HydrophobicContact CB-CD2 3.76Å; P133-Y144 HydrophobicContact CB-CE1 3.73Å; P133-Y144 HydrophobicContact CB-CE2 3.6Å; P133-Y144 HydrophobicContact CB-CG 3.88Å; P133-Y144 HydrophobicContact CG-CD1 4.35Å; P133-Y144 HydrophobicContact CG-CE1 3.74Å; P133-Y144 HydrophobicContact CG-CE2 4.02Å
134	C	94	Very high	91	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.02	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	168.2	172.5	61.9	0	0	0	0	111.5	N27 C29 N131 I143	N27-C134 CarbonylContact O-C 3.34Å; N27-C134 VanDerWaalsContact O-CA 3.3Å; N27-C134 WeakPolarHBondContact O-CA 3.31Å; N27-C134 VanDerWaalsContact O-CB 3.31Å; N27-C134 WeakPolarHBondContact O-CB 3.26Å; C29-C134 WeakPolarHBondContact CA-SG 3.32Å; C29-C134 HydrophobicContact CB-CB 4.05Å; C29-C134 WeakPolarHBondContact CB-SG 3.05Å; C29-C134 WeakPolarHBondContact SG-CB 3.28Å; C29-C134 CovalentContact SG-SG 2.04Å; C29-C134 PolarHBondContact SG-SG 2.86Å; N131-C134 WeakPolarHBondContact O-CB 3.11Å; C134-I143 PolarHBondContact N-O 2.79Å; C134-I143 PolarHBondContact O-N 2.69Å
135	I	93.1	Very high	90.9	Very high	17 Å²	17	44.5 Å²	44.5	9%	0.087	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.4	172.8	53.8	168.8	0	0	0	112	L26 N27 Y28 C29 N137 E141 L142	L26-I135 HydrophobicContact CB-CB 4.3Å; L26-I135 HydrophobicContact CB-CD1 4.15Å; L26-I135 HydrophobicContact CB-CG1 3.86Å; L26-I135 HydrophobicContact CB-CG2 3.64Å; L26-I135 HydrophobicContact CD1-CG2 3.46Å; L26-I135 VanDerWaalsContact CD1-CG2 3.46Å; L26-I135 HydrophobicContact CG-CG2 4.04Å; N27-I135 WeakPolarHBondContact O-CG1 3.43Å; N27-I135 PolarHBondContact O-N 3.38Å; Y28-I135 CarbonylContact C-O 3.51Å; Y28-I135 VanDerWaalsContact CA-O 3.28Å; Y28-I135 WeakPolarHBondContact CA-O 3.46Å; Y28-I135 HydrophobicContact CD1-CD1 4.05Å; Y28-I135 HydrophobicContact CD1-CG1 3.84Å; Y28-I135 HydrophobicContact CE1-CD1 3.7Å; Y28-I135 HydrophobicContact CE1-CG1 4.03Å; C29-I135 PolarHBondContact N-O 3.27Å; C29-I135 VanDerWaalsContact SG-C 3.53Å; I135-N137 PolarHBondContact O-N 3.15Å; I135-E141 CarbonylContact C-O 3.44Å; I135-E141 VanDerWaalsContact CA-O 3.27Å; I135-E141 WeakPolarHBondContact CA-O 3.42Å; I135-L142 HydrophobicContact CG2-CD1 4.33Å
136	M	89.4	Confident	90.9	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.246	C	C	.	.			trans	-73.3	124.2	168.5	-63.9	-159.1	78.3	0	0	109.5	D31 R33 N138 T139 N140 E141 I143	D31-M136 WeakPolarHBondContact O-CE 3.45Å; R33-M136 HydrophobicContact CB-CE 3.65Å; R33-M136 HydrophobicContact CG-CE 3.8Å; M136-N138 PolarHBondContact O-N 3.11Å; M136-T139 VanDerWaalsContact CB-OG1 3.3Å; M136-T139 WeakPolarHBondContact CB-OG1 3.32Å; M136-N140 VanDerWaalsContact O-CA 3.28Å; M136-N140 WeakPolarHBondContact O-CA 3.31Å; M136-N140 PolarHBondContact O-N 3.45Å; M136-E141 HydrophobicContact CB-CB 4.28Å; M136-E141 HydrophobicContact CG-CB 4.16Å; M136-E141 PolarHBondContact N-O 3.35Å; M136-E141 HydrophobicContact SD-CB 4.4Å; M136-E141 VanDerWaalsContact SD-OE2 3.41Å; M136-I143 HydrophobicContact CG-CD1 3.42Å; M136-I143 VanDerWaalsContact CG-CD1 3.42Å; M136-I143 HydrophobicContact CG-CG1 4.11Å; M136-I143 HydrophobicContact SD-CD1 3.69Å
137	N	84.6	Confident	91.1	Very high	58 Å²	58	46.2 Å²	46.2	31%	0.31	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-49.7	-175.5	-173	3.6	0	0	0	111.6	Y28 R84 I135	Y28-N137 HydrophobicContact CD1-CB 3.58Å; Y28-N137 HydrophobicContact CE1-CB 3.86Å; Y28-N137 HydrophobicContact CG-CB 4.28Å; R84-N137 PolarHBondContact NH1-O 3.15Å; R84-N137 PolarHBondContact NH1-OD1 3.23Å; I135-N137 PolarHBondContact O-N 3.15Å
138	N	83	Confident	91.4	Very high	50 Å²	50	44.1 Å²	44.1	27%	0.267	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-38.4	-172.4	-66.3	-15.4	0	0	0	113.7	R33 L35 R84 M136	R33-N138 PolarHBondContact O-ND2 2.94Å; L35-N138 WeakPolarHBondContact CD2-O 3.35Å; L35-N138 HydrophobicContact CG-CB 4.48Å; R84-N138 VanDerWaalsContact CD-O 3.29Å; R84-N138 WeakPolarHBondContact CD-O 3.42Å; M136-N138 PolarHBondContact O-N 3.11Å
139	T	86.8	Confident	91.9	Very high	15 Å²	15	36.7 Å²	36.7	9%	0.092	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-5.4	-168.3	48.2	0	0	0	0	113.5	L35 M136 E141	L35-T139 HydrophobicContact CD2-CG2 4.16Å; M136-T139 VanDerWaalsContact CB-OG1 3.3Å; M136-T139 WeakPolarHBondContact CB-OG1 3.32Å; T139-E141 PolarHBondContact O-N 2.99Å; T139-E141 VanDerWaalsContact O-N 3.15Å; T139-E141 WeakPolarHBondContact OG1-CG 3.42Å
140	N	91.6	Very high	92.3	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.064	18%	0.18	C	C	.	.			trans	54.9	24.5	-173.8	-157.7	35.4	0	0	0	113.8	C76 L78 W89 M136	C76-N140 HydrophobicContact CB-CB 4.12Å; C76-N140 VanDerWaalsContact CB-O 3.3Å; C76-N140 WeakPolarHBondContact CB-O 3.2Å; L78-N140 HydrophobicContact CD1-CB 3.83Å; W89-N140 PolarHBondContact NE1-O 3.02Å; M136-N140 VanDerWaalsContact O-CA 3.28Å; M136-N140 WeakPolarHBondContact O-CA 3.31Å; M136-N140 PolarHBondContact O-N 3.45Å
141	E	93.4	Very high	92.6	Very high	14 Å²	14	35 Å²	35	7%	0.065	17%	0.17	C	C	.	.			trans	-73.8	137.2	178	-58.7	-172.5	137.1	0	0	110.6	Q73 L74 T75 I135 M136 T139	Q73-E141 PolarHBondContact NE2-OE2 3.43Å; L74-E141 CarbonylContact O-C 3.52Å; L74-E141 WeakPolarHBondContact O-CA 3.41Å; T75-E141 HydrophobicContact CG2-CG 4.34Å; T75-E141 WeakPolarHBondContact CG2-OE1 3.23Å; T75-E141 PolarHBondContact OG1-OE1 2.04Å; I135-E141 CarbonylContact C-O 3.44Å; I135-E141 VanDerWaalsContact CA-O 3.27Å; I135-E141 WeakPolarHBondContact CA-O 3.42Å; M136-E141 HydrophobicContact CB-CB 4.28Å; M136-E141 HydrophobicContact CG-CB 4.16Å; M136-E141 PolarHBondContact N-O 3.35Å; M136-E141 HydrophobicContact SD-CB 4.4Å; M136-E141 VanDerWaalsContact SD-OE2 3.41Å; T139-E141 PolarHBondContact O-N 2.99Å; T139-E141 VanDerWaalsContact O-N 3.15Å; T139-E141 WeakPolarHBondContact OG1-CG 3.42Å
142	L	96	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124	175.9	-178.3	68.9	0	0	0	109.7	L26 Q73 L74 W89 I124 P133 I135 Y144 Y156	L26-L142 HydrophobicContact CD1-CD1 3.88Å; L26-L142 HydrophobicContact CD2-CD1 3.86Å; Q73-L142 CarbonylContact C-O 3.08Å; Q73-L142 WeakPolarHBondContact CA-O 3.16Å; L74-L142 HydrophobicContact CB-CB 4.34Å; L74-L142 HydrophobicContact CD1-CD2 4.19Å; L74-L142 PolarHBondContact N-O 2.77Å; L74-L142 PolarHBondContact O-N 2.74Å; W89-L142 HydrophobicContact CD2-CB 4Å; W89-L142 HydrophobicContact CD2-CD2 4.2Å; W89-L142 HydrophobicContact CE3-CD2 4.27Å; W89-L142 HydrophobicContact CG-CB 4.25Å; W89-L142 HydrophobicContact CG-CD2 4.39Å; W89-L142 HydrophobicContact CZ2-CB 4.07Å; I124-L142 HydrophobicContact CD1-CD2 3.47Å; I124-L142 VanDerWaalsContact CD1-CD2 3.47Å; I124-L142 HydrophobicContact CG2-CD1 4.32Å; P133-L142 HydrophobicContact CB-CD1 3.89Å; P133-L142 HydrophobicContact CG-CD1 4.38Å; I135-L142 HydrophobicContact CG2-CD1 4.33Å; L142-Y144 HydrophobicContact CD1-CE2 4.41Å; L142-Y144 HydrophobicContact CD2-CD2 4.44Å; L142-Y144 HydrophobicContact CD2-CE2 3.76Å; L142-Y144 HydrophobicContact CG-CD2 4.31Å; L142-Y144 HydrophobicContact CG-CE2 4Å; L142-Y156 HydrophobicContact CD2-CD1 3.63Å; L142-Y156 HydrophobicContact CD2-CE1 3.84Å
143	I	95.5	Very high	93.2	Very high	23 Å²	23	32.8 Å²	32.8	12%	0.118	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.9	178.2	-60.5	-176.7	0	0	0	109.3	I72 Q73 P133 C134 M136 E145	I72-I143 CarbonylContact O-C 3.57Å; I72-I143 WeakPolarHBondContact O-CA 3.43Å; Q73-I143 HydrophobicContact CG-CG1 4.21Å; P133-I143 CarbonylContact C-O 3.59Å; P133-I143 WeakPolarHBondContact CA-O 3.42Å; P133-I143 VanDerWaalsContact CB-O 3.23Å; P133-I143 WeakPolarHBondContact CB-O 3.43Å; C134-I143 PolarHBondContact N-O 2.79Å; C134-I143 PolarHBondContact O-N 2.69Å; M136-I143 HydrophobicContact CG-CD1 3.42Å; M136-I143 VanDerWaalsContact CG-CD1 3.42Å; M136-I143 HydrophobicContact CG-CG1 4.11Å; M136-I143 HydrophobicContact SD-CD1 3.69Å; I143-E145 HydrophobicContact CG2-CG 4.41Å
144	Y	96.5	Very high	93.3	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.1	158.8	-73.8	-105.5	0	0	0	108.7	N71 I72 R91 D132 P133 L142 F147 D152 Y156	N71-Y144 CarbonylContact C-O 3.53Å; N71-Y144 VanDerWaalsContact CA-O 3.29Å; N71-Y144 WeakPolarHBondContact CA-O 3.35Å; I72-Y144 PolarHBondContact N-O 2.95Å; I72-Y144 PolarHBondContact O-N 3.44Å; R91-Y144 PolarHBondContact NH1-OH 2.88Å; D132-Y144 WeakPolarHBondContact OD1-CA 3.26Å; P133-Y144 HydrophobicContact CB-CD1 3.87Å; P133-Y144 HydrophobicContact CB-CD2 3.76Å; P133-Y144 HydrophobicContact CB-CE1 3.73Å; P133-Y144 HydrophobicContact CB-CE2 3.6Å; P133-Y144 HydrophobicContact CB-CG 3.88Å; P133-Y144 HydrophobicContact CG-CD1 4.35Å; P133-Y144 HydrophobicContact CG-CE1 3.74Å; P133-Y144 HydrophobicContact CG-CE2 4.02Å; L142-Y144 HydrophobicContact CD1-CE2 4.41Å; L142-Y144 HydrophobicContact CD2-CD2 4.44Å; L142-Y144 HydrophobicContact CD2-CE2 3.76Å; L142-Y144 HydrophobicContact CG-CD2 4.31Å; L142-Y144 HydrophobicContact CG-CE2 4Å; Y144-F147 HydrophobicContact CD1-CB 4.32Å; Y144-F147 AromaticContact CD1-CD2 3.8Å; Y144-F147 HydrophobicContact CD1-CD2 3.8Å; Y144-F147 HydrophobicContact CD1-CG 4.49Å; Y144-F147 AromaticContact CD2-CD2 3.91Å; Y144-F147 HydrophobicContact CD2-CD2 3.91Å; Y144-F147 HydrophobicContact CD2-CE2 4.49Å; Y144-F147 HydrophobicContact CE1-CD2 4.17Å; Y144-F147 HydrophobicContact CE2-CD2 4.28Å; Y144-F147 HydrophobicContact CE2-CE2 4.49Å; Y144-F147 HydrophobicContact CG-CB 4.21Å; Y144-F147 AromaticContact CG-CD2 3.66Å; Y144-F147 HydrophobicContact CG-CD2 3.66Å; Y144-F147 HydrophobicContact CG-CG 4.44Å; Y144-D152 HydrophobicContact CE1-CB 4.07Å; Y144-Y156 AromaticContact CE2-CE1 3.88Å; Y144-Y156 HydrophobicContact CE2-CE1 3.88Å; Y144-Y156 PolarHBondContact OH-OH 3.03Å
145	E	93.8	Very high	93.5	Very high	131 Å²	131	32.2 Å²	32.2	61%	0.612	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	-31.6	168.6	-68.5	-171.9	175.4	0	0	110.9	N71 D132 I143	N71-E145 PolarHBondContact OD1-O 2.91Å; D132-E145 PolarHBondContact OD1-N 2.9Å; I143-E145 HydrophobicContact CG2-CG 4.41Å
146	K	94.3	Very high	93.7	Very high	121 Å²	121	31.4 Å²	31.4	53%	0.526	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	64.2	-178.6	-163.5	-178.2	177.3	-177.8	0	111.2	F69 D132 D148	F69-K146 HydrophobicContact CB-CG 3.72Å; F69-K146 HydrophobicContact CD1-CD 4.17Å; F69-K146 HydrophobicContact CD1-CG 3.49Å; F69-K146 VanDerWaalsContact CD1-CG 3.49Å; F69-K146 HydrophobicContact CD2-CG 4.41Å; F69-K146 HydrophobicContact CE1-CD 4.41Å; F69-K146 HydrophobicContact CE1-CG 4.15Å; F69-K146 HydrophobicContact CG-CD 4.27Å; F69-K146 HydrophobicContact CG-CG 3.62Å; D132-K146 WeakPolarHBondContact OD2-CA 3.24Å; D132-K146 WeakPolarHBondContact OD2-CB 3.17Å; D132-K146 PolarHBondContact OD2-N 2.86Å; K146-D148 PolarHBondContact O-N 3.41Å
147	F	96.9	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	119.8	176.4	-171.3	-90.5	0	0	0	110.8	V64 F69 T70 I72 Y144 P149 D152 Y156 I175	V64-F147 HydrophobicContact CG2-CE1 4.15Å; F69-F147 WeakPolarHBondContact CA-O 3.47Å; T70-F147 HydrophobicContact CG2-CB 4.14Å; T70-F147 HydrophobicContact CG2-CD1 4.3Å; T70-F147 PolarHBondContact N-O 3.41Å; T70-F147 WeakPolarHBondContact O-CB 3.46Å; T70-F147 PolarHBondContact O-N 2.57Å; I72-F147 HydrophobicContact CB-CB 4.37Å; I72-F147 HydrophobicContact CB-CD2 4.14Å; I72-F147 HydrophobicContact CB-CG 4.4Å; I72-F147 HydrophobicContact CG1-CB 3.72Å; I72-F147 HydrophobicContact CG1-CD1 4.16Å; I72-F147 HydrophobicContact CG1-CD2 3.75Å; I72-F147 HydrophobicContact CG1-CE2 4.35Å; I72-F147 HydrophobicContact CG1-CG 3.62Å; Y144-F147 HydrophobicContact CD1-CB 4.32Å; Y144-F147 AromaticContact CD1-CD2 3.8Å; Y144-F147 HydrophobicContact CD1-CD2 3.8Å; Y144-F147 HydrophobicContact CD1-CG 4.49Å; Y144-F147 AromaticContact CD2-CD2 3.91Å; Y144-F147 HydrophobicContact CD2-CD2 3.91Å; Y144-F147 HydrophobicContact CD2-CE2 4.49Å; Y144-F147 HydrophobicContact CE1-CD2 4.17Å; Y144-F147 HydrophobicContact CE2-CD2 4.28Å; Y144-F147 HydrophobicContact CE2-CE2 4.49Å; Y144-F147 HydrophobicContact CG-CB 4.21Å; Y144-F147 AromaticContact CG-CD2 3.66Å; Y144-F147 HydrophobicContact CG-CD2 3.66Å; Y144-F147 HydrophobicContact CG-CG 4.44Å; F147-P149 WeakPolarHBondContact O-CD 3.29Å; F147-D152 HydrophobicContact CD1-CB 4.39Å; F147-D152 HydrophobicContact CD2-CB 3.75Å; F147-D152 HydrophobicContact CE1-CB 4.18Å; F147-D152 HydrophobicContact CE2-CB 3.52Å; F147-D152 HydrophobicContact CG-CB 4.2Å; F147-D152 HydrophobicContact CZ-CB 3.75Å; F147-D152 VanDerWaalsContact CZ-O 3.29Å; F147-D152 WeakPolarHBondContact CZ-O 3.48Å; F147-Y156 HydrophobicContact CE2-CE2 4.32Å; F147-Y156 WeakPolarHBondContact CE2-OH 3.38Å; F147-I175 HydrophobicContact CE1-CG2 3.7Å; F147-I175 HydrophobicContact CE2-CB 4.38Å; F147-I175 HydrophobicContact CE2-CG2 3.95Å; F147-I175 HydrophobicContact CZ-CB 3.87Å; F147-I175 HydrophobicContact CZ-CG2 3.35Å
148	D	95.9	Very high	94.8	Very high	34 Å²	34	28.7 Å²	28.7	18%	0.182	14%	0.136	C	C	.	.			trans	-89.1	110.7	172.7	-174.5	-19.9	0	0	0	109.7	F69 K146 Y150 N151 D152	F69-D148 HydrophobicContact CD1-CB 4.06Å; F69-D148 HydrophobicContact CE1-CB 3.69Å; K146-D148 PolarHBondContact O-N 3.41Å; D148-Y150 PolarHBondContact O-N 2.83Å; D148-Y150 VanDerWaalsContact O-N 3.1Å; D148-Y150 WeakPolarHBondContact OD1-CB 3.14Å; D148-Y150 PolarHBondContact OD1-N 3.15Å; D148-N151 HydrophobicContact CB-CB 4.16Å; D148-N151 PolarHBondContact O-N 3.44Å; D148-N151 PolarHBondContact OD2-ND2 3.37Å; D148-D152 WeakPolarHBondContact CB-OD2 3.06Å; D148-D152 PolarHBondContact N-OD2 2.77Å; D148-D152 WeakPolarHBondContact O-CA 3.21Å; D148-D152 WeakPolarHBondContact O-CB 3.27Å; D148-D152 PolarHBondContact O-N 2.5Å
149	P	95.7	Very high	95.4	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-53.1	-36.5	178.3	-23.9	32.8	0	0	0	113.4	V64 K65 Y66 Q68 F147 S153 Y177	V64-P149 HydrophobicContact CG2-CB 3.94Å; V64-P149 HydrophobicContact CG2-CG 4.06Å; K65-P149 WeakPolarHBondContact O-CG 3.3Å; Y66-P149 WeakPolarHBondContact O-CB 3.2Å; Q68-P149 WeakPolarHBondContact O-CG 3.41Å; F147-P149 WeakPolarHBondContact O-CD 3.29Å; P149-S153 WeakPolarHBondContact O-CB 3.25Å; P149-S153 PolarHBondContact O-N 3.15Å; P149-S153 PolarHBondContact O-OG 2.92Å; P149-Y177 HydrophobicContact CB-CD1 3.99Å; P149-Y177 HydrophobicContact CB-CG 4.5Å; P149-Y177 WeakPolarHBondContact O-CD1 3.08Å; P149-Y177 WeakPolarHBondContact O-CE1 3.29Å
150	Y	93.4	Very high	95.9	Very high	112 Å²	112	27.1 Å²	27.1	44%	0.439	13%	0.127	S	C	.	.	H	α-helix	trans	-74.5	-39.1	-176.8	179.3	-102.7	0	0	0	112.8	Y66 K95 D148	Y66-Y150 HydrophobicContact CE2-CD2 4.28Å; K95-Y150 HydrophobicContact CD-CE1 4.12Å; D148-Y150 PolarHBondContact O-N 2.83Å; D148-Y150 VanDerWaalsContact O-N 3.1Å; D148-Y150 WeakPolarHBondContact OD1-CB 3.14Å; D148-Y150 PolarHBondContact OD1-N 3.15Å
151	N	93.9	Very high	96	Very high	59 Å²	59	30.3 Å²	30.3	32%	0.316	14%	0.143	S	C	.	.	H	α-helix	trans	-94.7	-33.6	-175.3	-70.3	-51.9	0	0	0	113.3	K95 D148	K95-N151 PolarHBondContact NZ-OD1 2.81Å; D148-N151 HydrophobicContact CB-CB 4.16Å; D148-N151 PolarHBondContact O-N 3.44Å; D148-N151 PolarHBondContact OD2-ND2 3.37Å
152	D	96.1	Very high	96	Very high	25 Å²	25	37.8 Å²	37.8	13%	0.134	17%	0.172	C	C	.	.	H	α-helix	trans	-104.6	-11.9	-171	-59.1	-49.3	0	0	0	113.8	R91 Y144 F147 D148 G154 Y156	R91-D152 IonicContact CZ-OD1 2.93Å; R91-D152 IonicContact NH1-OD1 2.77Å; R91-D152 PolarHBondContact NH1-OD1 3.07Å; Y144-D152 HydrophobicContact CE1-CB 4.07Å; F147-D152 HydrophobicContact CD1-CB 4.39Å; F147-D152 HydrophobicContact CD2-CB 3.75Å; F147-D152 HydrophobicContact CE1-CB 4.18Å; F147-D152 HydrophobicContact CE2-CB 3.52Å; F147-D152 HydrophobicContact CG-CB 4.2Å; F147-D152 HydrophobicContact CZ-CB 3.75Å; F147-D152 VanDerWaalsContact CZ-O 3.29Å; F147-D152 WeakPolarHBondContact CZ-O 3.48Å; D148-D152 WeakPolarHBondContact CB-OD2 3.06Å; D148-D152 PolarHBondContact N-OD2 2.77Å; D148-D152 WeakPolarHBondContact O-CA 3.21Å; D148-D152 WeakPolarHBondContact O-CB 3.27Å; D148-D152 PolarHBondContact O-N 2.5Å; D152-G154 PolarHBondContact O-N 3Å; D152-Y156 WeakPolarHBondContact O-CE2 3.41Å; D152-Y156 PolarHBondContact O-OH 2.8Å
153	S	97.4	Very high	96	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.19	C	C	.	.			trans	-57.2	140.6	174.1	52.6	0	0	0	0	112.2	R94 P149 I175 Y177	R94-S153 WeakPolarHBondContact CG-O 3.35Å; R94-S153 PolarHBondContact N-O 3.27Å; P149-S153 WeakPolarHBondContact O-CB 3.25Å; P149-S153 PolarHBondContact O-N 3.15Å; P149-S153 PolarHBondContact O-OG 2.92Å; S153-I175 CarbonylContact C-O 3.55Å; S153-I175 VanDerWaalsContact CA-O 3.3Å; S153-I175 WeakPolarHBondContact CA-O 3.43Å; S153-I175 VanDerWaalsContact CB-O 3.29Å; S153-I175 WeakPolarHBondContact CB-O 3.3Å; S153-Y177 VanDerWaalsContact OG-CE1 3.27Å; S153-Y177 WeakPolarHBondContact OG-CE1 3.2Å
154	G	97.7	Very high	95.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.2	-179.3	-167.8	0	0	0	0	0	114.1	I92 R94 D152 I175	I92-G154 CarbonylContact O-C 3.52Å; I92-G154 WeakPolarHBondContact O-CA 3.49Å; R94-G154 VanDerWaalsContact NH1-C 3.34Å; R94-G154 PolarHBondContact NH2-O 2.84Å; D152-G154 PolarHBondContact O-N 3Å; G154-I175 PolarHBondContact N-O 2.04Å; G154-I175 PolarHBondContact O-N 2.91Å
155	T	98.4	Very high	95.8	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.8	166.3	-57.9	0	0	0	0	108.2	R91 I92 R94 I101 L116 W172 Y173 H174	R91-T155 CarbonylContact C-O 3.54Å; R91-T155 WeakPolarHBondContact CA-O 3.46Å; I92-T155 PolarHBondContact N-O 2.78Å; I92-T155 PolarHBondContact O-N 3.1Å; R94-T155 VanDerWaalsContact NH1-N 3.18Å; R94-T155 PolarHBondContact NH1-OG1 2.61Å; R94-T155 PolarHBondContact NH2-OG1 3.25Å; I101-T155 HydrophobicContact CD1-CG2 4.4Å; I101-T155 WeakPolarHBondContact CD1-OG1 3.42Å; L116-T155 HydrophobicContact CD1-CG2 3.68Å; L116-T155 HydrophobicContact CD2-CG2 4.43Å; T155-W172 HydrophobicContact CG2-CB 4.09Å; T155-Y173 CarbonylContact C-O 3.57Å; T155-Y173 WeakPolarHBondContact CA-O 3.05Å; T155-H174 WeakPolarHBondContact CG2-ND1 3.42Å; T155-H174 PolarHBondContact OG1-ND1 2.77Å
156	Y	98.6	Very high	95.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.6	-173	-70.9	-107.2	0	0	0	110.3	L74 F90 R91 I124 L142 Y144 F147 D152 Y173 I175	L74-Y156 HydrophobicContact CD1-CD1 3.81Å; L74-Y156 HydrophobicContact CD1-CD2 4.26Å; L74-Y156 HydrophobicContact CD1-CG 3.66Å; F90-Y156 WeakPolarHBondContact O-CA 3.35Å; R91-Y156 HydrophobicContact CB-CD1 4.03Å; R91-Y156 HydrophobicContact CB-CE1 4Å; R91-Y156 HydrophobicContact CB-CG 4.31Å; I124-Y156 HydrophobicContact CD1-CD1 3.37Å; I124-Y156 HydrophobicContact CD1-CE1 3.5Å; L142-Y156 HydrophobicContact CD2-CD1 3.63Å; L142-Y156 HydrophobicContact CD2-CE1 3.84Å; Y144-Y156 AromaticContact CE2-CE1 3.88Å; Y144-Y156 HydrophobicContact CE2-CE1 3.88Å; Y144-Y156 PolarHBondContact OH-OH 3.03Å; F147-Y156 HydrophobicContact CE2-CE2 4.32Å; F147-Y156 WeakPolarHBondContact CE2-OH 3.38Å; D152-Y156 WeakPolarHBondContact O-CE2 3.41Å; D152-Y156 PolarHBondContact O-OH 2.8Å; Y156-Y173 PolarHBondContact N-O 3.02Å; Y156-Y173 PolarHBondContact O-N 3.15Å; Y156-I175 HydrophobicContact CD2-CB 4.41Å; Y156-I175 HydrophobicContact CD2-CG1 3.92Å; Y156-I175 HydrophobicContact CE2-CB 4.24Å; Y156-I175 HydrophobicContact CE2-CG1 4.13Å
157	I	98.1	Very high	96.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	133.8	-176.9	-54.7	130	0	0	0	109.1	W89 F90 L116 Y121 Q159 W172	W89-I157 WeakPolarHBondContact CA-O 3.5Å; F90-I157 PolarHBondContact N-O 2.87Å; F90-I157 PolarHBondContact O-N 3.22Å; L116-I157 HydrophobicContact CD1-CD1 3.22Å; L116-I157 HydrophobicContact CD1-CG1 3.82Å; Y121-I157 HydrophobicContact CE1-CD1 3.77Å; Y121-I157 HydrophobicContact CE2-CD1 4.19Å; Y121-I157 WeakPolarHBondContact OH-CD1 3.47Å; I157-Q159 HydrophobicContact CG2-CB 4.41Å; I157-W172 HydrophobicContact CG1-CG 4.38Å
158	C	97.4	Very high	96	Very high	4 Å²	4	41 Å²	41	3%	0.027	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	100	166.7	-167.7	0	0	0	0	108.9	C76 W89 T168	C76-C158 HydrophobicContact CB-CB 3.71Å; C76-C158 WeakPolarHBondContact CB-SG 3.38Å; C76-C158 WeakPolarHBondContact SG-CB 3.27Å; C76-C158 CovalentContact SG-SG 2.03Å; C76-C158 PolarHBondContact SG-SG 2.76Å; W89-C158 HydrophobicContact CD2-CB 3.98Å; W89-C158 HydrophobicContact CE3-CB 4.08Å; W89-C158 HydrophobicContact CH2-CB 3.9Å; W89-C158 HydrophobicContact CZ2-CB 3.8Å; W89-C158 HydrophobicContact CZ3-CB 4.03Å; C158-T168 CarbonylContact O-C 3.57Å; C158-T168 VanDerWaalsContact O-CB 3.29Å; C158-T168 WeakPolarHBondContact O-CB 3.49Å; C158-T168 PolarHBondContact O-OG1 3.46Å; C158-T168 VanDerWaalsContact O-OG1 3.08Å
159	Q	96.5	Very high	96.1	Very high	24 Å²	24	40 Å²	40	11%	0.112	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.1	-170.8	-170.9	177.9	11.9	0	0	111.4	F87 Q88 F90 Y121 I157 N169	F87-Q159 VanDerWaalsContact CA-O 3.29Å; F87-Q159 WeakPolarHBondContact CA-O 2.85Å; Q88-Q159 PolarHBondContact N-O 3.04Å; Q88-Q159 PolarHBondContact O-N 2.66Å; F90-Q159 HydrophobicContact CD2-CB 3.78Å; F90-Q159 HydrophobicContact CE2-CB 3.99Å; Y121-Q159 VanDerWaalsContact CE2-OE1 3.29Å; I157-Q159 HydrophobicContact CG2-CB 4.41Å; Q159-N169 VanDerWaalsContact CA-OD1 3.32Å; Q159-N169 WeakPolarHBondContact CA-OD1 3.05Å; Q159-N169 WeakPolarHBondContact CG-OD1 3.49Å
160	S	96.4	Very high	96.2	Very high	8 Å²	8	40.4 Å²	40.4	6%	0.056	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	123.3	163.3	-176	0	0	0	0	109.9	H86 Y162 N163 N169	H86-S160 WeakPolarHBondContact O-CA 3.42Å; S160-Y162 VanDerWaalsContact C-N 3.33Å; S160-N163 WeakPolarHBondContact CB-O 3.08Å; S160-N163 PolarHBondContact OG-N 3.5Å; S160-N169 PolarHBondContact N-OD1 2.91Å
161	L	94.4	Very high	96.4	Very high	78 Å²	78	35.3 Å²	35.3	41%	0.408	17%	0.171	S	C	.	.	S	Bend	trans	-73.5	-25.2	-178.6	-61.8	176.7	0	0	0	112.8	H86 Q88 F90	H86-L161 WeakPolarHBondContact O-CG 3.47Å; H86-L161 PolarHBondContact O-N 3.45Å; Q88-L161 HydrophobicContact CB-CD1 4.34Å; Q88-L161 HydrophobicContact CB-CD2 3.98Å; Q88-L161 HydrophobicContact CB-CG 4.33Å; F90-L161 HydrophobicContact CE2-CD2 4.25Å; F90-L161 HydrophobicContact CZ-CD2 4.4Å
162	Y	94.1	Very high	96.6	Very high	171 Å²	171	32.6 Å²	32.6	67%	0.671	16%	0.156	S	C	*	.	S	Bend	trans	-112	-15.4	-173.1	-54.6	-73.1	0	0	0	113.9	H86 S160	H86-Y162 HydrophobicContact CB-CD2 3.63Å; H86-Y162 HydrophobicContact CB-CE2 3.85Å; H86-Y162 AromaticContact CD2-CD2 3.77Å; H86-Y162 AromaticContact CD2-CE2 3.36Å; H86-Y162 WeakPolarHBondContact CD2-CE2 3.19Å; H86-Y162 AromaticContact CG-CD2 3.44Å; H86-Y162 VanDerWaalsContact CG-CD2 3.44Å; H86-Y162 AromaticContact CG-CE2 3.52Å; H86-Y162 AromaticContact ND1-CD2 3.72Å; H86-Y162 AromaticContact NE2-CE2 3.9Å; S160-Y162 VanDerWaalsContact C-N 3.33Å
163	N	95	Very high	96.7	Very high	71 Å²	71	32.2 Å²	32.2	38%	0.38	15%	0.153	S	C	.	.			trans	-127.1	98.6	177.6	-178.8	1.7	0	0	0	110.3	S160 K165 H166 N169	S160-N163 WeakPolarHBondContact CB-O 3.08Å; S160-N163 PolarHBondContact OG-N 3.5Å; N163-K165 PolarHBondContact O-N 3.26Å; N163-K165 WeakPolarHBondContact OD1-CA 3.45Å; N163-K165 PolarHBondContact OD1-N 2.8Å; N163-H166 HydrophobicContact CB-CB 4.16Å; N163-H166 VanDerWaalsContact O-CB 3.28Å; N163-H166 WeakPolarHBondContact O-CB 3.36Å; N163-H166 PolarHBondContact O-N 3.34Å; N163-H166 VanDerWaalsContact O-N 3.13Å; N163-H166 PolarHBondContact OD1-N 3.49Å; N163-N169 PolarHBondContact O-ND2 3.42Å
164	N	92.7	Very high	96.8	Very high	110 Å²	110	32.2 Å²	32.2	59%	0.588	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.7	178.3	66.9	-2.4	0	0	0	113.5	N169	N164-N169 WeakPolarHBondContact CA-ND2 3.47Å; N164-N169 PolarHBondContact O-ND2 2.94Å
165	K	95.2	Very high	96.8	Very high	123 Å²	123	32.2 Å²	32.2	54%	0.535	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5	177	-46.4	-163.8	178.8	171	0	113.1	F109 Y110 N163	F109-K165 HydrophobicContact CE1-CB 4.15Å; F109-K165 HydrophobicContact CE1-CD 4.16Å; F109-K165 HydrophobicContact CE1-CG 3.86Å; Y110-K165 PolarHBondContact OH-O 3.23Å; N163-K165 PolarHBondContact O-N 3.26Å; N163-K165 WeakPolarHBondContact OD1-CA 3.45Å; N163-K165 PolarHBondContact OD1-N 2.8Å
166	H	96.7	Very high	96.7	Very high	17 Å²	17	32.2 Å²	32.2	8%	0.079	15%	0.153	C	C	.	.			trans	-62.3	139.5	-178.5	-162.7	-91.7	0	0	0	112	E82 F87 N163 T168 N169 F170	E82-H166 IonicContact OE1-CE1 3.65Å; E82-H166 PolarHBondContact OE1-CE1 3.49Å; E82-H166 IonicContact OE1-NE2 2.65Å; E82-H166 PolarHBondContact OE1-NE2 3.35Å; E82-H166 IonicContact OE2-CE1 3.44Å; F87-H166 AromaticContact CE1-CE1 3.56Å; F87-H166 AromaticContact CE1-ND1 3.57Å; F87-H166 AromaticContact CZ-CE1 3.63Å; F87-H166 AromaticContact CZ-NE2 3.68Å; N163-H166 HydrophobicContact CB-CB 4.16Å; N163-H166 VanDerWaalsContact O-CB 3.28Å; N163-H166 WeakPolarHBondContact O-CB 3.36Å; N163-H166 PolarHBondContact O-N 3.34Å; N163-H166 VanDerWaalsContact O-N 3.13Å; N163-H166 PolarHBondContact OD1-N 3.49Å; H166-T168 VanDerWaalsContact C-N 3.25Å; H166-T168 PolarHBondContact ND1-N 3.43Å; H166-T168 PolarHBondContact ND1-OG1 2.96Å; H166-T168 PolarHBondContact O-N 3.47Å; H166-T168 VanDerWaalsContact O-N 3.17Å; H166-N169 WeakPolarHBondContact O-CB 3.14Å; H166-N169 PolarHBondContact O-N 3.48Å; H166-N169 VanDerWaalsContact O-N 3.09Å; H166-F170 WeakPolarHBondContact O-CD2 3.4Å; H166-F170 WeakPolarHBondContact O-CE2 3.27Å
167	P	97.2	Very high	96.5	Very high	21 Å²	21	32.7 Å²	32.7	14%	0.136	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53.6	-39.3	-178.2	-25	30	0	0	0	113.9	Q51 A55 Y110 N169 F170	Q51-P167 HydrophobicContact CB-CB 4.07Å; Q51-P167 HydrophobicContact CB-CG 4.46Å; A55-P167 HydrophobicContact CB-CB 3.96Å; Y110-P167 HydrophobicContact CE1-CG 4.32Å; Y110-P167 WeakPolarHBondContact OH-CA 3.38Å; Y110-P167 WeakPolarHBondContact OH-CD 3.32Å; Y110-P167 VanDerWaalsContact OH-CG 3.24Å; Y110-P167 WeakPolarHBondContact OH-CG 3.24Å; Y110-P167 VanDerWaalsContact OH-N 3.11Å; P167-N169 PolarHBondContact O-N 2.8Å; P167-F170 WeakPolarHBondContact O-CA 3.43Å; P167-F170 WeakPolarHBondContact O-CB 3.44Å; P167-F170 PolarHBondContact O-N 3.47Å
168	T	96.2	Very high	96.3	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.025	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-62.1	-27.2	-178.2	63.3	0	0	0	0	113.8	H77 L78 F87 C158 H166 F170 I171	H77-T168 WeakPolarHBondContact O-CG2 3.24Å; L78-T168 HydrophobicContact CD2-CG2 4.22Å; F87-T168 HydrophobicContact CE1-CG2 4.48Å; C158-T168 CarbonylContact O-C 3.57Å; C158-T168 VanDerWaalsContact O-CB 3.29Å; C158-T168 WeakPolarHBondContact O-CB 3.49Å; C158-T168 PolarHBondContact O-OG1 3.46Å; C158-T168 VanDerWaalsContact O-OG1 3.08Å; H166-T168 VanDerWaalsContact C-N 3.25Å; H166-T168 PolarHBondContact ND1-N 3.43Å; H166-T168 PolarHBondContact ND1-OG1 2.96Å; H166-T168 PolarHBondContact O-N 3.47Å; H166-T168 VanDerWaalsContact O-N 3.17Å; T168-F170 PolarHBondContact O-N 2.83Å; T168-I171 PolarHBondContact O-N 2.84Å; T168-I171 VanDerWaalsContact O-N 3.17Å
169	N	97.3	Very high	96	Very high	11 Å²	11	34.1 Å²	34.1	6%	0.059	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-63	-16	174.9	-59.3	-9.8	0	0	0	112.2	Q159 S160 N163 N164 H166 P167 W172	Q159-N169 VanDerWaalsContact CA-OD1 3.32Å; Q159-N169 WeakPolarHBondContact CA-OD1 3.05Å; Q159-N169 WeakPolarHBondContact CG-OD1 3.49Å; S160-N169 PolarHBondContact N-OD1 2.91Å; N163-N169 PolarHBondContact O-ND2 3.42Å; N164-N169 WeakPolarHBondContact CA-ND2 3.47Å; N164-N169 PolarHBondContact O-ND2 2.94Å; H166-N169 WeakPolarHBondContact O-CB 3.14Å; H166-N169 PolarHBondContact O-N 3.48Å; H166-N169 VanDerWaalsContact O-N 3.09Å; P167-N169 PolarHBondContact O-N 2.8Å; N169-W172 PolarHBondContact O-NE1 2.9Å
170	F	97.6	Very high	95.5	Very high	11 Å²	11	33.6 Å²	33.6	5%	0.048	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-116.4	14.5	-175	-56.5	-79.6	0	0	0	112.5	A55 R58 F109 Y110 I115 H166 P167 T168	A55-F170 HydrophobicContact CB-CB 4.23Å; R58-F170 WeakPolarHBondContact CA-O 3.3Å; R58-F170 WeakPolarHBondContact CD-O 3.44Å; R58-F170 PolarHBondContact NE-O 3.17Å; R58-F170 VanDerWaalsContact NE-O 3.11Å; F109-F170 HydrophobicContact CB-CD1 3.99Å; F109-F170 HydrophobicContact CB-CE1 3.48Å; F109-F170 VanDerWaalsContact CB-CE1 3.48Å; F109-F170 HydrophobicContact CB-CE2 4.3Å; F109-F170 HydrophobicContact CB-CZ 3.65Å; F109-F170 HydrophobicContact CD1-CE1 4.04Å; F109-F170 AromaticContact CD1-CE2 3.9Å; F109-F170 HydrophobicContact CD1-CE2 3.9Å; F109-F170 AromaticContact CD1-CZ 3.34Å; F109-F170 HydrophobicContact CD1-CZ 3.34Å; F109-F170 HydrophobicContact CD2-CE1 4.03Å; F109-F170 HydrophobicContact CD2-CZ 4.05Å; F109-F170 AromaticContact CE1-CZ 3.96Å; F109-F170 HydrophobicContact CE1-CZ 3.96Å; F109-F170 AromaticContact CG-CE1 3.57Å; F109-F170 HydrophobicContact CG-CE1 3.57Å; F109-F170 HydrophobicContact CG-CE2 4.24Å; F109-F170 AromaticContact CG-CZ 3.39Å; F109-F170 HydrophobicContact CG-CZ 3.39Å; Y110-F170 HydrophobicContact CD2-CB 4.12Å; Y110-F170 AromaticContact CD2-CD2 3.73Å; Y110-F170 HydrophobicContact CD2-CD2 3.73Å; Y110-F170 HydrophobicContact CD2-CE2 4.29Å; Y110-F170 AromaticContact CD2-CG 3.94Å; Y110-F170 HydrophobicContact CD2-CG 3.94Å; Y110-F170 HydrophobicContact CE2-CB 4.4Å; Y110-F170 AromaticContact CE2-CD2 3.33Å; Y110-F170 HydrophobicContact CE2-CD2 3.33Å; Y110-F170 AromaticContact CE2-CE2 3.72Å; Y110-F170 HydrophobicContact CE2-CE2 3.72Å; Y110-F170 HydrophobicContact CE2-CG 4.02Å; I115-F170 HydrophobicContact CG2-CE1 4.3Å; H166-F170 WeakPolarHBondContact O-CD2 3.4Å; H166-F170 WeakPolarHBondContact O-CE2 3.27Å; P167-F170 WeakPolarHBondContact O-CA 3.43Å; P167-F170 WeakPolarHBondContact O-CB 3.44Å; P167-F170 PolarHBondContact O-N 3.47Å; T168-F170 PolarHBondContact O-N 2.83Å
171	I	97.8	Very high	94.7	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	16%	0.159	C	C	.	.			trans	-104.4	107.3	169.3	-57	174.2	0	0	0	107.2	L54 A55 I60 H77 T168 Y173	L54-I171 HydrophobicContact CB-CD1 3.66Å; L54-I171 HydrophobicContact CB-CG1 3.9Å; L54-I171 HydrophobicContact CB-CG2 4.4Å; L54-I171 HydrophobicContact CD1-CD1 4.31Å; A55-I171 HydrophobicContact CB-CG1 4.41Å; I60-I171 HydrophobicContact CD1-CG2 3.56Å; I60-I171 HydrophobicContact CG1-CG2 4.46Å; H77-I171 HydrophobicContact CB-CD1 4.24Å; T168-I171 PolarHBondContact O-N 2.84Å; T168-I171 VanDerWaalsContact O-N 3.17Å; I171-Y173 HydrophobicContact CG2-CD2 4.49Å; I171-Y173 HydrophobicContact CG2-CE2 3.77Å
172	W	97.9	Very high	93.4	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.4	-171.6	-53.6	-20.2	0	0	0	110.5	R58 H59 I60 F102 W114 L116 T155 I157 N169	R58-W172 HydrophobicContact CG-CD2 3.99Å; R58-W172 HydrophobicContact CG-CE3 3.56Å; R58-W172 HydrophobicContact CG-CH2 3.99Å; R58-W172 HydrophobicContact CG-CZ2 4.37Å; R58-W172 HydrophobicContact CG-CZ3 3.55Å; R58-W172 WeakPolarHBondContact O-CB 3.33Å; R58-W172 PolarHBondContact O-N 3.02Å; H59-W172 AromaticContact CE1-CE3 3.42Å; H59-W172 VanDerWaalsContact CE1-CE3 3.42Å; H59-W172 AromaticContact CE1-CZ3 3.49Å; H59-W172 VanDerWaalsContact CE1-CZ3 3.49Å; H59-W172 WeakPolarHBondContact CE1-CZ3 3.37Å; H59-W172 AromaticContact ND1-CE3 3.67Å; I60-W172 PolarHBondContact N-O 3.24Å; F102-W172 HydrophobicContact CD1-CH2 4.45Å; F102-W172 AromaticContact CD1-CZ3 3.84Å; F102-W172 HydrophobicContact CD1-CZ3 3.84Å; F102-W172 AromaticContact CE1-CE3 3.85Å; F102-W172 HydrophobicContact CE1-CE3 3.85Å; F102-W172 AromaticContact CE1-CZ3 3.55Å; F102-W172 HydrophobicContact CE1-CZ3 3.55Å; W114-W172 WeakPolarHBondContact O-CH2 3.34Å; L116-W172 HydrophobicContact CB-CZ2 4.5Å; L116-W172 HydrophobicContact CD1-CB 4.37Å; L116-W172 HydrophobicContact CD1-CD2 3.55Å; L116-W172 HydrophobicContact CD1-CE3 4.15Å; L116-W172 HydrophobicContact CD1-CG 3.63Å; L116-W172 HydrophobicContact CD1-CZ2 4.24Å; L116-W172 HydrophobicContact CD2-CD2 4.44Å; L116-W172 HydrophobicContact CD2-CE3 4.23Å; L116-W172 HydrophobicContact CD2-CZ3 4.32Å; L116-W172 HydrophobicContact CG-CD2 3.8Å; L116-W172 HydrophobicContact CG-CE3 4.02Å; L116-W172 HydrophobicContact CG-CG 4.41Å; L116-W172 HydrophobicContact CG-CH2 4.01Å; L116-W172 HydrophobicContact CG-CZ2 3.78Å; L116-W172 HydrophobicContact CG-CZ3 4.14Å; T155-W172 HydrophobicContact CG2-CB 4.09Å; I157-W172 HydrophobicContact CG1-CG 4.38Å; N169-W172 PolarHBondContact O-NE1 2.9Å
173	Y	98.5	Very high	91.9	Very high	17 Å²	17	33.8 Å²	33.8	7%	0.067	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.3	175.1	-63.3	-89.2	0	0	0	109.7	I60 L74 T75 H77 W89 T155 Y156 I171	I60-Y173 HydrophobicContact CB-CD1 3.8Å; I60-Y173 HydrophobicContact CB-CE1 4Å; I60-Y173 HydrophobicContact CD1-CD1 4.18Å; I60-Y173 HydrophobicContact CD1-CE1 3.53Å; I60-Y173 HydrophobicContact CG1-CE1 4.38Å; I60-Y173 HydrophobicContact CG2-CD1 3.69Å; I60-Y173 HydrophobicContact CG2-CE1 3.78Å; I60-Y173 CarbonylContact O-C 3.53Å; I60-Y173 VanDerWaalsContact O-CA 3.22Å; I60-Y173 WeakPolarHBondContact O-CA 2.93Å; L74-Y173 HydrophobicContact CB-CG 4.49Å; L74-Y173 HydrophobicContact CD1-CG 4.35Å; L74-Y173 HydrophobicContact CD2-CD1 4.04Å; L74-Y173 HydrophobicContact CD2-CG 4.21Å; T75-Y173 WeakPolarHBondContact O-CE2 3.3Å; T75-Y173 PolarHBondContact O-OH 3.05Å; H77-Y173 PolarHBondContact CD2-OH 3.37Å; H77-Y173 PolarHBondContact NE2-OH 3.27Å; W89-Y173 HydrophobicContact CH2-CD2 4.05Å; W89-Y173 AromaticContact CH2-CE2 3.95Å; W89-Y173 HydrophobicContact CH2-CE2 3.95Å; W89-Y173 HydrophobicContact CZ3-CD2 4.1Å; W89-Y173 HydrophobicContact CZ3-CE2 4.41Å; T155-Y173 CarbonylContact C-O 3.57Å; T155-Y173 WeakPolarHBondContact CA-O 3.05Å; Y156-Y173 PolarHBondContact N-O 3.02Å; Y156-Y173 PolarHBondContact O-N 3.15Å; I171-Y173 HydrophobicContact CG2-CD2 4.49Å; I171-Y173 HydrophobicContact CG2-CE2 3.77Å
174	H	98	Very high	90.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	103.4	172.4	-50	-78.3	0	0	0	109.1	H59 I60 I61 K62 F102 T155 L336	H59-H174 AromaticContact CG-NE2 3.84Å; H59-H174 AromaticContact ND1-CD2 3.94Å; H59-H174 AromaticContact ND1-CE1 3.93Å; H59-H174 AromaticContact ND1-NE2 2.98Å; H59-H174 PolarHBondContact ND1-NE2 2.96Å; I60-H174 PolarHBondContact O-N 3.29Å; I61-H174 WeakPolarHBondContact CA-O 3.49Å; I61-H174 HydrophobicContact CG1-CB 3.94Å; I61-H174 HydrophobicContact CG2-CB 4.5Å; K62-H174 PolarHBondContact N-O 3.14Å; F102-H174 AromaticContact CZ-CE1 3.95Å; T155-H174 WeakPolarHBondContact CG2-ND1 3.42Å; T155-H174 PolarHBondContact OG1-ND1 2.77Å; H174-L336 HydrophobicContact CB-CD2 4.41Å
175	I	97.9	Very high	89.8	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	109.8	176.7	-45.4	-56	0	0	0	107.6	K62 V64 I72 L74 F147 S153 G154 Y156	K62-I175 HydrophobicContact CB-CD1 3.67Å; K62-I175 HydrophobicContact CD-CD1 4.47Å; K62-I175 WeakPolarHBondContact O-CA 3.46Å; V64-I175 HydrophobicContact CG1-CG2 3.91Å; I72-I175 HydrophobicContact CD1-CG2 4.11Å; I72-I175 HydrophobicContact CG1-CG2 4.33Å; L74-I175 HydrophobicContact CD1-CD1 4.49Å; L74-I175 HydrophobicContact CD1-CG1 4.19Å; L74-I175 HydrophobicContact CD2-CD1 3.55Å; L74-I175 HydrophobicContact CD2-CG1 4.08Å; F147-I175 HydrophobicContact CE1-CG2 3.7Å; F147-I175 HydrophobicContact CE2-CB 4.38Å; F147-I175 HydrophobicContact CE2-CG2 3.95Å; F147-I175 HydrophobicContact CZ-CB 3.87Å; F147-I175 HydrophobicContact CZ-CG2 3.35Å; S153-I175 CarbonylContact C-O 3.55Å; S153-I175 VanDerWaalsContact CA-O 3.3Å; S153-I175 WeakPolarHBondContact CA-O 3.43Å; S153-I175 VanDerWaalsContact CB-O 3.29Å; S153-I175 WeakPolarHBondContact CB-O 3.3Å; G154-I175 PolarHBondContact N-O 2.04Å; G154-I175 PolarHBondContact O-N 2.91Å; Y156-I175 HydrophobicContact CD2-CB 4.41Å; Y156-I175 HydrophobicContact CD2-CG1 3.92Å; Y156-I175 HydrophobicContact CE2-CB 4.24Å; Y156-I175 HydrophobicContact CE2-CG1 4.13Å
176	D	96.6	Very high	89	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	174.1	-163.7	-144.8	-29.6	0	0	0	112.2	K62 L63 V64 R94 Y334 N335 L336	K62-D176 PolarHBondContact O-N 3.2Å; L63-D176 CarbonylContact C-O 3.6Å; L63-D176 VanDerWaalsContact CA-O 3.27Å; L63-D176 WeakPolarHBondContact CA-O 3.43Å; V64-D176 WeakPolarHBondContact CG2-O 3.49Å; V64-D176 PolarHBondContact N-O 2.96Å; R94-D176 IonicContact CZ-OD2 3.99Å; R94-D176 IonicContact NE-OD2 3.18Å; R94-D176 PolarHBondContact NE-OD2 2.97Å; R94-D176 IonicContact NH2-OD2 2.93Å; R94-D176 PolarHBondContact NH2-OD2 3.13Å; R94-D176 VanDerWaalsContact NH2-OD2 3.13Å; D176-Y334 HydrophobicContact CB-CE2 3.87Å; D176-N335 VanDerWaalsContact OD1-CB 3.23Å; D176-N335 WeakPolarHBondContact OD1-CB 3.46Å; D176-N335 PolarHBondContact OD1-ND2 3.43Å; D176-L336 WeakPolarHBondContact OD2-CA 3.3Å; D176-L336 VanDerWaalsContact OD2-CB 3.28Å; D176-L336 WeakPolarHBondContact OD2-CB 3.27Å; D176-L336 PolarHBondContact OD2-N 2.88Å; D176-L336 VanDerWaalsContact OD2-N 3.14Å
177	Y	95.5	Very high	88.2	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.035	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	165.8	-173.4	63	-95.9	0	0	0	112	V64 Y66 P149 S153 N179 N335	V64-Y177 WeakPolarHBondContact O-CB 2.97Å; Y66-Y177 HydrophobicContact CD2-CD1 4.38Å; Y66-Y177 AromaticContact CD2-CD2 3.34Å; Y66-Y177 HydrophobicContact CD2-CD2 3.34Å; Y66-Y177 HydrophobicContact CD2-CE1 4.2Å; Y66-Y177 AromaticContact CD2-CE2 3.11Å; Y66-Y177 HydrophobicContact CD2-CE2 3.11Å; Y66-Y177 AromaticContact CD2-CG 3.99Å; Y66-Y177 HydrophobicContact CD2-CG 3.99Å; Y66-Y177 AromaticContact CD2-CZ 3.6Å; Y66-Y177 HydrophobicContact CE2-CD2 4.21Å; Y66-Y177 AromaticContact CE2-CE2 3.52Å; Y66-Y177 HydrophobicContact CE2-CE2 3.52Å; Y66-Y177 AromaticContact CE2-CZ 3.73Å; Y66-Y177 AromaticContact CG-CD2 3.93Å; Y66-Y177 HydrophobicContact CG-CD2 3.93Å; Y66-Y177 HydrophobicContact CG-CE2 4.05Å; P149-Y177 HydrophobicContact CB-CD1 3.99Å; P149-Y177 HydrophobicContact CB-CG 4.5Å; P149-Y177 WeakPolarHBondContact O-CD1 3.08Å; P149-Y177 WeakPolarHBondContact O-CE1 3.29Å; S153-Y177 VanDerWaalsContact OG-CE1 3.27Å; S153-Y177 WeakPolarHBondContact OG-CE1 3.2Å; Y177-N179 WeakPolarHBondContact CE2-OD1 3.33Å; Y177-N335 HydrophobicContact CD2-CB 4.29Å; Y177-N335 HydrophobicContact CE1-CB 4.46Å; Y177-N335 HydrophobicContact CE2-CB 3.98Å; Y177-N335 WeakPolarHBondContact O-CB 3.31Å; Y177-N335 PolarHBondContact O-N 3.49Å; Y177-N335 VanDerWaalsContact O-N 3.11Å
178	I	94.3	Very high	87.2	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-93.7	123.2	169.2	-49.3	-49.8	0	0	0	108.5	L63 F283 F319 P331 Q333 Y334	L63-I178 HydrophobicContact CD2-CD1 4.48Å; I178-F283 HydrophobicContact CD1-CE1 4.27Å; I178-F283 HydrophobicContact CD1-CZ 3.85Å; I178-F319 HydrophobicContact CB-CB 4.43Å; I178-F319 HydrophobicContact CG1-CB 4.27Å; I178-F319 HydrophobicContact CG1-CD1 3.81Å; I178-F319 HydrophobicContact CG1-CE1 4.43Å; I178-F319 HydrophobicContact CG1-CG 4.23Å; I178-F319 HydrophobicContact CG2-CB 4.1Å; I178-P331 HydrophobicContact CB-CG 4.47Å; I178-P331 HydrophobicContact CD1-CG 3.72Å; I178-P331 HydrophobicContact CG1-CG 3.95Å; I178-P331 HydrophobicContact CG2-CB 4Å; I178-P331 HydrophobicContact CG2-CG 3.65Å; I178-Q333 HydrophobicContact CG2-CB 3.84Å; I178-Y334 HydrophobicContact CD1-CD2 3.62Å; I178-Y334 HydrophobicContact CD1-CG 4.04Å
179	N	90.8	Very high	86.1	Confident	34 Å²	34	41.2 Å²	41.2	18%	0.182	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-61.7	139	173.6	-68.3	-80.3	0	0	0	109.8	Y177 Y181 Q333	Y177-N179 WeakPolarHBondContact CE2-OD1 3.33Å; N179-Y181 PolarHBondContact O-N 3.25Å; N179-Q333 HydrophobicContact CB-CB 4.05Å; N179-Q333 PolarHBondContact N-O 2.85Å; N179-Q333 PolarHBondContact ND2-O 2.71Å; N179-Q333 WeakPolarHBondContact O-CB 3.48Å
180	P	85.2	Confident	84.8	Confident	12 Å²	12	42 Å²	42	8%	0.078	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-63.5	133.9	177.3	26.4	-33.8	0	0	0	110.1	Y66 Q182	Y66-P180 HydrophobicContact CD1-CG 3.63Å; Y66-P180 HydrophobicContact CE1-CG 3.68Å; P180-Q182 VanDerWaalsContact C-N 3.33Å
181	Y	79.1	Confident	83.4	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.016	25%	0.246	C	C	.	.	S	Bend	trans	-66.6	-39.3	177.7	-43.7	-72.4	0	0	0	111.3	N179 N183 K184 L185 I255 Y257 F319 P331 Q333	N179-Y181 PolarHBondContact O-N 3.25Å; Y181-N183 PolarHBondContact O-N 3.39Å; Y181-K184 CarbonylContact O-C 3.55Å; Y181-K184 PolarHBondContact O-N 2.9Å; Y181-L185 WeakPolarHBondContact O-CG 3.08Å; Y181-L185 PolarHBondContact O-N 2.83Å; Y181-I255 HydrophobicContact CD1-CD1 4.05Å; Y181-I255 HydrophobicContact CD1-CG1 4.31Å; Y181-I255 HydrophobicContact CD1-CG2 3.52Å; Y181-I255 HydrophobicContact CE1-CG2 3.27Å; Y181-I255 HydrophobicContact CG-CD1 3.93Å; Y181-I255 HydrophobicContact CG-CG1 4.32Å; Y181-I255 HydrophobicContact CG-CG2 4.3Å; Y181-Y257 PolarHBondContact OH-OH 2.94Å; Y181-F319 HydrophobicContact CE2-CB 4.36Å; Y181-F319 WeakPolarHBondContact OH-CB 3.48Å; Y181-P331 HydrophobicContact CE1-CB 4.09Å; Y181-P331 WeakPolarHBondContact OH-CB 3.38Å; Y181-Q333 HydrophobicContact CD1-CB 4.39Å; Y181-Q333 HydrophobicContact CD1-CG 3.62Å; Y181-Q333 HydrophobicContact CE1-CB 4.19Å; Y181-Q333 HydrophobicContact CE1-CG 3.83Å
182	Q	66.7	Low	81.9	Confident	127 Å²	127	51 Å²	51	59%	0.593	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-53.3	-33.9	-166.2	-66.1	89.8	-14.8	0	0	112.9	P180 K184	P180-Q182 VanDerWaalsContact C-N 3.33Å; Q182-K184 VanDerWaalsContact C-N 3.26Å; Q182-K184 PolarHBondContact O-N 3.01Å
183	N	63.1	Low	80.6	Confident	130 Å²	130	51.8 Å²	51.8	70%	0.695	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-75.1	-13.3	-177	-61.5	-0.3	0	0	0	113.5	Y181	Y181-N183 PolarHBondContact O-N 3.39Å
184	K	68.1	Low	79.3	Confident	142 Å²	142	55.4 Å²	55.4	62%	0.617	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-129.4	18.5	-176.1	-65.2	-171.8	176.3	-174.1	0	113.1	Y181 Q182	Y181-K184 CarbonylContact O-C 3.55Å; Y181-K184 PolarHBondContact O-N 2.9Å; Q182-K184 VanDerWaalsContact C-N 3.26Å; Q182-K184 PolarHBondContact O-N 3.01Å
185	L	76.3	Confident	78.3	Confident	26 Å²	26	60.4 Å²	60.4	14%	0.136	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.9	175.6	-66.6	169	0	0	0	110.1	Y181 I255 N354 Y356	Y181-L185 WeakPolarHBondContact O-CG 3.08Å; Y181-L185 PolarHBondContact O-N 2.83Å; L185-I255 HydrophobicContact CD2-CD1 3.38Å; L185-N354 WeakPolarHBondContact CA-O 3.48Å; L185-N354 HydrophobicContact CD2-CB 3.39Å; L185-Y356 HydrophobicContact CB-CD1 3.43Å; L185-Y356 VanDerWaalsContact CB-CD1 3.43Å; L185-Y356 HydrophobicContact CB-CE1 4Å; L185-Y356 HydrophobicContact CB-CG 4.18Å; L185-Y356 HydrophobicContact CD1-CG 4.49Å; L185-Y356 HydrophobicContact CG-CD1 4.48Å; L185-Y356 WeakPolarHBondContact O-CE1 3.21Å
186	S	77.9	Confident	77.6	Confident	47 Å²	47	64.4 Å²	64.4	33%	0.329	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.2	169.3	-66	0	0	0	0	109.6	N354 Y355 Y356	S186-N354 PolarHBondContact N-O 3.17Å; S186-Y355 CarbonylContact O-C 3.54Å; S186-Y355 VanDerWaalsContact O-CA 3.25Å; S186-Y355 WeakPolarHBondContact O-CA 3.49Å; S186-Y355 WeakPolarHBondContact O-CD1 3.48Å; S186-Y356 WeakPolarHBondContact O-CD1 3.28Å; S186-Y356 PolarHBondContact O-N 3.45Å
187	Q	81.2	Confident	77	Confident	105 Å²	105	64.4 Å²	64.4	49%	0.491	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.3	177.2	-173.7	177	-26.9	0	0	109.7	N189 Y356	Q187-N189 PolarHBondContact NE2-OD1 3.27Å; Q187-Y356 VanDerWaalsContact CA-CE1 3.48Å; Q187-Y356 WeakPolarHBondContact CA-O 3.28Å; Q187-Y356 HydrophobicContact CB-CD1 4.29Å; Q187-Y356 HydrophobicContact CB-CE1 3.63Å; Q187-Y356 HydrophobicContact CB-CE2 4.36Å; Q187-Y356 HydrophobicContact CG-CE1 4.37Å; Q187-Y356 HydrophobicContact CG-CE2 4.26Å
188	F	75.5	Confident	76.3	Confident	61 Å²	61	67.4 Å²	67.4	27%	0.268	36%	0.36	S	S	.	.			trans	-110.1	132.5	170.5	-170.8	-86.9	0	0	0	110.1	I190 L217 Y356 I357	F188-I190 HydrophobicContact CD1-CG1 3.88Å; F188-I190 HydrophobicContact CE1-CG1 3.76Å; F188-L217 HydrophobicContact CD1-CD1 4.36Å; F188-L217 HydrophobicContact CE1-CD1 3.41Å; F188-L217 VanDerWaalsContact CE1-CD1 3.41Å; F188-L217 HydrophobicContact CE2-CD1 3.8Å; F188-L217 HydrophobicContact CZ-CD1 3.1Å; F188-L217 HydrophobicContact CZ-CD2 4.39Å; F188-L217 HydrophobicContact CZ-CG 4.35Å; F188-Y356 PolarHBondContact N-O 2.55Å; F188-I357 HydrophobicContact CB-CD1 4.08Å; F188-I357 HydrophobicContact CB-CG1 3.8Å; F188-I357 HydrophobicContact CD1-CD1 3.71Å; F188-I357 HydrophobicContact CD1-CG1 4.29Å; F188-I357 HydrophobicContact CG-CD1 4.3Å; F188-I357 WeakPolarHBondContact O-CG1 3.37Å
189	N	72	Confident	75.5	Confident	121 Å²	121	70.6 Å²	70.6	65%	0.647	38%	0.379	S	S	*	.			trans	-103.1	130.2	-178.5	-72.8	-28.4	0	0	0	110.2	Q187	Q187-N189 PolarHBondContact NE2-OD1 3.27Å
190	I	71.3	Confident	74.9	Confident	27 Å²	27	73 Å²	73	14%	0.138	39%	0.386	C	S	.	.			trans	-114	117.1	171	-56.1	169.9	0	0	0	108.2	F188 I193 I210 I214 I357	F188-I190 HydrophobicContact CD1-CG1 3.88Å; F188-I190 HydrophobicContact CE1-CG1 3.76Å; I190-I193 HydrophobicContact CB-CD1 3.51Å; I190-I193 HydrophobicContact CB-CG1 4.33Å; I190-I193 HydrophobicContact CD1-CD1 3.84Å; I190-I193 HydrophobicContact CG1-CD1 4.28Å; I190-I193 HydrophobicContact CG2-CD1 3.35Å; I190-I193 HydrophobicContact CG2-CG1 3.63Å; I190-I210 HydrophobicContact CD1-CG2 3.53Å; I190-I214 HydrophobicContact CD1-CD1 3.88Å; I190-I214 HydrophobicContact CD1-CG1 4.04Å; I190-I357 HydrophobicContact CD1-CD1 3.64Å; I190-I357 HydrophobicContact CD1-CG2 4.29Å; I190-I357 HydrophobicContact CG1-CD1 4.16Å
191	S	67.8	Low	74.8	Confident	119 Å²	119	79.2 Å²	79.2	83%	0.832	41%	0.414	S	S	*	.	S	Bend	trans	-78.2	-23.9	-176.6	47.2	0	0	0	0	113.5
192	S	66.5	Low	75	Confident	85 Å²	85	81.8 Å²	81.8	59%	0.594	43%	0.427	S	S	*	.			trans	-112.4	30.5	-160.1	55.6	0	0	0	0	116.2
193	I	70	Confident	75.7	Confident	19 Å²	19	75.8 Å²	75.8	10%	0.097	40%	0.398	C	S	.	.			trans	-105.8	130.4	179.7	-58	148.8	0	0	0	110.7	I190 K195 L206 I210 I359	I190-I193 HydrophobicContact CB-CD1 3.51Å; I190-I193 HydrophobicContact CB-CG1 4.33Å; I190-I193 HydrophobicContact CD1-CD1 3.84Å; I190-I193 HydrophobicContact CG1-CD1 4.28Å; I190-I193 HydrophobicContact CG2-CD1 3.35Å; I190-I193 HydrophobicContact CG2-CG1 3.63Å; I193-K195 PolarHBondContact O-N 3.3Å; I193-K195 VanDerWaalsContact O-N 3.15Å; I193-L206 HydrophobicContact CG2-CD2 4.43Å; I193-I210 HydrophobicContact CD1-CD1 3.75Å; I193-I210 HydrophobicContact CD1-CG1 3.48Å; I193-I210 VanDerWaalsContact CD1-CG1 3.48Å; I193-I210 HydrophobicContact CG1-CD1 4.32Å; I193-I210 HydrophobicContact CG1-CG1 3.87Å; I193-I210 HydrophobicContact CG2-CD1 4.18Å; I193-I210 HydrophobicContact CG2-CG1 4.46Å; I193-I359 HydrophobicContact CD1-CD1 4.02Å; I193-I359 HydrophobicContact CD1-CG1 4.25Å
194	N	70.9	Confident	76.6	Confident	94 Å²	94	72.5 Å²	72.5	50%	0.503	38%	0.38	S	S	.	.			trans	-62.1	115.1	166.3	-174.4	-2.3	0	0	0	109.7	I196	N194-I196 VanDerWaalsContact C-N 3.35Å; N194-I196 PolarHBondContact OD1-N 2.91Å
195	K	78.6	Confident	77.3	Confident	105 Å²	105	72.6 Å²	72.6	46%	0.457	38%	0.381	S	S	.	.			trans	-88.7	-0.3	-176.4	-71.4	170.5	-169.6	172	0	112.9	I193 I359 K360 Y361 K362	I193-K195 PolarHBondContact O-N 3.3Å; I193-K195 VanDerWaalsContact O-N 3.15Å; K195-I359 HydrophobicContact CG-CG2 4.24Å; K195-K360 VanDerWaalsContact CB-O 3.32Å; K195-K360 WeakPolarHBondContact CB-O 3.12Å; K195-K360 WeakPolarHBondContact CG-O 3.34Å; K195-Y361 CarbonylContact O-C 3.55Å; K195-Y361 WeakPolarHBondContact O-CA 3.28Å; K195-K362 PolarHBondContact O-N 2.84Å
196	I	83	Confident	77.6	Confident	85 Å²	85	72.6 Å²	72.6	44%	0.436	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.4	179.8	-57	171.5	0	0	0	109.1	N194 K362 N364	N194-I196 VanDerWaalsContact C-N 3.35Å; N194-I196 PolarHBondContact OD1-N 2.91Å; I196-K362 WeakPolarHBondContact CA-O 3.44Å; I196-N364 HydrophobicContact CG2-CB 4.28Å
197	V	82.3	Confident	77.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140.2	178.5	-69.8	0	0	0	0	110.4	Q202 L203 L206 Y361 K362 F363 N364	V197-Q202 HydrophobicContact CG1-CG 4.23Å; V197-L203 HydrophobicContact CG1-CB 4.28Å; V197-L203 HydrophobicContact CG1-CD1 4.17Å; V197-L203 HydrophobicContact CG2-CD1 4.27Å; V197-L206 HydrophobicContact CG1-CD1 3.36Å; V197-Y361 HydrophobicContact CG1-CD1 3.9Å; V197-Y361 HydrophobicContact CG1-CE1 4.28Å; V197-Y361 HydrophobicContact CG2-CD1 4.43Å; V197-K362 PolarHBondContact N-O 2.84Å; V197-F363 HydrophobicContact CG2-CD1 4.13Å; V197-F363 HydrophobicContact CG2-CD2 3.3Å; V197-F363 HydrophobicContact CG2-CE1 4.12Å; V197-F363 HydrophobicContact CG2-CE2 3.32Å; V197-F363 HydrophobicContact CG2-CG 3.75Å; V197-F363 HydrophobicContact CG2-CZ 3.74Å; V197-F363 CarbonylContact O-C 3.55Å; V197-F363 VanDerWaalsContact O-CA 3.29Å; V197-F363 WeakPolarHBondContact O-CA 3.34Å; V197-N364 PolarHBondContact O-N 3.46Å
198	T	81	Confident	78	Confident	72 Å²	72	68.9 Å²	68.9	44%	0.442	36%	0.361	S	S	.	.	S	Bend	trans	-102.1	-21.4	178.2	61.2	0	0	0	0	112.4	Q202 N364	T198-Q202 PolarHBondContact OG1-OE1 3.37Å; T198-Q202 VanDerWaalsContact OG1-OE1 3.1Å; T198-N364 WeakPolarHBondContact CA-O 3.36Å; T198-N364 WeakPolarHBondContact CG2-O 3.28Å
199	T	78.9	Confident	78.3	Confident	67 Å²	67	70 Å²	70	41%	0.411	37%	0.369	S	S	.	.	S	Bend	trans	-140	154.6	-177.9	63.3	0	0	0	0	111.5	Q201 Q202 L203	T199-Q201 VanDerWaalsContact C-N 3.26Å; T199-Q201 PolarHBondContact O-N 3.31Å; T199-Q202 WeakPolarHBondContact O-CB 3.48Å; T199-Q202 PolarHBondContact O-N 3.16Å; T199-Q202 WeakPolarHBondContact OG1-CB 3.39Å; T199-Q202 PolarHBondContact OG1-N 3.29Å; T199-L203 PolarHBondContact O-N 3.02Å
200	Y	78.5	Confident	78.7	Confident	85 Å²	85	64.3 Å²	64.3	33%	0.333	34%	0.339	S	S	.	.	H	α-helix	trans	-61.1	-33.9	173.3	-178.6	-108.9	0	0	0	112.7	L203 I204	Y200-L203 HydrophobicContact CD2-CD2 4.19Å; Y200-L203 HydrophobicContact CE2-CD2 4.36Å; Y200-L203 WeakPolarHBondContact O-CB 3.38Å; Y200-L203 PolarHBondContact O-N 2.9Å; Y200-I204 HydrophobicContact CD1-CD1 3.75Å; Y200-I204 HydrophobicContact CD1-CG1 4.47Å; Y200-I204 HydrophobicContact CE1-CD1 3.31Å; Y200-I204 HydrophobicContact CE1-CG1 4.09Å; Y200-I204 PolarHBondContact O-N 2.69Å
201	Q	82.3	Confident	79.1	Confident	143 Å²	143	64.9 Å²	64.9	67%	0.668	34%	0.34	S	S	*	.	H	α-helix	trans	-65.5	-39.2	175.7	-68.5	-179.2	-8.5	0	0	112.4	T199 L203 I204 K205	T199-Q201 VanDerWaalsContact C-N 3.26Å; T199-Q201 PolarHBondContact O-N 3.31Å; Q201-L203 VanDerWaalsContact C-N 3.3Å; Q201-L203 PolarHBondContact O-N 2.98Å; Q201-I204 PolarHBondContact O-N 3.31Å; Q201-K205 WeakPolarHBondContact O-CG 3.4Å; Q201-K205 PolarHBondContact O-N 3.22Å
202	Q	82.8	Confident	79.7	Confident	58 Å²	58	65.9 Å²	65.9	27%	0.271	33%	0.33	S	S	.	.	H	α-helix	trans	-62.7	-40.7	174.2	-173.2	-175.1	3.1	0	0	111	V197 T198 T199 K205 L206	V197-Q202 HydrophobicContact CG1-CG 4.23Å; T198-Q202 PolarHBondContact OG1-OE1 3.37Å; T198-Q202 VanDerWaalsContact OG1-OE1 3.1Å; T199-Q202 WeakPolarHBondContact O-CB 3.48Å; T199-Q202 PolarHBondContact O-N 3.16Å; T199-Q202 WeakPolarHBondContact OG1-CB 3.39Å; T199-Q202 PolarHBondContact OG1-N 3.29Å; Q202-K205 PolarHBondContact O-N 2.86Å; Q202-L206 HydrophobicContact CG-CD1 4.34Å; Q202-L206 WeakPolarHBondContact O-CG 3.45Å; Q202-L206 PolarHBondContact O-N 2.84Å
203	L	82.4	Confident	80.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-48.5	174.5	-177	75.6	0	0	0	111.6	V197 T199 Y200 Q201 K205 L206 Q207 L238 Y241 I250 Y361 F363	V197-L203 HydrophobicContact CG1-CB 4.28Å; V197-L203 HydrophobicContact CG1-CD1 4.17Å; V197-L203 HydrophobicContact CG2-CD1 4.27Å; T199-L203 PolarHBondContact O-N 3.02Å; Y200-L203 HydrophobicContact CD2-CD2 4.19Å; Y200-L203 HydrophobicContact CE2-CD2 4.36Å; Y200-L203 WeakPolarHBondContact O-CB 3.38Å; Y200-L203 PolarHBondContact O-N 2.9Å; Q201-L203 VanDerWaalsContact C-N 3.3Å; Q201-L203 PolarHBondContact O-N 2.98Å; L203-K205 VanDerWaalsContact C-N 3.31Å; L203-K205 PolarHBondContact O-N 2.86Å; L203-L206 PolarHBondContact O-N 3.3Å; L203-Q207 HydrophobicContact CG-CG 4.44Å; L203-Q207 WeakPolarHBondContact O-CB 3.23Å; L203-Q207 WeakPolarHBondContact O-CG 3.37Å; L203-Q207 PolarHBondContact O-N 3.12Å; L203-L238 HydrophobicContact CD2-CD2 3.57Å; L203-L238 HydrophobicContact CG-CD2 4.35Å; L203-Y241 HydrophobicContact CD2-CD2 4.35Å; L203-Y241 HydrophobicContact CD2-CE2 4.42Å; L203-I250 HydrophobicContact CD1-CD1 3.59Å; L203-I250 HydrophobicContact CD2-CD1 3.67Å; L203-I250 HydrophobicContact CG-CD1 4.09Å; L203-Y361 HydrophobicContact CD1-CD1 3.66Å; L203-Y361 HydrophobicContact CD1-CD2 3.62Å; L203-Y361 HydrophobicContact CD1-CE1 3.82Å; L203-Y361 HydrophobicContact CD1-CE2 3.71Å; L203-Y361 HydrophobicContact CD1-CG 3.53Å; L203-F363 HydrophobicContact CB-CE2 4.41Å; L203-F363 HydrophobicContact CB-CZ 4.07Å; L203-F363 HydrophobicContact CD1-CE2 4.26Å; L203-F363 HydrophobicContact CD2-CE2 3.83Å; L203-F363 HydrophobicContact CD2-CZ 3.88Å; L203-F363 HydrophobicContact CG-CE2 4.39Å; L203-F363 HydrophobicContact CG-CZ 4.45Å
204	I	81	Confident	80.3	Confident	62 Å²	62	65.8 Å²	65.8	32%	0.318	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-44.1	176.5	-68.9	167.1	0	0	0	111.3	Y200 Q201 L206 Q207 N208	Y200-I204 HydrophobicContact CD1-CD1 3.75Å; Y200-I204 HydrophobicContact CD1-CG1 4.47Å; Y200-I204 HydrophobicContact CE1-CD1 3.31Å; Y200-I204 HydrophobicContact CE1-CG1 4.09Å; Y200-I204 PolarHBondContact O-N 2.69Å; Q201-I204 PolarHBondContact O-N 3.31Å; I204-L206 PolarHBondContact O-N 2.96Å; I204-Q207 PolarHBondContact O-N 2.93Å; I204-N208 PolarHBondContact O-N 3.21Å
205	K	83.6	Confident	80.5	Confident	144 Å²	144	67.8 Å²	67.8	63%	0.626	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-45.5	177.9	-74	179.8	179.8	-179.6	0	111.7	Q201 Q202 L203 Q207 N208 N209	Q201-K205 WeakPolarHBondContact O-CG 3.4Å; Q201-K205 PolarHBondContact O-N 3.22Å; Q202-K205 PolarHBondContact O-N 2.86Å; L203-K205 VanDerWaalsContact C-N 3.31Å; L203-K205 PolarHBondContact O-N 2.86Å; K205-Q207 PolarHBondContact O-N 2.93Å; K205-N208 PolarHBondContact O-N 3.33Å; K205-N209 PolarHBondContact O-N 2.9Å
206	L	83	Confident	80.2	Confident	26 Å²	26	69.4 Å²	69.4	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-44.7	176.4	-73.2	169.3	0	0	0	111.5	I193 V197 Q202 L203 I204 N208 N209 I210 Y361	I193-L206 HydrophobicContact CG2-CD2 4.43Å; V197-L206 HydrophobicContact CG1-CD1 3.36Å; Q202-L206 HydrophobicContact CG-CD1 4.34Å; Q202-L206 WeakPolarHBondContact O-CG 3.45Å; Q202-L206 PolarHBondContact O-N 2.84Å; L203-L206 PolarHBondContact O-N 3.3Å; I204-L206 PolarHBondContact O-N 2.96Å; L206-N208 VanDerWaalsContact C-N 3.28Å; L206-N208 PolarHBondContact O-N 3.18Å; L206-N209 WeakPolarHBondContact O-CB 3.23Å; L206-N209 PolarHBondContact O-N 3.04Å; L206-N209 VanDerWaalsContact O-N 3.1Å; L206-I210 VanDerWaalsContact O-CD1 3.31Å; L206-I210 WeakPolarHBondContact O-CD1 3.35Å; L206-I210 VanDerWaalsContact O-CG1 3.26Å; L206-I210 WeakPolarHBondContact O-CG1 3.44Å; L206-I210 PolarHBondContact O-N 2.65Å; L206-Y361 HydrophobicContact CB-CE1 4.36Å; L206-Y361 HydrophobicContact CD1-CE1 3.89Å
207	Q	83.1	Confident	79.4	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-39.4	176.8	-69.2	-75.6	-53.1	0	0	112	L203 I204 K205 I210 K211 L238 Y361	L203-Q207 HydrophobicContact CG-CG 4.44Å; L203-Q207 WeakPolarHBondContact O-CB 3.23Å; L203-Q207 WeakPolarHBondContact O-CG 3.37Å; L203-Q207 PolarHBondContact O-N 3.12Å; I204-Q207 PolarHBondContact O-N 2.93Å; K205-Q207 PolarHBondContact O-N 2.93Å; Q207-I210 PolarHBondContact O-N 3.08Å; Q207-K211 VanDerWaalsContact O-CG 3.32Å; Q207-K211 WeakPolarHBondContact O-CG 3.43Å; Q207-K211 PolarHBondContact O-N 3.34Å; Q207-K211 VanDerWaalsContact O-N 3.09Å; Q207-L238 HydrophobicContact CG-CD1 4.13Å; Q207-Y361 PolarHBondContact NE2-OH 3.5Å
208	N	83	Confident	78.2	Confident	73 Å²	73	74 Å²	74	39%	0.39	36%	0.36	S	S	.	.	H	α-helix	trans	-69.5	-36.4	174.4	-71.8	-22.3	0	0	0	112.9	I204 K205 L206 I210 K211 K212	I204-N208 PolarHBondContact O-N 3.21Å; K205-N208 PolarHBondContact O-N 3.33Å; L206-N208 VanDerWaalsContact C-N 3.28Å; L206-N208 PolarHBondContact O-N 3.18Å; N208-I210 VanDerWaalsContact C-N 3.34Å; N208-K211 PolarHBondContact O-N 2.77Å; N208-K212 WeakPolarHBondContact O-CG 3.2Å; N208-K212 PolarHBondContact O-N 2.91Å
209	N	82.6	Confident	77.2	Confident	84 Å²	84	73.7 Å²	73.7	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-64.1	-41.4	174.6	-72.1	-8	0	0	0	111.6	K205 L206 K212 Q213	K205-N209 PolarHBondContact O-N 2.9Å; L206-N209 WeakPolarHBondContact O-CB 3.23Å; L206-N209 PolarHBondContact O-N 3.04Å; L206-N209 VanDerWaalsContact O-N 3.1Å; N209-K212 WeakPolarHBondContact O-CB 3.3Å; N209-K212 PolarHBondContact O-N 3.44Å; N209-Q213 WeakPolarHBondContact O-CG 3.3Å; N209-Q213 PolarHBondContact O-N 2.7Å
210	I	80.2	Confident	76.5	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-48	174.6	-69.1	156.3	0	0	0	110.9	I190 I193 L206 Q207 N208 K212 Q213 I214 I252 I359 Y361	I190-I210 HydrophobicContact CD1-CG2 3.53Å; I193-I210 HydrophobicContact CD1-CD1 3.75Å; I193-I210 HydrophobicContact CD1-CG1 3.48Å; I193-I210 VanDerWaalsContact CD1-CG1 3.48Å; I193-I210 HydrophobicContact CG1-CD1 4.32Å; I193-I210 HydrophobicContact CG1-CG1 3.87Å; I193-I210 HydrophobicContact CG2-CD1 4.18Å; I193-I210 HydrophobicContact CG2-CG1 4.46Å; L206-I210 VanDerWaalsContact O-CD1 3.31Å; L206-I210 WeakPolarHBondContact O-CD1 3.35Å; L206-I210 VanDerWaalsContact O-CG1 3.26Å; L206-I210 WeakPolarHBondContact O-CG1 3.44Å; L206-I210 PolarHBondContact O-N 2.65Å; Q207-I210 PolarHBondContact O-N 3.08Å; N208-I210 VanDerWaalsContact C-N 3.34Å; I210-K212 VanDerWaalsContact C-N 3.29Å; I210-K212 PolarHBondContact O-N 2.84Å; I210-Q213 PolarHBondContact O-N 3.05Å; I210-I214 HydrophobicContact CG2-CD1 3.57Å; I210-I214 VanDerWaalsContact O-CD1 3.23Å; I210-I214 WeakPolarHBondContact O-CD1 3.07Å; I210-I214 VanDerWaalsContact O-CG1 3.28Å; I210-I214 WeakPolarHBondContact O-CG1 3.27Å; I210-I214 PolarHBondContact O-N 2.95Å; I210-I252 HydrophobicContact CB-CD1 4.38Å; I210-I252 HydrophobicContact CD1-CD1 4.4Å; I210-I252 HydrophobicContact CG2-CD1 3.73Å; I210-I359 HydrophobicContact CD1-CD1 3.26Å; I210-I359 HydrophobicContact CG1-CD1 4.21Å; I210-I359 HydrophobicContact CG2-CD1 4.31Å; I210-Y361 WeakPolarHBondContact CD1-OH 3.17Å
211	K	80.4	Confident	76	Confident	39 Å²	39	76.6 Å²	76.6	17%	0.17	37%	0.366	C	S	.	.	H	α-helix	trans	-54.3	-46.5	175.4	-70.2	174	-175	171.8	0	111.2	Q207 N208 I214 Y215 F234	Q207-K211 VanDerWaalsContact O-CG 3.32Å; Q207-K211 WeakPolarHBondContact O-CG 3.43Å; Q207-K211 PolarHBondContact O-N 3.34Å; Q207-K211 VanDerWaalsContact O-N 3.09Å; N208-K211 PolarHBondContact O-N 2.77Å; K211-I214 PolarHBondContact O-N 2.67Å; K211-Y215 VanDerWaalsContact O-CD2 3.22Å; K211-Y215 WeakPolarHBondContact O-CD2 3.49Å; K211-Y215 PolarHBondContact O-N 3.49Å; K211-F234 HydrophobicContact CB-CD1 4.2Å; K211-F234 HydrophobicContact CB-CE1 4.2Å; K211-F234 HydrophobicContact CD-CB 4.27Å; K211-F234 HydrophobicContact CD-CD1 4.32Å; K211-F234 HydrophobicContact CD-CG 4.43Å; K211-F234 HydrophobicContact CG-CB 4.49Å; K211-F234 HydrophobicContact CG-CD1 3.69Å; K211-F234 HydrophobicContact CG-CE1 4.19Å; K211-F234 HydrophobicContact CG-CG 4.29Å
212	K	79.9	Confident	76	Confident	139 Å²	139	73.2 Å²	73.2	60%	0.604	35%	0.352	S	S	*	.	H	α-helix	trans	-62.8	-45.7	177.8	-71.3	178.3	179.4	-176.7	0	112.6	N208 N209 I210 I214 Y215 L216	N208-K212 WeakPolarHBondContact O-CG 3.2Å; N208-K212 PolarHBondContact O-N 2.91Å; N209-K212 WeakPolarHBondContact O-CB 3.3Å; N209-K212 PolarHBondContact O-N 3.44Å; I210-K212 VanDerWaalsContact C-N 3.29Å; I210-K212 PolarHBondContact O-N 2.84Å; K212-I214 PolarHBondContact O-N 3.28Å; K212-Y215 PolarHBondContact O-N 3.38Å; K212-L216 WeakPolarHBondContact O-CG 3.31Å; K212-L216 PolarHBondContact O-N 3.03Å
213	Q	76.2	Confident	76.1	Confident	82 Å²	82	74.4 Å²	74.4	38%	0.383	36%	0.358	S	S	.	.	H	α-helix	trans	-59.1	-38.3	178	-76.3	-179.8	-11.2	0	0	111.7	N209 I210 L216 L217	N209-Q213 WeakPolarHBondContact O-CG 3.3Å; N209-Q213 PolarHBondContact O-N 2.7Å; I210-Q213 PolarHBondContact O-N 3.05Å; Q213-L216 WeakPolarHBondContact O-CB 3.31Å; Q213-L216 PolarHBondContact O-N 2.98Å; Q213-L217 PolarHBondContact O-N 3.46Å
214	I	73.4	Confident	76.4	Confident	21 Å²	21	81.9 Å²	81.9	11%	0.108	39%	0.39	C	S	.	.	H	α-helix	trans	-76.1	-34.6	-178.9	-62.8	155.5	0	0	0	112.1	I190 I210 K211 K212 L216 L217 Y254 I357	I190-I214 HydrophobicContact CD1-CD1 3.88Å; I190-I214 HydrophobicContact CD1-CG1 4.04Å; I210-I214 HydrophobicContact CG2-CD1 3.57Å; I210-I214 VanDerWaalsContact O-CD1 3.23Å; I210-I214 WeakPolarHBondContact O-CD1 3.07Å; I210-I214 VanDerWaalsContact O-CG1 3.28Å; I210-I214 WeakPolarHBondContact O-CG1 3.27Å; I210-I214 PolarHBondContact O-N 2.95Å; K211-I214 PolarHBondContact O-N 2.67Å; K212-I214 PolarHBondContact O-N 3.28Å; I214-L216 PolarHBondContact O-N 3.3Å; I214-L217 HydrophobicContact CB-CD1 4.39Å; I214-L217 HydrophobicContact CG1-CD1 4.21Å; I214-L217 HydrophobicContact CG2-CD1 4.42Å; I214-L217 WeakPolarHBondContact O-CB 3.28Å; I214-L217 PolarHBondContact O-N 3.24Å; I214-Y254 HydrophobicContact CB-CE1 3.97Å; I214-Y254 HydrophobicContact CD1-CD1 4.41Å; I214-Y254 HydrophobicContact CD1-CE1 3.25Å; I214-Y254 HydrophobicContact CD1-CE2 4.23Å; I214-Y254 WeakPolarHBondContact CD1-OH 3.33Å; I214-Y254 HydrophobicContact CG1-CE1 4.22Å; I214-Y254 HydrophobicContact CG2-CD1 3.84Å; I214-Y254 HydrophobicContact CG2-CE1 3.6Å; I214-I357 HydrophobicContact CD1-CD1 3.16Å; I214-I357 HydrophobicContact CG1-CD1 3.99Å
215	Y	74.3	Confident	76.6	Confident	136 Å²	136	80.6 Å²	80.6	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-57.7	-27.7	170.1	-90.8	-65.7	0	0	0	112.7	K211 K212 F234	K211-Y215 VanDerWaalsContact O-CD2 3.22Å; K211-Y215 WeakPolarHBondContact O-CD2 3.49Å; K211-Y215 PolarHBondContact O-N 3.49Å; K212-Y215 PolarHBondContact O-N 3.38Å; Y215-F234 HydrophobicContact CD1-CZ 4.26Å; Y215-F234 HydrophobicContact CD2-CE1 4.29Å; Y215-F234 HydrophobicContact CD2-CE2 4.25Å; Y215-F234 AromaticContact CD2-CZ 3.68Å; Y215-F234 HydrophobicContact CD2-CZ 3.68Å; Y215-F234 AromaticContact CE1-CE2 3.88Å; Y215-F234 HydrophobicContact CE1-CE2 3.88Å; Y215-F234 AromaticContact CE1-CZ 3.89Å; Y215-F234 HydrophobicContact CE1-CZ 3.89Å; Y215-F234 HydrophobicContact CE2-CD2 4.18Å; Y215-F234 HydrophobicContact CE2-CE1 4.05Å; Y215-F234 AromaticContact CE2-CE2 3.36Å; Y215-F234 HydrophobicContact CE2-CE2 3.36Å; Y215-F234 AromaticContact CE2-CZ 3.25Å; Y215-F234 HydrophobicContact CE2-CZ 3.25Å; Y215-F234 HydrophobicContact CG-CZ 4.18Å; Y215-F234 AromaticContact CZ-CE2 3.16Å; Y215-F234 AromaticContact CZ-CZ 3.39Å; Y215-F234 WeakPolarHBondContact OH-CE2 3.2Å
216	L	71.6	Confident	76.7	Confident	139 Å²	139	77.2 Å²	77.2	73%	0.728	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-15.8	175.8	-63.1	170.4	0	0	0	113.1	K212 Q213 I214 N218	K212-L216 WeakPolarHBondContact O-CG 3.31Å; K212-L216 PolarHBondContact O-N 3.03Å; Q213-L216 WeakPolarHBondContact O-CB 3.31Å; Q213-L216 PolarHBondContact O-N 2.98Å; I214-L216 PolarHBondContact O-N 3.3Å; L216-N218 PolarHBondContact O-N 2.87Å; L216-N218 VanDerWaalsContact O-N 3.12Å
217	L	65.9	Low	77	Confident	66 Å²	66	77.1 Å²	77.1	35%	0.346	37%	0.371	S	S	.	.	S	Bend	trans	-74.9	104.6	173.2	-62.7	169.2	0	0	0	107.9	F188 Q213 I214 S219	F188-L217 HydrophobicContact CD1-CD1 4.36Å; F188-L217 HydrophobicContact CE1-CD1 3.41Å; F188-L217 VanDerWaalsContact CE1-CD1 3.41Å; F188-L217 HydrophobicContact CE2-CD1 3.8Å; F188-L217 HydrophobicContact CZ-CD1 3.1Å; F188-L217 HydrophobicContact CZ-CD2 4.39Å; F188-L217 HydrophobicContact CZ-CG 4.35Å; Q213-L217 PolarHBondContact O-N 3.46Å; I214-L217 HydrophobicContact CB-CD1 4.39Å; I214-L217 HydrophobicContact CG1-CD1 4.21Å; I214-L217 HydrophobicContact CG2-CD1 4.42Å; I214-L217 WeakPolarHBondContact O-CB 3.28Å; I214-L217 PolarHBondContact O-N 3.24Å; L217-S219 PolarHBondContact O-N 3.42Å; L217-S219 PolarHBondContact O-OG 2.76Å; L217-S219 VanDerWaalsContact O-OG 3.13Å
218	N	57.7	Low	77.4	Confident	116 Å²	116	77 Å²	77	62%	0.62	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	3	176.9	-82.6	-10.3	0	0	0	115.9	L216 F220 Y221	L216-N218 PolarHBondContact O-N 2.87Å; L216-N218 VanDerWaalsContact O-N 3.12Å; N218-F220 PolarHBondContact O-N 3.3Å; N218-Y221 WeakPolarHBondContact CB-OH 3.3Å; N218-Y221 PolarHBondContact ND2-OH 2.86Å; N218-Y221 VanDerWaalsContact O-CE2 3.24Å; N218-Y221 WeakPolarHBondContact O-CE2 3.43Å
219	S	61.3	Low	77.8	Confident	65 Å²	65	76.1 Å²	76.1	46%	0.455	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-11.7	171.4	49	0	0	0	0	114.7	L217	L217-S219 PolarHBondContact O-N 3.42Å; L217-S219 PolarHBondContact O-OG 2.76Å; L217-S219 VanDerWaalsContact O-OG 3.13Å
220	F	63.6	Low	78.2	Confident	59 Å²	59	72.3 Å²	72.3	26%	0.259	34%	0.342	S	S	.	.			trans	-145.5	113.2	-179.6	-105.2	-67.4	0	0	0	115	N218 I232 I352 L353 Y355	N218-F220 PolarHBondContact O-N 3.3Å; F220-I232 HydrophobicContact CB-CD1 3.48Å; F220-I232 VanDerWaalsContact CB-CD1 3.48Å; F220-I232 HydrophobicContact CD1-CD1 3.51Å; F220-I232 HydrophobicContact CD1-CG1 4.35Å; F220-I232 HydrophobicContact CD2-CD1 3.54Å; F220-I232 HydrophobicContact CE1-CD1 4.15Å; F220-I232 HydrophobicContact CE2-CD1 4.14Å; F220-I232 HydrophobicContact CG-CD1 3.2Å; F220-I232 HydrophobicContact CG-CG1 4.44Å; F220-I232 HydrophobicContact CZ-CD1 4.46Å; F220-I352 HydrophobicContact CE1-CG2 3.25Å; F220-I352 HydrophobicContact CZ-CG2 3.29Å; F220-L353 WeakPolarHBondContact CE2-O 3.43Å; F220-L353 HydrophobicContact CZ-CB 4.46Å; F220-L353 WeakPolarHBondContact CZ-O 3.42Å; F220-Y355 AromaticContact CD2-CD2 3.95Å; F220-Y355 HydrophobicContact CD2-CD2 3.95Å; F220-Y355 AromaticContact CD2-CE2 3.49Å; F220-Y355 HydrophobicContact CD2-CE2 3.49Å; F220-Y355 VanDerWaalsContact CD2-CE2 3.49Å; F220-Y355 AromaticContact CE2-CD2 3.71Å; F220-Y355 HydrophobicContact CE2-CD2 3.71Å; F220-Y355 AromaticContact CE2-CE2 3.22Å; F220-Y355 HydrophobicContact CE2-CE2 3.22Å; F220-Y355 HydrophobicContact CZ-CE2 4.46Å
221	Y	67.9	Low	78.6	Confident	153 Å²	153	73 Å²	73	60%	0.6	35%	0.346	S	S	*	.			trans	-101.1	128.8	169.9	-60.6	-77	0	0	0	109.9	N218 Q223	N218-Y221 WeakPolarHBondContact CB-OH 3.3Å; N218-Y221 PolarHBondContact ND2-OH 2.86Å; N218-Y221 VanDerWaalsContact O-CE2 3.24Å; N218-Y221 WeakPolarHBondContact O-CE2 3.43Å; Y221-Q223 PolarHBondContact O-N 3.32Å
222	N	81.1	Confident	79	Confident	72 Å²	72	72.1 Å²	72.1	39%	0.385	34%	0.343	S	S	.	.			trans	-61.6	133.4	169.2	-63.6	-43.8	0	0	0	109	Y229 I230 T231	N222-Y229 HydrophobicContact CB-CE1 3.98Å; N222-Y229 HydrophobicContact CB-CE2 3.69Å; N222-Y229 WeakPolarHBondContact CB-OH 3.41Å; N222-Y229 VanDerWaalsContact CG-OH 3.23Å; N222-Y229 PolarHBondContact ND2-OH 2.86Å; N222-I230 VanDerWaalsContact CA-O 3.32Å; N222-I230 WeakPolarHBondContact CA-O 3.49Å; N222-I230 WeakPolarHBondContact CB-O 3.46Å; N222-T231 WeakPolarHBondContact OD1-CA 3.37Å; N222-T231 PolarHBondContact OD1-OG1 3.46Å; N222-T231 VanDerWaalsContact OD1-OG1 3.07Å
223	Q	85.7	Confident	79.4	Confident	83 Å²	83	67.7 Å²	67.7	39%	0.388	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.5	-179.6	-57.4	174.9	-1.9	0	0	109.3	Y221 F225 I230	Y221-Q223 PolarHBondContact O-N 3.32Å; Q223-F225 HydrophobicContact CB-CD2 4.36Å; Q223-F225 HydrophobicContact CB-CE2 3.54Å; Q223-F225 HydrophobicContact CB-CZ 4.08Å; Q223-I230 HydrophobicContact CB-CB 4.14Å; Q223-I230 HydrophobicContact CB-CD1 4.42Å; Q223-I230 HydrophobicContact CB-CG1 4.49Å; Q223-I230 PolarHBondContact N-O 3.44Å; Q223-I230 PolarHBondContact O-N 3.28Å
224	K	88	Confident	79.8	Confident	157 Å²	157	65.1 Å²	65.1	68%	0.683	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.6	179.2	-170.7	-179.5	176.4	-172.6	0	109.7	N226 Y229	K224-N226 WeakPolarHBondContact CE-O 3.29Å; K224-N226 WeakPolarHBondContact CG-O 3.44Å; K224-Y229 HydrophobicContact CB-CD2 3.84Å; K224-Y229 HydrophobicContact CB-CE2 4.27Å; K224-Y229 HydrophobicContact CG-CD2 4.12Å
225	F	85.9	Confident	80.5	Confident	36 Å²	36	66.2 Å²	66.2	16%	0.158	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	84.3	173.6	-56.8	-87.3	0	0	0	107.6	Q223 L227 L228 I230 L343 T346 F347	Q223-F225 HydrophobicContact CB-CD2 4.36Å; Q223-F225 HydrophobicContact CB-CE2 3.54Å; Q223-F225 HydrophobicContact CB-CZ 4.08Å; F225-L227 PolarHBondContact O-N 3.07Å; F225-L228 HydrophobicContact CB-CB 4.32Å; F225-L228 PolarHBondContact N-O 2.84Å; F225-L228 PolarHBondContact O-N 3.09Å; F225-I230 HydrophobicContact CD2-CD1 4.36Å; F225-I230 HydrophobicContact CD2-CG1 4.46Å; F225-I230 HydrophobicContact CE2-CD1 3.78Å; F225-I230 HydrophobicContact CE2-CG1 4.26Å; F225-L343 HydrophobicContact CB-CD1 3.73Å; F225-L343 HydrophobicContact CG-CD1 4.38Å; F225-T346 VanDerWaalsContact CE1-OG1 3.3Å; F225-T346 WeakPolarHBondContact CE1-OG1 3.06Å; F225-F347 AromaticContact CD2-CD2 3.67Å; F225-F347 HydrophobicContact CD2-CD2 3.67Å; F225-F347 HydrophobicContact CD2-CE2 4.33Å; F225-F347 AromaticContact CE2-CD2 3.96Å; F225-F347 HydrophobicContact CE2-CD2 3.96Å; F225-F347 HydrophobicContact CG-CD2 4.12Å
226	N	86.4	Confident	80.8	Confident	72 Å²	72	62.9 Å²	62.9	39%	0.385	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	-108.7	-171.3	-167.9	-9.5	0	0	0	111.8	K224 N268 I272	K224-N226 WeakPolarHBondContact CE-O 3.29Å; K224-N226 WeakPolarHBondContact CG-O 3.44Å; N226-N268 PolarHBondContact ND2-OD1 2.97Å; N226-N268 PolarHBondContact OD1-OD1 2.88Å; N226-I272 HydrophobicContact CB-CD1 3.54Å; N226-I272 HydrophobicContact CB-CG2 4.42Å
227	L	89.2	Confident	81.1	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.126	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-15	179.9	72.2	95	0	0	0	113.9	F225 P261 L264 N268 I272 Y276	F225-L227 PolarHBondContact O-N 3.07Å; L227-P261 HydrophobicContact CB-CG 4.38Å; L227-P261 HydrophobicContact CD1-CG 4.32Å; L227-L264 HydrophobicContact CD2-CD1 3.72Å; L227-N268 HydrophobicContact CD2-CB 4.12Å; L227-N268 VanDerWaalsContact CD2-CG 3.41Å; L227-N268 VanDerWaalsContact CD2-ND2 3.31Å; L227-N268 WeakPolarHBondContact CD2-ND2 3.5Å; L227-I272 HydrophobicContact CD1-CG2 4.48Å; L227-I272 HydrophobicContact CD2-CG2 3.39Å; L227-I272 HydrophobicContact CG-CG2 3.62Å; L227-Y276 HydrophobicContact CD1-CD2 3.46Å; L227-Y276 VanDerWaalsContact CD1-CD2 3.46Å; L227-Y276 HydrophobicContact CD1-CE2 4.31Å; L227-Y276 HydrophobicContact CD1-CG 4.15Å
228	L	90.3	Very high	81.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.2	176.1	-51.4	177.7	0	0	0	109	F225 I258 I260 I275 L279 L343 F347	F225-L228 HydrophobicContact CB-CB 4.32Å; F225-L228 PolarHBondContact N-O 2.84Å; F225-L228 PolarHBondContact O-N 3.09Å; L228-I258 HydrophobicContact CB-CG2 4.45Å; L228-I258 HydrophobicContact CD2-CG2 4.47Å; L228-I260 HydrophobicContact CD2-CG2 3.47Å; L228-I260 VanDerWaalsContact CD2-CG2 3.47Å; L228-I275 HydrophobicContact CD1-CB 4.31Å; L228-I275 HydrophobicContact CD1-CD1 4.37Å; L228-I275 HydrophobicContact CD1-CG2 3.56Å; L228-I275 HydrophobicContact CD2-CG2 4.14Å; L228-L279 HydrophobicContact CD2-CD1 4.18Å; L228-L343 HydrophobicContact CD1-CD1 3.73Å; L228-F347 HydrophobicContact CB-CE2 4.24Å; L228-F347 HydrophobicContact CD1-CD2 4.43Å; L228-F347 HydrophobicContact CD1-CE1 4.22Å; L228-F347 HydrophobicContact CD1-CE2 3.89Å; L228-F347 HydrophobicContact CD1-CZ 3.76Å
229	Y	91.8	Very high	81.6	Confident	53 Å²	53	56.5 Å²	56.5	21%	0.208	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	106.8	179.8	-175.1	-107.7	0	0	0	111.2	N222 K224 T231 R259	N222-Y229 HydrophobicContact CB-CE1 3.98Å; N222-Y229 HydrophobicContact CB-CE2 3.69Å; N222-Y229 WeakPolarHBondContact CB-OH 3.41Å; N222-Y229 VanDerWaalsContact CG-OH 3.23Å; N222-Y229 PolarHBondContact ND2-OH 2.86Å; K224-Y229 HydrophobicContact CB-CD2 3.84Å; K224-Y229 HydrophobicContact CB-CE2 4.27Å; K224-Y229 HydrophobicContact CG-CD2 4.12Å; Y229-T231 HydrophobicContact CD1-CG2 4.28Å; Y229-T231 PolarHBondContact O-N 3.43Å; Y229-R259 HydrophobicContact CD1-CB 4.37Å; Y229-R259 PolarHBondContact N-O 2.86Å; Y229-R259 WeakPolarHBondContact O-CB 3.47Å; Y229-R259 PolarHBondContact O-N 3.47Å
230	I	90.6	Very high	81.6	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123.9	173.3	-58.4	-171.6	0	0	0	108.3	N222 Q223 F225 I258 F347 P349 I352	N222-I230 VanDerWaalsContact CA-O 3.32Å; N222-I230 WeakPolarHBondContact CA-O 3.49Å; N222-I230 WeakPolarHBondContact CB-O 3.46Å; Q223-I230 HydrophobicContact CB-CB 4.14Å; Q223-I230 HydrophobicContact CB-CD1 4.42Å; Q223-I230 HydrophobicContact CB-CG1 4.49Å; Q223-I230 PolarHBondContact N-O 3.44Å; Q223-I230 PolarHBondContact O-N 3.28Å; F225-I230 HydrophobicContact CD2-CD1 4.36Å; F225-I230 HydrophobicContact CD2-CG1 4.46Å; F225-I230 HydrophobicContact CE2-CD1 3.78Å; F225-I230 HydrophobicContact CE2-CG1 4.26Å; I230-I258 HydrophobicContact CG1-CG1 3.98Å; I230-F347 HydrophobicContact CD1-CD2 4.14Å; I230-F347 HydrophobicContact CD1-CE2 4.09Å; I230-F347 HydrophobicContact CG1-CE2 4.23Å; I230-P349 HydrophobicContact CD1-CB 4.4Å; I230-I352 HydrophobicContact CB-CD1 4.42Å; I230-I352 HydrophobicContact CD1-CD1 3.7Å; I230-I352 HydrophobicContact CG2-CD1 3.27Å
231	T	90.3	Very high	81.4	Confident	16 Å²	16	60.7 Å²	60.7	10%	0.098	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	169.5	-177.4	-164.6	0	0	0	0	111.7	N222 Y229 C256 Y257 R259 Y329	N222-T231 WeakPolarHBondContact OD1-CA 3.37Å; N222-T231 PolarHBondContact OD1-OG1 3.46Å; N222-T231 VanDerWaalsContact OD1-OG1 3.07Å; Y229-T231 HydrophobicContact CD1-CG2 4.28Å; Y229-T231 PolarHBondContact O-N 3.43Å; T231-C256 CarbonylContact O-C 3.55Å; T231-C256 WeakPolarHBondContact O-CA 3.43Å; T231-Y257 PolarHBondContact N-O 2.93Å; T231-Y257 PolarHBondContact O-N 3.15Å; T231-R259 HydrophobicContact CG2-CB 4.35Å; T231-Y329 HydrophobicContact CG2-CD1 4.33Å; T231-Y329 HydrophobicContact CG2-CE1 4.1Å
232	I	86.9	Confident	80.9	Confident	20 Å²	20	58.5 Å²	58.5	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.5	177	-67.6	165.5	0	0	0	110.5	F220 F234 I255	F220-I232 HydrophobicContact CB-CD1 3.48Å; F220-I232 VanDerWaalsContact CB-CD1 3.48Å; F220-I232 HydrophobicContact CD1-CD1 3.51Å; F220-I232 HydrophobicContact CD1-CG1 4.35Å; F220-I232 HydrophobicContact CD2-CD1 3.54Å; F220-I232 HydrophobicContact CE1-CD1 4.15Å; F220-I232 HydrophobicContact CE2-CD1 4.14Å; F220-I232 HydrophobicContact CG-CD1 3.2Å; F220-I232 HydrophobicContact CG-CG1 4.44Å; F220-I232 HydrophobicContact CZ-CD1 4.46Å; I232-F234 HydrophobicContact CB-CE2 4.34Å; I232-F234 HydrophobicContact CG2-CD2 4.25Å; I232-F234 HydrophobicContact CG2-CE2 3.72Å; I232-F234 HydrophobicContact CG2-CZ 4.08Å; I232-I255 WeakPolarHBondContact CA-O 3.5Å
233	K	88.9	Confident	80	Confident	47 Å²	47	62.7 Å²	62.7	20%	0.204	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	149.5	168.9	-64.6	-64.8	-172.8	177.8	0	111	I255 Y257 F322 Y329	K233-I255 PolarHBondContact N-O 2.83Å; K233-I255 PolarHBondContact O-N 2.74Å; K233-Y257 HydrophobicContact CB-CD2 3.67Å; K233-Y257 HydrophobicContact CB-CE2 3.89Å; K233-Y257 HydrophobicContact CB-CG 4.47Å; K233-Y257 HydrophobicContact CG-CD2 3.75Å; K233-Y257 HydrophobicContact CG-CE2 4.34Å; K233-Y257 HydrophobicContact CG-CG 4.07Å; K233-F322 HydrophobicContact CB-CD1 4.31Å; K233-F322 HydrophobicContact CB-CD2 3.75Å; K233-F322 HydrophobicContact CB-CE1 4.01Å; K233-F322 HydrophobicContact CB-CE2 3.4Å; K233-F322 VanDerWaalsContact CB-CE2 3.4Å; K233-F322 HydrophobicContact CB-CG 4.2Å; K233-F322 HydrophobicContact CB-CZ 3.55Å; K233-F322 HydrophobicContact CD-CD1 4.21Å; K233-F322 HydrophobicContact CD-CG 4.25Å; K233-F322 HydrophobicContact CG-CD1 4.31Å; K233-F322 HydrophobicContact CG-CD2 3.84Å; K233-F322 HydrophobicContact CG-CE1 4.49Å; K233-F322 HydrophobicContact CG-CE2 4.05Å; K233-F322 HydrophobicContact CG-CG 3.98Å; K233-F322 HydrophobicContact CG-CZ 4.37Å; K233-Y329 HydrophobicContact CD-CE1 4.48Å; K233-Y329 HydrophobicContact CG-CD1 4.49Å; K233-Y329 PolarHBondContact NZ-OH 3.14Å; K233-Y329 VanDerWaalsContact NZ-OH 3.15Å
234	F	85.7	Confident	79.2	Confident	27 Å²	27	61.1 Å²	61.1	12%	0.118	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.2	-173.1	-56.9	-116.3	0	0	0	107.8	K211 Y215 I232 N253 Y254	K211-F234 HydrophobicContact CB-CD1 4.2Å; K211-F234 HydrophobicContact CB-CE1 4.2Å; K211-F234 HydrophobicContact CD-CB 4.27Å; K211-F234 HydrophobicContact CD-CD1 4.32Å; K211-F234 HydrophobicContact CD-CG 4.43Å; K211-F234 HydrophobicContact CG-CB 4.49Å; K211-F234 HydrophobicContact CG-CD1 3.69Å; K211-F234 HydrophobicContact CG-CE1 4.19Å; K211-F234 HydrophobicContact CG-CG 4.29Å; Y215-F234 HydrophobicContact CD1-CZ 4.26Å; Y215-F234 HydrophobicContact CD2-CE1 4.29Å; Y215-F234 HydrophobicContact CD2-CE2 4.25Å; Y215-F234 AromaticContact CD2-CZ 3.68Å; Y215-F234 HydrophobicContact CD2-CZ 3.68Å; Y215-F234 AromaticContact CE1-CE2 3.88Å; Y215-F234 HydrophobicContact CE1-CE2 3.88Å; Y215-F234 AromaticContact CE1-CZ 3.89Å; Y215-F234 HydrophobicContact CE1-CZ 3.89Å; Y215-F234 HydrophobicContact CE2-CD2 4.18Å; Y215-F234 HydrophobicContact CE2-CE1 4.05Å; Y215-F234 AromaticContact CE2-CE2 3.36Å; Y215-F234 HydrophobicContact CE2-CE2 3.36Å; Y215-F234 AromaticContact CE2-CZ 3.25Å; Y215-F234 HydrophobicContact CE2-CZ 3.25Å; Y215-F234 HydrophobicContact CG-CZ 4.18Å; Y215-F234 AromaticContact CZ-CE2 3.16Å; Y215-F234 AromaticContact CZ-CZ 3.39Å; Y215-F234 WeakPolarHBondContact OH-CE2 3.2Å; I232-F234 HydrophobicContact CB-CE2 4.34Å; I232-F234 HydrophobicContact CG2-CD2 4.25Å; I232-F234 HydrophobicContact CG2-CE2 3.72Å; I232-F234 HydrophobicContact CG2-CZ 4.08Å; F234-N253 WeakPolarHBondContact CA-O 3.36Å; F234-Y254 AromaticContact CD1-CD1 3.49Å; F234-Y254 HydrophobicContact CD1-CD1 3.49Å; F234-Y254 VanDerWaalsContact CD1-CD1 3.49Å; F234-Y254 AromaticContact CD1-CE1 3.27Å; F234-Y254 HydrophobicContact CD1-CE1 3.27Å; F234-Y254 HydrophobicContact CD1-CG 4.44Å; F234-Y254 AromaticContact CE1-CD1 3.29Å; F234-Y254 HydrophobicContact CE1-CD1 3.29Å; F234-Y254 AromaticContact CE1-CE1 3.13Å; F234-Y254 HydrophobicContact CE1-CE1 3.13Å; F234-Y254 HydrophobicContact CG-CD1 4.49Å; F234-Y254 HydrophobicContact CZ-CD1 4.02Å; F234-Y254 HydrophobicContact CZ-CE1 4.21Å
235	Y	86.7	Confident	78.4	Confident	44 Å²	44	57.9 Å²	57.9	17%	0.173	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	159.2	165.7	62.1	-86.4	0	0	0	109.4	N253 I255 K320 F322	Y235-N253 HydrophobicContact CD1-CB 4.2Å; Y235-N253 HydrophobicContact CD2-CB 4.2Å; Y235-N253 HydrophobicContact CE1-CB 3.77Å; Y235-N253 HydrophobicContact CE2-CB 3.75Å; Y235-N253 WeakPolarHBondContact CE2-ND2 3.49Å; Y235-N253 HydrophobicContact CG-CB 4.41Å; Y235-N253 VanDerWaalsContact CZ-CB 3.49Å; Y235-N253 PolarHBondContact N-O 3.38Å; Y235-N253 PolarHBondContact O-N 3.4Å; Y235-I255 HydrophobicContact CD1-CG1 4.46Å; Y235-I255 HydrophobicContact CE1-CB 4.21Å; Y235-I255 HydrophobicContact CE1-CG1 3.44Å; Y235-I255 VanDerWaalsContact CE1-CG1 3.44Å; Y235-K320 HydrophobicContact CD1-CB 4.06Å; Y235-K320 HydrophobicContact CD1-CG 4.16Å; Y235-K320 HydrophobicContact CE1-CB 4.03Å; Y235-K320 HydrophobicContact CG-CB 4.37Å; Y235-K320 HydrophobicContact CG-CG 4.14Å; Y235-F322 HydrophobicContact CD1-CE2 4.24Å; Y235-F322 AromaticContact CD1-CZ 3.98Å; Y235-F322 HydrophobicContact CD1-CZ 3.98Å
236	H	81.3	Confident	78	Confident	67 Å²	67	59.8 Å²	59.8	31%	0.31	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158.6	-178.9	50.9	48.9	0	0	0	110.1	L238 Q251 I252	H236-L238 HydrophobicContact CB-CG 4.12Å; H236-L238 VanDerWaalsContact CE1-CD1 3.48Å; H236-L238 WeakPolarHBondContact CE1-CD1 3.35Å; H236-L238 VanDerWaalsContact ND1-CB 3.35Å; H236-L238 WeakPolarHBondContact ND1-CB 3.4Å; H236-L238 WeakPolarHBondContact ND1-CG 3.34Å; H236-L238 PolarHBondContact ND1-N 3.35Å; H236-L238 PolarHBondContact O-N 2.78Å; H236-Q251 WeakPolarHBondContact CA-O 3.42Å; H236-I252 HydrophobicContact CB-CG1 4.42Å
237	N	77.2	Confident	77.8	Confident	75 Å²	75	62 Å²	62	40%	0.401	31%	0.309	S	S	.	.			trans	-83.9	21.3	174	69.6	-22.5	0	0	0	113.6	T239 I250 Q251	N237-T239 PolarHBondContact O-N 2.76Å; N237-I250 WeakPolarHBondContact OD1-CA 3.33Å; N237-Q251 PolarHBondContact N-O 3.48Å; N237-Q251 PolarHBondContact OD1-N 2.66Å; N237-Q251 PolarHBondContact OD1-O 2.74Å
238	L	69.9	Low	77.4	Confident	23 Å²	23	62 Å²	62	12%	0.12	31%	0.308	C	S	.	.			trans	-58.1	113.1	177.3	-66.5	177.5	0	0	0	111.1	L203 Q207 H236 Y241 I250	L203-L238 HydrophobicContact CD2-CD2 3.57Å; L203-L238 HydrophobicContact CG-CD2 4.35Å; Q207-L238 HydrophobicContact CG-CD1 4.13Å; H236-L238 HydrophobicContact CB-CG 4.12Å; H236-L238 VanDerWaalsContact CE1-CD1 3.48Å; H236-L238 WeakPolarHBondContact CE1-CD1 3.35Å; H236-L238 VanDerWaalsContact ND1-CB 3.35Å; H236-L238 WeakPolarHBondContact ND1-CB 3.4Å; H236-L238 WeakPolarHBondContact ND1-CG 3.34Å; H236-L238 PolarHBondContact ND1-N 3.35Å; H236-L238 PolarHBondContact O-N 2.78Å; L238-Y241 HydrophobicContact CD2-CE2 3.94Å; L238-I250 HydrophobicContact CD2-CB 4.26Å; L238-I250 HydrophobicContact CD2-CD1 3.28Å; L238-I250 HydrophobicContact CD2-CG1 3.66Å; L238-I250 HydrophobicContact CD2-CG2 3.59Å; L238-I250 HydrophobicContact CG-CG2 4.11Å
239	T	64.3	Low	77	Confident	88 Å²	88	66.2 Å²	66.2	54%	0.54	33%	0.33	S	S	.	.			trans	-100.4	161.5	161.1	53.1	0	0	0	0	109.1	N237 Y241	N237-T239 PolarHBondContact O-N 2.76Å; T239-Y241 VanDerWaalsContact O-CD2 3.23Å; T239-Y241 WeakPolarHBondContact O-CD2 3.22Å; T239-Y241 WeakPolarHBondContact O-CE2 3.48Å; T239-Y241 PolarHBondContact O-N 3.47Å; T239-Y241 VanDerWaalsContact O-N 3.1Å; T239-Y241 WeakPolarHBondContact OG1-CE1 3.3Å
240	Q	61.7	Low	76.6	Confident	168 Å²	168	63.7 Å²	63.7	79%	0.785	32%	0.32	S	S	*	.			trans	-64.2	114.5	172.3	-77.7	-178.6	-18.4	0	0	108.7
241	Y	60	Low	76.3	Confident	44 Å²	44	66 Å²	66	17%	0.173	33%	0.331	C	S	.	.			trans	-92	119.6	179.4	-61	-63.3	0	0	0	109.8	L203 L238 T239 Y248 I250 F363	L203-Y241 HydrophobicContact CD2-CD2 4.35Å; L203-Y241 HydrophobicContact CD2-CE2 4.42Å; L238-Y241 HydrophobicContact CD2-CE2 3.94Å; T239-Y241 VanDerWaalsContact O-CD2 3.23Å; T239-Y241 WeakPolarHBondContact O-CD2 3.22Å; T239-Y241 WeakPolarHBondContact O-CE2 3.48Å; T239-Y241 PolarHBondContact O-N 3.47Å; T239-Y241 VanDerWaalsContact O-N 3.1Å; T239-Y241 WeakPolarHBondContact OG1-CE1 3.3Å; Y241-Y248 AromaticContact CD1-CD1 3.2Å; Y241-Y248 HydrophobicContact CD1-CD1 3.2Å; Y241-Y248 AromaticContact CD1-CE1 3.14Å; Y241-Y248 HydrophobicContact CD1-CE1 3.14Å; Y241-Y248 HydrophobicContact CD1-CE2 4.46Å; Y241-Y248 AromaticContact CD1-CG 3.92Å; Y241-Y248 HydrophobicContact CD1-CG 3.92Å; Y241-Y248 AromaticContact CD1-CZ 3.79Å; Y241-Y248 HydrophobicContact CD2-CD1 4.41Å; Y241-Y248 HydrophobicContact CD2-CG 4.35Å; Y241-Y248 AromaticContact CE1-CD1 3.34Å; Y241-Y248 HydrophobicContact CE1-CD1 3.34Å; Y241-Y248 AromaticContact CE1-CE1 3.73Å; Y241-Y248 HydrophobicContact CE1-CE1 3.73Å; Y241-Y248 HydrophobicContact CE1-CG 4.08Å; Y241-Y248 AromaticContact CG-CD1 3.77Å; Y241-Y248 HydrophobicContact CG-CD1 3.77Å; Y241-Y248 HydrophobicContact CG-CD2 4.32Å; Y241-Y248 AromaticContact CG-CE1 3.74Å; Y241-Y248 HydrophobicContact CG-CE1 3.74Å; Y241-Y248 HydrophobicContact CG-CE2 4.26Å; Y241-Y248 HydrophobicContact CG-CG 4.04Å; Y241-Y248 AromaticContact CG-CZ 3.95Å; Y241-I250 HydrophobicContact CE2-CD1 3.98Å; Y241-I250 HydrophobicContact CE2-CG1 4.2Å; Y241-F363 HydrophobicContact CD2-CE2 4.39Å
242	T	57.2	Low	76.1	Confident	107 Å²	107	65.2 Å²	65.2	66%	0.656	33%	0.326	S	S	*	.			trans	-97.1	-16.9	-176.1	47.8	0	0	0	0	113.6
243	Y	61.7	Low	76.1	Confident	160 Å²	160	64.9 Å²	64.9	63%	0.627	33%	0.325	S	S	*	.			trans	-101.8	121.6	-169.1	-51.2	-77.1	0	0	0	112.7	N246 Y248	Y243-N246 WeakPolarHBondContact CB-ND2 3.34Å; Y243-Y248 WeakPolarHBondContact CB-OH 3.24Å; Y243-Y248 PolarHBondContact N-OH 3.25Å; Y243-Y248 WeakPolarHBondContact O-CE2 3.29Å; Y243-Y248 PolarHBondContact O-OH 3.49Å
244	C	69.1	Low	76	Confident	50 Å²	50	63 Å²	63	34%	0.338	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	157	174.7	-60.6	0	0	0	0	111.5	N246 C365	C244-N246 PolarHBondContact O-N 3.46Å; C244-C365 VanDerWaalsContact CA-SG 3.58Å; C244-C365 HydrophobicContact CB-CB 4.06Å; C244-C365 WeakPolarHBondContact CB-SG 3.3Å; C244-C365 WeakPolarHBondContact SG-CB 3.32Å; C244-C365 CovalentContact SG-SG 2.05Å; C244-C365 PolarHBondContact SG-SG 3.17Å
245	N	70.5	Confident	76.2	Confident	90 Å²	90	61.7 Å²	61.7	48%	0.481	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	11.6	-178.4	-62.9	-23	0	0	0	116.2	F363 N364	N245-F363 WeakPolarHBondContact CA-O 3.07Å; N245-F363 PolarHBondContact N-O 3.39Å; N245-N364 PolarHBondContact OD1-OD1 3.12Å
246	N	78.8	Confident	76.3	Confident	76 Å²	76	59.6 Å²	59.6	41%	0.406	30%	0.303	S	S	.	.			trans	-92.5	154	175.7	-74.6	-12.5	0	0	0	112.8	Y243 C244 Y248 F363	Y243-N246 WeakPolarHBondContact CB-ND2 3.34Å; C244-N246 PolarHBondContact O-N 3.46Å; N246-Y248 HydrophobicContact CB-CD2 4.38Å; N246-Y248 HydrophobicContact CB-CE1 4.48Å; N246-Y248 HydrophobicContact CB-CE2 3.71Å; N246-F363 PolarHBondContact O-N 3.05Å; N246-F363 VanDerWaalsContact O-N 3.07Å
247	I	81.3	Confident	76.9	Confident	117 Å²	117	56.4 Å²	56.4	60%	0.6	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.7	171	-60.5	174.3	0	0	0	108.2	K360 Y361	I247-K360 HydrophobicContact CG2-CB 4.05Å; I247-Y361 CarbonylContact C-O 3.57Å; I247-Y361 VanDerWaalsContact CA-O 3.32Å; I247-Y361 WeakPolarHBondContact CA-O 3.41Å
248	Y	80.5	Confident	77.7	Confident	26 Å²	26	52.9 Å²	52.9	10%	0.102	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.4	179	-66.4	-75.4	0	0	0	110.5	Y241 Y243 N246 K360 Y361 F363	Y241-Y248 AromaticContact CD1-CD1 3.2Å; Y241-Y248 HydrophobicContact CD1-CD1 3.2Å; Y241-Y248 AromaticContact CD1-CE1 3.14Å; Y241-Y248 HydrophobicContact CD1-CE1 3.14Å; Y241-Y248 HydrophobicContact CD1-CE2 4.46Å; Y241-Y248 AromaticContact CD1-CG 3.92Å; Y241-Y248 HydrophobicContact CD1-CG 3.92Å; Y241-Y248 AromaticContact CD1-CZ 3.79Å; Y241-Y248 HydrophobicContact CD2-CD1 4.41Å; Y241-Y248 HydrophobicContact CD2-CG 4.35Å; Y241-Y248 AromaticContact CE1-CD1 3.34Å; Y241-Y248 HydrophobicContact CE1-CD1 3.34Å; Y241-Y248 AromaticContact CE1-CE1 3.73Å; Y241-Y248 HydrophobicContact CE1-CE1 3.73Å; Y241-Y248 HydrophobicContact CE1-CG 4.08Å; Y241-Y248 AromaticContact CG-CD1 3.77Å; Y241-Y248 HydrophobicContact CG-CD1 3.77Å; Y241-Y248 HydrophobicContact CG-CD2 4.32Å; Y241-Y248 AromaticContact CG-CE1 3.74Å; Y241-Y248 HydrophobicContact CG-CE1 3.74Å; Y241-Y248 HydrophobicContact CG-CE2 4.26Å; Y241-Y248 HydrophobicContact CG-CG 4.04Å; Y241-Y248 AromaticContact CG-CZ 3.95Å; Y243-Y248 WeakPolarHBondContact CB-OH 3.24Å; Y243-Y248 PolarHBondContact N-OH 3.25Å; Y243-Y248 WeakPolarHBondContact O-CE2 3.29Å; Y243-Y248 PolarHBondContact O-OH 3.49Å; N246-Y248 HydrophobicContact CB-CD2 4.38Å; N246-Y248 HydrophobicContact CB-CE1 4.48Å; N246-Y248 HydrophobicContact CB-CE2 3.71Å; Y248-K360 CarbonylContact O-C 3.59Å; Y248-K360 WeakPolarHBondContact O-CA 3.17Å; Y248-Y361 PolarHBondContact N-O 2.76Å; Y248-Y361 PolarHBondContact O-N 2.94Å; Y248-F363 HydrophobicContact CD2-CB 4.22Å; Y248-F363 AromaticContact CD2-CD2 3.6Å; Y248-F363 HydrophobicContact CD2-CD2 3.6Å; Y248-F363 HydrophobicContact CD2-CE2 4.34Å; Y248-F363 HydrophobicContact CD2-CG 4.21Å; Y248-F363 HydrophobicContact CE2-CB 4.02Å; Y248-F363 AromaticContact CE2-CD2 3.98Å; Y248-F363 HydrophobicContact CE2-CD2 3.98Å; Y248-F363 HydrophobicContact CE2-CG 4.16Å
249	N	82.8	Confident	78.9	Confident	87 Å²	87	54.8 Å²	54.8	47%	0.465	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	108.2	174.4	-65.4	-22.3	0	0	0	108.9	I358 K360	N249-I358 HydrophobicContact CB-CG2 4.36Å; N249-K360 VanDerWaalsContact OD1-CG 3.26Å; N249-K360 WeakPolarHBondContact OD1-CG 3.24Å
250	I	82.9	Confident	80.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.3	-179.4	-65.6	165.9	0	0	0	108	L203 N237 L238 Y241 I358 I359 Y361	L203-I250 HydrophobicContact CD1-CD1 3.59Å; L203-I250 HydrophobicContact CD2-CD1 3.67Å; L203-I250 HydrophobicContact CG-CD1 4.09Å; N237-I250 WeakPolarHBondContact OD1-CA 3.33Å; L238-I250 HydrophobicContact CD2-CB 4.26Å; L238-I250 HydrophobicContact CD2-CD1 3.28Å; L238-I250 HydrophobicContact CD2-CG1 3.66Å; L238-I250 HydrophobicContact CD2-CG2 3.59Å; L238-I250 HydrophobicContact CG-CG2 4.11Å; Y241-I250 HydrophobicContact CE2-CD1 3.98Å; Y241-I250 HydrophobicContact CE2-CG1 4.2Å; I250-I358 WeakPolarHBondContact O-CA 3.45Å; I250-I359 PolarHBondContact N-O 3.18Å; I250-I359 PolarHBondContact O-N 2.93Å; I250-Y361 HydrophobicContact CB-CD2 4.16Å; I250-Y361 HydrophobicContact CB-CE2 4.2Å; I250-Y361 HydrophobicContact CD1-CD2 3.44Å; I250-Y361 VanDerWaalsContact CD1-CD2 3.44Å; I250-Y361 HydrophobicContact CD1-CE2 3.89Å; I250-Y361 HydrophobicContact CD1-CG 4.27Å; I250-Y361 HydrophobicContact CG1-CD2 4.15Å
251	Q	85.6	Confident	81.8	Confident	54 Å²	54	43.9 Å²	43.9	25%	0.252	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	122.7	174.7	-179	171.5	-27.8	0	0	109.2	H236 N237 N253 Y356 I357 I358	H236-Q251 WeakPolarHBondContact CA-O 3.42Å; N237-Q251 PolarHBondContact N-O 3.48Å; N237-Q251 PolarHBondContact OD1-N 2.66Å; N237-Q251 PolarHBondContact OD1-O 2.74Å; Q251-N253 PolarHBondContact NE2-OD1 2.81Å; Q251-Y356 HydrophobicContact CG-CD2 4.18Å; Q251-I357 CarbonylContact C-O 3.46Å; Q251-I357 VanDerWaalsContact CA-O 3.3Å; Q251-I357 WeakPolarHBondContact CA-O 3.49Å; Q251-I358 HydrophobicContact CB-CG1 4.38Å; Q251-I358 HydrophobicContact CG-CG1 4.42Å
252	I	85.8	Confident	83.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.8	168.9	-45.6	172.7	0	0	0	107.3	I210 H236 Y254 Y356 I357 I359	I210-I252 HydrophobicContact CB-CD1 4.38Å; I210-I252 HydrophobicContact CD1-CD1 4.4Å; I210-I252 HydrophobicContact CG2-CD1 3.73Å; H236-I252 HydrophobicContact CB-CG1 4.42Å; I252-Y254 HydrophobicContact CB-CE2 3.72Å; I252-Y254 HydrophobicContact CG2-CD2 4.5Å; I252-Y254 HydrophobicContact CG2-CE2 3.59Å; I252-Y254 VanDerWaalsContact CG2-OH 3.26Å; I252-Y254 WeakPolarHBondContact CG2-OH 3.44Å; I252-Y254 VanDerWaalsContact O-CE2 3.3Å; I252-Y254 WeakPolarHBondContact O-CE2 3.35Å; I252-Y356 CarbonylContact O-C 3.57Å; I252-Y356 WeakPolarHBondContact O-CA 3.36Å; I252-I357 PolarHBondContact N-O 3.37Å; I252-I357 PolarHBondContact O-N 3.09Å; I252-I359 HydrophobicContact CD1-CD1 4Å
253	N	86.9	Confident	84.6	Confident	13 Å²	13	45.3 Å²	45.3	7%	0.07	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.7	177.9	-64	-52.1	0	0	0	110.4	F234 Y235 Q251 I255	F234-N253 WeakPolarHBondContact CA-O 3.36Å; Y235-N253 HydrophobicContact CD1-CB 4.2Å; Y235-N253 HydrophobicContact CD2-CB 4.2Å; Y235-N253 HydrophobicContact CE1-CB 3.77Å; Y235-N253 HydrophobicContact CE2-CB 3.75Å; Y235-N253 WeakPolarHBondContact CE2-ND2 3.49Å; Y235-N253 HydrophobicContact CG-CB 4.41Å; Y235-N253 VanDerWaalsContact CZ-CB 3.49Å; Y235-N253 PolarHBondContact N-O 3.38Å; Y235-N253 PolarHBondContact O-N 3.4Å; Q251-N253 PolarHBondContact NE2-OD1 2.81Å; N253-I255 HydrophobicContact CB-CD1 4.17Å; N253-I255 HydrophobicContact CB-CG1 4.05Å
254	Y	86.5	Confident	85.7	Confident	6 Å²	6	40.1 Å²	40.1	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	91.7	-176.8	-58.8	-104.3	0	0	0	106.6	I214 F234 I252 N354 Y355 I357	I214-Y254 HydrophobicContact CB-CE1 3.97Å; I214-Y254 HydrophobicContact CD1-CD1 4.41Å; I214-Y254 HydrophobicContact CD1-CE1 3.25Å; I214-Y254 HydrophobicContact CD1-CE2 4.23Å; I214-Y254 WeakPolarHBondContact CD1-OH 3.33Å; I214-Y254 HydrophobicContact CG1-CE1 4.22Å; I214-Y254 HydrophobicContact CG2-CD1 3.84Å; I214-Y254 HydrophobicContact CG2-CE1 3.6Å; F234-Y254 AromaticContact CD1-CD1 3.49Å; F234-Y254 HydrophobicContact CD1-CD1 3.49Å; F234-Y254 VanDerWaalsContact CD1-CD1 3.49Å; F234-Y254 AromaticContact CD1-CE1 3.27Å; F234-Y254 HydrophobicContact CD1-CE1 3.27Å; F234-Y254 HydrophobicContact CD1-CG 4.44Å; F234-Y254 AromaticContact CE1-CD1 3.29Å; F234-Y254 HydrophobicContact CE1-CD1 3.29Å; F234-Y254 AromaticContact CE1-CE1 3.13Å; F234-Y254 HydrophobicContact CE1-CE1 3.13Å; F234-Y254 HydrophobicContact CG-CD1 4.49Å; F234-Y254 HydrophobicContact CZ-CD1 4.02Å; F234-Y254 HydrophobicContact CZ-CE1 4.21Å; I252-Y254 HydrophobicContact CB-CE2 3.72Å; I252-Y254 HydrophobicContact CG2-CD2 4.5Å; I252-Y254 HydrophobicContact CG2-CE2 3.59Å; I252-Y254 VanDerWaalsContact CG2-OH 3.26Å; I252-Y254 WeakPolarHBondContact CG2-OH 3.44Å; I252-Y254 VanDerWaalsContact O-CE2 3.3Å; I252-Y254 WeakPolarHBondContact O-CE2 3.35Å; Y254-N354 WeakPolarHBondContact O-CA 3.38Å; Y254-Y355 WeakPolarHBondContact CB-O 3.34Å; Y254-Y355 WeakPolarHBondContact CD2-O 3.26Å; Y254-Y355 PolarHBondContact N-O 3.22Å; Y254-Y355 PolarHBondContact O-N 3.23Å; Y254-I357 HydrophobicContact CD2-CG1 4.31Å; Y254-I357 HydrophobicContact CE2-CB 4.03Å; Y254-I357 HydrophobicContact CE2-CD1 3.65Å; Y254-I357 HydrophobicContact CE2-CG1 3.59Å
255	I	88.7	Confident	86.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135	-168.6	-57.1	-50.4	0	0	0	109.2	Y181 L185 I232 K233 Y235 N253 Y257 N354	Y181-I255 HydrophobicContact CD1-CD1 4.05Å; Y181-I255 HydrophobicContact CD1-CG1 4.31Å; Y181-I255 HydrophobicContact CD1-CG2 3.52Å; Y181-I255 HydrophobicContact CE1-CG2 3.27Å; Y181-I255 HydrophobicContact CG-CD1 3.93Å; Y181-I255 HydrophobicContact CG-CG1 4.32Å; Y181-I255 HydrophobicContact CG-CG2 4.3Å; L185-I255 HydrophobicContact CD2-CD1 3.38Å; I232-I255 WeakPolarHBondContact CA-O 3.5Å; K233-I255 PolarHBondContact N-O 2.83Å; K233-I255 PolarHBondContact O-N 2.74Å; Y235-I255 HydrophobicContact CD1-CG1 4.46Å; Y235-I255 HydrophobicContact CE1-CB 4.21Å; Y235-I255 HydrophobicContact CE1-CG1 3.44Å; Y235-I255 VanDerWaalsContact CE1-CG1 3.44Å; N253-I255 HydrophobicContact CB-CD1 4.17Å; N253-I255 HydrophobicContact CB-CG1 4.05Å; I255-Y257 HydrophobicContact CB-CD2 4.37Å; I255-Y257 HydrophobicContact CB-CE2 3.81Å; I255-Y257 HydrophobicContact CG2-CD2 4.08Å; I255-Y257 HydrophobicContact CG2-CE2 3.52Å; I255-Y257 WeakPolarHBondContact O-CD2 3.2Å; I255-N354 WeakPolarHBondContact CA-OD1 3.35Å; I255-N354 HydrophobicContact CD1-CB 3.87Å
256	C	90.3	Very high	86	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.1	172.4	179.7	0	0	0	0	111.2	T231 C332 I352 N354	T231-C256 CarbonylContact O-C 3.55Å; T231-C256 WeakPolarHBondContact O-CA 3.43Å; C256-C332 HydrophobicContact CB-CB 3.55Å; C256-C332 WeakPolarHBondContact CB-SG 3.4Å; C256-C332 PolarHBondContact O-N 3.47Å; C256-C332 PolarHBondContact O-SG 2.86Å; C256-C332 VanDerWaalsContact O-SG 3.34Å; C256-C332 WeakPolarHBondContact SG-CB 3.45Å; C256-C332 CovalentContact SG-SG 2.04Å; C256-C332 PolarHBondContact SG-SG 3.38Å; C256-I352 HydrophobicContact CB-CB 4.21Å; C256-I352 HydrophobicContact CB-CG2 3.72Å; C256-I352 VanDerWaalsContact SG-CG2 3.57Å; C256-N354 PolarHBondContact N-OD1 2.96Å
257	Y	94.2	Very high	85.3	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.8	170	-76.1	-102.5	0	0	0	110.3	Y181 T231 K233 I255 K320 F322 I330 P331 C332	Y181-Y257 PolarHBondContact OH-OH 2.94Å; T231-Y257 PolarHBondContact N-O 2.93Å; T231-Y257 PolarHBondContact O-N 3.15Å; K233-Y257 HydrophobicContact CB-CD2 3.67Å; K233-Y257 HydrophobicContact CB-CE2 3.89Å; K233-Y257 HydrophobicContact CB-CG 4.47Å; K233-Y257 HydrophobicContact CG-CD2 3.75Å; K233-Y257 HydrophobicContact CG-CE2 4.34Å; K233-Y257 HydrophobicContact CG-CG 4.07Å; I255-Y257 HydrophobicContact CB-CD2 4.37Å; I255-Y257 HydrophobicContact CB-CE2 3.81Å; I255-Y257 HydrophobicContact CG2-CD2 4.08Å; I255-Y257 HydrophobicContact CG2-CE2 3.52Å; I255-Y257 WeakPolarHBondContact O-CD2 3.2Å; Y257-K320 WeakPolarHBondContact CE1-O 3.44Å; Y257-K320 PolarHBondContact OH-O 3.02Å; Y257-F322 HydrophobicContact CD1-CD2 4.37Å; Y257-F322 HydrophobicContact CD2-CD2 4.39Å; Y257-F322 HydrophobicContact CD2-CE2 4.44Å; Y257-F322 AromaticContact CE1-CD2 3.82Å; Y257-F322 HydrophobicContact CE1-CD2 3.82Å; Y257-F322 HydrophobicContact CE1-CE2 4.36Å; Y257-F322 AromaticContact CE2-CD2 3.85Å; Y257-F322 HydrophobicContact CE2-CD2 3.85Å; Y257-F322 AromaticContact CE2-CE2 3.66Å; Y257-F322 HydrophobicContact CE2-CE2 3.66Å; Y257-F322 AromaticContact CZ-CD2 3.55Å; Y257-F322 AromaticContact CZ-CE2 3.62Å; Y257-I330 CarbonylContact C-O 3.57Å; Y257-I330 WeakPolarHBondContact CA-O 3.01Å; Y257-I330 VanDerWaalsContact CD1-C 3.47Å; Y257-P331 HydrophobicContact CD1-CB 4.34Å; Y257-P331 HydrophobicContact CE1-CB 3.98Å; Y257-C332 PolarHBondContact N-SG 2.88Å; Y257-C332 VanDerWaalsContact N-SG 3.35Å
258	I	94.1	Very high	85	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.6	163.6	-71.1	157.6	0	0	0	108.3	L228 I230 I260 L279 Y329 I330 F337 F347 P349	L228-I258 HydrophobicContact CB-CG2 4.45Å; L228-I258 HydrophobicContact CD2-CG2 4.47Å; I230-I258 HydrophobicContact CG1-CG1 3.98Å; I258-I260 HydrophobicContact CG2-CG2 3.85Å; I258-L279 HydrophobicContact CG2-CD1 4.43Å; I258-Y329 WeakPolarHBondContact O-CA 3.29Å; I258-I330 PolarHBondContact N-O 2.67Å; I258-I330 PolarHBondContact O-N 3.36Å; I258-F337 HydrophobicContact CD1-CD1 4.18Å; I258-F337 HydrophobicContact CD1-CD2 4.4Å; I258-F337 HydrophobicContact CD1-CE1 3.38Å; I258-F337 HydrophobicContact CD1-CE2 3.62Å; I258-F337 HydrophobicContact CD1-CZ 3.09Å; I258-F337 HydrophobicContact CG1-CZ 4.33Å; I258-F347 HydrophobicContact CD1-CE2 3.9Å; I258-F347 HydrophobicContact CD1-CZ 3.48Å; I258-F347 VanDerWaalsContact CD1-CZ 3.48Å; I258-F347 HydrophobicContact CG1-CE2 4.36Å; I258-F347 HydrophobicContact CG1-CZ 4.35Å; I258-P349 HydrophobicContact CD1-CB 3.52Å; I258-P349 HydrophobicContact CD1-CG 3.69Å; I258-P349 HydrophobicContact CG1-CB 4.33Å
259	R	93.9	Very high	85.2	Confident	64 Å²	64	53.6 Å²	53.6	24%	0.242	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.7	171.4	-178.9	-175.4	65	166.9	-7.4	108.8	Y229 T231 Y327 L328 Y329	Y229-R259 HydrophobicContact CD1-CB 4.37Å; Y229-R259 PolarHBondContact N-O 2.86Å; Y229-R259 WeakPolarHBondContact O-CB 3.47Å; Y229-R259 PolarHBondContact O-N 3.47Å; T231-R259 HydrophobicContact CG2-CB 4.35Å; R259-Y327 HydrophobicContact CG-CD1 3.69Å; R259-Y327 HydrophobicContact CG-CD2 4.45Å; R259-Y327 HydrophobicContact CG-CG 3.68Å; R259-L328 WeakPolarHBondContact CA-O 3.33Å; R259-Y329 HydrophobicContact CB-CD1 3.88Å; R259-Y329 HydrophobicContact CB-CE1 3.65Å; R259-Y329 HydrophobicContact CG-CD1 4.17Å; R259-Y329 HydrophobicContact CG-CE1 3.63Å
260	I	93.6	Very high	85.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.5	170.5	66.8	175.1	0	0	0	110	L228 I258 Y276 L279 F280 Y327 L328 I330	L228-I260 HydrophobicContact CD2-CG2 3.47Å; L228-I260 VanDerWaalsContact CD2-CG2 3.47Å; I258-I260 HydrophobicContact CG2-CG2 3.85Å; I260-Y276 HydrophobicContact CB-CD2 4.37Å; I260-Y276 HydrophobicContact CB-CE2 4.47Å; I260-Y276 HydrophobicContact CD1-CD2 4.28Å; I260-Y276 HydrophobicContact CD1-CE2 4.31Å; I260-L279 HydrophobicContact CD1-CB 3.95Å; I260-L279 HydrophobicContact CG2-CD1 4.35Å; I260-F280 HydrophobicContact CD1-CB 4.15Å; I260-Y327 CarbonylContact O-C 3.48Å; I260-Y327 WeakPolarHBondContact O-CA 3.46Å; I260-Y327 WeakPolarHBondContact O-CB 3.22Å; I260-L328 HydrophobicContact CD1-CB 4.46Å; I260-L328 HydrophobicContact CD1-CD2 4.24Å; I260-L328 HydrophobicContact CG1-CB 3.89Å; I260-L328 PolarHBondContact N-O 2.75Å; I260-L328 PolarHBondContact O-N 3.21Å; I260-I330 HydrophobicContact CD1-CD1 3.84Å; I260-I330 HydrophobicContact CG1-CD1 4.36Å
261	P	92.7	Very high	85.6	Confident	27 Å²	27	55.3 Å²	55.3	18%	0.175	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	155.1	173.2	29.8	-35	0	0	0	110.9	L227 K263 Y276 Y327	L227-P261 HydrophobicContact CB-CG 4.38Å; L227-P261 HydrophobicContact CD1-CG 4.32Å; P261-K263 VanDerWaalsContact C-N 3.33Å; P261-Y276 HydrophobicContact CG-CE2 4.12Å; P261-Y276 VanDerWaalsContact O-CE2 3.26Å; P261-Y276 WeakPolarHBondContact O-CE2 3.29Å; P261-Y276 PolarHBondContact O-OH 2.7Å; P261-Y327 HydrophobicContact CB-CD1 4.39Å; P261-Y327 HydrophobicContact CB-CE1 4.4Å
262	R	90	Very high	85.8	Confident	12 Å²	12	53.3 Å²	53.3	5%	0.045	25%	0.253	C	S	.	.	S	Bend	trans	-78.7	-18.4	172.4	-66.8	-172.8	70.1	70.1	9.2	113.6	Y276 F280 G287 D291 K325 T326	R262-Y276 PolarHBondContact O-OH 2.92Å; R262-F280 HydrophobicContact CB-CE2 4.42Å; R262-F280 VanDerWaalsContact O-CE2 3.27Å; R262-F280 WeakPolarHBondContact O-CE2 3.27Å; R262-G287 VanDerWaalsContact CZ-O 3.24Å; R262-G287 PolarHBondContact NH2-O 2.84Å; R262-D291 IonicContact CZ-OD1 3.95Å; R262-D291 IonicContact CZ-OD2 3.94Å; R262-D291 IonicContact NE-OD1 3.46Å; R262-D291 PolarHBondContact NE-OD1 3.41Å; R262-D291 IonicContact NE-OD2 3.7Å; R262-D291 IonicContact NH2-OD1 3.03Å; R262-D291 PolarHBondContact NH2-OD1 2.83Å; R262-D291 VanDerWaalsContact NH2-OD1 3.12Å; R262-D291 IonicContact NH2-OD2 2.91Å; R262-D291 PolarHBondContact NH2-OD2 2.94Å; R262-K325 VanDerWaalsContact CD-O 3.31Å; R262-K325 WeakPolarHBondContact CD-O 3.33Å; R262-T326 PolarHBondContact N-O 3.14Å
263	K	86.3	Confident	86	Confident	169 Å²	169	55.8 Å²	55.8	74%	0.735	27%	0.265	S	S	*	.	S	Bend	trans	-123	128.3	178.5	-64.6	-174.3	179.3	-175.2	0	108.9	P261	P261-K263 VanDerWaalsContact C-N 3.33Å
264	L	84.4	Confident	86.3	Confident	50 Å²	50	55.6 Å²	55.6	26%	0.262	26%	0.264	S	S	.	.			trans	-75.6	138.8	176.1	-168.6	63.1	0	0	0	109.8	L227 N268 Q273 Y276 F277	L227-L264 HydrophobicContact CD2-CD1 3.72Å; L264-N268 WeakPolarHBondContact CD1-ND2 3.47Å; L264-Q273 HydrophobicContact CD2-CG 4.45Å; L264-Y276 HydrophobicContact CB-CD1 4.27Å; L264-Y276 HydrophobicContact CB-CE1 3.75Å; L264-Y276 HydrophobicContact CD1-CD1 3.75Å; L264-Y276 HydrophobicContact CD1-CD2 4.14Å; L264-Y276 HydrophobicContact CD1-CE1 4.03Å; L264-Y276 HydrophobicContact CD1-CE2 4.33Å; L264-Y276 HydrophobicContact CD1-CG 3.81Å; L264-Y276 HydrophobicContact CD2-CD1 4.08Å; L264-Y276 HydrophobicContact CD2-CE1 4.3Å; L264-Y276 HydrophobicContact CG-CD1 4.25Å; L264-Y276 HydrophobicContact CG-CE1 4.24Å; L264-Y276 PolarHBondContact N-OH 2.84Å; L264-F277 HydrophobicContact CD2-CE1 4.15Å; L264-F277 HydrophobicContact CD2-CE2 4.1Å; L264-F277 HydrophobicContact CD2-CZ 3.58Å
265	L	77.5	Confident	86.6	Confident	132 Å²	132	55.3 Å²	55.3	69%	0.691	26%	0.263	S	S	*	.			trans	-95.1	142.8	170	-62	170.8	0	0	0	108.8	N267 N268	L265-N267 PolarHBondContact O-N 2.96Å; L265-N268 PolarHBondContact O-ND2 3.27Å
266	Y	68.6	Low	86.8	Confident	223 Å²	223	55.6 Å²	55.6	88%	0.875	26%	0.264	S	S	*	.	S	Bend	trans	-63.2	-11.1	-168.7	-75	-82.3	0	0	0	116.3
267	N	64.7	Low	86.9	Confident	154 Å²	154	58.9 Å²	58.9	82%	0.824	28%	0.278	S	S	*	.			trans	-105	39.8	-167.6	-63.9	-0.3	0	0	0	114.3	L265	L265-N267 PolarHBondContact O-N 2.96Å
268	N	75.7	Confident	87	Confident	19 Å²	19	58.9 Å²	58.9	10%	0.102	28%	0.278	C	S	.	.			trans	-106.5	144.8	-177.2	-68.1	-53.4	0	0	0	112.4	N226 L227 L264 L265 Q273	N226-N268 PolarHBondContact ND2-OD1 2.97Å; N226-N268 PolarHBondContact OD1-OD1 2.88Å; L227-N268 HydrophobicContact CD2-CB 4.12Å; L227-N268 VanDerWaalsContact CD2-CG 3.41Å; L227-N268 VanDerWaalsContact CD2-ND2 3.31Å; L227-N268 WeakPolarHBondContact CD2-ND2 3.5Å; L264-N268 WeakPolarHBondContact CD1-ND2 3.47Å; L265-N268 PolarHBondContact O-ND2 3.27Å; N268-Q273 HydrophobicContact CB-CG 3.86Å; N268-Q273 PolarHBondContact O-NE2 3.48Å
269	I	84.3	Confident	87	Confident	114 Å²	114	58.9 Å²	58.9	59%	0.585	28%	0.278	S	S	*	.			trans	-62.4	141.6	174.4	-59	165.5	0	0	0	109.8	E271 I272 Q273	I269-E271 PolarHBondContact O-N 2.98Å; I269-E271 VanDerWaalsContact O-N 3.11Å; I269-I272 HydrophobicContact CB-CD1 4.19Å; I269-I272 HydrophobicContact CB-CG1 4.31Å; I269-I272 HydrophobicContact CD1-CD1 4.19Å; I269-I272 WeakPolarHBondContact O-CA 3.37Å; I269-I272 WeakPolarHBondContact O-CB 3.17Å; I269-I272 PolarHBondContact O-N 2.92Å; I269-Q273 PolarHBondContact O-N 2.98Å
270	D	85.1	Confident	87	Confident	78 Å²	78	57.2 Å²	57.2	42%	0.417	27%	0.273	S	S	.	.	H	α-helix	trans	-48.7	-39.5	-176.1	-68.6	-3.9	0	0	0	114.2	W114 Q273 L274	W114-D270 PolarHBondContact NE1-O 2.94Å; D270-Q273 PolarHBondContact O-N 2.91Å; D270-L274 PolarHBondContact O-N 2.78Å
271	E	89.2	Confident	86.9	Confident	46 Å²	46	59.5 Å²	59.5	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-40.9	177.6	-170.2	-177.4	165.1	0	0	112.3	W114 I269 Q273 L274 I275 P341 L343	W114-E271 HydrophobicContact CH2-CB 4.25Å; W114-E271 HydrophobicContact CH2-CG 4.14Å; W114-E271 HydrophobicContact CZ2-CB 3.75Å; W114-E271 HydrophobicContact CZ2-CG 4.08Å; I269-E271 PolarHBondContact O-N 2.98Å; I269-E271 VanDerWaalsContact O-N 3.11Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-L274 WeakPolarHBondContact O-CB 3.49Å; E271-L274 PolarHBondContact O-N 2.8Å; E271-I275 HydrophobicContact CG-CD1 4.47Å; E271-I275 WeakPolarHBondContact O-CG1 2.85Å; E271-I275 PolarHBondContact O-N 2.88Å; E271-P341 HydrophobicContact CG-CB 3.51Å; E271-P341 HydrophobicContact CG-CG 4.04Å; E271-P341 WeakPolarHBondContact OE1-CB 3.49Å; E271-L343 HydrophobicContact CB-CD2 4.39Å; E271-L343 HydrophobicContact CG-CD2 3.89Å
272	I	90.2	Very high	86.9	Confident	11 Å²	11	58.5 Å²	58.5	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-35.4	179	-58.2	178.7	0	0	0	109.7	N226 L227 I269 Y276 L343	N226-I272 HydrophobicContact CB-CD1 3.54Å; N226-I272 HydrophobicContact CB-CG2 4.42Å; L227-I272 HydrophobicContact CD1-CG2 4.48Å; L227-I272 HydrophobicContact CD2-CG2 3.39Å; L227-I272 HydrophobicContact CG-CG2 3.62Å; I269-I272 HydrophobicContact CB-CD1 4.19Å; I269-I272 HydrophobicContact CB-CG1 4.31Å; I269-I272 HydrophobicContact CD1-CD1 4.19Å; I269-I272 WeakPolarHBondContact O-CA 3.37Å; I269-I272 WeakPolarHBondContact O-CB 3.17Å; I269-I272 PolarHBondContact O-N 2.92Å; I272-Y276 VanDerWaalsContact O-CB 3.24Å; I272-Y276 WeakPolarHBondContact O-CB 3.22Å; I272-Y276 PolarHBondContact O-N 3.34Å; I272-L343 HydrophobicContact CD1-CD2 4.42Å; I272-L343 HydrophobicContact CG1-CD1 4.38Å; I272-L343 HydrophobicContact CG1-CD2 3.64Å
273	Q	89.7	Confident	87.1	Confident	53 Å²	53	58 Å²	58	25%	0.248	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-45.4	172.6	-62.7	-175.4	4	0	0	111.4	L264 N268 I269 D270 E271 I275 Y276 F277	L264-Q273 HydrophobicContact CD2-CG 4.45Å; N268-Q273 HydrophobicContact CB-CG 3.86Å; N268-Q273 PolarHBondContact O-NE2 3.48Å; I269-Q273 PolarHBondContact O-N 2.98Å; D270-Q273 PolarHBondContact O-N 2.91Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; Q273-I275 PolarHBondContact O-N 2.95Å; Q273-Y276 WeakPolarHBondContact O-CB 3.28Å; Q273-Y276 PolarHBondContact O-N 2.77Å; Q273-F277 HydrophobicContact CB-CD2 4.33Å; Q273-F277 HydrophobicContact CB-CE2 4.08Å; Q273-F277 WeakPolarHBondContact O-CD2 3.44Å; Q273-F277 WeakPolarHBondContact O-CG 3.41Å; Q273-F277 PolarHBondContact O-N 2.9Å
274	L	91.9	Very high	87.4	Confident	9 Å²	9	53.5 Å²	53.5	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-53.3	175.2	174	67.9	0	0	0	111.3	H59 F102 W114 D270 E271 Y276 F277 I278 P341	H59-L274 WeakPolarHBondContact NE2-CD1 3.22Å; F102-L274 HydrophobicContact CB-CD2 3.91Å; F102-L274 HydrophobicContact CD1-CD1 4.47Å; F102-L274 HydrophobicContact CD1-CD2 4.06Å; F102-L274 HydrophobicContact CD2-CD2 4.32Å; F102-L274 HydrophobicContact CG-CD2 3.83Å; W114-L274 HydrophobicContact CB-CD1 4.23Å; W114-L274 HydrophobicContact CB-CD2 4.22Å; W114-L274 HydrophobicContact CD2-CD2 3.52Å; W114-L274 HydrophobicContact CD2-CG 4.48Å; W114-L274 HydrophobicContact CE3-CD2 3.82Å; W114-L274 HydrophobicContact CG-CB 4.33Å; W114-L274 HydrophobicContact CG-CD1 4.19Å; W114-L274 HydrophobicContact CG-CD2 3.69Å; W114-L274 HydrophobicContact CG-CG 4.28Å; W114-L274 HydrophobicContact CZ2-CD2 4.46Å; W114-L274 HydrophobicContact CZ3-CD2 4.39Å; D270-L274 PolarHBondContact O-N 2.78Å; E271-L274 WeakPolarHBondContact O-CB 3.49Å; E271-L274 PolarHBondContact O-N 2.8Å; L274-Y276 VanDerWaalsContact C-N 3.28Å; L274-Y276 PolarHBondContact O-N 2.75Å; L274-F277 PolarHBondContact O-N 2.98Å; L274-I278 HydrophobicContact CD1-CD1 3.8Å; L274-I278 HydrophobicContact CD1-CG1 4.3Å; L274-I278 HydrophobicContact CG-CD1 3.93Å; L274-I278 WeakPolarHBondContact O-CG1 3.18Å; L274-I278 PolarHBondContact O-N 3.47Å; L274-P341 HydrophobicContact CD2-CG 3.91Å
275	I	93.6	Very high	87.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-44.8	179.1	-65.6	167.2	0	0	0	109.9	L228 E271 Q273 L279 L340 L343 F347	L228-I275 HydrophobicContact CD1-CB 4.31Å; L228-I275 HydrophobicContact CD1-CD1 4.37Å; L228-I275 HydrophobicContact CD1-CG2 3.56Å; L228-I275 HydrophobicContact CD2-CG2 4.14Å; E271-I275 HydrophobicContact CG-CD1 4.47Å; E271-I275 WeakPolarHBondContact O-CG1 2.85Å; E271-I275 PolarHBondContact O-N 2.88Å; Q273-I275 PolarHBondContact O-N 2.95Å; I275-L279 HydrophobicContact CG2-CD1 3.64Å; I275-L279 HydrophobicContact CG2-CG 4.1Å; I275-L279 VanDerWaalsContact O-CB 3.28Å; I275-L279 WeakPolarHBondContact O-CB 3.26Å; I275-L279 WeakPolarHBondContact O-CG 3.3Å; I275-L279 PolarHBondContact O-N 3.29Å; I275-L340 HydrophobicContact CG1-CB 4.49Å; I275-L340 HydrophobicContact CG1-CD1 4.45Å; I275-L340 HydrophobicContact CG2-CD1 4.03Å; I275-L343 HydrophobicContact CD1-CD1 4.13Å; I275-L343 HydrophobicContact CD1-CD2 3.91Å; I275-L343 HydrophobicContact CD1-CG 3.85Å; I275-F347 HydrophobicContact CG2-CE1 4.5Å
276	Y	93.3	Very high	88.2	Confident	6 Å²	6	48.5 Å²	48.5	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-57	-51.3	176.9	174.4	-94.6	0	0	0	112.3	L227 I260 P261 R262 L264 I272 Q273 L274 I278 L279 F280	L227-Y276 HydrophobicContact CD1-CD2 3.46Å; L227-Y276 VanDerWaalsContact CD1-CD2 3.46Å; L227-Y276 HydrophobicContact CD1-CE2 4.31Å; L227-Y276 HydrophobicContact CD1-CG 4.15Å; I260-Y276 HydrophobicContact CB-CD2 4.37Å; I260-Y276 HydrophobicContact CB-CE2 4.47Å; I260-Y276 HydrophobicContact CD1-CD2 4.28Å; I260-Y276 HydrophobicContact CD1-CE2 4.31Å; P261-Y276 HydrophobicContact CG-CE2 4.12Å; P261-Y276 VanDerWaalsContact O-CE2 3.26Å; P261-Y276 WeakPolarHBondContact O-CE2 3.29Å; P261-Y276 PolarHBondContact O-OH 2.7Å; R262-Y276 PolarHBondContact O-OH 2.92Å; L264-Y276 HydrophobicContact CB-CD1 4.27Å; L264-Y276 HydrophobicContact CB-CE1 3.75Å; L264-Y276 HydrophobicContact CD1-CD1 3.75Å; L264-Y276 HydrophobicContact CD1-CD2 4.14Å; L264-Y276 HydrophobicContact CD1-CE1 4.03Å; L264-Y276 HydrophobicContact CD1-CE2 4.33Å; L264-Y276 HydrophobicContact CD1-CG 3.81Å; L264-Y276 HydrophobicContact CD2-CD1 4.08Å; L264-Y276 HydrophobicContact CD2-CE1 4.3Å; L264-Y276 HydrophobicContact CG-CD1 4.25Å; L264-Y276 HydrophobicContact CG-CE1 4.24Å; L264-Y276 PolarHBondContact N-OH 2.84Å; I272-Y276 VanDerWaalsContact O-CB 3.24Å; I272-Y276 WeakPolarHBondContact O-CB 3.22Å; I272-Y276 PolarHBondContact O-N 3.34Å; Q273-Y276 WeakPolarHBondContact O-CB 3.28Å; Q273-Y276 PolarHBondContact O-N 2.77Å; L274-Y276 VanDerWaalsContact C-N 3.28Å; L274-Y276 PolarHBondContact O-N 2.75Å; Y276-I278 PolarHBondContact O-N 3.07Å; Y276-L279 PolarHBondContact O-N 2.68Å; Y276-F280 HydrophobicContact CD1-CB 4.48Å; Y276-F280 HydrophobicContact CE1-CB 4.11Å; Y276-F280 HydrophobicContact CE1-CG 4.29Å; Y276-F280 WeakPolarHBondContact O-CB 3.45Å; Y276-F280 PolarHBondContact O-N 2.88Å
277	F	92.5	Very high	89.1	Confident	69 Å²	69	37.9 Å²	37.9	30%	0.303	19%	0.187	S	C	.	.	H	α-helix	trans	-64.9	-40.8	-176	-73.3	-57.2	0	0	0	112.2	L264 Q273 L274 N281	L264-F277 HydrophobicContact CD2-CE1 4.15Å; L264-F277 HydrophobicContact CD2-CE2 4.1Å; L264-F277 HydrophobicContact CD2-CZ 3.58Å; Q273-F277 HydrophobicContact CB-CD2 4.33Å; Q273-F277 HydrophobicContact CB-CE2 4.08Å; Q273-F277 WeakPolarHBondContact O-CD2 3.44Å; Q273-F277 WeakPolarHBondContact O-CG 3.41Å; Q273-F277 PolarHBondContact O-N 2.9Å; L274-F277 PolarHBondContact O-N 2.98Å; F277-N281 VanDerWaalsContact O-CB 3.22Å; F277-N281 WeakPolarHBondContact O-CB 3.28Å; F277-N281 PolarHBondContact O-N 3.15Å
278	I	95.2	Very high	90	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.4	-52.7	173.4	-67.7	169.8	0	0	0	109.9	H59 I61 F102 L274 Y276 F280 G282 L336 L340	H59-I278 HydrophobicContact CB-CG1 4.49Å; H59-I278 VanDerWaalsContact CE1-CG1 3.49Å; H59-I278 WeakPolarHBondContact CE1-CG1 3.34Å; I61-I278 HydrophobicContact CD1-CG2 3.9Å; I61-I278 WeakPolarHBondContact CD1-O 3.26Å; F102-I278 HydrophobicContact CE1-CD1 4.1Å; F102-I278 HydrophobicContact CE2-CD1 3.92Å; F102-I278 HydrophobicContact CZ-CD1 3.53Å; L274-I278 HydrophobicContact CD1-CD1 3.8Å; L274-I278 HydrophobicContact CD1-CG1 4.3Å; L274-I278 HydrophobicContact CG-CD1 3.93Å; L274-I278 WeakPolarHBondContact O-CG1 3.18Å; L274-I278 PolarHBondContact O-N 3.47Å; Y276-I278 PolarHBondContact O-N 3.07Å; I278-F280 PolarHBondContact O-N 3.35Å; I278-G282 PolarHBondContact O-N 3.09Å; I278-L336 HydrophobicContact CG2-CD2 3.41Å; I278-L336 VanDerWaalsContact CG2-CD2 3.41Å; I278-L336 HydrophobicContact CG2-CG 4.48Å; I278-L340 HydrophobicContact CD1-CD2 3.63Å; I278-L340 HydrophobicContact CG2-CD2 4.19Å
279	L	95.2	Very high	90.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.8	-40.8	-176.6	-71.4	-174.5	0	0	0	112.7	L228 I258 I260 I275 Y276 F283 I330 Y334 F337 L340	L228-L279 HydrophobicContact CD2-CD1 4.18Å; I258-L279 HydrophobicContact CG2-CD1 4.43Å; I260-L279 HydrophobicContact CD1-CB 3.95Å; I260-L279 HydrophobicContact CG2-CD1 4.35Å; I275-L279 HydrophobicContact CG2-CD1 3.64Å; I275-L279 HydrophobicContact CG2-CG 4.1Å; I275-L279 VanDerWaalsContact O-CB 3.28Å; I275-L279 WeakPolarHBondContact O-CB 3.26Å; I275-L279 WeakPolarHBondContact O-CG 3.3Å; I275-L279 PolarHBondContact O-N 3.29Å; Y276-L279 PolarHBondContact O-N 2.68Å; L279-F283 WeakPolarHBondContact O-CD2 3.42Å; L279-F283 PolarHBondContact O-N 2.77Å; L279-I330 HydrophobicContact CB-CD1 3.52Å; L279-I330 HydrophobicContact CD1-CD1 4.28Å; L279-I330 HydrophobicContact CD2-CD1 4.1Å; L279-I330 HydrophobicContact CD2-CG2 4.43Å; L279-I330 HydrophobicContact CG-CD1 4.17Å; L279-I330 WeakPolarHBondContact O-CD1 3.32Å; L279-Y334 HydrophobicContact CD2-CD1 3.97Å; L279-Y334 HydrophobicContact CD2-CE1 4.04Å; L279-F337 HydrophobicContact CD1-CE1 3.87Å; L279-F337 HydrophobicContact CD1-CZ 4.2Å; L279-F337 HydrophobicContact CD2-CE1 3.58Å; L279-F337 HydrophobicContact CD2-CZ 3.67Å; L279-F337 HydrophobicContact CG-CE1 4.3Å; L279-L340 HydrophobicContact CD2-CD1 4.31Å
280	F	93.3	Very high	90.1	Very high	29 Å²	29	29.5 Å²	29.5	13%	0.127	14%	0.138	C	C	.	.	H	α-helix	trans	-65.7	-52.5	178.1	-175.8	-99	0	0	0	110.6	I260 R262 Y276 I278 G282 F283 Y284	I260-F280 HydrophobicContact CD1-CB 4.15Å; R262-F280 HydrophobicContact CB-CE2 4.42Å; R262-F280 VanDerWaalsContact O-CE2 3.27Å; R262-F280 WeakPolarHBondContact O-CE2 3.27Å; Y276-F280 HydrophobicContact CD1-CB 4.48Å; Y276-F280 HydrophobicContact CE1-CB 4.11Å; Y276-F280 HydrophobicContact CE1-CG 4.29Å; Y276-F280 WeakPolarHBondContact O-CB 3.45Å; Y276-F280 PolarHBondContact O-N 2.88Å; I278-F280 PolarHBondContact O-N 3.35Å; F280-G282 VanDerWaalsContact C-N 3.27Å; F280-G282 PolarHBondContact O-N 2.93Å; F280-F283 CarbonylContact O-C 3.59Å; F280-F283 PolarHBondContact O-N 3.44Å; F280-F283 VanDerWaalsContact O-N 3.16Å; F280-Y284 HydrophobicContact CD1-CD2 4.29Å; F280-Y284 AromaticContact CE1-CD2 3.43Å; F280-Y284 HydrophobicContact CE1-CD2 3.43Å; F280-Y284 VanDerWaalsContact CE1-CD2 3.43Å; F280-Y284 AromaticContact CE1-CE2 3.97Å; F280-Y284 HydrophobicContact CE1-CE2 3.97Å; F280-Y284 HydrophobicContact CE1-CG 4.31Å; F280-Y284 HydrophobicContact CE2-CD2 4.21Å; F280-Y284 AromaticContact CZ-CD2 3.39Å; F280-Y284 HydrophobicContact CZ-CD2 3.39Å; F280-Y284 AromaticContact CZ-CE2 3.78Å; F280-Y284 HydrophobicContact CZ-CE2 3.78Å; F280-Y284 WeakPolarHBondContact O-CA 3.32Å; F280-Y284 VanDerWaalsContact O-CB 3.29Å; F280-Y284 WeakPolarHBondContact O-CB 3.47Å; F280-Y284 PolarHBondContact O-N 2.81Å
281	N	91.5	Very high	89.5	Confident	49 Å²	49	28.5 Å²	28.5	26%	0.262	13%	0.133	S	C	.	.	H	α-helix	trans	-60.2	-38.1	-179.7	-70.8	-5.2	0	0	0	111.9	I61 F277 F283	I61-N281 HydrophobicContact CD1-CB 4.23Å; F277-N281 VanDerWaalsContact O-CB 3.22Å; F277-N281 WeakPolarHBondContact O-CB 3.28Å; F277-N281 PolarHBondContact O-N 3.15Å; N281-F283 VanDerWaalsContact C-N 3.26Å; N281-F283 PolarHBondContact O-N 2.9Å
282	G	92.9	Very high	88.6	Confident	5 Å²	5	31.2 Å²	31.2	5%	0.052	15%	0.149	C	C	.	.	H	α-helix	trans	-68.3	-23	-179.2	0	0	0	0	0	114.8	I278 F280	I278-G282 PolarHBondContact O-N 3.09Å; F280-G282 VanDerWaalsContact C-N 3.27Å; F280-G282 PolarHBondContact O-N 2.93Å
283	F	94.8	Very high	87	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-124.3	4.4	-176	-68.5	-97.2	0	0	0	113.1	L63 I178 L279 F280 N281 Q285 F286 F319 L328 I330 Y334	L63-F283 HydrophobicContact CD1-CD1 4.25Å; L63-F283 HydrophobicContact CD1-CE1 3.8Å; L63-F283 HydrophobicContact CD1-CZ 3.97Å; I178-F283 HydrophobicContact CD1-CE1 4.27Å; I178-F283 HydrophobicContact CD1-CZ 3.85Å; L279-F283 WeakPolarHBondContact O-CD2 3.42Å; L279-F283 PolarHBondContact O-N 2.77Å; F280-F283 CarbonylContact O-C 3.59Å; F280-F283 PolarHBondContact O-N 3.44Å; F280-F283 VanDerWaalsContact O-N 3.16Å; N281-F283 VanDerWaalsContact C-N 3.26Å; N281-F283 PolarHBondContact O-N 2.9Å; F283-Q285 VanDerWaalsContact C-N 3.31Å; F283-Q285 PolarHBondContact O-N 3.05Å; F283-F286 HydrophobicContact CB-CD2 4.13Å; F283-F286 AromaticContact CD1-CD2 3.94Å; F283-F286 HydrophobicContact CD1-CD2 3.94Å; F283-F286 AromaticContact CD1-CE2 3.92Å; F283-F286 HydrophobicContact CD1-CE2 3.92Å; F283-F286 HydrophobicContact CG-CD2 4.44Å; F283-F286 WeakPolarHBondContact O-CD2 3.35Å; F283-F286 PolarHBondContact O-N 3.38Å; F283-F286 VanDerWaalsContact O-N 3.15Å; F283-F319 HydrophobicContact CD1-CZ 4.38Å; F283-F319 HydrophobicContact CE1-CE2 4.45Å; F283-F319 HydrophobicContact CE1-CZ 4.16Å; F283-L328 HydrophobicContact CB-CD1 4.24Å; F283-L328 HydrophobicContact CB-CD2 3.41Å; F283-L328 VanDerWaalsContact CB-CD2 3.41Å; F283-L328 HydrophobicContact CB-CG 4.03Å; F283-I330 HydrophobicContact CB-CD1 4.44Å; F283-I330 HydrophobicContact CB-CG1 4.22Å; F283-I330 HydrophobicContact CD1-CG1 4.22Å; F283-I330 HydrophobicContact CD2-CD1 3.78Å; F283-I330 HydrophobicContact CD2-CG1 3.75Å; F283-I330 HydrophobicContact CD2-CG2 4.07Å; F283-I330 HydrophobicContact CE1-CG2 4.19Å; F283-I330 HydrophobicContact CE2-CB 4.4Å; F283-I330 HydrophobicContact CE2-CD1 4.28Å; F283-I330 HydrophobicContact CE2-CG1 4.13Å; F283-I330 HydrophobicContact CE2-CG2 3.52Å; F283-I330 HydrophobicContact CG-CD1 4.2Å; F283-I330 HydrophobicContact CG-CG1 3.81Å; F283-I330 HydrophobicContact CZ-CB 4.5Å; F283-I330 HydrophobicContact CZ-CG2 3.59Å; F283-Y334 AromaticContact CE2-CD1 3.9Å; F283-Y334 HydrophobicContact CE2-CD1 3.9Å; F283-Y334 AromaticContact CE2-CE1 3.92Å; F283-Y334 HydrophobicContact CE2-CE1 3.92Å; F283-Y334 HydrophobicContact CE2-CG 4.22Å; F283-Y334 HydrophobicContact CZ-CD1 4.31Å; F283-Y334 HydrophobicContact CZ-CD2 4.36Å; F283-Y334 HydrophobicContact CZ-CG 4.17Å
284	Y	91	Very high	85.5	Confident	75 Å²	75	37.8 Å²	37.8	29%	0.294	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-53.7	-47.2	-176.7	175.4	-105.5	0	0	0	112.2	F280 F286 G287 Q288 D291	F280-Y284 HydrophobicContact CD1-CD2 4.29Å; F280-Y284 AromaticContact CE1-CD2 3.43Å; F280-Y284 HydrophobicContact CE1-CD2 3.43Å; F280-Y284 VanDerWaalsContact CE1-CD2 3.43Å; F280-Y284 AromaticContact CE1-CE2 3.97Å; F280-Y284 HydrophobicContact CE1-CE2 3.97Å; F280-Y284 HydrophobicContact CE1-CG 4.31Å; F280-Y284 HydrophobicContact CE2-CD2 4.21Å; F280-Y284 AromaticContact CZ-CD2 3.39Å; F280-Y284 HydrophobicContact CZ-CD2 3.39Å; F280-Y284 AromaticContact CZ-CE2 3.78Å; F280-Y284 HydrophobicContact CZ-CE2 3.78Å; F280-Y284 WeakPolarHBondContact O-CA 3.32Å; F280-Y284 VanDerWaalsContact O-CB 3.29Å; F280-Y284 WeakPolarHBondContact O-CB 3.47Å; F280-Y284 PolarHBondContact O-N 2.81Å; Y284-F286 PolarHBondContact O-N 3.22Å; Y284-G287 PolarHBondContact O-N 3.14Å; Y284-Q288 HydrophobicContact CD1-CB 4.17Å; Y284-Q288 HydrophobicContact CE1-CB 3.6Å; Y284-Q288 HydrophobicContact CE2-CB 4.44Å; Y284-Q288 PolarHBondContact O-N 2.97Å; Y284-D291 WeakPolarHBondContact CE2-OD2 3.33Å
285	Q	90	Very high	83.8	Confident	78 Å²	78	43.7 Å²	43.7	36%	0.364	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-50.8	-35.1	-178.5	66.9	176.8	-2.9	0	0	112.9	F283 G287 F310	F283-Q285 VanDerWaalsContact C-N 3.31Å; F283-Q285 PolarHBondContact O-N 3.05Å; Q285-G287 PolarHBondContact O-N 3.17Å; Q285-F310 VanDerWaalsContact O-CE1 3.24Å; Q285-F310 WeakPolarHBondContact O-CE1 3.31Å; Q285-F310 WeakPolarHBondContact O-CZ 3.29Å
286	F	90.5	Very high	82	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-71.9	-11.6	-175.7	-63.1	-72.2	0	0	0	113.6	L63 F283 Y284 F289 F310 L313 A314 L317 F319 L321 L323	L63-F286 HydrophobicContact CD1-CE2 3.97Å; L63-F286 HydrophobicContact CD1-CZ 4.33Å; F283-F286 HydrophobicContact CB-CD2 4.13Å; F283-F286 AromaticContact CD1-CD2 3.94Å; F283-F286 HydrophobicContact CD1-CD2 3.94Å; F283-F286 AromaticContact CD1-CE2 3.92Å; F283-F286 HydrophobicContact CD1-CE2 3.92Å; F283-F286 HydrophobicContact CG-CD2 4.44Å; F283-F286 WeakPolarHBondContact O-CD2 3.35Å; F283-F286 PolarHBondContact O-N 3.38Å; F283-F286 VanDerWaalsContact O-N 3.15Å; Y284-F286 PolarHBondContact O-N 3.22Å; F286-F289 WeakPolarHBondContact O-CE1 3.16Å; F286-F310 HydrophobicContact CD1-CB 4.15Å; F286-F310 HydrophobicContact CD1-CD1 4.19Å; F286-L313 HydrophobicContact CE1-CB 4.37Å; F286-L313 HydrophobicContact CE1-CD2 3.92Å; F286-L313 HydrophobicContact CE1-CG 4.07Å; F286-L313 HydrophobicContact CZ-CD2 4.47Å; F286-A314 HydrophobicContact CD1-CB 4.48Å; F286-A314 HydrophobicContact CE1-CB 4.11Å; F286-L317 HydrophobicContact CZ-CD1 3.83Å; F286-F319 HydrophobicContact CD1-CZ 4.47Å; F286-F319 HydrophobicContact CD2-CZ 4.33Å; F286-F319 HydrophobicContact CE1-CE1 4.44Å; F286-F319 AromaticContact CE1-CZ 3.97Å; F286-F319 HydrophobicContact CE1-CZ 3.97Å; F286-F319 HydrophobicContact CE2-CE1 4.39Å; F286-F319 AromaticContact CE2-CZ 3.82Å; F286-F319 HydrophobicContact CE2-CZ 3.82Å; F286-F319 AromaticContact CZ-CE1 3.94Å; F286-F319 HydrophobicContact CZ-CE1 3.94Å; F286-F319 AromaticContact CZ-CZ 3.63Å; F286-F319 HydrophobicContact CZ-CZ 3.63Å; F286-L321 HydrophobicContact CB-CD1 3.78Å; F286-L321 HydrophobicContact CB-CD2 4.07Å; F286-L321 HydrophobicContact CD1-CD1 4.22Å; F286-L321 HydrophobicContact CD1-CD2 3.99Å; F286-L321 HydrophobicContact CG-CD1 4.02Å; F286-L321 HydrophobicContact CG-CD2 4.39Å; F286-L323 HydrophobicContact CB-CD2 4.42Å; F286-L323 VanDerWaalsContact O-CD1 3.32Å; F286-L323 WeakPolarHBondContact O-CD1 3.3Å; F286-L323 VanDerWaalsContact O-CD2 3.24Å; F286-L323 WeakPolarHBondContact O-CD2 2.98Å
287	G	85.6	Confident	80.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137	6.5	178.8	0	0	0	0	0	115.1	R262 Y284 Q285 F289 Y290	R262-G287 VanDerWaalsContact CZ-O 3.24Å; R262-G287 PolarHBondContact NH2-O 2.84Å; Y284-G287 PolarHBondContact O-N 3.14Å; Q285-G287 PolarHBondContact O-N 3.17Å; G287-F289 PolarHBondContact O-N 3.24Å; G287-F289 VanDerWaalsContact O-N 3.08Å; G287-Y290 WeakPolarHBondContact O-CB 3.35Å; G287-Y290 PolarHBondContact O-N 2.85Å
288	Q	84.5	Confident	78.3	Confident	71 Å²	71	62.4 Å²	62.4	33%	0.332	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-52.1	-33.4	-177.1	70.3	-174.2	7.4	0	0	113.3	Y284 Y290 D291 D292	Y284-Q288 HydrophobicContact CD1-CB 4.17Å; Y284-Q288 HydrophobicContact CE1-CB 3.6Å; Y284-Q288 HydrophobicContact CE2-CB 4.44Å; Y284-Q288 PolarHBondContact O-N 2.97Å; Q288-Y290 PolarHBondContact O-N 3.04Å; Q288-D291 WeakPolarHBondContact O-CB 3.28Å; Q288-D291 PolarHBondContact O-N 3.33Å; Q288-D292 PolarHBondContact O-N 3.11Å
289	F	81.7	Confident	76.8	Confident	8 Å²	8	64.1 Å²	64.1	4%	0.035	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-63.8	-13.5	178.7	64.4	-94.9	0	0	0	114.5	F286 G287 T303 Y306 K307 F310 L323	F286-F289 WeakPolarHBondContact O-CE1 3.16Å; G287-F289 PolarHBondContact O-N 3.24Å; G287-F289 VanDerWaalsContact O-N 3.08Å; F289-T303 HydrophobicContact CD2-CG2 3.95Å; F289-T303 HydrophobicContact CE2-CG2 3.74Å; F289-Y306 HydrophobicContact CB-CD2 4.24Å; F289-Y306 HydrophobicContact CB-CG 4.39Å; F289-K307 HydrophobicContact CZ-CB 4.22Å; F289-F310 AromaticContact CD1-CD2 3.78Å; F289-F310 HydrophobicContact CD1-CD2 3.78Å; F289-F310 AromaticContact CD1-CE2 3.78Å; F289-F310 HydrophobicContact CD1-CE2 3.78Å; F289-F310 AromaticContact CE1-CD2 3.74Å; F289-F310 HydrophobicContact CE1-CD2 3.74Å; F289-F310 HydrophobicContact CE1-CE2 4.23Å; F289-L323 HydrophobicContact CE1-CD1 4.09Å; F289-L323 HydrophobicContact CZ-CD1 3.79Å
290	Y	80.6	Confident	75.5	Confident	31 Å²	31	67.9 Å²	67.9	12%	0.122	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-82.8	-21.7	169.7	-71.4	-57.1	0	0	0	113.4	G287 Q288 D293 L323 K325	G287-Y290 WeakPolarHBondContact O-CB 3.35Å; G287-Y290 PolarHBondContact O-N 2.85Å; Q288-Y290 PolarHBondContact O-N 3.04Å; Y290-D293 WeakPolarHBondContact O-CB 3.45Å; Y290-D293 VanDerWaalsContact O-CG 3.29Å; Y290-L323 HydrophobicContact CE2-CB 4.1Å; Y290-K325 HydrophobicContact CD1-CB 4.45Å; Y290-K325 HydrophobicContact CD1-CD 4.44Å; Y290-K325 HydrophobicContact CD1-CG 3.62Å; Y290-K325 HydrophobicContact CE1-CG 3.65Å; Y290-K325 HydrophobicContact CG-CG 4.36Å
291	D	73.3	Confident	74.6	Confident	57 Å²	57	71.4 Å²	71.4	31%	0.305	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-24.2	179.9	-54.8	-24.8	0	0	0	111	R262 Y284 Q288 D293	R262-D291 IonicContact CZ-OD1 3.95Å; R262-D291 IonicContact CZ-OD2 3.94Å; R262-D291 IonicContact NE-OD1 3.46Å; R262-D291 PolarHBondContact NE-OD1 3.41Å; R262-D291 IonicContact NE-OD2 3.7Å; R262-D291 IonicContact NH2-OD1 3.03Å; R262-D291 PolarHBondContact NH2-OD1 2.83Å; R262-D291 VanDerWaalsContact NH2-OD1 3.12Å; R262-D291 IonicContact NH2-OD2 2.91Å; R262-D291 PolarHBondContact NH2-OD2 2.94Å; Y284-D291 WeakPolarHBondContact CE2-OD2 3.33Å; Q288-D291 WeakPolarHBondContact O-CB 3.28Å; Q288-D291 PolarHBondContact O-N 3.33Å; D291-D293 PolarHBondContact O-N 2.9Å; D291-D293 VanDerWaalsContact O-N 3.09Å
292	D	69.4	Low	73.9	Confident	104 Å²	104	73 Å²	73	56%	0.556	37%	0.373	S	S	*	.			trans	-74.3	13.9	173.7	-59	-33.1	0	0	0	113.5	Q288 N294	Q288-D292 PolarHBondContact O-N 3.11Å; D292-N294 PolarHBondContact O-N 3.32Å
293	D	57.4	Low	73.2	Confident	50 Å²	50	74.1 Å²	74.1	27%	0.267	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	11.3	-170.5	-103.6	10.2	0	0	0	115.8	Y290 D291 N295 Q299 K325	Y290-D293 WeakPolarHBondContact O-CB 3.45Å; Y290-D293 VanDerWaalsContact O-CG 3.29Å; D291-D293 PolarHBondContact O-N 2.9Å; D291-D293 VanDerWaalsContact O-N 3.09Å; D293-N295 VanDerWaalsContact C-N 3.35Å; D293-N295 PolarHBondContact O-N 2.93Å; D293-Q299 PolarHBondContact OD1-NE2 3.06Å; D293-K325 IonicContact OD1-NZ 3.13Å; D293-K325 IonicContact OD2-NZ 3.36Å; D293-K325 PolarHBondContact OD2-NZ 3.17Å
294	N	58.3	Low	72.6	Confident	152 Å²	152	80.3 Å²	80.3	81%	0.813	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.7	179.1	-73.9	-18.2	0	0	0	114.1	D292	D292-N294 PolarHBondContact O-N 3.32Å
295	N	55.1	Low	72.3	Confident	133 Å²	133	82 Å²	82	71%	0.711	42%	0.419	S	S	*	.			trans	-114.6	86.8	-175.8	-74.7	-22.7	0	0	0	113.3	D293 I297	D293-N295 VanDerWaalsContact C-N 3.35Å; D293-N295 PolarHBondContact O-N 2.93Å; N295-I297 PolarHBondContact O-N 3.25Å
296	K	57	Low	72.1	Confident	182 Å²	182	83.6 Å²	83.6	79%	0.791	42%	0.423	S	S	*	.			trans	-67	-19	-169.4	-71.3	178.6	177.7	173.3	0	117.2
297	I	52	Low	71.9	Confident	159 Å²	159	87.3 Å²	87.3	82%	0.815	44%	0.439	S	S	*	.	S	Bend	trans	-87.7	-38.1	-160.4	-60.7	175.7	0	0	0	114	N295	N295-I297 PolarHBondContact O-N 3.25Å
298	N	56	Low	72.1	Confident	127 Å²	127	91 Å²	91	68%	0.679	46%	0.461	S	S	*	.	S	Bend	trans	-103.9	11.5	179.9	-78.2	-18.6	0	0	0	113.9	L302	N298-L302 HydrophobicContact CB-CD1 4.33Å; N298-L302 WeakPolarHBondContact O-CG 3.48Å
299	Q	61.7	Low	72.4	Confident	36 Å²	36	93.5 Å²	93.5	17%	0.168	47%	0.471	C	S	.	.	H	α-helix	trans	-77.5	-30	-161.5	-128.9	-173.5	-13.2	0	0	113.8	D293 N301 L302 T303	D293-Q299 PolarHBondContact OD1-NE2 3.06Å; Q299-N301 PolarHBondContact O-N 2.87Å; Q299-L302 PolarHBondContact O-N 3.49Å; Q299-T303 WeakPolarHBondContact O-CA 3.44Å; Q299-T303 WeakPolarHBondContact O-CB 3.49Å; Q299-T303 PolarHBondContact O-N 3.24Å; Q299-T303 PolarHBondContact O-OG1 2.88Å
300	S	68.7	Low	72.9	Confident	78 Å²	78	93.6 Å²	93.6	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-67.1	-41.5	-171.6	71.8	0	0	0	0	112.3	K304	S300-K304 VanDerWaalsContact O-CG 3.26Å; S300-K304 WeakPolarHBondContact O-CG 3.43Å; S300-K304 PolarHBondContact O-N 2.94Å
301	N	74.4	Confident	73.4	Confident	103 Å²	103	94.4 Å²	94.4	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-74.7	-44.4	177.2	-74	-13.6	0	0	0	111.4	Q299 T303 K304 I305	Q299-N301 PolarHBondContact O-N 2.87Å; N301-T303 PolarHBondContact O-N 3.37Å; N301-K304 WeakPolarHBondContact O-CB 3.49Å; N301-K304 PolarHBondContact O-N 2.84Å; N301-I305 WeakPolarHBondContact O-CG1 3.02Å; N301-I305 PolarHBondContact O-N 2.99Å
302	L	77.2	Confident	74.3	Confident	82 Å²	82	95.8 Å²	95.8	43%	0.429	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176	-69.7	174.5	0	0	0	111.8	N298 Q299 K304 I305 Y306	N298-L302 HydrophobicContact CB-CD1 4.33Å; N298-L302 WeakPolarHBondContact O-CG 3.48Å; Q299-L302 PolarHBondContact O-N 3.49Å; L302-K304 VanDerWaalsContact C-N 3.3Å; L302-K304 PolarHBondContact O-N 3.08Å; L302-I305 PolarHBondContact O-N 2.84Å; L302-I305 VanDerWaalsContact O-N 3.13Å; L302-Y306 HydrophobicContact CB-CD2 4.33Å; L302-Y306 HydrophobicContact CB-CE2 4.17Å; L302-Y306 WeakPolarHBondContact O-CD2 3.43Å; L302-Y306 PolarHBondContact O-N 3.17Å
303	T	78.3	Confident	75.4	Confident	30 Å²	30	92.9 Å²	92.9	18%	0.184	47%	0.468	C	S	.	.	H	α-helix	trans	-58.1	-41.7	175.4	-63.5	0	0	0	0	111.7	F289 Q299 N301 K307	F289-T303 HydrophobicContact CD2-CG2 3.95Å; F289-T303 HydrophobicContact CE2-CG2 3.74Å; Q299-T303 WeakPolarHBondContact O-CA 3.44Å; Q299-T303 WeakPolarHBondContact O-CB 3.49Å; Q299-T303 PolarHBondContact O-N 3.24Å; Q299-T303 PolarHBondContact O-OG1 2.88Å; N301-T303 PolarHBondContact O-N 3.37Å; T303-K307 WeakPolarHBondContact O-CB 3.42Å; T303-K307 PolarHBondContact O-N 3.28Å
304	K	81.7	Confident	77.2	Confident	130 Å²	130	90.5 Å²	90.5	57%	0.565	46%	0.455	S	S	*	.	H	α-helix	trans	-64.3	-42	176.1	-74.6	169.2	-173.7	171.5	0	111.8	S300 N301 L302 T308	S300-K304 VanDerWaalsContact O-CG 3.26Å; S300-K304 WeakPolarHBondContact O-CG 3.43Å; S300-K304 PolarHBondContact O-N 2.94Å; N301-K304 WeakPolarHBondContact O-CB 3.49Å; N301-K304 PolarHBondContact O-N 2.84Å; L302-K304 VanDerWaalsContact C-N 3.3Å; L302-K304 PolarHBondContact O-N 3.08Å; K304-T308 WeakPolarHBondContact O-CB 3.24Å; K304-T308 PolarHBondContact O-N 3.05Å; K304-T308 PolarHBondContact O-OG1 2.03Å
305	I	84.9	Confident	78.7	Confident	110 Å²	110	86.7 Å²	86.7	56%	0.564	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-52.9	178	-66.8	166.3	0	0	0	110	N301 L302 K307 T308 F309	N301-I305 WeakPolarHBondContact O-CG1 3.02Å; N301-I305 PolarHBondContact O-N 2.99Å; L302-I305 PolarHBondContact O-N 2.84Å; L302-I305 VanDerWaalsContact O-N 3.13Å; I305-K307 VanDerWaalsContact C-N 3.34Å; I305-K307 PolarHBondContact O-N 3.44Å; I305-T308 PolarHBondContact O-N 3.12Å; I305-T308 VanDerWaalsContact O-N 3.16Å; I305-F309 PolarHBondContact O-N 3.29Å
306	Y	85.9	Confident	80.5	Confident	112 Å²	112	86.1 Å²	86.1	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-58.7	-45.3	177.9	-73.8	-56.5	0	0	0	112	F289 L302 T308 F309 F310	F289-Y306 HydrophobicContact CB-CD2 4.24Å; F289-Y306 HydrophobicContact CB-CG 4.39Å; L302-Y306 HydrophobicContact CB-CD2 4.33Å; L302-Y306 HydrophobicContact CB-CE2 4.17Å; L302-Y306 WeakPolarHBondContact O-CD2 3.43Å; L302-Y306 PolarHBondContact O-N 3.17Å; Y306-T308 VanDerWaalsContact C-N 3.33Å; Y306-T308 PolarHBondContact O-N 2.78Å; Y306-F309 WeakPolarHBondContact O-CB 3.39Å; Y306-F309 PolarHBondContact O-N 3.49Å; Y306-F310 HydrophobicContact CD1-CE2 4.32Å; Y306-F310 WeakPolarHBondContact O-CD2 3.49Å; Y306-F310 PolarHBondContact O-N 2.81Å
307	K	86.9	Confident	82.2	Confident	79 Å²	79	78.2 Å²	78.2	34%	0.343	40%	0.395	S	S	.	.	H	α-helix	trans	-57.1	-46.6	176.1	178.4	175.1	173.1	-180	0	111.6	F289 T303 I305 F310 E311 L323	F289-K307 HydrophobicContact CZ-CB 4.22Å; T303-K307 WeakPolarHBondContact O-CB 3.42Å; T303-K307 PolarHBondContact O-N 3.28Å; I305-K307 VanDerWaalsContact C-N 3.34Å; I305-K307 PolarHBondContact O-N 3.44Å; K307-F310 PolarHBondContact O-N 3.45Å; K307-E311 WeakPolarHBondContact CE-OE1 3.09Å; K307-E311 HydrophobicContact CG-CG 4.42Å; K307-E311 IonicContact NZ-OE1 3.88Å; K307-E311 WeakPolarHBondContact O-CB 3.38Å; K307-E311 VanDerWaalsContact O-CG 3.27Å; K307-E311 WeakPolarHBondContact O-CG 3.49Å; K307-E311 PolarHBondContact O-N 3.33Å; K307-L323 HydrophobicContact CG-CD1 4.39Å
308	T	88.4	Confident	84	Confident	76 Å²	76	72.9 Å²	72.9	47%	0.466	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-42.7	179.1	-53.7	0	0	0	0	111.3	K304 I305 Y306 E311 N312	K304-T308 WeakPolarHBondContact O-CB 3.24Å; K304-T308 PolarHBondContact O-N 3.05Å; K304-T308 PolarHBondContact O-OG1 2.03Å; I305-T308 PolarHBondContact O-N 3.12Å; I305-T308 VanDerWaalsContact O-N 3.16Å; Y306-T308 VanDerWaalsContact C-N 3.33Å; Y306-T308 PolarHBondContact O-N 2.78Å; T308-E311 PolarHBondContact O-N 2.77Å; T308-N312 VanDerWaalsContact O-CG 3.3Å; T308-N312 PolarHBondContact O-N 2.91Å; T308-N312 PolarHBondContact O-ND2 2.98Å
309	F	91.4	Very high	85.7	Confident	125 Å²	125	67 Å²	67	55%	0.548	34%	0.336	S	S	.	.	H	α-helix	trans	-58.7	-50.2	175.5	174.4	-96.4	0	0	0	111.9	I305 Y306 E311 N312 L313	I305-F309 PolarHBondContact O-N 3.29Å; Y306-F309 WeakPolarHBondContact O-CB 3.39Å; Y306-F309 PolarHBondContact O-N 3.49Å; F309-E311 PolarHBondContact O-N 3.1Å; F309-N312 WeakPolarHBondContact O-CB 3.02Å; F309-N312 PolarHBondContact O-N 3.11Å; F309-L313 PolarHBondContact O-N 3.39Å
310	F	92.2	Very high	87.1	Confident	10 Å²	10	68.1 Å²	68.1	4%	0.044	34%	0.34	C	S	.	.	H	α-helix	trans	-69.7	-33	-179.9	-71.6	-56.4	0	0	0	113.1	Q285 F286 F289 Y306 K307 N312 L313 A314 L321	Q285-F310 VanDerWaalsContact O-CE1 3.24Å; Q285-F310 WeakPolarHBondContact O-CE1 3.31Å; Q285-F310 WeakPolarHBondContact O-CZ 3.29Å; F286-F310 HydrophobicContact CD1-CB 4.15Å; F286-F310 HydrophobicContact CD1-CD1 4.19Å; F289-F310 AromaticContact CD1-CD2 3.78Å; F289-F310 HydrophobicContact CD1-CD2 3.78Å; F289-F310 AromaticContact CD1-CE2 3.78Å; F289-F310 HydrophobicContact CD1-CE2 3.78Å; F289-F310 AromaticContact CE1-CD2 3.74Å; F289-F310 HydrophobicContact CE1-CD2 3.74Å; F289-F310 HydrophobicContact CE1-CE2 4.23Å; Y306-F310 HydrophobicContact CD1-CE2 4.32Å; Y306-F310 WeakPolarHBondContact O-CD2 3.49Å; Y306-F310 PolarHBondContact O-N 2.81Å; K307-F310 PolarHBondContact O-N 3.45Å; F310-N312 VanDerWaalsContact C-N 3.33Å; F310-L313 HydrophobicContact CD1-CD2 4.27Å; F310-L313 PolarHBondContact O-N 3.02Å; F310-A314 WeakPolarHBondContact O-CB 3.5Å; F310-A314 PolarHBondContact O-N 2.83Å; F310-L321 HydrophobicContact CB-CD2 3.83Å
311	E	91.7	Very high	88.1	Confident	47 Å²	47	64.7 Å²	64.7	22%	0.22	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-41.6	170.3	-78.4	-178.6	-169.2	0	0	111.4	K307 T308 F309 A314 N315 L321	K307-E311 WeakPolarHBondContact CE-OE1 3.09Å; K307-E311 HydrophobicContact CG-CG 4.42Å; K307-E311 IonicContact NZ-OE1 3.88Å; K307-E311 WeakPolarHBondContact O-CB 3.38Å; K307-E311 VanDerWaalsContact O-CG 3.27Å; K307-E311 WeakPolarHBondContact O-CG 3.49Å; K307-E311 PolarHBondContact O-N 3.33Å; T308-E311 PolarHBondContact O-N 2.77Å; F309-E311 PolarHBondContact O-N 3.1Å; E311-A314 PolarHBondContact O-N 2.87Å; E311-N315 WeakPolarHBondContact O-CB 3.29Å; E311-N315 PolarHBondContact O-N 3.02Å; E311-N315 PolarHBondContact O-ND2 2.95Å; E311-N315 VanDerWaalsContact O-ND2 3.11Å; E311-L321 HydrophobicContact CG-CB 4.27Å; E311-L321 HydrophobicContact CG-CD2 4.27Å
312	N	91.7	Very high	88.9	Confident	86 Å²	86	61.6 Å²	61.6	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-43.9	175.4	-71.9	-20.9	0	0	0	112	T308 F309 F310 A314 N315 Q316	T308-N312 VanDerWaalsContact O-CG 3.3Å; T308-N312 PolarHBondContact O-N 2.91Å; T308-N312 PolarHBondContact O-ND2 2.98Å; F309-N312 WeakPolarHBondContact O-CB 3.02Å; F309-N312 PolarHBondContact O-N 3.11Å; F310-N312 VanDerWaalsContact C-N 3.33Å; N312-A314 VanDerWaalsContact C-N 3.35Å; N312-A314 PolarHBondContact O-N 3.24Å; N312-N315 WeakPolarHBondContact O-CB 3.27Å; N312-N315 PolarHBondContact O-N 2.82Å; N312-Q316 WeakPolarHBondContact O-CG 3.33Å; N312-Q316 PolarHBondContact O-N 3.06Å
313	L	93.2	Very high	89	Confident	43 Å²	43	59.1 Å²	59.1	23%	0.225	28%	0.284	C	S	.	.	H	α-helix	trans	-60.2	-44.2	175.9	-178.2	63.8	0	0	0	111.7	F286 F309 F310 N315 Q316 L317	F286-L313 HydrophobicContact CE1-CB 4.37Å; F286-L313 HydrophobicContact CE1-CD2 3.92Å; F286-L313 HydrophobicContact CE1-CG 4.07Å; F286-L313 HydrophobicContact CZ-CD2 4.47Å; F309-L313 PolarHBondContact O-N 3.39Å; F310-L313 HydrophobicContact CD1-CD2 4.27Å; F310-L313 PolarHBondContact O-N 3.02Å; L313-N315 PolarHBondContact O-N 2.75Å; L313-Q316 WeakPolarHBondContact O-CB 3.41Å; L313-Q316 PolarHBondContact O-N 2.95Å; L313-L317 HydrophobicContact CG-CD1 4.37Å; L313-L317 WeakPolarHBondContact O-CG 3.11Å; L313-L317 PolarHBondContact O-N 3.09Å
314	A	93.5	Very high	89.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-42.5	175.6	0	0	0	0	0	112.2	F286 F310 E311 N312 Q316 L317 N318 F319 L321	F286-A314 HydrophobicContact CD1-CB 4.48Å; F286-A314 HydrophobicContact CE1-CB 4.11Å; F310-A314 WeakPolarHBondContact O-CB 3.5Å; F310-A314 PolarHBondContact O-N 2.83Å; E311-A314 PolarHBondContact O-N 2.87Å; N312-A314 VanDerWaalsContact C-N 3.35Å; N312-A314 PolarHBondContact O-N 3.24Å; A314-Q316 VanDerWaalsContact C-N 3.3Å; A314-Q316 PolarHBondContact O-N 2.83Å; A314-L317 CarbonylContact O-C 3.55Å; A314-L317 WeakPolarHBondContact O-CA 3.5Å; A314-L317 PolarHBondContact O-N 3.21Å; A314-N318 PolarHBondContact O-N 3.11Å; A314-F319 CarbonylContact C-O 3.48Å; A314-F319 HydrophobicContact CB-CD1 4.13Å; A314-F319 HydrophobicContact CB-CD2 4.06Å; A314-F319 HydrophobicContact CB-CE1 3.7Å; A314-F319 HydrophobicContact CB-CE2 3.62Å; A314-F319 HydrophobicContact CB-CG 4.29Å; A314-F319 HydrophobicContact CB-CZ 3.42Å; A314-F319 VanDerWaalsContact CB-CZ 3.42Å; A314-F319 WeakPolarHBondContact O-CD1 3.19Å; A314-F319 PolarHBondContact O-N 2.82Å; A314-L321 HydrophobicContact CB-CB 3.62Å; A314-L321 HydrophobicContact CB-CD2 4.37Å; A314-L321 HydrophobicContact CB-CG 4.39Å
315	N	91.2	Very high	89.4	Confident	73 Å²	73	59.7 Å²	59.7	39%	0.39	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-39	175.2	-67.1	-29.1	0	0	0	111.3	E311 N312 L313 L317 N318 F319	E311-N315 WeakPolarHBondContact O-CB 3.29Å; E311-N315 PolarHBondContact O-N 3.02Å; E311-N315 PolarHBondContact O-ND2 2.95Å; E311-N315 VanDerWaalsContact O-ND2 3.11Å; N312-N315 WeakPolarHBondContact O-CB 3.27Å; N312-N315 PolarHBondContact O-N 2.82Å; L313-N315 PolarHBondContact O-N 2.75Å; N315-L317 VanDerWaalsContact C-N 3.26Å; N315-L317 PolarHBondContact O-N 2.81Å; N315-N318 PolarHBondContact O-N 2.74Å; N315-F319 PolarHBondContact N-O 2.83Å
316	Q	91.9	Very high	89.7	Confident	121 Å²	121	58.3 Å²	58.3	57%	0.565	28%	0.283	S	S	*	.	H	α-helix	trans	-63	-33.3	173.9	-72	172.3	-11.9	0	0	112.1	K65 N312 L313 A314 N318	K65-Q316 WeakPolarHBondContact CD-O 3.09Å; K65-Q316 WeakPolarHBondContact CE-O 3.39Å; K65-Q316 VanDerWaalsContact CG-O 3.25Å; K65-Q316 WeakPolarHBondContact CG-O 3.32Å; N312-Q316 WeakPolarHBondContact O-CG 3.33Å; N312-Q316 PolarHBondContact O-N 3.06Å; L313-Q316 WeakPolarHBondContact O-CB 3.41Å; L313-Q316 PolarHBondContact O-N 2.95Å; A314-Q316 VanDerWaalsContact C-N 3.3Å; A314-Q316 PolarHBondContact O-N 2.83Å; Q316-N318 PolarHBondContact O-N 3.23Å
317	L	92.7	Very high	90	Very high	16 Å²	16	56.8 Å²	56.8	8%	0.084	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	13.2	173.2	-64.9	169.8	0	0	0	113.4	L63 F286 L313 A314 N315 F319	L63-L317 HydrophobicContact CB-CD1 3.93Å; L63-L317 HydrophobicContact CB-CD2 4.22Å; L63-L317 HydrophobicContact CD1-CD1 4.32Å; F286-L317 HydrophobicContact CZ-CD1 3.83Å; L313-L317 HydrophobicContact CG-CD1 4.37Å; L313-L317 WeakPolarHBondContact O-CG 3.11Å; L313-L317 PolarHBondContact O-N 3.09Å; A314-L317 CarbonylContact O-C 3.55Å; A314-L317 WeakPolarHBondContact O-CA 3.5Å; A314-L317 PolarHBondContact O-N 3.21Å; N315-L317 VanDerWaalsContact C-N 3.26Å; N315-L317 PolarHBondContact O-N 2.81Å; L317-F319 HydrophobicContact CB-CD1 3.8Å; L317-F319 HydrophobicContact CB-CE1 3.82Å; L317-F319 HydrophobicContact CD1-CE1 4.09Å; L317-F319 PolarHBondContact O-N 3.28Å
318	N	89.7	Confident	90.3	Very high	47 Å²	47	53 Å²	53	25%	0.251	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	29.1	177.4	-61.1	-19.7	0	0	0	115.7	A314 N315 Q316	A314-N318 PolarHBondContact O-N 3.11Å; N315-N318 PolarHBondContact O-N 2.74Å; Q316-N318 PolarHBondContact O-N 3.23Å
319	F	91.5	Very high	90.6	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.018	24%	0.242	C	C	.	.			trans	-135.9	151.6	175.1	80	-87.8	0	0	0	113.7	I178 Y181 F283 F286 A314 N315 L317 L321 P331	I178-F319 HydrophobicContact CB-CB 4.43Å; I178-F319 HydrophobicContact CG1-CB 4.27Å; I178-F319 HydrophobicContact CG1-CD1 3.81Å; I178-F319 HydrophobicContact CG1-CE1 4.43Å; I178-F319 HydrophobicContact CG1-CG 4.23Å; I178-F319 HydrophobicContact CG2-CB 4.1Å; Y181-F319 HydrophobicContact CE2-CB 4.36Å; Y181-F319 WeakPolarHBondContact OH-CB 3.48Å; F283-F319 HydrophobicContact CD1-CZ 4.38Å; F283-F319 HydrophobicContact CE1-CE2 4.45Å; F283-F319 HydrophobicContact CE1-CZ 4.16Å; F286-F319 HydrophobicContact CD1-CZ 4.47Å; F286-F319 HydrophobicContact CD2-CZ 4.33Å; F286-F319 HydrophobicContact CE1-CE1 4.44Å; F286-F319 AromaticContact CE1-CZ 3.97Å; F286-F319 HydrophobicContact CE1-CZ 3.97Å; F286-F319 HydrophobicContact CE2-CE1 4.39Å; F286-F319 AromaticContact CE2-CZ 3.82Å; F286-F319 HydrophobicContact CE2-CZ 3.82Å; F286-F319 AromaticContact CZ-CE1 3.94Å; F286-F319 HydrophobicContact CZ-CE1 3.94Å; F286-F319 AromaticContact CZ-CZ 3.63Å; F286-F319 HydrophobicContact CZ-CZ 3.63Å; A314-F319 CarbonylContact C-O 3.48Å; A314-F319 HydrophobicContact CB-CD1 4.13Å; A314-F319 HydrophobicContact CB-CD2 4.06Å; A314-F319 HydrophobicContact CB-CE1 3.7Å; A314-F319 HydrophobicContact CB-CE2 3.62Å; A314-F319 HydrophobicContact CB-CG 4.29Å; A314-F319 HydrophobicContact CB-CZ 3.42Å; A314-F319 VanDerWaalsContact CB-CZ 3.42Å; A314-F319 WeakPolarHBondContact O-CD1 3.19Å; A314-F319 PolarHBondContact O-N 2.82Å; N315-F319 PolarHBondContact N-O 2.83Å; L317-F319 HydrophobicContact CB-CD1 3.8Å; L317-F319 HydrophobicContact CB-CE1 3.82Å; L317-F319 HydrophobicContact CD1-CE1 4.09Å; L317-F319 PolarHBondContact O-N 3.28Å; F319-L321 HydrophobicContact CE2-CB 4.45Å; F319-L321 HydrophobicContact CE2-CD1 3.94Å; F319-L321 HydrophobicContact CZ-CD1 4.48Å; F319-P331 HydrophobicContact CB-CG 4.18Å; F319-P331 HydrophobicContact CD2-CG 4.16Å; F319-P331 HydrophobicContact CG-CG 4.24Å
320	K	91.3	Very high	90.8	Very high	59 Å²	59	44.3 Å²	44.3	26%	0.257	22%	0.216	S	C	.	.			trans	-85.7	126.4	174.3	-173.4	63.8	179.7	171.1	0	109.7	Y235 Y257 F322	Y235-K320 HydrophobicContact CD1-CB 4.06Å; Y235-K320 HydrophobicContact CD1-CG 4.16Å; Y235-K320 HydrophobicContact CE1-CB 4.03Å; Y235-K320 HydrophobicContact CG-CB 4.37Å; Y235-K320 HydrophobicContact CG-CG 4.14Å; Y257-K320 WeakPolarHBondContact CE1-O 3.44Å; Y257-K320 PolarHBondContact OH-O 3.02Å; K320-F322 HydrophobicContact CB-CE2 4.1Å; K320-F322 HydrophobicContact CG-CE2 3.88Å; K320-F322 HydrophobicContact CG-CZ 3.98Å
321	L	91.4	Very high	90.9	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.031	21%	0.214	C	C	.	.			trans	-81.5	130.2	177.2	-171.4	59.9	0	0	0	111.3	F286 F310 E311 A314 F319 L323	F286-L321 HydrophobicContact CB-CD1 3.78Å; F286-L321 HydrophobicContact CB-CD2 4.07Å; F286-L321 HydrophobicContact CD1-CD1 4.22Å; F286-L321 HydrophobicContact CD1-CD2 3.99Å; F286-L321 HydrophobicContact CG-CD1 4.02Å; F286-L321 HydrophobicContact CG-CD2 4.39Å; F310-L321 HydrophobicContact CB-CD2 3.83Å; E311-L321 HydrophobicContact CG-CB 4.27Å; E311-L321 HydrophobicContact CG-CD2 4.27Å; A314-L321 HydrophobicContact CB-CB 3.62Å; A314-L321 HydrophobicContact CB-CD2 4.37Å; A314-L321 HydrophobicContact CB-CG 4.39Å; F319-L321 HydrophobicContact CE2-CB 4.45Å; F319-L321 HydrophobicContact CE2-CD1 3.94Å; F319-L321 HydrophobicContact CZ-CD1 4.48Å; L321-L323 HydrophobicContact CD1-CD2 3.85Å; L321-L323 HydrophobicContact CD1-CG 4.17Å; L321-L323 HydrophobicContact CD2-CD1 3.65Å; L321-L323 HydrophobicContact CD2-CD2 4.18Å; L321-L323 HydrophobicContact CD2-CG 3.91Å; L321-L323 HydrophobicContact CG-CD1 4.04Å; L321-L323 HydrophobicContact CG-CD2 3.99Å; L321-L323 HydrophobicContact CG-CG 3.74Å
322	F	89.9	Confident	90.9	Very high	38 Å²	38	41.6 Å²	41.6	17%	0.167	20%	0.204	C	C	.	.			trans	-119.6	124.4	169.4	-67.8	-82.8	0	0	0	108.6	K233 Y235 Y257 K320 Y329	K233-F322 HydrophobicContact CB-CD1 4.31Å; K233-F322 HydrophobicContact CB-CD2 3.75Å; K233-F322 HydrophobicContact CB-CE1 4.01Å; K233-F322 HydrophobicContact CB-CE2 3.4Å; K233-F322 VanDerWaalsContact CB-CE2 3.4Å; K233-F322 HydrophobicContact CB-CG 4.2Å; K233-F322 HydrophobicContact CB-CZ 3.55Å; K233-F322 HydrophobicContact CD-CD1 4.21Å; K233-F322 HydrophobicContact CD-CG 4.25Å; K233-F322 HydrophobicContact CG-CD1 4.31Å; K233-F322 HydrophobicContact CG-CD2 3.84Å; K233-F322 HydrophobicContact CG-CE1 4.49Å; K233-F322 HydrophobicContact CG-CE2 4.05Å; K233-F322 HydrophobicContact CG-CG 3.98Å; K233-F322 HydrophobicContact CG-CZ 4.37Å; Y235-F322 HydrophobicContact CD1-CE2 4.24Å; Y235-F322 AromaticContact CD1-CZ 3.98Å; Y235-F322 HydrophobicContact CD1-CZ 3.98Å; Y257-F322 HydrophobicContact CD1-CD2 4.37Å; Y257-F322 HydrophobicContact CD2-CD2 4.39Å; Y257-F322 HydrophobicContact CD2-CE2 4.44Å; Y257-F322 AromaticContact CE1-CD2 3.82Å; Y257-F322 HydrophobicContact CE1-CD2 3.82Å; Y257-F322 HydrophobicContact CE1-CE2 4.36Å; Y257-F322 AromaticContact CE2-CD2 3.85Å; Y257-F322 HydrophobicContact CE2-CD2 3.85Å; Y257-F322 AromaticContact CE2-CE2 3.66Å; Y257-F322 HydrophobicContact CE2-CE2 3.66Å; Y257-F322 AromaticContact CZ-CD2 3.55Å; Y257-F322 AromaticContact CZ-CE2 3.62Å; K320-F322 HydrophobicContact CB-CE2 4.1Å; K320-F322 HydrophobicContact CG-CE2 3.88Å; K320-F322 HydrophobicContact CG-CZ 3.98Å; F322-Y329 HydrophobicContact CB-CD2 3.92Å; F322-Y329 HydrophobicContact CB-CG 4.03Å; F322-Y329 WeakPolarHBondContact O-CD2 3.49Å
323	L	79.7	Confident	91	Very high	29 Å²	29	38.2 Å²	38.2	15%	0.152	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-128.4	143.4	-175.2	-65.4	174.1	0	0	0	111.1	F286 F289 Y290 K307 L321 L328	F286-L323 HydrophobicContact CB-CD2 4.42Å; F286-L323 VanDerWaalsContact O-CD1 3.32Å; F286-L323 WeakPolarHBondContact O-CD1 3.3Å; F286-L323 VanDerWaalsContact O-CD2 3.24Å; F286-L323 WeakPolarHBondContact O-CD2 2.98Å; F289-L323 HydrophobicContact CE1-CD1 4.09Å; F289-L323 HydrophobicContact CZ-CD1 3.79Å; Y290-L323 HydrophobicContact CE2-CB 4.1Å; K307-L323 HydrophobicContact CG-CD1 4.39Å; L321-L323 HydrophobicContact CD1-CD2 3.85Å; L321-L323 HydrophobicContact CD1-CG 4.17Å; L321-L323 HydrophobicContact CD2-CD1 3.65Å; L321-L323 HydrophobicContact CD2-CD2 4.18Å; L321-L323 HydrophobicContact CD2-CG 3.91Å; L321-L323 HydrophobicContact CG-CD1 4.04Å; L321-L323 HydrophobicContact CG-CD2 3.99Å; L321-L323 HydrophobicContact CG-CG 3.74Å; L323-L328 HydrophobicContact CD2-CD1 4.45Å
324	N	84.2	Confident	91.1	Very high	46 Å²	46	36.1 Å²	36.1	25%	0.246	17%	0.174	C	C	.	.			trans	-147.5	171.9	158.1	63.6	26.9	0	0	0	109.4	T326 Y327 Y329	N324-T326 PolarHBondContact O-N 3.48Å; N324-T326 PolarHBondContact OD1-N 2.93Å; N324-T326 PolarHBondContact OD1-OG1 2.94Å; N324-Y327 VanDerWaalsContact OD1-CA 3.3Å; N324-Y327 WeakPolarHBondContact OD1-CA 3.39Å; N324-Y327 WeakPolarHBondContact OD1-CB 3.48Å; N324-Y327 PolarHBondContact OD1-N 3.08Å; N324-Y327 PolarHBondContact OD1-O 3.08Å; N324-Y329 PolarHBondContact ND2-OH 2.85Å
325	K	85.1	Confident	91.1	Very high	126 Å²	126	36.4 Å²	36.4	55%	0.548	18%	0.176	S	C	.	.	S	Bend	trans	-64.8	-19.5	-177.6	-69.1	-163.8	167.8	-136.1	0	114.3	R262 Y290 D293	R262-K325 VanDerWaalsContact CD-O 3.31Å; R262-K325 WeakPolarHBondContact CD-O 3.33Å; Y290-K325 HydrophobicContact CD1-CB 4.45Å; Y290-K325 HydrophobicContact CD1-CD 4.44Å; Y290-K325 HydrophobicContact CD1-CG 3.62Å; Y290-K325 HydrophobicContact CE1-CG 3.65Å; Y290-K325 HydrophobicContact CG-CG 4.36Å; D293-K325 IonicContact OD1-NZ 3.13Å; D293-K325 IonicContact OD2-NZ 3.36Å; D293-K325 PolarHBondContact OD2-NZ 3.17Å
326	T	90.4	Very high	91.3	Very high	81 Å²	81	32.9 Å²	32.9	50%	0.497	16%	0.157	S	C	.	.	S	Bend	trans	-110.1	-26.2	-166.9	47	0	0	0	0	113.4	R262 N324	R262-T326 PolarHBondContact N-O 3.14Å; N324-T326 PolarHBondContact O-N 3.48Å; N324-T326 PolarHBondContact OD1-N 2.93Å; N324-T326 PolarHBondContact OD1-OG1 2.94Å
327	Y	92.7	Very high	91.4	Very high	81 Å²	81	27.3 Å²	27.3	32%	0.318	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149	-170.9	-56.9	-74.7	0	0	0	112.2	R259 I260 P261 N324	R259-Y327 HydrophobicContact CG-CD1 3.69Å; R259-Y327 HydrophobicContact CG-CD2 4.45Å; R259-Y327 HydrophobicContact CG-CG 3.68Å; I260-Y327 CarbonylContact O-C 3.48Å; I260-Y327 WeakPolarHBondContact O-CA 3.46Å; I260-Y327 WeakPolarHBondContact O-CB 3.22Å; P261-Y327 HydrophobicContact CB-CD1 4.39Å; P261-Y327 HydrophobicContact CB-CE1 4.4Å; N324-Y327 VanDerWaalsContact OD1-CA 3.3Å; N324-Y327 WeakPolarHBondContact OD1-CA 3.39Å; N324-Y327 WeakPolarHBondContact OD1-CB 3.48Å; N324-Y327 PolarHBondContact OD1-N 3.08Å; N324-Y327 PolarHBondContact OD1-O 3.08Å
328	L	92.4	Very high	91.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	138	167.6	-169.6	62.7	0	0	0	108.8	R259 I260 F283 L323 I330	R259-L328 WeakPolarHBondContact CA-O 3.33Å; I260-L328 HydrophobicContact CD1-CB 4.46Å; I260-L328 HydrophobicContact CD1-CD2 4.24Å; I260-L328 HydrophobicContact CG1-CB 3.89Å; I260-L328 PolarHBondContact N-O 2.75Å; I260-L328 PolarHBondContact O-N 3.21Å; F283-L328 HydrophobicContact CB-CD1 4.24Å; F283-L328 HydrophobicContact CB-CD2 3.41Å; F283-L328 VanDerWaalsContact CB-CD2 3.41Å; F283-L328 HydrophobicContact CB-CG 4.03Å; L323-L328 HydrophobicContact CD2-CD1 4.45Å; L328-I330 HydrophobicContact CD2-CD1 4.4Å; L328-I330 HydrophobicContact CD2-CG1 4.49Å; L328-I330 HydrophobicContact CG-CG1 4.32Å
329	Y	94.8	Very high	91.5	Very high	17 Å²	17	26.2 Å²	26.2	7%	0.067	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.1	177.4	-67.1	-85.4	0	0	0	109.8	T231 K233 I258 R259 F322 N324	T231-Y329 HydrophobicContact CG2-CD1 4.33Å; T231-Y329 HydrophobicContact CG2-CE1 4.1Å; K233-Y329 HydrophobicContact CD-CE1 4.48Å; K233-Y329 HydrophobicContact CG-CD1 4.49Å; K233-Y329 PolarHBondContact NZ-OH 3.14Å; K233-Y329 VanDerWaalsContact NZ-OH 3.15Å; I258-Y329 WeakPolarHBondContact O-CA 3.29Å; R259-Y329 HydrophobicContact CB-CD1 3.88Å; R259-Y329 HydrophobicContact CB-CE1 3.65Å; R259-Y329 HydrophobicContact CG-CD1 4.17Å; R259-Y329 HydrophobicContact CG-CE1 3.63Å; F322-Y329 HydrophobicContact CB-CD2 3.92Å; F322-Y329 HydrophobicContact CB-CG 4.03Å; F322-Y329 WeakPolarHBondContact O-CD2 3.49Å; N324-Y329 PolarHBondContact ND2-OH 2.85Å
330	I	95.2	Very high	91.6	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.8	-175.3	-63.4	170.4	0	0	0	108.5	Y257 I258 I260 L279 F283 L328 C332 Y334 F337	Y257-I330 CarbonylContact C-O 3.57Å; Y257-I330 WeakPolarHBondContact CA-O 3.01Å; Y257-I330 VanDerWaalsContact CD1-C 3.47Å; I258-I330 PolarHBondContact N-O 2.67Å; I258-I330 PolarHBondContact O-N 3.36Å; I260-I330 HydrophobicContact CD1-CD1 3.84Å; I260-I330 HydrophobicContact CG1-CD1 4.36Å; L279-I330 HydrophobicContact CB-CD1 3.52Å; L279-I330 HydrophobicContact CD1-CD1 4.28Å; L279-I330 HydrophobicContact CD2-CD1 4.1Å; L279-I330 HydrophobicContact CD2-CG2 4.43Å; L279-I330 HydrophobicContact CG-CD1 4.17Å; L279-I330 WeakPolarHBondContact O-CD1 3.32Å; F283-I330 HydrophobicContact CB-CD1 4.44Å; F283-I330 HydrophobicContact CB-CG1 4.22Å; F283-I330 HydrophobicContact CD1-CG1 4.22Å; F283-I330 HydrophobicContact CD2-CD1 3.78Å; F283-I330 HydrophobicContact CD2-CG1 3.75Å; F283-I330 HydrophobicContact CD2-CG2 4.07Å; F283-I330 HydrophobicContact CE1-CG2 4.19Å; F283-I330 HydrophobicContact CE2-CB 4.4Å; F283-I330 HydrophobicContact CE2-CD1 4.28Å; F283-I330 HydrophobicContact CE2-CG1 4.13Å; F283-I330 HydrophobicContact CE2-CG2 3.52Å; F283-I330 HydrophobicContact CG-CD1 4.2Å; F283-I330 HydrophobicContact CG-CG1 3.81Å; F283-I330 HydrophobicContact CZ-CB 4.5Å; F283-I330 HydrophobicContact CZ-CG2 3.59Å; L328-I330 HydrophobicContact CD2-CD1 4.4Å; L328-I330 HydrophobicContact CD2-CG1 4.49Å; L328-I330 HydrophobicContact CG-CG1 4.32Å; I330-C332 PolarHBondContact O-N 3.35Å; I330-Y334 HydrophobicContact CG2-CD1 4.42Å; I330-F337 HydrophobicContact CG2-CE2 4.18Å; I330-F337 HydrophobicContact CG2-CZ 3.98Å
331	P	94.6	Very high	91.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	134.4	-179.6	27.5	-35	0	0	0	110.9	I178 Y181 Y257 F319 Q333 Y334 F337	I178-P331 HydrophobicContact CB-CG 4.47Å; I178-P331 HydrophobicContact CD1-CG 3.72Å; I178-P331 HydrophobicContact CG1-CG 3.95Å; I178-P331 HydrophobicContact CG2-CB 4Å; I178-P331 HydrophobicContact CG2-CG 3.65Å; Y181-P331 HydrophobicContact CE1-CB 4.09Å; Y181-P331 WeakPolarHBondContact OH-CB 3.38Å; Y257-P331 HydrophobicContact CD1-CB 4.34Å; Y257-P331 HydrophobicContact CE1-CB 3.98Å; F319-P331 HydrophobicContact CB-CG 4.18Å; F319-P331 HydrophobicContact CD2-CG 4.16Å; F319-P331 HydrophobicContact CG-CG 4.24Å; P331-Q333 PolarHBondContact O-N 2.93Å; P331-Y334 WeakPolarHBondContact O-CB 3.21Å; P331-Y334 PolarHBondContact O-N 3.17Å; P331-F337 WeakPolarHBondContact O-CE2 3.49Å
332	C	92.9	Very high	90.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.2	-180	-64.4	0	0	0	0	113.7	C256 Y257 I330 Y334 F337 P349 L350	C256-C332 HydrophobicContact CB-CB 3.55Å; C256-C332 WeakPolarHBondContact CB-SG 3.4Å; C256-C332 PolarHBondContact O-N 3.47Å; C256-C332 PolarHBondContact O-SG 2.86Å; C256-C332 VanDerWaalsContact O-SG 3.34Å; C256-C332 WeakPolarHBondContact SG-CB 3.45Å; C256-C332 CovalentContact SG-SG 2.04Å; C256-C332 PolarHBondContact SG-SG 3.38Å; Y257-C332 PolarHBondContact N-SG 2.88Å; Y257-C332 VanDerWaalsContact N-SG 3.35Å; I330-C332 PolarHBondContact O-N 3.35Å; C332-Y334 PolarHBondContact O-N 2.81Å; C332-F337 WeakPolarHBondContact O-CD2 3.45Å; C332-P349 HydrophobicContact CB-CB 3.83Å; C332-P349 WeakPolarHBondContact CB-O 3.09Å; C332-L350 WeakPolarHBondContact O-CD2 3.38Å
333	Q	92.5	Very high	90.3	Very high	15 Å²	15	24.7 Å²	24.7	7%	0.07	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-1.9	178.3	-68.6	74.5	13.4	0	0	113	I178 N179 Y181 P331 N335 N354	I178-Q333 HydrophobicContact CG2-CB 3.84Å; N179-Q333 HydrophobicContact CB-CB 4.05Å; N179-Q333 PolarHBondContact N-O 2.85Å; N179-Q333 PolarHBondContact ND2-O 2.71Å; N179-Q333 WeakPolarHBondContact O-CB 3.48Å; Y181-Q333 HydrophobicContact CD1-CB 4.39Å; Y181-Q333 HydrophobicContact CD1-CG 3.62Å; Y181-Q333 HydrophobicContact CE1-CB 4.19Å; Y181-Q333 HydrophobicContact CE1-CG 3.83Å; P331-Q333 PolarHBondContact O-N 2.93Å; Q333-N335 PolarHBondContact O-N 3.34Å; Q333-N335 VanDerWaalsContact O-N 3.15Å; Q333-N354 PolarHBondContact NE2-ND2 3.32Å; Q333-N354 PolarHBondContact NE2-OD1 3.23Å
334	Y	94.9	Very high	90	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-58.7	118.1	173.7	-179.3	-144.1	0	0	0	110.2	I61 L63 D176 I178 L279 F283 I330 P331 C332 L336 F337	I61-Y334 WeakPolarHBondContact CG2-OH 3.43Å; L63-Y334 HydrophobicContact CD2-CD2 4.17Å; L63-Y334 HydrophobicContact CD2-CE2 3.53Å; D176-Y334 HydrophobicContact CB-CE2 3.87Å; I178-Y334 HydrophobicContact CD1-CD2 3.62Å; I178-Y334 HydrophobicContact CD1-CG 4.04Å; L279-Y334 HydrophobicContact CD2-CD1 3.97Å; L279-Y334 HydrophobicContact CD2-CE1 4.04Å; F283-Y334 AromaticContact CE2-CD1 3.9Å; F283-Y334 HydrophobicContact CE2-CD1 3.9Å; F283-Y334 AromaticContact CE2-CE1 3.92Å; F283-Y334 HydrophobicContact CE2-CE1 3.92Å; F283-Y334 HydrophobicContact CE2-CG 4.22Å; F283-Y334 HydrophobicContact CZ-CD1 4.31Å; F283-Y334 HydrophobicContact CZ-CD2 4.36Å; F283-Y334 HydrophobicContact CZ-CG 4.17Å; I330-Y334 HydrophobicContact CG2-CD1 4.42Å; P331-Y334 WeakPolarHBondContact O-CB 3.21Å; P331-Y334 PolarHBondContact O-N 3.17Å; C332-Y334 PolarHBondContact O-N 2.81Å; Y334-L336 VanDerWaalsContact C-N 3.25Å; Y334-L336 HydrophobicContact CD1-CB 4.01Å; Y334-L336 HydrophobicContact CD2-CB 4.43Å; Y334-L336 HydrophobicContact CE1-CB 3.52Å; Y334-L336 HydrophobicContact CE1-CD2 3.88Å; Y334-L336 HydrophobicContact CE1-CG 4.21Å; Y334-L336 HydrophobicContact CE2-CB 4Å; Y334-L336 HydrophobicContact CG-CB 4.44Å; Y334-L336 PolarHBondContact O-N 2.95Å; Y334-L336 WeakPolarHBondContact OH-CD2 3.34Å; Y334-F337 HydrophobicContact CD1-CD2 4.45Å; Y334-F337 HydrophobicContact CD1-CE2 4.19Å; Y334-F337 HydrophobicContact CD1-CZ 4.32Å; Y334-F337 HydrophobicContact CG-CE2 4.39Å; Y334-F337 WeakPolarHBondContact O-CB 3.34Å; Y334-F337 WeakPolarHBondContact O-CD2 3.14Å; Y334-F337 PolarHBondContact O-N 2.71Å; Y334-F337 VanDerWaalsContact O-N 3.15Å
335	N	93.6	Very high	89.5	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.027	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-70.4	-19.6	-165.6	171.1	68.1	0	0	0	113.6	R94 D176 Y177 Q333 F337 K338	R94-N335 WeakPolarHBondContact CB-ND2 3.21Å; R94-N335 VanDerWaalsContact CG-ND2 3.31Å; R94-N335 WeakPolarHBondContact CG-ND2 3.35Å; D176-N335 VanDerWaalsContact OD1-CB 3.23Å; D176-N335 WeakPolarHBondContact OD1-CB 3.46Å; D176-N335 PolarHBondContact OD1-ND2 3.43Å; Y177-N335 HydrophobicContact CD2-CB 4.29Å; Y177-N335 HydrophobicContact CE1-CB 4.46Å; Y177-N335 HydrophobicContact CE2-CB 3.98Å; Y177-N335 WeakPolarHBondContact O-CB 3.31Å; Y177-N335 PolarHBondContact O-N 3.49Å; Y177-N335 VanDerWaalsContact O-N 3.11Å; Q333-N335 PolarHBondContact O-N 3.34Å; Q333-N335 VanDerWaalsContact O-N 3.15Å; N335-F337 PolarHBondContact O-N 2.89Å; N335-K338 WeakPolarHBondContact O-CD 3.21Å; N335-K338 WeakPolarHBondContact O-CG 3.37Å; N335-K338 WeakPolarHBondContact OD1-CE 3.35Å; N335-K338 PolarHBondContact OD1-NZ 3.43Å
336	L	95.2	Very high	89.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-61.7	-25.3	172.2	-174.9	48	0	0	0	113.3	H174 D176 I278 Y334 K338 Q339 L340	H174-L336 HydrophobicContact CB-CD2 4.41Å; D176-L336 WeakPolarHBondContact OD2-CA 3.3Å; D176-L336 VanDerWaalsContact OD2-CB 3.28Å; D176-L336 WeakPolarHBondContact OD2-CB 3.27Å; D176-L336 PolarHBondContact OD2-N 2.88Å; D176-L336 VanDerWaalsContact OD2-N 3.14Å; I278-L336 HydrophobicContact CG2-CD2 3.41Å; I278-L336 VanDerWaalsContact CG2-CD2 3.41Å; I278-L336 HydrophobicContact CG2-CG 4.48Å; Y334-L336 VanDerWaalsContact C-N 3.25Å; Y334-L336 HydrophobicContact CD1-CB 4.01Å; Y334-L336 HydrophobicContact CD2-CB 4.43Å; Y334-L336 HydrophobicContact CE1-CB 3.52Å; Y334-L336 HydrophobicContact CE1-CD2 3.88Å; Y334-L336 HydrophobicContact CE1-CG 4.21Å; Y334-L336 HydrophobicContact CE2-CB 4Å; Y334-L336 HydrophobicContact CG-CB 4.44Å; Y334-L336 PolarHBondContact O-N 2.95Å; Y334-L336 WeakPolarHBondContact OH-CD2 3.34Å; L336-K338 PolarHBondContact O-N 3.44Å; L336-Q339 HydrophobicContact CD1-CB 4.31Å; L336-Q339 PolarHBondContact O-N 2.87Å; L336-L340 HydrophobicContact CD1-CD2 4.28Å; L336-L340 HydrophobicContact CD2-CD2 4.35Å; L336-L340 HydrophobicContact CG-CD2 3.92Å; L336-L340 HydrophobicContact CG-CG 4.21Å; L336-L340 PolarHBondContact O-N 3.18Å
337	F	94	Very high	88.8	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.018	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-55	-31.9	-175.6	-80.6	-54	0	0	0	113.9	I258 L279 I330 P331 C332 Y334 N335 Q339 L340 F347 P349 L350	I258-F337 HydrophobicContact CD1-CD1 4.18Å; I258-F337 HydrophobicContact CD1-CD2 4.4Å; I258-F337 HydrophobicContact CD1-CE1 3.38Å; I258-F337 HydrophobicContact CD1-CE2 3.62Å; I258-F337 HydrophobicContact CD1-CZ 3.09Å; I258-F337 HydrophobicContact CG1-CZ 4.33Å; L279-F337 HydrophobicContact CD1-CE1 3.87Å; L279-F337 HydrophobicContact CD1-CZ 4.2Å; L279-F337 HydrophobicContact CD2-CE1 3.58Å; L279-F337 HydrophobicContact CD2-CZ 3.67Å; L279-F337 HydrophobicContact CG-CE1 4.3Å; I330-F337 HydrophobicContact CG2-CE2 4.18Å; I330-F337 HydrophobicContact CG2-CZ 3.98Å; P331-F337 WeakPolarHBondContact O-CE2 3.49Å; C332-F337 WeakPolarHBondContact O-CD2 3.45Å; Y334-F337 HydrophobicContact CD1-CD2 4.45Å; Y334-F337 HydrophobicContact CD1-CE2 4.19Å; Y334-F337 HydrophobicContact CD1-CZ 4.32Å; Y334-F337 HydrophobicContact CG-CE2 4.39Å; Y334-F337 WeakPolarHBondContact O-CB 3.34Å; Y334-F337 WeakPolarHBondContact O-CD2 3.14Å; Y334-F337 PolarHBondContact O-N 2.71Å; Y334-F337 VanDerWaalsContact O-N 3.15Å; N335-F337 PolarHBondContact O-N 2.89Å; F337-Q339 PolarHBondContact O-N 3.1Å; F337-L340 HydrophobicContact CD1-CD1 3.76Å; F337-L340 HydrophobicContact CE1-CD1 4.07Å; F337-L340 PolarHBondContact O-N 3.36Å; F337-F347 AromaticContact CD1-CE1 3.95Å; F337-F347 HydrophobicContact CD1-CE1 3.95Å; F337-F347 HydrophobicContact CD1-CZ 4.29Å; F337-F347 HydrophobicContact CE1-CE1 4.07Å; F337-F347 HydrophobicContact CE1-CZ 4.01Å; F337-P349 HydrophobicContact CB-CG 3.74Å; F337-P349 HydrophobicContact CD1-CG 3.58Å; F337-P349 HydrophobicContact CD2-CB 4.3Å; F337-P349 HydrophobicContact CD2-CG 3.66Å; F337-P349 HydrophobicContact CE1-CG 4.12Å; F337-P349 HydrophobicContact CE2-CG 4.17Å; F337-P349 HydrophobicContact CG-CB 4.47Å; F337-P349 HydrophobicContact CG-CG 3.38Å; F337-P349 HydrophobicContact CZ-CG 4.43Å; F337-L350 HydrophobicContact CB-CD1 3.88Å; F337-L350 HydrophobicContact CB-CG 3.98Å
338	K	91.4	Very high	88.3	Confident	39 Å²	39	31.4 Å²	31.4	17%	0.17	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-69.2	-14.1	178.9	76.3	-160.4	-177	-177.5	0	114.5	R94 N98 Q99 N335 L336 L350	R94-K338 WeakPolarHBondContact O-CE 3.46Å; R94-K338 PolarHBondContact O-NZ 2.96Å; N98-K338 WeakPolarHBondContact OD1-CB 3.32Å; Q99-K338 CarbonylContact C-O 3.59Å; N335-K338 WeakPolarHBondContact O-CD 3.21Å; N335-K338 WeakPolarHBondContact O-CG 3.37Å; N335-K338 WeakPolarHBondContact OD1-CE 3.35Å; N335-K338 PolarHBondContact OD1-NZ 3.43Å; L336-K338 PolarHBondContact O-N 3.44Å; K338-L350 HydrophobicContact CB-CD1 3.71Å
339	Q	94.4	Very high	87.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-116.6	3.8	-178.8	-65.7	-170.3	-13.8	0	0	112.8	T93 Y97 Q99 T100 I101 F102 L336 F337	T93-Q339 PolarHBondContact O-NE2 2.77Å; Y97-Q339 PolarHBondContact O-NE2 3.44Å; Q99-Q339 WeakPolarHBondContact O-CA 3.35Å; Q99-Q339 WeakPolarHBondContact O-CG 3.45Å; T100-Q339 WeakPolarHBondContact CA-O 3.11Å; I101-Q339 HydrophobicContact CD1-CB 4.42Å; I101-Q339 HydrophobicContact CG1-CB 4.21Å; I101-Q339 HydrophobicContact CG2-CB 3.89Å; I101-Q339 HydrophobicContact CG2-CG 3.97Å; I101-Q339 PolarHBondContact N-O 3.24Å; I101-Q339 VanDerWaalsContact N-O 3.15Å; F102-Q339 WeakPolarHBondContact CD2-O 3.28Å; L336-Q339 HydrophobicContact CD1-CB 4.31Å; L336-Q339 PolarHBondContact O-N 2.87Å; F337-Q339 PolarHBondContact O-N 3.1Å
340	L	93.9	Very high	87.5	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.16	C	C	.	.	S	Bend	trans	-78.6	159.3	167	-64.1	-171.7	0	0	0	110.1	F102 I275 I278 L279 L336 F337 N342	F102-L340 HydrophobicContact CE2-CD2 3.83Å; I275-L340 HydrophobicContact CG1-CB 4.49Å; I275-L340 HydrophobicContact CG1-CD1 4.45Å; I275-L340 HydrophobicContact CG2-CD1 4.03Å; I278-L340 HydrophobicContact CD1-CD2 3.63Å; I278-L340 HydrophobicContact CG2-CD2 4.19Å; L279-L340 HydrophobicContact CD2-CD1 4.31Å; L336-L340 HydrophobicContact CD1-CD2 4.28Å; L336-L340 HydrophobicContact CD2-CD2 4.35Å; L336-L340 HydrophobicContact CG-CD2 3.92Å; L336-L340 HydrophobicContact CG-CG 4.21Å; L336-L340 PolarHBondContact O-N 3.18Å; F337-L340 HydrophobicContact CD1-CD1 3.76Å; F337-L340 HydrophobicContact CE1-CD1 4.07Å; F337-L340 PolarHBondContact O-N 3.36Å; L340-N342 PolarHBondContact O-N 2.05Å
341	P	88.7	Confident	86.8	Confident	7 Å²	7	38.2 Å²	38.2	5%	0.045	19%	0.189	C	C	.	.			trans	-55.1	134.1	168.1	-25.7	36.4	0	0	0	111.3	F102 W114 E271 L274 L343	F102-P341 HydrophobicContact CB-CG 4.35Å; W114-P341 HydrophobicContact CH2-CG 4.42Å; W114-P341 HydrophobicContact CZ3-CG 4.4Å; E271-P341 HydrophobicContact CG-CB 3.51Å; E271-P341 HydrophobicContact CG-CG 4.04Å; E271-P341 WeakPolarHBondContact OE1-CB 3.49Å; L274-P341 HydrophobicContact CD2-CG 3.91Å; P341-L343 PolarHBondContact O-N 3.47Å
342	N	78.1	Confident	86.2	Confident	55 Å²	55	39.1 Å²	39.1	29%	0.294	19%	0.193	S	C	.	.			trans	-88.5	99.2	176.6	-72.2	-32.1	0	0	0	108.5	L340 N344 Y345 F347	L340-N342 PolarHBondContact O-N 2.05Å; N342-N344 PolarHBondContact O-N 3.2Å; N342-Y345 PolarHBondContact O-N 2.97Å; N342-F347 PolarHBondContact OD1-O 3.46Å
343	L	78.2	Confident	85.5	Confident	12 Å²	12	43.6 Å²	43.6	6%	0.063	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-51.1	108	177.8	-60.8	171.2	0	0	0	110.2	F225 L228 E271 I272 I275 P341 Y345 T346 F347	F225-L343 HydrophobicContact CB-CD1 3.73Å; F225-L343 HydrophobicContact CG-CD1 4.38Å; L228-L343 HydrophobicContact CD1-CD1 3.73Å; E271-L343 HydrophobicContact CB-CD2 4.39Å; E271-L343 HydrophobicContact CG-CD2 3.89Å; I272-L343 HydrophobicContact CD1-CD2 4.42Å; I272-L343 HydrophobicContact CG1-CD1 4.38Å; I272-L343 HydrophobicContact CG1-CD2 3.64Å; I275-L343 HydrophobicContact CD1-CD1 4.13Å; I275-L343 HydrophobicContact CD1-CD2 3.91Å; I275-L343 HydrophobicContact CD1-CG 3.85Å; P341-L343 PolarHBondContact O-N 3.47Å; L343-Y345 PolarHBondContact O-N 2.95Å; L343-Y345 VanDerWaalsContact O-N 3.09Å; L343-T346 PolarHBondContact O-N 3.44Å; L343-T346 PolarHBondContact O-OG1 2.78Å; L343-F347 HydrophobicContact CB-CB 3.83Å; L343-F347 HydrophobicContact CD1-CB 4.18Å; L343-F347 HydrophobicContact CD1-CD2 4.48Å; L343-F347 HydrophobicContact CD1-CG 4.19Å; L343-F347 HydrophobicContact CG-CB 4.14Å; L343-F347 PolarHBondContact O-N 3.19Å
344	N	73.2	Confident	85.1	Confident	140 Å²	140	43.1 Å²	43.1	75%	0.749	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	47.6	35.1	-174.8	-59.9	-22.3	0	0	0	113.7	N342 T346	N342-N344 PolarHBondContact O-N 3.2Å; N344-T346 WeakPolarHBondContact O-CG2 3.32Å; N344-T346 PolarHBondContact O-N 2.65Å; N344-T346 VanDerWaalsContact O-N 3.07Å
345	Y	74.3	Confident	84.6	Confident	200 Å²	200	45.4 Å²	45.4	78%	0.784	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	62.1	8.7	-176.5	-52.7	-79.7	0	0	0	116.1	N342 L343	N342-Y345 PolarHBondContact O-N 2.97Å; L343-Y345 PolarHBondContact O-N 2.95Å; L343-Y345 VanDerWaalsContact O-N 3.09Å
346	T	76.7	Confident	84.2	Confident	80 Å²	80	47.6 Å²	47.6	49%	0.491	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-23.7	-171.8	52.8	0	0	0	0	114	F225 L343 N344 Q348	F225-T346 VanDerWaalsContact CE1-OG1 3.3Å; F225-T346 WeakPolarHBondContact CE1-OG1 3.06Å; L343-T346 PolarHBondContact O-N 3.44Å; L343-T346 PolarHBondContact O-OG1 2.78Å; N344-T346 WeakPolarHBondContact O-CG2 3.32Å; N344-T346 PolarHBondContact O-N 2.65Å; N344-T346 VanDerWaalsContact O-N 3.07Å; T346-Q348 PolarHBondContact O-N 2.85Å
347	F	82.8	Confident	83.6	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	23%	0.233	C	C	.	.			trans	-75.6	87.2	178.4	-177.4	-107.7	0	0	0	111.5	F225 L228 I230 I258 I275 F337 N342 L343 P349	F225-F347 AromaticContact CD2-CD2 3.67Å; F225-F347 HydrophobicContact CD2-CD2 3.67Å; F225-F347 HydrophobicContact CD2-CE2 4.33Å; F225-F347 AromaticContact CE2-CD2 3.96Å; F225-F347 HydrophobicContact CE2-CD2 3.96Å; F225-F347 HydrophobicContact CG-CD2 4.12Å; L228-F347 HydrophobicContact CB-CE2 4.24Å; L228-F347 HydrophobicContact CD1-CD2 4.43Å; L228-F347 HydrophobicContact CD1-CE1 4.22Å; L228-F347 HydrophobicContact CD1-CE2 3.89Å; L228-F347 HydrophobicContact CD1-CZ 3.76Å; I230-F347 HydrophobicContact CD1-CD2 4.14Å; I230-F347 HydrophobicContact CD1-CE2 4.09Å; I230-F347 HydrophobicContact CG1-CE2 4.23Å; I258-F347 HydrophobicContact CD1-CE2 3.9Å; I258-F347 HydrophobicContact CD1-CZ 3.48Å; I258-F347 VanDerWaalsContact CD1-CZ 3.48Å; I258-F347 HydrophobicContact CG1-CE2 4.36Å; I258-F347 HydrophobicContact CG1-CZ 4.35Å; I275-F347 HydrophobicContact CG2-CE1 4.5Å; F337-F347 AromaticContact CD1-CE1 3.95Å; F337-F347 HydrophobicContact CD1-CE1 3.95Å; F337-F347 HydrophobicContact CD1-CZ 4.29Å; F337-F347 HydrophobicContact CE1-CE1 4.07Å; F337-F347 HydrophobicContact CE1-CZ 4.01Å; N342-F347 PolarHBondContact OD1-O 3.46Å; L343-F347 HydrophobicContact CB-CB 3.83Å; L343-F347 HydrophobicContact CD1-CB 4.18Å; L343-F347 HydrophobicContact CD1-CD2 4.48Å; L343-F347 HydrophobicContact CD1-CG 4.19Å; L343-F347 HydrophobicContact CG-CB 4.14Å; L343-F347 PolarHBondContact O-N 3.19Å; F347-P349 HydrophobicContact CE1-CG 4.2Å; F347-P349 HydrophobicContact CZ-CG 4.15Å; F347-P349 WeakPolarHBondContact O-CD 3.48Å
348	Q	82.6	Confident	83.2	Confident	83 Å²	83	50.8 Å²	50.8	39%	0.388	25%	0.249	S	C	.	.			trans	-127.2	67.8	-177.3	-64.6	-177.8	-10.9	0	0	111.7	T346 L350 N351	T346-Q348 PolarHBondContact O-N 2.85Å; Q348-L350 PolarHBondContact O-N 3.07Å; Q348-L350 VanDerWaalsContact O-N 3.15Å; Q348-N351 HydrophobicContact CB-CB 4.31Å; Q348-N351 PolarHBondContact O-N 2.89Å; Q348-N351 VanDerWaalsContact O-N 3.07Å; Q348-N351 PolarHBondContact OE1-ND2 3.27Å
349	P	84.7	Confident	82.8	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.013	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-60.5	-28.4	-175.1	25.5	-36	0	0	0	113.7	I230 I258 C332 F337 F347 N351 I352	I230-P349 HydrophobicContact CD1-CB 4.4Å; I258-P349 HydrophobicContact CD1-CB 3.52Å; I258-P349 HydrophobicContact CD1-CG 3.69Å; I258-P349 HydrophobicContact CG1-CB 4.33Å; C332-P349 HydrophobicContact CB-CB 3.83Å; C332-P349 WeakPolarHBondContact CB-O 3.09Å; F337-P349 HydrophobicContact CB-CG 3.74Å; F337-P349 HydrophobicContact CD1-CG 3.58Å; F337-P349 HydrophobicContact CD2-CB 4.3Å; F337-P349 HydrophobicContact CD2-CG 3.66Å; F337-P349 HydrophobicContact CE1-CG 4.12Å; F337-P349 HydrophobicContact CE2-CG 4.17Å; F337-P349 HydrophobicContact CG-CB 4.47Å; F337-P349 HydrophobicContact CG-CG 3.38Å; F337-P349 HydrophobicContact CZ-CG 4.43Å; F347-P349 HydrophobicContact CE1-CG 4.2Å; F347-P349 HydrophobicContact CZ-CG 4.15Å; F347-P349 WeakPolarHBondContact O-CD 3.48Å; P349-N351 PolarHBondContact O-N 3.46Å; P349-I352 VanDerWaalsContact O-CB 3.28Å; P349-I352 WeakPolarHBondContact O-CB 3.25Å; P349-I352 WeakPolarHBondContact O-CG1 3.07Å; P349-I352 PolarHBondContact O-N 3.13Å
350	L	84.9	Confident	82.4	Confident	44 Å²	44	55.4 Å²	55.4	23%	0.23	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-67.5	-21.8	178.3	-72.1	167.3	0	0	0	113.8	C332 F337 K338 Q348 I352	C332-L350 WeakPolarHBondContact O-CD2 3.38Å; F337-L350 HydrophobicContact CB-CD1 3.88Å; F337-L350 HydrophobicContact CB-CG 3.98Å; K338-L350 HydrophobicContact CB-CD1 3.71Å; Q348-L350 PolarHBondContact O-N 3.07Å; Q348-L350 VanDerWaalsContact O-N 3.15Å; L350-I352 PolarHBondContact O-N 3.2Å
351	N	82.2	Confident	81.9	Confident	114 Å²	114	55.4 Å²	55.4	61%	0.61	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-83.8	-3.3	178.6	-68.1	-9.5	0	0	0	112.3	Q348 P349 L353	Q348-N351 HydrophobicContact CB-CB 4.31Å; Q348-N351 PolarHBondContact O-N 2.89Å; Q348-N351 VanDerWaalsContact O-N 3.07Å; Q348-N351 PolarHBondContact OE1-ND2 3.27Å; P349-N351 PolarHBondContact O-N 3.46Å; N351-L353 PolarHBondContact O-N 2.79Å
352	I	81.1	Confident	81.7	Confident	20 Å²	20	60.3 Å²	60.3	10%	0.103	29%	0.289	C	S	.	.			trans	-79.8	117.8	-176.7	-61.2	-172.5	0	0	0	110.3	F220 I230 C256 P349 L350 N354	F220-I352 HydrophobicContact CE1-CG2 3.25Å; F220-I352 HydrophobicContact CZ-CG2 3.29Å; I230-I352 HydrophobicContact CB-CD1 4.42Å; I230-I352 HydrophobicContact CD1-CD1 3.7Å; I230-I352 HydrophobicContact CG2-CD1 3.27Å; C256-I352 HydrophobicContact CB-CB 4.21Å; C256-I352 HydrophobicContact CB-CG2 3.72Å; C256-I352 VanDerWaalsContact SG-CG2 3.57Å; P349-I352 VanDerWaalsContact O-CB 3.28Å; P349-I352 WeakPolarHBondContact O-CB 3.25Å; P349-I352 WeakPolarHBondContact O-CG1 3.07Å; P349-I352 PolarHBondContact O-N 3.13Å; L350-I352 PolarHBondContact O-N 3.2Å; I352-N354 PolarHBondContact O-ND2 2.75Å
353	L	77.3	Confident	81.8	Confident	93 Å²	93	58 Å²	58	49%	0.487	28%	0.277	S	S	.	.			trans	-61.6	139.6	178.2	-70	171	0	0	0	111	F220 N351 Y355	F220-L353 WeakPolarHBondContact CE2-O 3.43Å; F220-L353 HydrophobicContact CZ-CB 4.46Å; F220-L353 WeakPolarHBondContact CZ-O 3.42Å; N351-L353 PolarHBondContact O-N 2.79Å; L353-Y355 HydrophobicContact CB-CE2 4.5Å
354	N	84.7	Confident	82	Confident	6 Å²	6	61.3 Å²	61.3	3%	0.032	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	146.7	174.7	-57.1	-87.9	0	0	0	107.2	L185 S186 Y254 I255 C256 Q333 I352	L185-N354 WeakPolarHBondContact CA-O 3.48Å; L185-N354 HydrophobicContact CD2-CB 3.39Å; S186-N354 PolarHBondContact N-O 3.17Å; Y254-N354 WeakPolarHBondContact O-CA 3.38Å; I255-N354 WeakPolarHBondContact CA-OD1 3.35Å; I255-N354 HydrophobicContact CD1-CB 3.87Å; C256-N354 PolarHBondContact N-OD1 2.96Å; Q333-N354 PolarHBondContact NE2-ND2 3.32Å; Q333-N354 PolarHBondContact NE2-OD1 3.23Å; I352-N354 PolarHBondContact O-ND2 2.75Å
355	Y	83.7	Confident	81.8	Confident	47 Å²	47	56 Å²	56	18%	0.184	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.5	-178.4	-61	-73.8	0	0	0	111.2	S186 F220 Y254 L353	S186-Y355 CarbonylContact O-C 3.54Å; S186-Y355 VanDerWaalsContact O-CA 3.25Å; S186-Y355 WeakPolarHBondContact O-CA 3.49Å; S186-Y355 WeakPolarHBondContact O-CD1 3.48Å; F220-Y355 AromaticContact CD2-CD2 3.95Å; F220-Y355 HydrophobicContact CD2-CD2 3.95Å; F220-Y355 AromaticContact CD2-CE2 3.49Å; F220-Y355 HydrophobicContact CD2-CE2 3.49Å; F220-Y355 VanDerWaalsContact CD2-CE2 3.49Å; F220-Y355 AromaticContact CE2-CD2 3.71Å; F220-Y355 HydrophobicContact CE2-CD2 3.71Å; F220-Y355 AromaticContact CE2-CE2 3.22Å; F220-Y355 HydrophobicContact CE2-CE2 3.22Å; F220-Y355 HydrophobicContact CZ-CE2 4.46Å; Y254-Y355 WeakPolarHBondContact CB-O 3.34Å; Y254-Y355 WeakPolarHBondContact CD2-O 3.26Å; Y254-Y355 PolarHBondContact N-O 3.22Å; Y254-Y355 PolarHBondContact O-N 3.23Å; L353-Y355 HydrophobicContact CB-CE2 4.5Å
356	Y	86	Confident	81.3	Confident	52 Å²	52	56.2 Å²	56.2	20%	0.204	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	154.5	165.4	76.7	-71	0	0	0	110.4	L185 S186 Q187 F188 Q251 I252 I358	L185-Y356 HydrophobicContact CB-CD1 3.43Å; L185-Y356 VanDerWaalsContact CB-CD1 3.43Å; L185-Y356 HydrophobicContact CB-CE1 4Å; L185-Y356 HydrophobicContact CB-CG 4.18Å; L185-Y356 HydrophobicContact CD1-CG 4.49Å; L185-Y356 HydrophobicContact CG-CD1 4.48Å; L185-Y356 WeakPolarHBondContact O-CE1 3.21Å; S186-Y356 WeakPolarHBondContact O-CD1 3.28Å; S186-Y356 PolarHBondContact O-N 3.45Å; Q187-Y356 VanDerWaalsContact CA-CE1 3.48Å; Q187-Y356 WeakPolarHBondContact CA-O 3.28Å; Q187-Y356 HydrophobicContact CB-CD1 4.29Å; Q187-Y356 HydrophobicContact CB-CE1 3.63Å; Q187-Y356 HydrophobicContact CB-CE2 4.36Å; Q187-Y356 HydrophobicContact CG-CE1 4.37Å; Q187-Y356 HydrophobicContact CG-CE2 4.26Å; F188-Y356 PolarHBondContact N-O 2.55Å; Q251-Y356 HydrophobicContact CG-CD2 4.18Å; I252-Y356 CarbonylContact O-C 3.57Å; I252-Y356 WeakPolarHBondContact O-CA 3.36Å; Y356-I358 HydrophobicContact CD2-CD1 4.15Å; Y356-I358 HydrophobicContact CD2-CG1 3.81Å; Y356-I358 HydrophobicContact CE2-CD1 3.63Å; Y356-I358 HydrophobicContact CE2-CG1 3.76Å
357	I	83.3	Confident	79.9	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.015	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	125	-179.9	-61	-175.8	0	0	0	107.4	F188 I190 I214 Q251 I252 Y254 I359	F188-I357 HydrophobicContact CB-CD1 4.08Å; F188-I357 HydrophobicContact CB-CG1 3.8Å; F188-I357 HydrophobicContact CD1-CD1 3.71Å; F188-I357 HydrophobicContact CD1-CG1 4.29Å; F188-I357 HydrophobicContact CG-CD1 4.3Å; F188-I357 WeakPolarHBondContact O-CG1 3.37Å; I190-I357 HydrophobicContact CD1-CD1 3.64Å; I190-I357 HydrophobicContact CD1-CG2 4.29Å; I190-I357 HydrophobicContact CG1-CD1 4.16Å; I214-I357 HydrophobicContact CD1-CD1 3.16Å; I214-I357 HydrophobicContact CG1-CD1 3.99Å; Q251-I357 CarbonylContact C-O 3.46Å; Q251-I357 VanDerWaalsContact CA-O 3.3Å; Q251-I357 WeakPolarHBondContact CA-O 3.49Å; I252-I357 PolarHBondContact N-O 3.37Å; I252-I357 PolarHBondContact O-N 3.09Å; Y254-I357 HydrophobicContact CD2-CG1 4.31Å; Y254-I357 HydrophobicContact CE2-CB 4.03Å; Y254-I357 HydrophobicContact CE2-CD1 3.65Å; Y254-I357 HydrophobicContact CE2-CG1 3.59Å; I357-I359 HydrophobicContact CG2-CD1 3.82Å; I357-I359 HydrophobicContact CG2-CG1 3.8Å
358	I	84.2	Confident	77.9	Confident	68 Å²	68	67.2 Å²	67.2	35%	0.349	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.7	171.7	-60.7	179.9	0	0	0	108.2	N249 I250 Q251 Y356	N249-I358 HydrophobicContact CB-CG2 4.36Å; I250-I358 WeakPolarHBondContact O-CA 3.45Å; Q251-I358 HydrophobicContact CB-CG1 4.38Å; Q251-I358 HydrophobicContact CG-CG1 4.42Å; Y356-I358 HydrophobicContact CD2-CD1 4.15Å; Y356-I358 HydrophobicContact CD2-CG1 3.81Å; Y356-I358 HydrophobicContact CE2-CD1 3.63Å; Y356-I358 HydrophobicContact CE2-CG1 3.76Å
359	I	83.1	Confident	75.7	Confident	7 Å²	7	68.8 Å²	68.8	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125	172.8	-60.5	144.9	0	0	0	108.4	I193 K195 I210 I250 I252 I357 Y361	I193-I359 HydrophobicContact CD1-CD1 4.02Å; I193-I359 HydrophobicContact CD1-CG1 4.25Å; K195-I359 HydrophobicContact CG-CG2 4.24Å; I210-I359 HydrophobicContact CD1-CD1 3.26Å; I210-I359 HydrophobicContact CG1-CD1 4.21Å; I210-I359 HydrophobicContact CG2-CD1 4.31Å; I250-I359 PolarHBondContact N-O 3.18Å; I250-I359 PolarHBondContact O-N 2.93Å; I252-I359 HydrophobicContact CD1-CD1 4Å; I357-I359 HydrophobicContact CG2-CD1 3.82Å; I357-I359 HydrophobicContact CG2-CG1 3.8Å; I359-Y361 HydrophobicContact CB-CD2 4.1Å; I359-Y361 HydrophobicContact CB-CE2 3.56Å; I359-Y361 HydrophobicContact CD1-CE2 4.4Å; I359-Y361 HydrophobicContact CG2-CD1 4.35Å; I359-Y361 HydrophobicContact CG2-CD2 3.66Å; I359-Y361 HydrophobicContact CG2-CE1 3.96Å; I359-Y361 HydrophobicContact CG2-CE2 3.26Å; I359-Y361 HydrophobicContact CG2-CG 4.24Å; I359-Y361 VanDerWaalsContact CG2-CZ 3.44Å
360	K	85.8	Confident	73.2	Confident	129 Å²	129	75.7 Å²	75.7	56%	0.561	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.2	172.9	-51.1	-162.5	174.8	174.2	0	108.4	K195 I247 Y248 N249	K195-K360 VanDerWaalsContact CB-O 3.32Å; K195-K360 WeakPolarHBondContact CB-O 3.12Å; K195-K360 WeakPolarHBondContact CG-O 3.34Å; I247-K360 HydrophobicContact CG2-CB 4.05Å; Y248-K360 CarbonylContact O-C 3.59Å; Y248-K360 WeakPolarHBondContact O-CA 3.17Å; N249-K360 VanDerWaalsContact OD1-CG 3.26Å; N249-K360 WeakPolarHBondContact OD1-CG 3.24Å
361	Y	84.5	Confident	70.6	Confident	1 Å²	1	81.1 Å²	81.1	0%	0.004	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.3	175.9	-71.5	-84.4	0	0	0	111.2	K195 V197 L203 L206 Q207 I210 I247 Y248 I250 I359	K195-Y361 CarbonylContact O-C 3.55Å; K195-Y361 WeakPolarHBondContact O-CA 3.28Å; V197-Y361 HydrophobicContact CG1-CD1 3.9Å; V197-Y361 HydrophobicContact CG1-CE1 4.28Å; V197-Y361 HydrophobicContact CG2-CD1 4.43Å; L203-Y361 HydrophobicContact CD1-CD1 3.66Å; L203-Y361 HydrophobicContact CD1-CD2 3.62Å; L203-Y361 HydrophobicContact CD1-CE1 3.82Å; L203-Y361 HydrophobicContact CD1-CE2 3.71Å; L203-Y361 HydrophobicContact CD1-CG 3.53Å; L206-Y361 HydrophobicContact CB-CE1 4.36Å; L206-Y361 HydrophobicContact CD1-CE1 3.89Å; Q207-Y361 PolarHBondContact NE2-OH 3.5Å; I210-Y361 WeakPolarHBondContact CD1-OH 3.17Å; I247-Y361 CarbonylContact C-O 3.57Å; I247-Y361 VanDerWaalsContact CA-O 3.32Å; I247-Y361 WeakPolarHBondContact CA-O 3.41Å; Y248-Y361 PolarHBondContact N-O 2.76Å; Y248-Y361 PolarHBondContact O-N 2.94Å; I250-Y361 HydrophobicContact CB-CD2 4.16Å; I250-Y361 HydrophobicContact CB-CE2 4.2Å; I250-Y361 HydrophobicContact CD1-CD2 3.44Å; I250-Y361 VanDerWaalsContact CD1-CD2 3.44Å; I250-Y361 HydrophobicContact CD1-CE2 3.89Å; I250-Y361 HydrophobicContact CD1-CG 4.27Å; I250-Y361 HydrophobicContact CG1-CD2 4.15Å; I359-Y361 HydrophobicContact CB-CD2 4.1Å; I359-Y361 HydrophobicContact CB-CE2 3.56Å; I359-Y361 HydrophobicContact CD1-CE2 4.4Å; I359-Y361 HydrophobicContact CG2-CD1 4.35Å; I359-Y361 HydrophobicContact CG2-CD2 3.66Å; I359-Y361 HydrophobicContact CG2-CE1 3.96Å; I359-Y361 HydrophobicContact CG2-CE2 3.26Å; I359-Y361 HydrophobicContact CG2-CG 4.24Å; I359-Y361 VanDerWaalsContact CG2-CZ 3.44Å
362	K	84.1	Confident	68.3	Low	109 Å²	109	85.1 Å²	85.1	47%	0.474	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.2	168.5	-174.4	175.5	-178.6	177.1	0	108.8	K195 I196 V197 N364	K195-K362 PolarHBondContact O-N 2.84Å; I196-K362 WeakPolarHBondContact CA-O 3.44Å; V197-K362 PolarHBondContact N-O 2.84Å; K362-N364 PolarHBondContact O-N 3.01Å
363	F	81.3	Confident	66.3	Low	8 Å²	8	90.4 Å²	90.4	4%	0.035	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	109	174.4	-101.8	-100.4	0	0	0	110	V197 L203 Y241 N245 N246 Y248	V197-F363 HydrophobicContact CG2-CD1 4.13Å; V197-F363 HydrophobicContact CG2-CD2 3.3Å; V197-F363 HydrophobicContact CG2-CE1 4.12Å; V197-F363 HydrophobicContact CG2-CE2 3.32Å; V197-F363 HydrophobicContact CG2-CG 3.75Å; V197-F363 HydrophobicContact CG2-CZ 3.74Å; V197-F363 CarbonylContact O-C 3.55Å; V197-F363 VanDerWaalsContact O-CA 3.29Å; V197-F363 WeakPolarHBondContact O-CA 3.34Å; L203-F363 HydrophobicContact CB-CE2 4.41Å; L203-F363 HydrophobicContact CB-CZ 4.07Å; L203-F363 HydrophobicContact CD1-CE2 4.26Å; L203-F363 HydrophobicContact CD2-CE2 3.83Å; L203-F363 HydrophobicContact CD2-CZ 3.88Å; L203-F363 HydrophobicContact CG-CE2 4.39Å; L203-F363 HydrophobicContact CG-CZ 4.45Å; Y241-F363 HydrophobicContact CD2-CE2 4.39Å; N245-F363 WeakPolarHBondContact CA-O 3.07Å; N245-F363 PolarHBondContact N-O 3.39Å; N246-F363 PolarHBondContact O-N 3.05Å; N246-F363 VanDerWaalsContact O-N 3.07Å; Y248-F363 HydrophobicContact CD2-CB 4.22Å; Y248-F363 AromaticContact CD2-CD2 3.6Å; Y248-F363 HydrophobicContact CD2-CD2 3.6Å; Y248-F363 HydrophobicContact CD2-CE2 4.34Å; Y248-F363 HydrophobicContact CD2-CG 4.21Å; Y248-F363 HydrophobicContact CE2-CB 4.02Å; Y248-F363 AromaticContact CE2-CD2 3.98Å; Y248-F363 HydrophobicContact CE2-CD2 3.98Å; Y248-F363 HydrophobicContact CE2-CG 4.16Å
364	N	80.8	Confident	64.2	Low	80 Å²	80	97.2 Å²	97.2	43%	0.428	47%	0.47	S	S	.	.			trans	-109.7	80.5	175.5	-171.3	13.8	0	0	0	109.3	I196 V197 T198 N245 K362	I196-N364 HydrophobicContact CG2-CB 4.28Å; V197-N364 PolarHBondContact O-N 3.46Å; T198-N364 WeakPolarHBondContact CA-O 3.36Å; T198-N364 WeakPolarHBondContact CG2-O 3.28Å; N245-N364 PolarHBondContact OD1-OD1 3.12Å; K362-N364 PolarHBondContact O-N 3.01Å
365	C	69.8	Low	63.2	Low	30 Å²	30	101.8 Å²	101.8	20%	0.203	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-86.9	136	171.9	6.3	0	0	0	0	109.2	C244 Q367	C244-C365 VanDerWaalsContact CA-SG 3.58Å; C244-C365 HydrophobicContact CB-CB 4.06Å; C244-C365 WeakPolarHBondContact CB-SG 3.3Å; C244-C365 WeakPolarHBondContact SG-CB 3.32Å; C244-C365 CovalentContact SG-SG 2.05Å; C244-C365 PolarHBondContact SG-SG 3.17Å; C365-Q367 PolarHBondContact O-N 3.07Å; C365-Q367 VanDerWaalsContact O-N 3.13Å
366	K	63.3	Low	62.1	Low	203 Å²	203	104.6 Å²	104.6	88%	0.883	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-57.4	120.6	165.9	-69.3	-176.7	178.6	-178.2	0	106.1	L368	K366-L368 PolarHBondContact O-N 2.94Å; K366-L368 VanDerWaalsContact O-N 3.14Å
367	Q	48.3	Very low	60.8	Low	149 Å²	149	107.6 Å²	107.6	70%	0.696	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-48	127.9	167.9	-82.5	175.1	-25.3	0	0	106.6	C365 N369	C365-Q367 PolarHBondContact O-N 3.07Å; C365-Q367 VanDerWaalsContact O-N 3.13Å; Q367-N369 PolarHBondContact O-N 3.06Å
368	L	40.1	Very low	59.4	Low	163 Å²	163	113.7 Å²	113.7	85%	0.853	56%	0.555	S	S	*	*			trans	-60.4	88.6	161.7	-85.7	158	0	0	0	104.7	K366 N370	K366-L368 PolarHBondContact O-N 2.94Å; K366-L368 VanDerWaalsContact O-N 3.14Å; L368-N370 PolarHBondContact O-N 3.21Å
369	N	36.7	Very low	57.9	Low	117 Å²	117	116.6 Å²	116.6	63%	0.626	57%	0.568	S	S	*	*			trans	-61	91.3	164.5	-80.4	-15.4	0	0	0	104.2	Q367 K371	Q367-N369 PolarHBondContact O-N 3.06Å; N369-K371 HydrophobicContact CB-CG 4.49Å; N369-K371 PolarHBondContact O-N 3.45Å
370	N	32.3	Very low	56.2	Low	147 Å²	147	123.9 Å²	123.9	79%	0.786	60%	0.604	S	S	*	*			trans	-65.1	69.6	158.6	-80.3	-14.7	0	0	0	106.6	L368 K372	L368-N370 PolarHBondContact O-N 3.21Å; N370-K372 PolarHBondContact O-N 3.3Å
371	K	30.8	Very low	54.1	Low	158 Å²	158	123.5 Å²	123.5	69%	0.687	61%	0.607	S	S	*	*			trans	-69.4	80.2	154.9	-81.6	-172.6	174.9	-173.2	0	105.6	N369 N373	N369-K371 HydrophobicContact CB-CG 4.49Å; N369-K371 PolarHBondContact O-N 3.45Å; K371-N373 PolarHBondContact O-N 2.74Å; K371-N373 VanDerWaalsContact O-N 3.14Å
372	K	33.8	Very low	51.8	Low	198 Å²	198	132.9 Å²	132.9	86%	0.861	65%	0.653	S	S	*	*			trans	-72	89	142.3	-83.9	-173.4	173.5	-176.1	0	104.3	N370	N370-K372 PolarHBondContact O-N 3.3Å
373	N	38.1	Very low	49.1	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	67%	0.668	S	S	*	*			trans	-63.1	135.8	165.1	-75.1	-18.1	0	0	0	107.1	K371	K371-N373 PolarHBondContact O-N 2.74Å; K371-N373 VanDerWaalsContact O-N 3.14Å
374	N	33.4	Very low	46.1	Very low	236 Å²	236	146.5 Å²	146.5	100%	1.262	73%	0.725	S	S	*	*			trans	-47.7	0	-177.9	-61.9	-29	0	0	0	114.8

Retrieved 374 of 374 residues in 724.2 ms (Link to these results)

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