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Heme sensor protein HssS

Member of the two-component regulatory system HssS/HssR involved in intracellular heme homeostasis and tempering of staphylococcal virulence. HssS functions as a heme sensor histidine kinase which is autophosphorylated at a histidine residue and transfers its phosphate group to an aspartate residue of HssR. HssR/HssS activates the expression of hrtAB, an efflux pump, in response to extracellular heme, hemin, hemoglobin or blood.

AlphaFold DB , UniProt , Accession A0A077ZGU7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 339 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	54.8	Low	69.9	Low	196 Å²	196	105.5 Å²	105.5	97%	0.966	53%	0.527	S	S	*	.				0	-44.6	0	-76.2	-75.8	-102.2	0	0	113.3	F3 V4 A5	M1-F3 PolarHBondContact O-N 3.37Å; M1-V4 PolarHBondContact O-N 2.65Å; M1-A5 PolarHBondContact O-N 2.92Å; M1-A5 VanDerWaalsContact O-N 3.16Å
2	Y	63.1	Low	70.8	Confident	198 Å²	198	101.9 Å²	101.9	78%	0.776	52%	0.515	S	S	*	.	H	α-helix	trans	-54.7	-43	-177.7	-99.8	-83.2	0	0	0	114.9	A5 I6	Y2-A5 PolarHBondContact O-N 3.14Å; Y2-I6 WeakPolarHBondContact O-CG1 3.34Å; Y2-I6 PolarHBondContact O-N 3.45Å
3	F	64.9	Low	71.4	Confident	68 Å²	68	99.9 Å²	99.9	30%	0.298	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-47.5	-179.8	177.8	-105.5	0	0	0	112.6	M1 A5 I6 T7 V60 I64 M93	M1-F3 PolarHBondContact O-N 3.37Å; F3-A5 VanDerWaalsContact C-N 3.25Å; F3-A5 PolarHBondContact O-N 3.29Å; F3-I6 PolarHBondContact O-N 2.79Å; F3-I6 VanDerWaalsContact O-N 3.12Å; F3-T7 HydrophobicContact CD1-CG2 4.17Å; F3-T7 HydrophobicContact CD2-CG2 4.18Å; F3-T7 HydrophobicContact CE1-CG2 3.68Å; F3-T7 HydrophobicContact CE2-CG2 3.68Å; F3-T7 HydrophobicContact CG-CG2 4.41Å; F3-T7 HydrophobicContact CZ-CG2 3.41Å; F3-T7 VanDerWaalsContact CZ-CG2 3.41Å; F3-T7 WeakPolarHBondContact O-CG2 3.43Å; F3-T7 PolarHBondContact O-N 2.98Å; F3-T7 PolarHBondContact O-OG1 3.25Å; F3-V60 HydrophobicContact CE2-CB 4.37Å; F3-V60 HydrophobicContact CE2-CG1 4.35Å; F3-V60 HydrophobicContact CE2-CG2 3.69Å; F3-V60 HydrophobicContact CZ-CB 4.22Å; F3-V60 HydrophobicContact CZ-CG1 3.86Å; F3-V60 HydrophobicContact CZ-CG2 3.5Å; F3-I64 HydrophobicContact CB-CD1 4.42Å; F3-I64 HydrophobicContact CD1-CD1 3.83Å; F3-I64 HydrophobicContact CD2-CD1 3.48Å; F3-I64 VanDerWaalsContact CD2-CD1 3.48Å; F3-I64 HydrophobicContact CE1-CD1 3.87Å; F3-I64 HydrophobicContact CE2-CD1 3.52Å; F3-I64 HydrophobicContact CG-CD1 3.63Å; F3-I64 HydrophobicContact CZ-CD1 3.71Å; F3-M93 HydrophobicContact CB-CE 4.5Å
4	V	66.2	Low	71.8	Confident	97 Å²	97	95.9 Å²	95.9	59%	0.588	49%	0.493	S	S	*	.	H	α-helix	trans	-60.8	-38.3	177.5	179.6	0	0	0	0	110.7	M1 T7 F8	M1-V4 PolarHBondContact O-N 2.65Å; V4-T7 WeakPolarHBondContact CA-OG1 3.34Å; V4-T7 PolarHBondContact O-OG1 3.3Å; V4-T7 VanDerWaalsContact O-OG1 3.05Å; V4-F8 WeakPolarHBondContact O-CB 3.2Å; V4-F8 PolarHBondContact O-N 3.06Å
5	A	71.4	Confident	72.3	Confident	58 Å²	58	96.6 Å²	96.6	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.2	0	0	0	0	0	112.3	M1 Y2 F3 L9	M1-A5 PolarHBondContact O-N 2.92Å; M1-A5 VanDerWaalsContact O-N 3.16Å; Y2-A5 PolarHBondContact O-N 3.14Å; F3-A5 VanDerWaalsContact C-N 3.25Å; F3-A5 PolarHBondContact O-N 3.29Å; A5-L9 WeakPolarHBondContact O-CB 3.18Å; A5-L9 PolarHBondContact O-N 3.1Å
6	I	71.1	Confident	72.7	Confident	93 Å²	93	94.3 Å²	94.3	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-67.7	-44.8	177.4	-68.1	166.6	0	0	0	111	Y2 F3 L9 M10	Y2-I6 WeakPolarHBondContact O-CG1 3.34Å; Y2-I6 PolarHBondContact O-N 3.45Å; F3-I6 PolarHBondContact O-N 2.79Å; F3-I6 VanDerWaalsContact O-N 3.12Å; I6-L9 PolarHBondContact O-N 2.96Å; I6-M10 WeakPolarHBondContact O-CB 3.4Å; I6-M10 PolarHBondContact O-N 3.43Å
7	T	70.7	Confident	73	Confident	26 Å²	26	92 Å²	92	16%	0.16	49%	0.487	C	S	.	.	H	α-helix	trans	-66	-41.6	177.8	57.7	0	0	0	0	111.4	F3 V4 M10 M11 L56	F3-T7 HydrophobicContact CD1-CG2 4.17Å; F3-T7 HydrophobicContact CD2-CG2 4.18Å; F3-T7 HydrophobicContact CE1-CG2 3.68Å; F3-T7 HydrophobicContact CE2-CG2 3.68Å; F3-T7 HydrophobicContact CG-CG2 4.41Å; F3-T7 HydrophobicContact CZ-CG2 3.41Å; F3-T7 VanDerWaalsContact CZ-CG2 3.41Å; F3-T7 WeakPolarHBondContact O-CG2 3.43Å; F3-T7 PolarHBondContact O-N 2.98Å; F3-T7 PolarHBondContact O-OG1 3.25Å; V4-T7 WeakPolarHBondContact CA-OG1 3.34Å; V4-T7 PolarHBondContact O-OG1 3.3Å; V4-T7 VanDerWaalsContact O-OG1 3.05Å; T7-M10 PolarHBondContact O-N 2.99Å; T7-M11 WeakPolarHBondContact O-CB 3.39Å; T7-M11 WeakPolarHBondContact O-CG 3.41Å; T7-M11 PolarHBondContact O-N 2.95Å; T7-L56 HydrophobicContact CG2-CD1 3.91Å
8	F	77.2	Confident	73.4	Confident	135 Å²	135	91.6 Å²	91.6	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-63.2	-46.2	174.2	-177.1	-99.7	0	0	0	111.5	V4 M10 M11 V12	V4-F8 WeakPolarHBondContact O-CB 3.2Å; V4-F8 PolarHBondContact O-N 3.06Å; F8-M10 VanDerWaalsContact C-N 3.32Å; F8-M10 PolarHBondContact O-N 3.16Å; F8-M11 CarbonylContact O-C 3.6Å; F8-M11 WeakPolarHBondContact O-CB 3.41Å; F8-M11 PolarHBondContact O-N 2.87Å; F8-M11 VanDerWaalsContact O-N 3.15Å; F8-V12 HydrophobicContact CD1-CG2 3.91Å; F8-V12 HydrophobicContact CE1-CG2 3.54Å; F8-V12 HydrophobicContact CE2-CG2 4.25Å; F8-V12 HydrophobicContact CG-CG2 4.42Å; F8-V12 HydrophobicContact CZ-CG2 3.72Å; F8-V12 WeakPolarHBondContact O-CB 3.33Å; F8-V12 VanDerWaalsContact O-CG2 3.29Å; F8-V12 WeakPolarHBondContact O-CG2 3.48Å; F8-V12 PolarHBondContact O-N 3.49Å
9	L	77.5	Confident	73.6	Confident	108 Å²	108	91.2 Å²	91.2	57%	0.565	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-43	176.1	-176.6	68.3	0	0	0	110.9	A5 I6 V12 V13	A5-L9 WeakPolarHBondContact O-CB 3.18Å; A5-L9 PolarHBondContact O-N 3.1Å; I6-L9 PolarHBondContact O-N 2.96Å; L9-V12 PolarHBondContact O-N 2.98Å; L9-V13 WeakPolarHBondContact O-CB 3.3Å; L9-V13 VanDerWaalsContact O-CG2 3.27Å; L9-V13 WeakPolarHBondContact O-CG2 3.32Å; L9-V13 PolarHBondContact O-N 3.41Å
10	M	74.5	Confident	73.9	Confident	52 Å²	52	88.2 Å²	88.2	26%	0.256	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-46.4	173.4	-107.1	-163.4	141.3	0	0	111.5	I6 T7 F8 V12 V13 V14 I52 L56	I6-M10 WeakPolarHBondContact O-CB 3.4Å; I6-M10 PolarHBondContact O-N 3.43Å; T7-M10 PolarHBondContact O-N 2.99Å; F8-M10 VanDerWaalsContact C-N 3.32Å; F8-M10 PolarHBondContact O-N 3.16Å; M10-V12 VanDerWaalsContact C-N 3.34Å; M10-V12 PolarHBondContact O-N 3.08Å; M10-V13 PolarHBondContact O-N 3.45Å; M10-V14 WeakPolarHBondContact O-CB 3.37Å; M10-V14 WeakPolarHBondContact O-CG2 3.43Å; M10-V14 PolarHBondContact O-N 3.14Å; M10-I52 HydrophobicContact CE-CB 4.44Å; M10-I52 HydrophobicContact CE-CG2 3.63Å; M10-I52 HydrophobicContact SD-CG2 4.15Å; M10-L56 HydrophobicContact SD-CB 3.78Å; M10-L56 HydrophobicContact SD-CD1 3.68Å; M10-L56 HydrophobicContact SD-CG 4.17Å
11	M	77.5	Confident	73.9	Confident	129 Å²	129	85.3 Å²	85.3	64%	0.635	46%	0.459	S	S	*	.	H	α-helix	trans	-61.2	-41	176	-78.1	-176.7	167.2	0	0	112.2	T7 F8 V14 L15	T7-M11 WeakPolarHBondContact O-CB 3.39Å; T7-M11 WeakPolarHBondContact O-CG 3.41Å; T7-M11 PolarHBondContact O-N 2.95Å; F8-M11 CarbonylContact O-C 3.6Å; F8-M11 WeakPolarHBondContact O-CB 3.41Å; F8-M11 PolarHBondContact O-N 2.87Å; F8-M11 VanDerWaalsContact O-N 3.15Å; M11-V14 PolarHBondContact O-N 3.28Å; M11-L15 VanDerWaalsContact O-CB 3.3Å; M11-L15 WeakPolarHBondContact O-CB 3.25Å; M11-L15 PolarHBondContact O-N 3.32Å
12	V	80.3	Confident	75	Confident	63 Å²	63	79.6 Å²	79.6	38%	0.382	43%	0.431	S	S	.	.	H	α-helix	trans	-66	-42.5	176.9	170.1	0	0	0	0	111	F8 L9 M10 L15 A16	F8-V12 HydrophobicContact CD1-CG2 3.91Å; F8-V12 HydrophobicContact CE1-CG2 3.54Å; F8-V12 HydrophobicContact CE2-CG2 4.25Å; F8-V12 HydrophobicContact CG-CG2 4.42Å; F8-V12 HydrophobicContact CZ-CG2 3.72Å; F8-V12 WeakPolarHBondContact O-CB 3.33Å; F8-V12 VanDerWaalsContact O-CG2 3.29Å; F8-V12 WeakPolarHBondContact O-CG2 3.48Å; F8-V12 PolarHBondContact O-N 3.49Å; L9-V12 PolarHBondContact O-N 2.98Å; M10-V12 VanDerWaalsContact C-N 3.34Å; M10-V12 PolarHBondContact O-N 3.08Å; V12-L15 PolarHBondContact O-N 3.17Å; V12-A16 VanDerWaalsContact O-CB 3.25Å; V12-A16 WeakPolarHBondContact O-CB 3.15Å; V12-A16 PolarHBondContact O-N 3.11Å
13	V	79.1	Confident	75.7	Confident	76 Å²	76	76.7 Å²	76.7	46%	0.461	42%	0.423	S	S	.	.	H	α-helix	trans	-64.1	-44.2	175.7	170.9	0	0	0	0	110.4	L9 M10 L15 A16 V17	L9-V13 WeakPolarHBondContact O-CB 3.3Å; L9-V13 VanDerWaalsContact O-CG2 3.27Å; L9-V13 WeakPolarHBondContact O-CG2 3.32Å; L9-V13 PolarHBondContact O-N 3.41Å; M10-V13 PolarHBondContact O-N 3.45Å; V13-L15 VanDerWaalsContact C-N 3.34Å; V13-L15 PolarHBondContact O-N 3.41Å; V13-A16 PolarHBondContact O-N 2.61Å; V13-V17 HydrophobicContact CG1-CG2 4.39Å; V13-V17 WeakPolarHBondContact O-CB 3.47Å; V13-V17 VanDerWaalsContact O-CG2 3.26Å; V13-V17 WeakPolarHBondContact O-CG2 3.42Å; V13-V17 PolarHBondContact O-N 3.41Å
14	V	76.3	Confident	76.2	Confident	44 Å²	44	77.3 Å²	77.3	27%	0.267	43%	0.429	S	S	.	.	H	α-helix	trans	-57.5	-48.7	174	172.9	0	0	0	0	110.5	M10 M11 V17 F18 I52	M10-V14 WeakPolarHBondContact O-CB 3.37Å; M10-V14 WeakPolarHBondContact O-CG2 3.43Å; M10-V14 PolarHBondContact O-N 3.14Å; M11-V14 PolarHBondContact O-N 3.28Å; V14-V17 PolarHBondContact O-N 3.37Å; V14-F18 VanDerWaalsContact O-CB 3.25Å; V14-F18 WeakPolarHBondContact O-CB 3.38Å; V14-F18 PolarHBondContact O-N 3.02Å; V14-I52 HydrophobicContact CG2-CB 4.01Å; V14-I52 HydrophobicContact CG2-CD1 3.48Å; V14-I52 VanDerWaalsContact CG2-CD1 3.48Å; V14-I52 HydrophobicContact CG2-CG1 4.28Å; V14-I52 HydrophobicContact CG2-CG2 3.35Å
15	L	79.3	Confident	76.6	Confident	106 Å²	106	73.1 Å²	73.1	56%	0.555	40%	0.403	S	S	*	.	H	α-helix	trans	-64.1	-43	-179.8	-177.3	65.8	0	0	0	111.6	M11 V12 V13 F18 V19	M11-L15 VanDerWaalsContact O-CB 3.3Å; M11-L15 WeakPolarHBondContact O-CB 3.25Å; M11-L15 PolarHBondContact O-N 3.32Å; V12-L15 PolarHBondContact O-N 3.17Å; V13-L15 VanDerWaalsContact C-N 3.34Å; V13-L15 PolarHBondContact O-N 3.41Å; L15-F18 WeakPolarHBondContact O-CB 3.47Å; L15-F18 PolarHBondContact O-N 2.88Å; L15-V19 HydrophobicContact CD1-CG2 4.33Å; L15-V19 HydrophobicContact CG-CG2 4.43Å; L15-V19 WeakPolarHBondContact O-CB 3.49Å; L15-V19 VanDerWaalsContact O-CG2 3.28Å; L15-V19 WeakPolarHBondContact O-CG2 3.17Å; L15-V19 PolarHBondContact O-N 3.3Å
16	A	79.6	Confident	76.6	Confident	60 Å²	60	76.4 Å²	76.4	50%	0.496	41%	0.413	S	S	.	.	H	α-helix	trans	-65.1	-42	178.8	0	0	0	0	0	111.6	V12 V13 F18 V19 G20	V12-A16 VanDerWaalsContact O-CB 3.25Å; V12-A16 WeakPolarHBondContact O-CB 3.15Å; V12-A16 PolarHBondContact O-N 3.11Å; V13-A16 PolarHBondContact O-N 2.61Å; A16-F18 VanDerWaalsContact C-N 3.34Å; A16-V19 PolarHBondContact O-N 2.74Å; A16-G20 PolarHBondContact O-N 3.17Å
17	V	78.1	Confident	76.9	Confident	55 Å²	55	77.9 Å²	77.9	33%	0.333	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-40.6	174.3	175.9	0	0	0	0	110.6	V13 V14 G20 L21 L48	V13-V17 HydrophobicContact CG1-CG2 4.39Å; V13-V17 WeakPolarHBondContact O-CB 3.47Å; V13-V17 VanDerWaalsContact O-CG2 3.26Å; V13-V17 WeakPolarHBondContact O-CG2 3.42Å; V13-V17 PolarHBondContact O-N 3.41Å; V14-V17 PolarHBondContact O-N 3.37Å; V17-G20 PolarHBondContact O-N 3.46Å; V17-L21 HydrophobicContact CG1-CD1 3.69Å; V17-L21 HydrophobicContact CG1-CG 4.34Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 WeakPolarHBondContact O-CD1 3.37Å; V17-L21 VanDerWaalsContact O-CG 3.26Å; V17-L21 WeakPolarHBondContact O-CG 3.48Å; V17-L21 PolarHBondContact O-N 3.02Å; V17-L48 HydrophobicContact CB-CD2 4.21Å; V17-L48 HydrophobicContact CG1-CD2 3.34Å
18	F	78.7	Confident	77.1	Confident	85 Å²	85	83.5 Å²	83.5	37%	0.373	44%	0.437	S	S	.	.	H	α-helix	trans	-60.9	-49.4	175.2	-178.3	-98	0	0	0	112.2	V14 L15 A16 L21 L22 I45	V14-F18 VanDerWaalsContact O-CB 3.25Å; V14-F18 WeakPolarHBondContact O-CB 3.38Å; V14-F18 PolarHBondContact O-N 3.02Å; L15-F18 WeakPolarHBondContact O-CB 3.47Å; L15-F18 PolarHBondContact O-N 2.88Å; A16-F18 VanDerWaalsContact C-N 3.34Å; F18-L21 PolarHBondContact O-N 3.27Å; F18-L22 HydrophobicContact CD1-CD1 3.88Å; F18-L22 HydrophobicContact CD1-CG 4.48Å; F18-L22 HydrophobicContact CE1-CD1 3.37Å; F18-L22 HydrophobicContact CE1-CG 4.18Å; F18-L22 HydrophobicContact CZ-CD1 3.87Å; F18-L22 HydrophobicContact CZ-CG 4.37Å; F18-L22 WeakPolarHBondContact O-CG 3.46Å; F18-L22 PolarHBondContact O-N 3.24Å; F18-I45 HydrophobicContact CD2-CD1 4.09Å; F18-I45 HydrophobicContact CD2-CG1 4.39Å; F18-I45 HydrophobicContact CD2-CG2 3.45Å; F18-I45 VanDerWaalsContact CD2-CG2 3.45Å; F18-I45 HydrophobicContact CE2-CD1 4.17Å; F18-I45 HydrophobicContact CE2-CG2 3.64Å
19	V	78.3	Confident	76.7	Confident	83 Å²	83	83.3 Å²	83.3	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-43.1	177.3	170.9	0	0	0	0	111.1	L15 A16 L21 L22 F23	L15-V19 HydrophobicContact CD1-CG2 4.33Å; L15-V19 HydrophobicContact CG-CG2 4.43Å; L15-V19 WeakPolarHBondContact O-CB 3.49Å; L15-V19 VanDerWaalsContact O-CG2 3.28Å; L15-V19 WeakPolarHBondContact O-CG2 3.17Å; L15-V19 PolarHBondContact O-N 3.3Å; A16-V19 PolarHBondContact O-N 2.74Å; V19-L21 PolarHBondContact O-N 2.88Å; V19-L22 PolarHBondContact O-N 2.99Å; V19-F23 WeakPolarHBondContact O-CB 3.15Å; V19-F23 PolarHBondContact O-N 3.28Å
20	G	79.5	Confident	76.1	Confident	31 Å²	31	81 Å²	81	32%	0.32	43%	0.426	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.5	0	0	0	0	0	112.3	A16 V17 F23 I24	A16-G20 PolarHBondContact O-N 3.17Å; V17-G20 PolarHBondContact O-N 3.46Å; G20-F23 PolarHBondContact O-N 3.37Å; G20-I24 VanDerWaalsContact O-CG1 3.29Å; G20-I24 WeakPolarHBondContact O-CG1 3.36Å; G20-I24 PolarHBondContact O-N 2.96Å
21	L	74.7	Confident	75.4	Confident	29 Å²	29	82.3 Å²	82.3	15%	0.152	43%	0.433	C	S	.	.	H	α-helix	trans	-64.5	-45.7	174.8	-75.7	163	0	0	0	111.3	V17 F18 V19 F23 I24 V25 F44 I45	V17-L21 HydrophobicContact CG1-CD1 3.69Å; V17-L21 HydrophobicContact CG1-CG 4.34Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 WeakPolarHBondContact O-CD1 3.37Å; V17-L21 VanDerWaalsContact O-CG 3.26Å; V17-L21 WeakPolarHBondContact O-CG 3.48Å; V17-L21 PolarHBondContact O-N 3.02Å; F18-L21 PolarHBondContact O-N 3.27Å; V19-L21 PolarHBondContact O-N 2.88Å; L21-F23 VanDerWaalsContact C-N 3.28Å; L21-F23 PolarHBondContact O-N 3.37Å; L21-I24 PolarHBondContact O-N 3.05Å; L21-V25 WeakPolarHBondContact O-CB 3.38Å; L21-V25 WeakPolarHBondContact O-CG2 3.42Å; L21-V25 PolarHBondContact O-N 3.31Å; L21-F44 HydrophobicContact CD1-CD1 3.92Å; L21-F44 HydrophobicContact CD1-CE1 4.13Å; L21-F44 HydrophobicContact CD2-CD1 4.05Å; L21-F44 HydrophobicContact CD2-CE1 4.29Å; L21-I45 HydrophobicContact CB-CD1 3.91Å; L21-I45 HydrophobicContact CB-CG1 4.04Å; L21-I45 HydrophobicContact CD1-CD1 4.34Å; L21-I45 HydrophobicContact CD1-CG1 3.51Å; L21-I45 HydrophobicContact CG-CG1 4.36Å
22	L	75.8	Confident	74.8	Confident	75 Å²	75	77.4 Å²	77.4	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-58.3	-40.5	174.3	-75.7	179.6	0	0	0	112.2	F18 V19 V25 N26	F18-L22 HydrophobicContact CD1-CD1 3.88Å; F18-L22 HydrophobicContact CD1-CG 4.48Å; F18-L22 HydrophobicContact CE1-CD1 3.37Å; F18-L22 HydrophobicContact CE1-CG 4.18Å; F18-L22 HydrophobicContact CZ-CD1 3.87Å; F18-L22 HydrophobicContact CZ-CG 4.37Å; F18-L22 WeakPolarHBondContact O-CG 3.46Å; F18-L22 PolarHBondContact O-N 3.24Å; V19-L22 PolarHBondContact O-N 2.99Å; L22-V25 PolarHBondContact O-N 3.45Å; L22-N26 VanDerWaalsContact O-CB 3.28Å; L22-N26 WeakPolarHBondContact O-CB 3.39Å; L22-N26 PolarHBondContact O-N 3Å
23	F	78.2	Confident	73.8	Confident	137 Å²	137	79.7 Å²	79.7	60%	0.601	43%	0.43	S	S	*	.	H	α-helix	trans	-64.3	-46.1	177.3	-172.1	-91.8	0	0	0	111.8	V19 G20 L21 V25 N26 H27	V19-F23 WeakPolarHBondContact O-CB 3.15Å; V19-F23 PolarHBondContact O-N 3.28Å; G20-F23 PolarHBondContact O-N 3.37Å; L21-F23 VanDerWaalsContact C-N 3.28Å; L21-F23 PolarHBondContact O-N 3.37Å; F23-V25 VanDerWaalsContact C-N 3.32Å; F23-V25 PolarHBondContact O-N 3.03Å; F23-N26 PolarHBondContact O-N 3.39Å; F23-H27 HydrophobicContact CE1-CB 4.37Å; F23-H27 WeakPolarHBondContact O-CB 3.39Å; F23-H27 PolarHBondContact O-N 2.92Å
24	I	76.4	Confident	73.1	Confident	82 Å²	82	85.1 Å²	85.1	42%	0.421	45%	0.45	S	S	.	.	H	α-helix	trans	-59.7	-46.3	175.7	-69.6	166.1	0	0	0	110.2	G20 L21 N26 H27 Y28 L30	G20-I24 VanDerWaalsContact O-CG1 3.29Å; G20-I24 WeakPolarHBondContact O-CG1 3.36Å; G20-I24 PolarHBondContact O-N 2.96Å; L21-I24 PolarHBondContact O-N 3.05Å; I24-N26 VanDerWaalsContact C-N 3.33Å; I24-N26 PolarHBondContact O-N 2.92Å; I24-H27 PolarHBondContact O-N 3.28Å; I24-Y28 HydrophobicContact CG2-CD2 3.94Å; I24-Y28 HydrophobicContact CG2-CE2 4.32Å; I24-Y28 WeakPolarHBondContact O-CD2 3.28Å; I24-Y28 PolarHBondContact O-N 3.47Å; I24-L30 HydrophobicContact CG2-CD1 4.13Å
25	V	73.4	Confident	72.3	Confident	8 Å²	8	87.6 Å²	87.6	5%	0.048	46%	0.457	C	S	.	.	H	α-helix	trans	-59.2	-45.7	179	170.3	0	0	0	0	111.8	L21 L22 F23 Q29 L30 L31 P41	L21-V25 WeakPolarHBondContact O-CB 3.38Å; L21-V25 WeakPolarHBondContact O-CG2 3.42Å; L21-V25 PolarHBondContact O-N 3.31Å; L22-V25 PolarHBondContact O-N 3.45Å; F23-V25 VanDerWaalsContact C-N 3.32Å; F23-V25 PolarHBondContact O-N 3.03Å; V25-Q29 PolarHBondContact O-N 3.41Å; V25-L30 HydrophobicContact CG1-CB 4.37Å; V25-L30 PolarHBondContact O-N 3.26Å; V25-L31 HydrophobicContact CG1-CB 4.05Å; V25-L31 HydrophobicContact CG1-CD1 3.28Å; V25-L31 HydrophobicContact CG1-CG 3.34Å; V25-P41 HydrophobicContact CG2-CB 3.22Å; V25-P41 HydrophobicContact CG2-CG 3.58Å
26	N	73.2	Confident	71.6	Confident	127 Å²	127	92 Å²	92	68%	0.679	48%	0.475	S	S	*	.	H	α-helix	trans	-68.7	-46.3	178.6	-171.9	43.5	0	0	0	111.9	L22 F23 I24 Y28 Q29	L22-N26 VanDerWaalsContact O-CB 3.28Å; L22-N26 WeakPolarHBondContact O-CB 3.39Å; L22-N26 PolarHBondContact O-N 3Å; F23-N26 PolarHBondContact O-N 3.39Å; I24-N26 VanDerWaalsContact C-N 3.33Å; I24-N26 PolarHBondContact O-N 2.92Å; N26-Y28 PolarHBondContact O-N 2.92Å; N26-Q29 PolarHBondContact O-N 3.16Å; N26-Q29 VanDerWaalsContact O-N 3.15Å
27	H	77.5	Confident	70.8	Confident	124 Å²	124	91.7 Å²	91.7	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-41.9	-176.5	-174.8	69.2	0	0	0	112.6	F23 I24 Q29	F23-H27 HydrophobicContact CE1-CB 4.37Å; F23-H27 WeakPolarHBondContact O-CB 3.39Å; F23-H27 PolarHBondContact O-N 2.92Å; I24-H27 PolarHBondContact O-N 3.28Å; H27-Q29 VanDerWaalsContact C-N 3.29Å; H27-Q29 PolarHBondContact O-N 3Å
28	Y	74.6	Confident	70.3	Confident	144 Å²	144	91.8 Å²	91.8	57%	0.565	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	4.3	178.2	-71.4	-74.3	0	0	0	113.8	I24 N26 L30 K35	I24-Y28 HydrophobicContact CG2-CD2 3.94Å; I24-Y28 HydrophobicContact CG2-CE2 4.32Å; I24-Y28 WeakPolarHBondContact O-CD2 3.28Å; I24-Y28 PolarHBondContact O-N 3.47Å; N26-Y28 PolarHBondContact O-N 2.92Å; Y28-L30 PolarHBondContact O-N 3.47Å; Y28-L30 VanDerWaalsContact O-N 3.12Å; Y28-K35 PolarHBondContact O-NZ 3.2Å
29	Q	69	Low	69.9	Low	132 Å²	132	91.2 Å²	91.2	62%	0.617	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	40.6	-172.3	-59.2	174.9	-5	0	0	110.9	V25 N26 H27 L31 A32	V25-Q29 PolarHBondContact O-N 3.41Å; N26-Q29 PolarHBondContact O-N 3.16Å; N26-Q29 VanDerWaalsContact O-N 3.15Å; H27-Q29 VanDerWaalsContact C-N 3.29Å; H27-Q29 PolarHBondContact O-N 3Å; Q29-L31 PolarHBondContact O-N 2.83Å; Q29-A32 HydrophobicContact CB-CB 4.33Å; Q29-A32 WeakPolarHBondContact O-CB 3.32Å; Q29-A32 PolarHBondContact O-N 3.42Å
30	L	64.5	Low	69.9	Low	60 Å²	60	93.9 Å²	93.9	31%	0.314	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.6	-178	-80.8	156.2	0	0	0	110.8	I24 V25 Y28 A32 H38	I24-L30 HydrophobicContact CG2-CD1 4.13Å; V25-L30 HydrophobicContact CG1-CB 4.37Å; V25-L30 PolarHBondContact O-N 3.26Å; Y28-L30 PolarHBondContact O-N 3.47Å; Y28-L30 VanDerWaalsContact O-N 3.12Å; L30-A32 VanDerWaalsContact C-N 3.3Å; L30-H38 WeakPolarHBondContact O-CA 3.45Å; L30-H38 WeakPolarHBondContact O-CB 3.4Å
31	L	60.1	Low	69.6	Low	78 Å²	78	93 Å²	93	41%	0.408	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	3.3	173.2	-79.5	170.8	0	0	0	114.7	V25 Q29 H38 L42	V25-L31 HydrophobicContact CG1-CB 4.05Å; V25-L31 HydrophobicContact CG1-CD1 3.28Å; V25-L31 HydrophobicContact CG1-CG 3.34Å; Q29-L31 PolarHBondContact O-N 2.83Å; L31-H38 VanDerWaalsContact CD2-O 3.26Å; L31-H38 WeakPolarHBondContact CD2-O 3.33Å; L31-L42 HydrophobicContact CD2-CD1 4.12Å
32	A	63.6	Low	69.6	Low	27 Å²	27	95.3 Å²	95.3	22%	0.223	48%	0.48	C	S	.	.			trans	-58.8	124	172.7	0	0	0	0	0	108.5	Q29 L30 E34 K35	Q29-A32 HydrophobicContact CB-CB 4.33Å; Q29-A32 WeakPolarHBondContact O-CB 3.32Å; Q29-A32 PolarHBondContact O-N 3.42Å; L30-A32 VanDerWaalsContact C-N 3.3Å; A32-E34 PolarHBondContact O-N 2.6Å; A32-K35 PolarHBondContact O-N 2.93Å
33	P	60.8	Low	69.8	Low	111 Å²	111	99 Å²	99	72%	0.721	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.9	-172.4	22	-32.2	0	0	0	113	K35	P33-K35 VanDerWaalsContact C-N 3.34Å
34	E	62.9	Low	70	Confident	189 Å²	189	96.7 Å²	96.7	88%	0.883	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.5	178.7	-51.7	-167.6	-157.7	0	0	113.6	A32	A32-E34 PolarHBondContact O-N 2.6Å
35	K	60.4	Low	70.1	Confident	97 Å²	97	93.8 Å²	93.8	42%	0.422	47%	0.465	S	S	.	.	S	Bend	trans	-91.6	123.8	178.5	-68.1	-174.1	-177.9	176.4	0	111	Y28 A32 P33 G37 H38	Y28-K35 PolarHBondContact O-NZ 3.2Å; A32-K35 PolarHBondContact O-N 2.93Å; P33-K35 VanDerWaalsContact C-N 3.34Å; K35-G37 PolarHBondContact O-N 2.78Å; K35-H38 PolarHBondContact O-N 3.29Å; K35-H38 PolarHBondContact O-ND1 3.3Å; K35-H38 VanDerWaalsContact O-ND1 3.08Å
36	E	63.4	Low	70.5	Confident	199 Å²	199	98 Å²	98	93%	0.93	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	134.6	165.5	-71.6	-171.7	165.2	0	0	109.8
37	G	64.8	Low	71.1	Confident	52 Å²	52	98.2 Å²	98.2	54%	0.536	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	8.4	179.5	0	0	0	0	0	116.1	K35 L39 F40	K35-G37 PolarHBondContact O-N 2.78Å; G37-L39 PolarHBondContact O-N 3.36Å; G37-F40 VanDerWaalsContact O-CB 3.28Å; G37-F40 WeakPolarHBondContact O-CB 2.98Å; G37-F40 PolarHBondContact O-N 3Å
38	H	66.3	Low	71.3	Confident	58 Å²	58	94.6 Å²	94.6	27%	0.269	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.7	-179.8	63.6	-90.9	0	0	0	115.2	L30 L31 K35 P41	L30-H38 WeakPolarHBondContact O-CA 3.45Å; L30-H38 WeakPolarHBondContact O-CB 3.4Å; L31-H38 VanDerWaalsContact CD2-O 3.26Å; L31-H38 WeakPolarHBondContact CD2-O 3.33Å; K35-H38 PolarHBondContact O-N 3.29Å; K35-H38 PolarHBondContact O-ND1 3.3Å; K35-H38 VanDerWaalsContact O-ND1 3.08Å; H38-P41 WeakPolarHBondContact O-CD 3.2Å
39	L	71.4	Confident	71.6	Confident	72 Å²	72	90.4 Å²	90.4	38%	0.377	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-14.5	176.8	-59.3	178.9	0	0	0	114.2	G37 P41 L42 Y43	G37-L39 PolarHBondContact O-N 3.36Å; L39-P41 VanDerWaalsContact C-CD 3.49Å; L39-L42 HydrophobicContact CD2-CD1 3.97Å; L39-L42 WeakPolarHBondContact O-CB 3.5Å; L39-L42 PolarHBondContact O-N 3.06Å; L39-Y43 HydrophobicContact CB-CD2 3.98Å; L39-Y43 HydrophobicContact CB-CE2 3.49Å; L39-Y43 VanDerWaalsContact CB-CE2 3.49Å; L39-Y43 HydrophobicContact CD1-CE2 4.26Å; L39-Y43 WeakPolarHBondContact O-CD2 3.07Å; L39-Y43 PolarHBondContact O-N 3.31Å; L39-Y43 VanDerWaalsContact O-N 3.09Å
40	F	76.7	Confident	72.4	Confident	139 Å²	139	89.7 Å²	89.7	61%	0.61	46%	0.457	S	S	*	.	H	α-helix	trans	-53.8	-46.1	-177	173.4	-93.6	0	0	0	113.6	G37 L42 Y43 F44	G37-F40 VanDerWaalsContact O-CB 3.28Å; G37-F40 WeakPolarHBondContact O-CB 2.98Å; G37-F40 PolarHBondContact O-N 3Å; F40-L42 VanDerWaalsContact C-N 3.28Å; F40-L42 PolarHBondContact O-N 3.28Å; F40-Y43 PolarHBondContact O-N 2.88Å; F40-F44 WeakPolarHBondContact O-CB 3.22Å; F40-F44 PolarHBondContact O-N 3.36Å
41	P	73.7	Confident	73.5	Confident	14 Å²	14	89.8 Å²	89.8	9%	0.091	46%	0.46	C	S	.	.	H	α-helix	trans	-62.3	-34.2	178.4	-22.8	35.7	0	0	0	113.1	V25 H38 L39 F44 I45	V25-P41 HydrophobicContact CG2-CB 3.22Å; V25-P41 HydrophobicContact CG2-CG 3.58Å; H38-P41 WeakPolarHBondContact O-CD 3.2Å; L39-P41 VanDerWaalsContact C-CD 3.49Å; P41-F44 PolarHBondContact O-N 3.27Å; P41-I45 VanDerWaalsContact O-CG1 3.25Å; P41-I45 WeakPolarHBondContact O-CG1 3.44Å; P41-I45 PolarHBondContact O-N 3.04Å
42	L	74.5	Confident	74.6	Confident	76 Å²	76	87.5 Å²	87.5	40%	0.398	45%	0.448	S	S	.	.	H	α-helix	trans	-67	-46.7	176.2	-67.9	169	0	0	0	110.9	L31 L39 F40 F44 I45 I46	L31-L42 HydrophobicContact CD2-CD1 4.12Å; L39-L42 HydrophobicContact CD2-CD1 3.97Å; L39-L42 WeakPolarHBondContact O-CB 3.5Å; L39-L42 PolarHBondContact O-N 3.06Å; F40-L42 VanDerWaalsContact C-N 3.28Å; F40-L42 PolarHBondContact O-N 3.28Å; L42-F44 VanDerWaalsContact C-N 3.29Å; L42-F44 PolarHBondContact O-N 3.06Å; L42-I45 PolarHBondContact O-N 2.96Å; L42-I46 WeakPolarHBondContact O-CG1 3.08Å; L42-I46 PolarHBondContact O-N 3.42Å; L42-I46 VanDerWaalsContact O-N 3.12Å
43	Y	81.5	Confident	75.5	Confident	152 Å²	152	87.7 Å²	87.7	60%	0.596	45%	0.453	S	S	*	.	H	α-helix	trans	-61.2	-40	175.4	-67.2	-56.8	0	0	0	112	L39 F40 I46 F47	L39-Y43 HydrophobicContact CB-CD2 3.98Å; L39-Y43 HydrophobicContact CB-CE2 3.49Å; L39-Y43 VanDerWaalsContact CB-CE2 3.49Å; L39-Y43 HydrophobicContact CD1-CE2 4.26Å; L39-Y43 WeakPolarHBondContact O-CD2 3.07Å; L39-Y43 PolarHBondContact O-N 3.31Å; L39-Y43 VanDerWaalsContact O-N 3.09Å; F40-Y43 PolarHBondContact O-N 2.88Å; Y43-I46 PolarHBondContact O-N 2.78Å; Y43-F47 WeakPolarHBondContact O-CB 3.42Å; Y43-F47 PolarHBondContact O-N 3.21Å
44	F	81	Confident	76.8	Confident	90 Å²	90	85.4 Å²	85.4	40%	0.395	44%	0.443	S	S	.	.	H	α-helix	trans	-63.8	-42.8	178.4	-174.3	-102.9	0	0	0	112.3	L21 F40 P41 L42 F47 L48	L21-F44 HydrophobicContact CD1-CD1 3.92Å; L21-F44 HydrophobicContact CD1-CE1 4.13Å; L21-F44 HydrophobicContact CD2-CD1 4.05Å; L21-F44 HydrophobicContact CD2-CE1 4.29Å; F40-F44 WeakPolarHBondContact O-CB 3.22Å; F40-F44 PolarHBondContact O-N 3.36Å; P41-F44 PolarHBondContact O-N 3.27Å; L42-F44 VanDerWaalsContact C-N 3.29Å; L42-F44 PolarHBondContact O-N 3.06Å; F44-F47 PolarHBondContact O-N 2.97Å; F44-L48 WeakPolarHBondContact O-CB 3.06Å; F44-L48 PolarHBondContact O-N 2.8Å
45	I	78.4	Confident	77.9	Confident	21 Å²	21	79 Å²	79	11%	0.108	42%	0.417	C	S	.	.	H	α-helix	trans	-59.9	-47.1	174.9	-74.2	167.6	0	0	0	111.4	F18 L21 P41 L42 F47 L48 S49	F18-I45 HydrophobicContact CD2-CD1 4.09Å; F18-I45 HydrophobicContact CD2-CG1 4.39Å; F18-I45 HydrophobicContact CD2-CG2 3.45Å; F18-I45 VanDerWaalsContact CD2-CG2 3.45Å; F18-I45 HydrophobicContact CE2-CD1 4.17Å; F18-I45 HydrophobicContact CE2-CG2 3.64Å; L21-I45 HydrophobicContact CB-CD1 3.91Å; L21-I45 HydrophobicContact CB-CG1 4.04Å; L21-I45 HydrophobicContact CD1-CD1 4.34Å; L21-I45 HydrophobicContact CD1-CG1 3.51Å; L21-I45 HydrophobicContact CG-CG1 4.36Å; P41-I45 VanDerWaalsContact O-CG1 3.25Å; P41-I45 WeakPolarHBondContact O-CG1 3.44Å; P41-I45 PolarHBondContact O-N 3.04Å; L42-I45 PolarHBondContact O-N 2.96Å; I45-F47 VanDerWaalsContact C-N 3.32Å; I45-F47 PolarHBondContact O-N 3.21Å; I45-L48 PolarHBondContact O-N 2.71Å; I45-S49 WeakPolarHBondContact O-CB 3.44Å; I45-S49 PolarHBondContact O-N 2.87Å; I45-S49 PolarHBondContact O-OG 3.02Å
46	I	81.7	Confident	79	Confident	97 Å²	97	76.1 Å²	76.1	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-42.7	179.8	-67.4	167.1	0	0	0	110.4	L42 Y43 S49 L50	L42-I46 WeakPolarHBondContact O-CG1 3.08Å; L42-I46 PolarHBondContact O-N 3.42Å; L42-I46 VanDerWaalsContact O-N 3.12Å; Y43-I46 PolarHBondContact O-N 2.78Å; I46-S49 PolarHBondContact O-N 3.27Å; I46-S49 PolarHBondContact O-OG 3.09Å; I46-L50 HydrophobicContact CG2-CD1 4.12Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.47Å
47	F	86.5	Confident	80	Confident	130 Å²	130	70.4 Å²	70.4	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-61.8	-46.9	176.7	177.1	-100.1	0	0	0	111.8	Y43 F44 I45 S49 L50 V51	Y43-F47 WeakPolarHBondContact O-CB 3.42Å; Y43-F47 PolarHBondContact O-N 3.21Å; F44-F47 PolarHBondContact O-N 2.97Å; I45-F47 VanDerWaalsContact C-N 3.32Å; I45-F47 PolarHBondContact O-N 3.21Å; F47-S49 PolarHBondContact O-N 2.93Å; F47-L50 WeakPolarHBondContact O-CB 3.47Å; F47-L50 PolarHBondContact O-N 2.98Å; F47-V51 HydrophobicContact CD1-CG2 4.39Å; F47-V51 HydrophobicContact CE1-CG2 3.95Å; F47-V51 HydrophobicContact CE2-CG2 4.23Å; F47-V51 HydrophobicContact CZ-CG2 3.86Å; F47-V51 WeakPolarHBondContact O-CG2 3.49Å; F47-V51 PolarHBondContact O-N 3.26Å
48	L	82.2	Confident	81.1	Confident	49 Å²	49	74.4 Å²	74.4	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-40.9	-179.5	-173.2	69.3	0	0	0	112.1	V17 F44 I45 L50 V51 I52	V17-L48 HydrophobicContact CB-CD2 4.21Å; V17-L48 HydrophobicContact CG1-CD2 3.34Å; F44-L48 WeakPolarHBondContact O-CB 3.06Å; F44-L48 PolarHBondContact O-N 2.8Å; I45-L48 PolarHBondContact O-N 2.71Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.46Å; L48-V51 PolarHBondContact O-N 3.48Å; L48-I52 HydrophobicContact CD1-CD1 4.22Å; L48-I52 HydrophobicContact CD2-CD1 4.4Å; L48-I52 HydrophobicContact CG-CD1 3.88Å; L48-I52 WeakPolarHBondContact O-CG1 3.48Å; L48-I52 PolarHBondContact O-N 2.84Å
49	S	81.2	Confident	82	Confident	55 Å²	55	77 Å²	77	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-65.5	-37.4	177.5	68.5	0	0	0	0	112.1	I45 I46 F47 I52 G53	I45-S49 WeakPolarHBondContact O-CB 3.44Å; I45-S49 PolarHBondContact O-N 2.87Å; I45-S49 PolarHBondContact O-OG 3.02Å; I46-S49 PolarHBondContact O-N 3.27Å; I46-S49 PolarHBondContact O-OG 3.09Å; F47-S49 PolarHBondContact O-N 2.93Å; S49-I52 PolarHBondContact O-N 2.84Å; S49-G53 PolarHBondContact O-N 3.04Å
50	L	85.9	Confident	82.5	Confident	117 Å²	117	75.1 Å²	75.1	61%	0.613	39%	0.393	S	S	*	.	H	α-helix	trans	-62.1	-45.4	172.4	-78	167.6	0	0	0	112	I46 F47 L48 G53 A54	I46-L50 HydrophobicContact CG2-CD1 4.12Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.47Å; F47-L50 WeakPolarHBondContact O-CB 3.47Å; F47-L50 PolarHBondContact O-N 2.98Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.46Å; L50-G53 PolarHBondContact O-N 3.26Å; L50-A54 VanDerWaalsContact O-CB 3.28Å; L50-A54 WeakPolarHBondContact O-CB 3.43Å; L50-A54 PolarHBondContact O-N 3.43Å
51	V	87.3	Confident	83	Confident	62 Å²	62	69.4 Å²	69.4	38%	0.376	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-44.3	178.6	172.1	0	0	0	0	111	F47 L48 A54 T55	F47-V51 HydrophobicContact CD1-CG2 4.39Å; F47-V51 HydrophobicContact CE1-CG2 3.95Å; F47-V51 HydrophobicContact CE2-CG2 4.23Å; F47-V51 HydrophobicContact CZ-CG2 3.86Å; F47-V51 WeakPolarHBondContact O-CG2 3.49Å; F47-V51 PolarHBondContact O-N 3.26Å; L48-V51 PolarHBondContact O-N 3.48Å; V51-A54 PolarHBondContact O-N 3.2Å; V51-T55 WeakPolarHBondContact O-CB 3.49Å; V51-T55 WeakPolarHBondContact O-CG2 3.37Å; V51-T55 PolarHBondContact O-N 3.49Å; V51-T55 PolarHBondContact O-OG1 2.86Å
52	I	82.1	Confident	83.6	Confident	30 Å²	30	74.2 Å²	74.2	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-67.8	-43	179.1	-67.9	168.1	0	0	0	111.1	M10 V14 L48 S49 A54 T55 L56	M10-I52 HydrophobicContact CE-CB 4.44Å; M10-I52 HydrophobicContact CE-CG2 3.63Å; M10-I52 HydrophobicContact SD-CG2 4.15Å; V14-I52 HydrophobicContact CG2-CB 4.01Å; V14-I52 HydrophobicContact CG2-CD1 3.48Å; V14-I52 VanDerWaalsContact CG2-CD1 3.48Å; V14-I52 HydrophobicContact CG2-CG1 4.28Å; V14-I52 HydrophobicContact CG2-CG2 3.35Å; L48-I52 HydrophobicContact CD1-CD1 4.22Å; L48-I52 HydrophobicContact CD2-CD1 4.4Å; L48-I52 HydrophobicContact CG-CD1 3.88Å; L48-I52 WeakPolarHBondContact O-CG1 3.48Å; L48-I52 PolarHBondContact O-N 2.84Å; S49-I52 PolarHBondContact O-N 2.84Å; I52-A54 PolarHBondContact O-N 3.45Å; I52-T55 WeakPolarHBondContact CA-OG1 3.37Å; I52-T55 PolarHBondContact O-N 2.95Å; I52-T55 PolarHBondContact O-OG1 3.41Å; I52-L56 VanDerWaalsContact O-CB 3.29Å; I52-L56 WeakPolarHBondContact O-CB 3.26Å; I52-L56 PolarHBondContact O-N 2.99Å
53	G	82.6	Confident	84	Confident	32 Å²	32	75.2 Å²	75.2	33%	0.33	39%	0.391	S	S	.	.	H	α-helix	trans	-60.2	-44.8	175.4	0	0	0	0	0	112.3	S49 L50 S57	S49-G53 PolarHBondContact O-N 3.04Å; L50-G53 PolarHBondContact O-N 3.26Å; G53-S57 VanDerWaalsContact O-CB 3.28Å; G53-S57 WeakPolarHBondContact O-CB 3.49Å; G53-S57 PolarHBondContact O-N 3.32Å; G53-S57 PolarHBondContact O-OG 3.46Å
54	A	87.8	Confident	84.1	Confident	62 Å²	62	69.8 Å²	69.8	51%	0.512	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-45.9	178.9	0	0	0	0	0	112.3	L50 V51 I52 S57 F58	L50-A54 VanDerWaalsContact O-CB 3.28Å; L50-A54 WeakPolarHBondContact O-CB 3.43Å; L50-A54 PolarHBondContact O-N 3.43Å; V51-A54 PolarHBondContact O-N 3.2Å; I52-A54 PolarHBondContact O-N 3.45Å; A54-S57 PolarHBondContact O-N 3.25Å; A54-F58 WeakPolarHBondContact O-CB 3.49Å; A54-F58 PolarHBondContact O-N 2.88Å
55	T	86.3	Confident	84.3	Confident	55 Å²	55	70.9 Å²	70.9	34%	0.337	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-46.1	177.5	48.4	0	0	0	0	111.4	V51 I52 S57 F58 F59	V51-T55 WeakPolarHBondContact O-CB 3.49Å; V51-T55 WeakPolarHBondContact O-CG2 3.37Å; V51-T55 PolarHBondContact O-N 3.49Å; V51-T55 PolarHBondContact O-OG1 2.86Å; I52-T55 WeakPolarHBondContact CA-OG1 3.37Å; I52-T55 PolarHBondContact O-N 2.95Å; I52-T55 PolarHBondContact O-OG1 3.41Å; T55-S57 PolarHBondContact O-N 3.3Å; T55-F58 WeakPolarHBondContact O-CB 3.47Å; T55-F58 PolarHBondContact O-N 2.87Å; T55-F59 VanDerWaalsContact O-CD2 3.25Å; T55-F59 WeakPolarHBondContact O-CD2 3.45Å; T55-F59 PolarHBondContact O-N 2.97Å
56	L	83.3	Confident	84.8	Confident	36 Å²	36	74.9 Å²	74.9	19%	0.188	40%	0.403	C	S	.	.	H	α-helix	trans	-58.4	-50.7	176	-177.4	64	0	0	0	110.8	T7 M10 I52 F58 F59 V60	T7-L56 HydrophobicContact CG2-CD1 3.91Å; M10-L56 HydrophobicContact SD-CB 3.78Å; M10-L56 HydrophobicContact SD-CD1 3.68Å; M10-L56 HydrophobicContact SD-CG 4.17Å; I52-L56 VanDerWaalsContact O-CB 3.29Å; I52-L56 WeakPolarHBondContact O-CB 3.26Å; I52-L56 PolarHBondContact O-N 2.99Å; L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 PolarHBondContact O-N 2.66Å; L56-F59 PolarHBondContact O-N 2.91Å; L56-V60 HydrophobicContact CD1-CG2 4.15Å; L56-V60 HydrophobicContact CG-CG2 4.14Å; L56-V60 VanDerWaalsContact O-CG2 3.23Å; L56-V60 WeakPolarHBondContact O-CG2 3.33Å; L56-V60 PolarHBondContact O-N 2.84Å
57	S	85.1	Confident	85.2	Confident	80 Å²	80	70.6 Å²	70.6	56%	0.559	38%	0.381	S	S	*	.	H	α-helix	trans	-57.4	-40.2	-179.8	-59.2	0	0	0	0	112.1	G53 A54 T55 G61	G53-S57 VanDerWaalsContact O-CB 3.28Å; G53-S57 WeakPolarHBondContact O-CB 3.49Å; G53-S57 PolarHBondContact O-N 3.32Å; G53-S57 PolarHBondContact O-OG 3.46Å; A54-S57 PolarHBondContact O-N 3.25Å; T55-S57 PolarHBondContact O-N 3.3Å; S57-G61 PolarHBondContact O-N 3.24Å
58	F	88	Confident	85.4	Confident	135 Å²	135	68.9 Å²	68.9	59%	0.592	38%	0.377	S	S	*	.	H	α-helix	trans	-62.3	-45.7	174.3	179.2	-98.4	0	0	0	112.2	A54 T55 L56 K62	A54-F58 WeakPolarHBondContact O-CB 3.49Å; A54-F58 PolarHBondContact O-N 2.88Å; T55-F58 WeakPolarHBondContact O-CB 3.47Å; T55-F58 PolarHBondContact O-N 2.87Å; L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 PolarHBondContact O-N 2.66Å; F58-K62 HydrophobicContact CZ-CD 4.45Å; F58-K62 WeakPolarHBondContact O-CB 3.48Å; F58-K62 PolarHBondContact O-N 3.44Å
59	F	85.1	Confident	85.9	Confident	114 Å²	114	67.7 Å²	67.7	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-64.6	-47.3	177.2	-86.1	-75.7	0	0	0	112.4	T55 L56 G61 K62 R63	T55-F59 VanDerWaalsContact O-CD2 3.25Å; T55-F59 WeakPolarHBondContact O-CD2 3.45Å; T55-F59 PolarHBondContact O-N 2.97Å; L56-F59 PolarHBondContact O-N 2.91Å; F59-G61 VanDerWaalsContact C-N 3.35Å; F59-G61 PolarHBondContact O-N 2.85Å; F59-K62 PolarHBondContact O-N 2.84Å; F59-R63 WeakPolarHBondContact O-CB 3.5Å; F59-R63 PolarHBondContact O-N 3.1Å
60	V	82.6	Confident	86.4	Confident	32 Å²	32	68.9 Å²	68.9	19%	0.194	38%	0.379	C	S	.	.	H	α-helix	trans	-60.3	-46.9	176.8	-174.1	0	0	0	0	110.5	F3 L56 K62 I64 L65	F3-V60 HydrophobicContact CE2-CB 4.37Å; F3-V60 HydrophobicContact CE2-CG1 4.35Å; F3-V60 HydrophobicContact CE2-CG2 3.69Å; F3-V60 HydrophobicContact CZ-CB 4.22Å; F3-V60 HydrophobicContact CZ-CG1 3.86Å; F3-V60 HydrophobicContact CZ-CG2 3.5Å; L56-V60 HydrophobicContact CD1-CG2 4.15Å; L56-V60 HydrophobicContact CG-CG2 4.14Å; L56-V60 VanDerWaalsContact O-CG2 3.23Å; L56-V60 WeakPolarHBondContact O-CG2 3.33Å; L56-V60 PolarHBondContact O-N 2.84Å; V60-K62 VanDerWaalsContact C-N 3.34Å; V60-K62 PolarHBondContact O-N 3.34Å; V60-I64 HydrophobicContact CG1-CD1 4.47Å; V60-I64 WeakPolarHBondContact O-CB 3.4Å; V60-I64 PolarHBondContact O-N 3.36Å; V60-L65 HydrophobicContact CG1-CG 4.48Å; V60-L65 PolarHBondContact O-N 2.86Å
61	G	85.6	Confident	86.9	Confident	18 Å²	18	64.1 Å²	64.1	19%	0.186	35%	0.354	C	S	.	.	I	π-helix	trans	-56.3	-48.6	179.4	0	0	0	0	0	111.9	S57 F59 L65 L66	S57-G61 PolarHBondContact O-N 3.24Å; F59-G61 VanDerWaalsContact C-N 3.35Å; F59-G61 PolarHBondContact O-N 2.85Å; G61-L65 PolarHBondContact O-N 3.45Å; G61-L66 WeakPolarHBondContact O-CB 3.29Å; G61-L66 WeakPolarHBondContact O-CG 3.33Å; G61-L66 PolarHBondContact O-N 2.91Å
62	K	86.6	Confident	87.2	Confident	115 Å²	115	69.8 Å²	69.8	50%	0.5	37%	0.368	S	S	.	.	I	π-helix	trans	-74.3	-39.9	-177	-170.1	176	178.6	179.4	0	113.6	F58 F59 V60 P67	F58-K62 HydrophobicContact CZ-CD 4.45Å; F58-K62 WeakPolarHBondContact O-CB 3.48Å; F58-K62 PolarHBondContact O-N 3.44Å; F59-K62 PolarHBondContact O-N 2.84Å; V60-K62 VanDerWaalsContact C-N 3.34Å; V60-K62 PolarHBondContact O-N 3.34Å; K62-P67 WeakPolarHBondContact O-CD 3.25Å
63	R	84	Confident	87.8	Confident	98 Å²	98	73.9 Å²	73.9	37%	0.37	39%	0.387	S	S	.	.	I	π-helix	trans	-90.1	-20.8	-172.9	-67	-141.7	-179.9	-172.7	3.2	114.7	F59 Q92 M93	F59-R63 WeakPolarHBondContact O-CB 3.5Å; F59-R63 PolarHBondContact O-N 3.1Å; R63-Q92 VanDerWaalsContact CZ-OE1 3.26Å; R63-M93 HydrophobicContact CB-SD 3.94Å
64	I	82.2	Confident	88.5	Confident	37 Å²	37	72.5 Å²	72.5	19%	0.19	37%	0.372	C	S	.	.	I	π-helix	trans	-126.8	-57.1	-174.2	-61	172.9	0	0	0	111.1	F3 V60 P67 I68 M93	F3-I64 HydrophobicContact CB-CD1 4.42Å; F3-I64 HydrophobicContact CD1-CD1 3.83Å; F3-I64 HydrophobicContact CD2-CD1 3.48Å; F3-I64 VanDerWaalsContact CD2-CD1 3.48Å; F3-I64 HydrophobicContact CE1-CD1 3.87Å; F3-I64 HydrophobicContact CE2-CD1 3.52Å; F3-I64 HydrophobicContact CG-CD1 3.63Å; F3-I64 HydrophobicContact CZ-CD1 3.71Å; V60-I64 HydrophobicContact CG1-CD1 4.47Å; V60-I64 WeakPolarHBondContact O-CB 3.4Å; V60-I64 PolarHBondContact O-N 3.36Å; I64-P67 WeakPolarHBondContact O-CD 3.27Å; I64-I68 HydrophobicContact CG2-CD1 3.6Å; I64-I68 WeakPolarHBondContact O-CB 3.23Å; I64-I68 VanDerWaalsContact O-CG1 3.23Å; I64-I68 WeakPolarHBondContact O-CG1 3.15Å; I64-I68 PolarHBondContact O-N 2.91Å; I64-M93 HydrophobicContact CG1-CE 4.5Å; I64-M93 HydrophobicContact CG1-SD 4.01Å
65	L	85.7	Confident	88.9	Confident	113 Å²	113	74 Å²	74	59%	0.592	37%	0.37	S	S	*	.	I	π-helix	trans	-68	-42.5	-171.5	-63.1	177	0	0	0	113.2	V60 G61 I68 G69	V60-L65 HydrophobicContact CG1-CG 4.48Å; V60-L65 PolarHBondContact O-N 2.86Å; G61-L65 PolarHBondContact O-N 3.45Å; L65-I68 PolarHBondContact O-N 3.2Å; L65-G69 PolarHBondContact O-N 3.44Å
66	L	89.2	Confident	89.4	Confident	106 Å²	106	74 Å²	74	56%	0.555	37%	0.372	S	S	*	.	H	α-helix	trans	-63.7	-49.4	177	-78.2	179.3	0	0	0	112	G61 I68 G69 N70	G61-L66 WeakPolarHBondContact O-CB 3.29Å; G61-L66 WeakPolarHBondContact O-CG 3.33Å; G61-L66 PolarHBondContact O-N 2.91Å; L66-I68 VanDerWaalsContact C-N 3.35Å; L66-I68 PolarHBondContact O-N 3.05Å; L66-G69 WeakPolarHBondContact O-CA 3.37Å; L66-G69 PolarHBondContact O-N 3.47Å; L66-G69 VanDerWaalsContact O-N 3.1Å; L66-N70 PolarHBondContact O-N 3.34Å
67	P	90.5	Very high	90	Very high	7 Å²	7	76.6 Å²	76.6	5%	0.045	38%	0.382	C	S	.	.	H	α-helix	trans	-58.5	-40.5	174.7	-28.9	35.4	0	0	0	114.6	K62 I64 G69 N70 L71 V96 Y100	K62-P67 WeakPolarHBondContact O-CD 3.25Å; I64-P67 WeakPolarHBondContact O-CD 3.27Å; P67-G69 VanDerWaalsContact C-N 3.31Å; P67-G69 PolarHBondContact O-N 3.43Å; P67-N70 PolarHBondContact O-N 3.26Å; P67-L71 PolarHBondContact O-N 2.83Å; P67-V96 HydrophobicContact CB-CG1 3.57Å; P67-V96 HydrophobicContact CG-CG1 4.27Å; P67-Y100 VanDerWaalsContact C-OH 3.29Å; P67-Y100 WeakPolarHBondContact CA-OH 3.31Å; P67-Y100 HydrophobicContact CB-CE1 4.45Å; P67-Y100 WeakPolarHBondContact CB-OH 3.46Å; P67-Y100 PolarHBondContact O-OH 3.25Å
68	I	89.4	Confident	90.5	Very high	94 Å²	94	73.4 Å²	73.4	48%	0.482	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-40.6	174.7	-68.6	170	0	0	0	110.7	I64 L65 L66 L71 R72	I64-I68 HydrophobicContact CG2-CD1 3.6Å; I64-I68 WeakPolarHBondContact O-CB 3.23Å; I64-I68 VanDerWaalsContact O-CG1 3.23Å; I64-I68 WeakPolarHBondContact O-CG1 3.15Å; I64-I68 PolarHBondContact O-N 2.91Å; L65-I68 PolarHBondContact O-N 3.2Å; L66-I68 VanDerWaalsContact C-N 3.35Å; L66-I68 PolarHBondContact O-N 3.05Å; I68-L71 PolarHBondContact O-N 2.92Å; I68-R72 WeakPolarHBondContact O-CB 3.26Å; I68-R72 PolarHBondContact O-N 3.36Å
69	G	92.6	Very high	90.8	Very high	24 Å²	24	71.7 Å²	71.7	25%	0.247	36%	0.363	C	S	.	.	H	α-helix	trans	-60	-44.9	175.6	0	0	0	0	0	112.8	L65 L66 P67 R72 Q73	L65-G69 PolarHBondContact O-N 3.44Å; L66-G69 WeakPolarHBondContact O-CA 3.37Å; L66-G69 PolarHBondContact O-N 3.47Å; L66-G69 VanDerWaalsContact O-N 3.1Å; P67-G69 VanDerWaalsContact C-N 3.31Å; P67-G69 PolarHBondContact O-N 3.43Å; G69-R72 PolarHBondContact O-N 3.46Å; G69-Q73 PolarHBondContact O-N 2.9Å
70	N	93.6	Very high	91.2	Very high	80 Å²	80	74.6 Å²	74.6	43%	0.428	38%	0.376	S	S	.	.	H	α-helix	trans	-63	-46.1	176.5	-68.1	-14.9	0	0	0	111.5	L66 P67 R72 Q73 A74 Y100	L66-N70 PolarHBondContact O-N 3.34Å; P67-N70 PolarHBondContact O-N 3.26Å; N70-R72 PolarHBondContact O-N 2.95Å; N70-Q73 PolarHBondContact O-N 3.22Å; N70-A74 WeakPolarHBondContact O-CB 3.13Å; N70-A74 PolarHBondContact O-N 3.4Å; N70-Y100 WeakPolarHBondContact CB-OH 3.46Å
71	L	94.7	Very high	91.7	Very high	17 Å²	17	74.7 Å²	74.7	9%	0.089	38%	0.384	C	S	.	.	H	α-helix	trans	-59.6	-45.5	175.9	177.5	62.8	0	0	0	111.3	P67 I68 Q73 A74 M75 L87 L99 Y100 F103	P67-L71 PolarHBondContact O-N 2.83Å; I68-L71 PolarHBondContact O-N 2.92Å; L71-Q73 VanDerWaalsContact C-N 3.29Å; L71-Q73 PolarHBondContact O-N 3.4Å; L71-A74 PolarHBondContact O-N 2.93Å; L71-A74 VanDerWaalsContact O-N 3.17Å; L71-M75 HydrophobicContact CD1-CG 4.19Å; L71-M75 HydrophobicContact CG-CE 4.04Å; L71-M75 HydrophobicContact CG-CG 4.4Å; L71-M75 HydrophobicContact CG-SD 4.37Å; L71-M75 WeakPolarHBondContact O-CB 3.45Å; L71-M75 WeakPolarHBondContact O-CG 3.26Å; L71-M75 PolarHBondContact O-N 2.86Å; L71-L87 HydrophobicContact CB-CD1 4.3Å; L71-L87 HydrophobicContact CD1-CD1 3.52Å; L71-L99 HydrophobicContact CD2-CD1 4.13Å; L71-L99 HydrophobicContact CD2-CD2 3.42Å; L71-L99 VanDerWaalsContact CD2-CD2 3.42Å; L71-L99 HydrophobicContact CD2-CG 3.7Å; L71-Y100 HydrophobicContact CB-CE1 4.05Å; L71-F103 HydrophobicContact CD1-CB 4.03Å; L71-F103 HydrophobicContact CD1-CD2 3.61Å; L71-F103 HydrophobicContact CD1-CE2 4.22Å; L71-F103 HydrophobicContact CD1-CG 3.79Å
72	R	94.2	Very high	92	Very high	181 Å²	181	76.6 Å²	76.6	68%	0.683	39%	0.39	S	S	*	.	H	α-helix	trans	-58.3	-41.9	176.2	-174.4	-173.8	65.3	173.3	-0.4	112	I68 G69 N70 M75 S76	I68-R72 WeakPolarHBondContact O-CB 3.26Å; I68-R72 PolarHBondContact O-N 3.36Å; G69-R72 PolarHBondContact O-N 3.46Å; N70-R72 PolarHBondContact O-N 2.95Å; R72-M75 HydrophobicContact CB-CE 4.46Å; R72-S76 PolarHBondContact O-N 2.88Å
73	Q	95.7	Very high	92.3	Very high	115 Å²	115	73 Å²	73	54%	0.537	37%	0.374	S	S	.	.	H	α-helix	trans	-66.7	-42	176.8	-173.5	178.6	3.3	0	0	111.6	G69 N70 L71 S76 K77	G69-Q73 PolarHBondContact O-N 2.9Å; N70-Q73 PolarHBondContact O-N 3.22Å; L71-Q73 VanDerWaalsContact C-N 3.29Å; L71-Q73 PolarHBondContact O-N 3.4Å; Q73-S76 PolarHBondContact O-N 3.29Å; Q73-K77 PolarHBondContact O-N 3.19Å; Q73-K77 VanDerWaalsContact O-N 3.12Å
74	A	96.7	Very high	92.7	Very high	4 Å²	4	74.1 Å²	74.1	3%	0.033	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-47.9	176.7	0	0	0	0	0	111.6	N70 L71 S76 K77 V78 V85 L87 F103	N70-A74 WeakPolarHBondContact O-CB 3.13Å; N70-A74 PolarHBondContact O-N 3.4Å; L71-A74 PolarHBondContact O-N 2.93Å; L71-A74 VanDerWaalsContact O-N 3.17Å; A74-S76 VanDerWaalsContact C-N 3.26Å; A74-S76 PolarHBondContact O-N 3.03Å; A74-K77 WeakPolarHBondContact O-CB 3.38Å; A74-K77 PolarHBondContact O-N 3.3Å; A74-V78 WeakPolarHBondContact O-CG2 3.45Å; A74-V78 PolarHBondContact O-N 2.84Å; A74-V85 HydrophobicContact CB-CG1 3.71Å; A74-L87 HydrophobicContact CB-CD1 4.17Å; A74-L87 HydrophobicContact CB-CD2 3.82Å; A74-L87 HydrophobicContact CB-CG 4.06Å; A74-F103 HydrophobicContact CB-CE1 3.85Å; A74-F103 HydrophobicContact CB-CE2 4.29Å; A74-F103 HydrophobicContact CB-CZ 3.53Å
75	M	95.7	Very high	93.2	Very high	93 Å²	93	73.1 Å²	73.1	46%	0.458	39%	0.387	S	S	.	.	H	α-helix	trans	-55.4	-40.4	172.9	-72	-170.5	-63.9	0	0	112.1	L71 R72 K77 V78 S79 F103	L71-M75 HydrophobicContact CD1-CG 4.19Å; L71-M75 HydrophobicContact CG-CE 4.04Å; L71-M75 HydrophobicContact CG-CG 4.4Å; L71-M75 HydrophobicContact CG-SD 4.37Å; L71-M75 WeakPolarHBondContact O-CB 3.45Å; L71-M75 WeakPolarHBondContact O-CG 3.26Å; L71-M75 PolarHBondContact O-N 2.86Å; R72-M75 HydrophobicContact CB-CE 4.46Å; M75-K77 VanDerWaalsContact C-N 3.3Å; M75-K77 PolarHBondContact O-N 3.34Å; M75-V78 PolarHBondContact O-N 2.94Å; M75-S79 WeakPolarHBondContact O-CB 3.49Å; M75-S79 PolarHBondContact O-N 2.61Å; M75-S79 PolarHBondContact O-OG 3.34Å; M75-F103 HydrophobicContact CB-CE2 4.49Å; M75-F103 HydrophobicContact CG-CD2 4.13Å; M75-F103 HydrophobicContact CG-CE2 3.72Å
76	S	96.7	Very high	93.6	Very high	54 Å²	54	75.3 Å²	75.3	38%	0.378	40%	0.395	S	S	.	.	H	α-helix	trans	-68.6	-24.9	176.7	179.6	0	0	0	0	114.1	R72 Q73 A74 S79 K80	R72-S76 PolarHBondContact O-N 2.88Å; Q73-S76 PolarHBondContact O-N 3.29Å; A74-S76 VanDerWaalsContact C-N 3.26Å; A74-S76 PolarHBondContact O-N 3.03Å; S76-S79 PolarHBondContact O-OG 3.13Å; S76-S79 VanDerWaalsContact O-OG 3.14Å; S76-K80 WeakPolarHBondContact O-CD 3.46Å; S76-K80 WeakPolarHBondContact O-CG 3.42Å
77	K	96.1	Very high	93.8	Very high	92 Å²	92	71.3 Å²	71.3	40%	0.4	37%	0.374	S	S	.	.	H	α-helix	trans	-77.9	-44.7	173.9	-72.7	-178.2	178.5	-175.1	0	110.3	Q73 A74 M75 S79 K80 G81 D82 V85	Q73-K77 PolarHBondContact O-N 3.19Å; Q73-K77 VanDerWaalsContact O-N 3.12Å; A74-K77 WeakPolarHBondContact O-CB 3.38Å; A74-K77 PolarHBondContact O-N 3.3Å; M75-K77 VanDerWaalsContact C-N 3.3Å; M75-K77 PolarHBondContact O-N 3.34Å; K77-S79 VanDerWaalsContact C-N 3.31Å; K77-S79 PolarHBondContact O-N 2.77Å; K77-K80 WeakPolarHBondContact O-CA 3.24Å; K77-K80 WeakPolarHBondContact O-CB 3.24Å; K77-K80 PolarHBondContact O-N 3.04Å; K77-G81 PolarHBondContact O-N 3.23Å; K77-D82 HydrophobicContact CB-CB 4.28Å; K77-D82 PolarHBondContact O-N 2.95Å; K77-D82 VanDerWaalsContact O-N 3.11Å; K77-V85 HydrophobicContact CB-CG2 3.69Å; K77-V85 HydrophobicContact CD-CG1 4.5Å; K77-V85 HydrophobicContact CD-CG2 3.57Å; K77-V85 HydrophobicContact CG-CG2 4.32Å
78	V	96.1	Very high	93.8	Very high	13 Å²	13	75.6 Å²	75.6	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-59.7	-41.7	176	175	0	0	0	0	111.2	A74 M75 K80 G81 D82 F83 F103 V107 L110	A74-V78 WeakPolarHBondContact O-CG2 3.45Å; A74-V78 PolarHBondContact O-N 2.84Å; M75-V78 PolarHBondContact O-N 2.94Å; V78-K80 PolarHBondContact O-N 3.08Å; V78-K80 VanDerWaalsContact O-N 3.15Å; V78-G81 PolarHBondContact O-N 3.13Å; V78-D82 WeakPolarHBondContact CA-O 2.94Å; V78-F83 HydrophobicContact CG1-CD1 3.91Å; V78-F83 HydrophobicContact CG1-CE1 3.8Å; V78-F103 HydrophobicContact CG2-CE2 4.22Å; V78-F103 HydrophobicContact CG2-CZ 3.69Å; V78-V107 HydrophobicContact CG1-CG2 4.19Å; V78-V107 HydrophobicContact CG2-CG1 4.28Å; V78-V107 HydrophobicContact CG2-CG2 3.55Å; V78-L110 HydrophobicContact CG1-CD1 4.24Å
79	S	94	Very high	93.9	Very high	98 Å²	98	74.4 Å²	74.4	69%	0.685	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.2	176.6	72.5	0	0	0	0	114.4	M75 S76 K77	M75-S79 WeakPolarHBondContact O-CB 3.49Å; M75-S79 PolarHBondContact O-N 2.61Å; M75-S79 PolarHBondContact O-OG 3.34Å; S76-S79 PolarHBondContact O-OG 3.13Å; S76-S79 VanDerWaalsContact O-OG 3.14Å; K77-S79 VanDerWaalsContact C-N 3.31Å; K77-S79 PolarHBondContact O-N 2.77Å
80	K	94.2	Very high	93.6	Very high	175 Å²	175	81.2 Å²	81.2	76%	0.761	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	3.1	173.3	-68.2	174.7	179.7	178.4	0	112.9	S76 K77 V78	S76-K80 WeakPolarHBondContact O-CD 3.46Å; S76-K80 WeakPolarHBondContact O-CG 3.42Å; K77-K80 WeakPolarHBondContact O-CA 3.24Å; K77-K80 WeakPolarHBondContact O-CB 3.24Å; K77-K80 PolarHBondContact O-N 3.04Å; V78-K80 PolarHBondContact O-N 3.08Å; V78-K80 VanDerWaalsContact O-N 3.15Å
81	G	91.5	Very high	93.1	Very high	35 Å²	35	79.7 Å²	79.7	36%	0.361	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	10.3	179.7	0	0	0	0	0	115	K77 V78 F83	K77-G81 PolarHBondContact O-N 3.23Å; V78-G81 PolarHBondContact O-N 3.13Å; G81-F83 WeakPolarHBondContact O-CD2 3.3Å; G81-F83 PolarHBondContact O-N 2.63Å
82	D	93.2	Very high	92.5	Very high	58 Å²	58	84.5 Å²	84.5	31%	0.31	43%	0.426	S	S	.	.			trans	-88.9	93.3	172.2	-179.4	7.6	0	0	0	110.4	K77 V78 T84 V85	K77-D82 HydrophobicContact CB-CB 4.28Å; K77-D82 PolarHBondContact O-N 2.95Å; K77-D82 VanDerWaalsContact O-N 3.11Å; V78-D82 WeakPolarHBondContact CA-O 2.94Å; D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 WeakPolarHBondContact OD1-CB 3.31Å; D82-T84 PolarHBondContact OD1-N 3.26Å; D82-T84 VanDerWaalsContact OD1-N 3.08Å; D82-T84 PolarHBondContact OD1-OG1 2.82Å; D82-V85 HydrophobicContact CB-CG2 4.42Å; D82-V85 WeakPolarHBondContact OD2-CG2 3.43Å
83	F	93.1	Very high	91.9	Very high	39 Å²	39	77.7 Å²	77.7	17%	0.171	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	11	177.6	-54.2	-80.6	0	0	0	113.8	V78 G81 V85 V107 L110 E114	V78-F83 HydrophobicContact CG1-CD1 3.91Å; V78-F83 HydrophobicContact CG1-CE1 3.8Å; G81-F83 WeakPolarHBondContact O-CD2 3.3Å; G81-F83 PolarHBondContact O-N 2.63Å; F83-V85 VanDerWaalsContact C-N 3.32Å; F83-V107 HydrophobicContact CB-CG1 4.17Å; F83-V107 VanDerWaalsContact O-CG1 3.31Å; F83-V107 WeakPolarHBondContact O-CG1 3.5Å; F83-L110 HydrophobicContact CD1-CB 3.72Å; F83-L110 HydrophobicContact CE1-CB 3.58Å; F83-L110 HydrophobicContact CE1-CD1 4.11Å; F83-L110 HydrophobicContact CE1-CG 4.39Å; F83-E114 WeakPolarHBondContact CD2-OE2 3.38Å; F83-E114 HydrophobicContact CE2-CB 4.34Å; F83-E114 WeakPolarHBondContact CE2-OE2 3.42Å
84	T	91.4	Very high	91.4	Very high	121 Å²	121	79.8 Å²	79.8	74%	0.742	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-8.2	175.7	70	0	0	0	0	112.8	D82 Q86	D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 WeakPolarHBondContact OD1-CB 3.31Å; D82-T84 PolarHBondContact OD1-N 3.26Å; D82-T84 VanDerWaalsContact OD1-N 3.08Å; D82-T84 PolarHBondContact OD1-OG1 2.82Å; T84-Q86 PolarHBondContact O-N 3.43Å
85	V	92.9	Very high	90.9	Very high	16 Å²	16	84.5 Å²	84.5	10%	0.097	44%	0.437	C	S	.	.			trans	-70.3	128.2	-177.3	-176.1	0	0	0	0	110.4	A74 K77 D82 F83	A74-V85 HydrophobicContact CB-CG1 3.71Å; K77-V85 HydrophobicContact CB-CG2 3.69Å; K77-V85 HydrophobicContact CD-CG1 4.5Å; K77-V85 HydrophobicContact CD-CG2 3.57Å; K77-V85 HydrophobicContact CG-CG2 4.32Å; D82-V85 HydrophobicContact CB-CG2 4.42Å; D82-V85 WeakPolarHBondContact OD2-CG2 3.43Å; F83-V85 VanDerWaalsContact C-N 3.32Å
86	Q	93.3	Very high	90.5	Very high	160 Å²	160	81 Å²	81	75%	0.748	42%	0.421	S	S	*	.			trans	-128	140.8	172.2	-67.4	-178.8	-25.5	0	0	109.4	T84 N104	T84-Q86 PolarHBondContact O-N 3.43Å; Q86-N104 WeakPolarHBondContact CA-OD1 3.24Å
87	L	94	Very high	90.2	Very high	21 Å²	21	82.7 Å²	82.7	11%	0.11	42%	0.423	C	S	.	.			trans	-95.9	145	172.4	-67.8	174.2	0	0	0	109.5	L71 A74 E89 Y100 F103 N104	L71-L87 HydrophobicContact CB-CD1 4.3Å; L71-L87 HydrophobicContact CD1-CD1 3.52Å; A74-L87 HydrophobicContact CB-CD1 4.17Å; A74-L87 HydrophobicContact CB-CD2 3.82Å; A74-L87 HydrophobicContact CB-CG 4.06Å; L87-E89 PolarHBondContact O-N 3.43Å; L87-Y100 HydrophobicContact CB-CD1 4.44Å; L87-Y100 HydrophobicContact CB-CD2 3.5Å; L87-Y100 HydrophobicContact CB-CE2 3.92Å; L87-Y100 HydrophobicContact CB-CG 3.77Å; L87-Y100 HydrophobicContact CD1-CD1 3.75Å; L87-Y100 HydrophobicContact CD1-CD2 4.25Å; L87-Y100 HydrophobicContact CD1-CE1 3.87Å; L87-Y100 HydrophobicContact CD1-CE2 4.35Å; L87-Y100 HydrophobicContact CD1-CG 3.93Å; L87-Y100 HydrophobicContact CD2-CE2 4.29Å; L87-Y100 HydrophobicContact CG-CD2 4.36Å; L87-Y100 HydrophobicContact CG-CE2 4.43Å; L87-Y100 HydrophobicContact CG-CG 4.46Å; L87-F103 HydrophobicContact CB-CD1 4.42Å; L87-F103 HydrophobicContact CD1-CB 4.33Å; L87-F103 HydrophobicContact CD1-CD1 3.47Å; L87-F103 VanDerWaalsContact CD1-CD1 3.47Å; L87-F103 HydrophobicContact CD1-CE1 3.88Å; L87-F103 HydrophobicContact CD1-CG 3.89Å; L87-F103 HydrophobicContact CG-CD1 3.82Å; L87-F103 HydrophobicContact CG-CE1 3.92Å; L87-N104 PolarHBondContact N-OD1 2.86Å; L87-N104 PolarHBondContact O-ND2 3.3Å
88	D	91.7	Very high	90	Very high	98 Å²	98	84 Å²	84	52%	0.524	43%	0.43	S	S	.	.			trans	-75.1	108.3	179	178	9.8	0	0	0	110.6	Q90 Q91 Y100	D88-Q90 PolarHBondContact O-N 3.02Å; D88-Q90 VanDerWaalsContact O-N 3.12Å; D88-Q90 WeakPolarHBondContact OD1-CB 3.28Å; D88-Q90 PolarHBondContact OD1-N 3.27Å; D88-Q91 PolarHBondContact O-NE2 2.96Å; D88-Y100 VanDerWaalsContact O-CD2 3.24Å; D88-Y100 WeakPolarHBondContact O-CD2 3.46Å
89	E	90.4	Very high	89.8	Confident	68 Å²	68	87.1 Å²	87.1	32%	0.318	45%	0.446	S	S	.	.			trans	-64.7	-14.4	-177.3	-64.7	176.7	-159.2	0	0	113	L87 Q91 E97 H101 N104	L87-E89 PolarHBondContact O-N 3.43Å; E89-Q91 VanDerWaalsContact C-N 3.25Å; E89-Q91 PolarHBondContact O-N 3.39Å; E89-E97 WeakPolarHBondContact O-CB 3.43Å; E89-E97 WeakPolarHBondContact O-CG 3.47Å; E89-H101 HydrophobicContact CG-CB 4.35Å; E89-H101 IonicContact OE1-ND1 2.83Å; E89-H101 IonicContact OE2-CG 3.83Å; E89-H101 IonicContact OE2-ND1 3.63Å; E89-H101 PolarHBondContact OE2-ND1 3.08Å; E89-N104 WeakPolarHBondContact CG-ND2 3.32Å; E89-N104 PolarHBondContact OE1-ND2 2.79Å
90	Q	86.7	Confident	89.9	Confident	167 Å²	167	82.6 Å²	82.6	78%	0.78	41%	0.414	S	S	*	.			trans	-74.9	70.8	179.6	-60.1	-170.9	-14.6	0	0	112.9	D88	D88-Q90 PolarHBondContact O-N 3.02Å; D88-Q90 VanDerWaalsContact O-N 3.12Å; D88-Q90 WeakPolarHBondContact OD1-CB 3.28Å; D88-Q90 PolarHBondContact OD1-N 3.27Å
91	Q	83.2	Confident	89.9	Confident	49 Å²	49	78.1 Å²	78.1	23%	0.229	40%	0.396	C	S	.	.			trans	-99.9	151.9	-178.4	-60	-59.2	-42.4	0	0	112.4	D88 E89 M93 V96 E97 Y100	D88-Q91 PolarHBondContact O-NE2 2.96Å; E89-Q91 VanDerWaalsContact C-N 3.25Å; E89-Q91 PolarHBondContact O-N 3.39Å; Q91-M93 PolarHBondContact O-N 3.48Å; Q91-V96 HydrophobicContact CB-CB 4.13Å; Q91-V96 HydrophobicContact CB-CG1 4.11Å; Q91-V96 HydrophobicContact CG-CB 4.44Å; Q91-V96 HydrophobicContact CG-CG1 3.91Å; Q91-E97 HydrophobicContact CB-CB 4.12Å; Q91-Y100 HydrophobicContact CG-CD2 3.77Å; Q91-Y100 HydrophobicContact CG-CE2 3.99Å; Q91-Y100 HydrophobicContact CG-CG 4.38Å
92	Q	80.7	Confident	90.1	Very high	118 Å²	118	80.7 Å²	80.7	55%	0.551	40%	0.401	S	S	*	.	S	Bend	trans	-74.7	-9.9	-178.4	-61.7	-168.8	-28.7	0	0	113.8	R63	R63-Q92 VanDerWaalsContact CZ-OE1 3.26Å
93	M	82.1	Confident	90.3	Very high	38 Å²	38	78.4 Å²	78.4	19%	0.187	39%	0.389	C	S	.	.	S	Bend	trans	-127.5	126.1	-178	-72.9	-176.7	65.8	0	0	107.9	F3 R63 I64 Q91 D95 V96 E97	F3-M93 HydrophobicContact CB-CE 4.5Å; R63-M93 HydrophobicContact CB-SD 3.94Å; I64-M93 HydrophobicContact CG1-CE 4.5Å; I64-M93 HydrophobicContact CG1-SD 4.01Å; Q91-M93 PolarHBondContact O-N 3.48Å; M93-D95 VanDerWaalsContact C-N 3.32Å; M93-D95 PolarHBondContact O-N 3.32Å; M93-V96 HydrophobicContact CB-CB 4.27Å; M93-V96 HydrophobicContact CB-CG2 3.87Å; M93-V96 PolarHBondContact O-N 3.04Å; M93-E97 PolarHBondContact O-N 3.13Å
94	E	84.9	Confident	90.5	Very high	158 Å²	158	77.4 Å²	77.4	74%	0.738	39%	0.385	S	S	*	.	H	α-helix	trans	-53.2	-47.2	179	-170.9	175.2	-176	0	0	111.6	V96 E97 E98	E94-V96 PolarHBondContact O-N 3.3Å; E94-V96 VanDerWaalsContact O-N 3.1Å; E94-E97 WeakPolarHBondContact O-CB 3.5Å; E94-E97 PolarHBondContact O-N 2.68Å; E94-E97 VanDerWaalsContact O-N 3.11Å; E94-E98 PolarHBondContact O-N 2.84Å
95	D	86	Confident	90.7	Very high	104 Å²	104	74.9 Å²	74.9	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-56.2	-30.7	176.7	-58.3	-10.1	0	0	0	113.6	M93 L99	M93-D95 VanDerWaalsContact C-N 3.32Å; M93-D95 PolarHBondContact O-N 3.32Å; D95-L99 WeakPolarHBondContact O-CB 3.29Å; D95-L99 PolarHBondContact O-N 3.5Å
96	V	88.3	Confident	90.9	Very high	19 Å²	19	78.4 Å²	78.4	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-86.4	-36.5	-179.5	-175.6	0	0	0	0	110.6	P67 Q91 M93 E94 L99 Y100	P67-V96 HydrophobicContact CB-CG1 3.57Å; P67-V96 HydrophobicContact CG-CG1 4.27Å; Q91-V96 HydrophobicContact CB-CB 4.13Å; Q91-V96 HydrophobicContact CB-CG1 4.11Å; Q91-V96 HydrophobicContact CG-CB 4.44Å; Q91-V96 HydrophobicContact CG-CG1 3.91Å; M93-V96 HydrophobicContact CB-CB 4.27Å; M93-V96 HydrophobicContact CB-CG2 3.87Å; M93-V96 PolarHBondContact O-N 3.04Å; E94-V96 PolarHBondContact O-N 3.3Å; E94-V96 VanDerWaalsContact O-N 3.1Å; V96-L99 PolarHBondContact O-N 3.33Å; V96-Y100 HydrophobicContact CG1-CD1 4.22Å; V96-Y100 HydrophobicContact CG1-CE1 3.99Å; V96-Y100 WeakPolarHBondContact O-CB 3.32Å; V96-Y100 WeakPolarHBondContact O-CD1 3.47Å; V96-Y100 PolarHBondContact O-N 3.48Å
97	E	90.3	Very high	91	Very high	90 Å²	90	71 Å²	71	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-59.4	-49.5	171.9	168.8	167.8	-166.9	0	0	110.6	E89 Q91 M93 E94 L99 Y100 H101	E89-E97 WeakPolarHBondContact O-CB 3.43Å; E89-E97 WeakPolarHBondContact O-CG 3.47Å; Q91-E97 HydrophobicContact CB-CB 4.12Å; M93-E97 PolarHBondContact O-N 3.13Å; E94-E97 WeakPolarHBondContact O-CB 3.5Å; E94-E97 PolarHBondContact O-N 2.68Å; E94-E97 VanDerWaalsContact O-N 3.11Å; E97-L99 PolarHBondContact O-N 3.25Å; E97-Y100 PolarHBondContact O-N 3.32Å; E97-H101 WeakPolarHBondContact O-CB 3.39Å; E97-H101 PolarHBondContact O-N 2.82Å
98	E	91.3	Very high	91.1	Very high	118 Å²	118	77 Å²	77	55%	0.551	38%	0.377	S	S	*	.	H	α-helix	trans	-59.3	-44.9	176	-171.8	176.9	-159.2	0	0	111.5	E94 Y100 H101 D102	E94-E98 PolarHBondContact O-N 2.84Å; E98-Y100 VanDerWaalsContact C-N 3.3Å; E98-Y100 PolarHBondContact O-N 3.5Å; E98-H101 WeakPolarHBondContact O-CB 3.43Å; E98-H101 PolarHBondContact O-N 2.65Å; E98-D102 WeakPolarHBondContact O-CB 3.43Å; E98-D102 PolarHBondContact O-N 2.76Å
99	L	92.3	Very high	91.1	Very high	79 Å²	79	77.6 Å²	77.6	41%	0.414	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-36.7	177.4	-177.7	61.1	0	0	0	113.1	L71 D95 V96 E97 F103	L71-L99 HydrophobicContact CD2-CD1 4.13Å; L71-L99 HydrophobicContact CD2-CD2 3.42Å; L71-L99 VanDerWaalsContact CD2-CD2 3.42Å; L71-L99 HydrophobicContact CD2-CG 3.7Å; D95-L99 WeakPolarHBondContact O-CB 3.29Å; D95-L99 PolarHBondContact O-N 3.5Å; V96-L99 PolarHBondContact O-N 3.33Å; E97-L99 PolarHBondContact O-N 3.25Å; L99-F103 WeakPolarHBondContact O-CB 3.3Å; L99-F103 PolarHBondContact O-N 2.83Å; L99-F103 VanDerWaalsContact O-N 3.09Å
100	Y	95.9	Very high	91.2	Very high	3 Å²	3	77.5 Å²	77.5	1%	0.012	38%	0.377	C	S	.	.	H	α-helix	trans	-74.3	-38.5	177.7	-81.4	22.5	0	0	0	111.3	P67 N70 L71 L87 D88 Q91 V96 E97 E98 F103 N104	P67-Y100 VanDerWaalsContact C-OH 3.29Å; P67-Y100 WeakPolarHBondContact CA-OH 3.31Å; P67-Y100 HydrophobicContact CB-CE1 4.45Å; P67-Y100 WeakPolarHBondContact CB-OH 3.46Å; P67-Y100 PolarHBondContact O-OH 3.25Å; N70-Y100 WeakPolarHBondContact CB-OH 3.46Å; L71-Y100 HydrophobicContact CB-CE1 4.05Å; L87-Y100 HydrophobicContact CB-CD1 4.44Å; L87-Y100 HydrophobicContact CB-CD2 3.5Å; L87-Y100 HydrophobicContact CB-CE2 3.92Å; L87-Y100 HydrophobicContact CB-CG 3.77Å; L87-Y100 HydrophobicContact CD1-CD1 3.75Å; L87-Y100 HydrophobicContact CD1-CD2 4.25Å; L87-Y100 HydrophobicContact CD1-CE1 3.87Å; L87-Y100 HydrophobicContact CD1-CE2 4.35Å; L87-Y100 HydrophobicContact CD1-CG 3.93Å; L87-Y100 HydrophobicContact CD2-CE2 4.29Å; L87-Y100 HydrophobicContact CG-CD2 4.36Å; L87-Y100 HydrophobicContact CG-CE2 4.43Å; L87-Y100 HydrophobicContact CG-CG 4.46Å; D88-Y100 VanDerWaalsContact O-CD2 3.24Å; D88-Y100 WeakPolarHBondContact O-CD2 3.46Å; Q91-Y100 HydrophobicContact CG-CD2 3.77Å; Q91-Y100 HydrophobicContact CG-CE2 3.99Å; Q91-Y100 HydrophobicContact CG-CG 4.38Å; V96-Y100 HydrophobicContact CG1-CD1 4.22Å; V96-Y100 HydrophobicContact CG1-CE1 3.99Å; V96-Y100 WeakPolarHBondContact O-CB 3.32Å; V96-Y100 WeakPolarHBondContact O-CD1 3.47Å; V96-Y100 PolarHBondContact O-N 3.48Å; E97-Y100 PolarHBondContact O-N 3.32Å; E98-Y100 VanDerWaalsContact C-N 3.3Å; E98-Y100 PolarHBondContact O-N 3.5Å; Y100-F103 PolarHBondContact O-N 2.92Å; Y100-N104 WeakPolarHBondContact O-CB 3.37Å; Y100-N104 VanDerWaalsContact O-CG 3.25Å; Y100-N104 PolarHBondContact O-N 3.18Å; Y100-N104 PolarHBondContact O-ND2 2.9Å
101	H	95.6	Very high	91.4	Very high	82 Å²	82	71.5 Å²	71.5	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-52.7	172.8	-177.7	75.9	0	0	0	111.2	E89 E97 E98 F103 N104 V105	E89-H101 HydrophobicContact CG-CB 4.35Å; E89-H101 IonicContact OE1-ND1 2.83Å; E89-H101 IonicContact OE2-CG 3.83Å; E89-H101 IonicContact OE2-ND1 3.63Å; E89-H101 PolarHBondContact OE2-ND1 3.08Å; E97-H101 WeakPolarHBondContact O-CB 3.39Å; E97-H101 PolarHBondContact O-N 2.82Å; E98-H101 WeakPolarHBondContact O-CB 3.43Å; E98-H101 PolarHBondContact O-N 2.65Å; H101-F103 VanDerWaalsContact C-N 3.28Å; H101-F103 PolarHBondContact O-N 2.91Å; H101-N104 WeakPolarHBondContact O-CB 3.5Å; H101-N104 PolarHBondContact O-N 3.02Å; H101-V105 WeakPolarHBondContact O-CG2 3.12Å; H101-V105 PolarHBondContact O-N 3.35Å
102	D	95.6	Very high	91.5	Very high	89 Å²	89	71.6 Å²	71.6	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-58.3	-41.2	177.6	-76.3	-10.3	0	0	0	111.8	E98 V105 M106	E98-D102 WeakPolarHBondContact O-CB 3.43Å; E98-D102 PolarHBondContact O-N 2.76Å; D102-V105 PolarHBondContact O-N 3.15Å; D102-M106 VanDerWaalsContact O-CB 3.31Å; D102-M106 WeakPolarHBondContact O-CB 3.4Å; D102-M106 PolarHBondContact O-N 2.94Å
103	F	97	Very high	91.8	Very high	10 Å²	10	70.9 Å²	70.9	4%	0.044	36%	0.359	C	S	.	.	H	α-helix	trans	-60.1	-47.8	173.8	174.1	-91.6	0	0	0	111.7	L71 A74 M75 V78 L87 L99 Y100 H101 M106 V107	L71-F103 HydrophobicContact CD1-CB 4.03Å; L71-F103 HydrophobicContact CD1-CD2 3.61Å; L71-F103 HydrophobicContact CD1-CE2 4.22Å; L71-F103 HydrophobicContact CD1-CG 3.79Å; A74-F103 HydrophobicContact CB-CE1 3.85Å; A74-F103 HydrophobicContact CB-CE2 4.29Å; A74-F103 HydrophobicContact CB-CZ 3.53Å; M75-F103 HydrophobicContact CB-CE2 4.49Å; M75-F103 HydrophobicContact CG-CD2 4.13Å; M75-F103 HydrophobicContact CG-CE2 3.72Å; V78-F103 HydrophobicContact CG2-CE2 4.22Å; V78-F103 HydrophobicContact CG2-CZ 3.69Å; L87-F103 HydrophobicContact CB-CD1 4.42Å; L87-F103 HydrophobicContact CD1-CB 4.33Å; L87-F103 HydrophobicContact CD1-CD1 3.47Å; L87-F103 VanDerWaalsContact CD1-CD1 3.47Å; L87-F103 HydrophobicContact CD1-CE1 3.88Å; L87-F103 HydrophobicContact CD1-CG 3.89Å; L87-F103 HydrophobicContact CG-CD1 3.82Å; L87-F103 HydrophobicContact CG-CE1 3.92Å; L99-F103 WeakPolarHBondContact O-CB 3.3Å; L99-F103 PolarHBondContact O-N 2.83Å; L99-F103 VanDerWaalsContact O-N 3.09Å; Y100-F103 PolarHBondContact O-N 2.92Å; H101-F103 VanDerWaalsContact C-N 3.28Å; H101-F103 PolarHBondContact O-N 2.91Å; F103-M106 HydrophobicContact CD2-CE 3.8Å; F103-M106 HydrophobicContact CE2-CE 4.17Å; F103-M106 PolarHBondContact O-N 2.79Å; F103-V107 HydrophobicContact CD1-CG2 4.15Å; F103-V107 HydrophobicContact CD2-CG2 4.34Å; F103-V107 HydrophobicContact CE1-CG2 3.7Å; F103-V107 HydrophobicContact CE2-CG2 3.91Å; F103-V107 HydrophobicContact CG-CG2 4.46Å; F103-V107 HydrophobicContact CZ-CG2 3.57Å; F103-V107 VanDerWaalsContact O-CG2 3.29Å; F103-V107 WeakPolarHBondContact O-CG2 3.48Å; F103-V107 PolarHBondContact O-N 3.37Å
104	N	96.8	Very high	92.1	Very high	18 Å²	18	71.6 Å²	71.6	10%	0.096	36%	0.362	C	S	.	.	H	α-helix	trans	-63.5	-42.3	-179.9	-73.8	-20.3	0	0	0	112	Q86 L87 E89 Y100 H101 V107 K108	Q86-N104 WeakPolarHBondContact CA-OD1 3.24Å; L87-N104 PolarHBondContact N-OD1 2.86Å; L87-N104 PolarHBondContact O-ND2 3.3Å; E89-N104 WeakPolarHBondContact CG-ND2 3.32Å; E89-N104 PolarHBondContact OE1-ND2 2.79Å; Y100-N104 WeakPolarHBondContact O-CB 3.37Å; Y100-N104 VanDerWaalsContact O-CG 3.25Å; Y100-N104 PolarHBondContact O-N 3.18Å; Y100-N104 PolarHBondContact O-ND2 2.9Å; H101-N104 WeakPolarHBondContact O-CB 3.5Å; H101-N104 PolarHBondContact O-N 3.02Å; N104-V107 PolarHBondContact O-N 3.49Å; N104-K108 WeakPolarHBondContact O-CB 3.5Å; N104-K108 PolarHBondContact O-N 2.83Å
105	V	96.3	Very high	92.1	Very high	67 Å²	67	67.3 Å²	67.3	41%	0.406	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-49.9	174.7	173.3	0	0	0	0	110.1	H101 D102 V107 K108 E109	H101-V105 WeakPolarHBondContact O-CG2 3.12Å; H101-V105 PolarHBondContact O-N 3.35Å; D102-V105 PolarHBondContact O-N 3.15Å; V105-V107 PolarHBondContact O-N 2.95Å; V105-K108 PolarHBondContact O-N 3.02Å; V105-E109 WeakPolarHBondContact O-CG 3.41Å; V105-E109 PolarHBondContact O-N 3.14Å
106	M	96.3	Very high	91.9	Very high	91 Å²	91	68 Å²	68	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-57.9	-44.9	177.3	179	-168.6	63.8	0	0	112.3	D102 F103 K108 E109 L110	D102-M106 VanDerWaalsContact O-CB 3.31Å; D102-M106 WeakPolarHBondContact O-CB 3.4Å; D102-M106 PolarHBondContact O-N 2.94Å; F103-M106 HydrophobicContact CD2-CE 3.8Å; F103-M106 HydrophobicContact CE2-CE 4.17Å; F103-M106 PolarHBondContact O-N 2.79Å; M106-K108 VanDerWaalsContact C-N 3.34Å; M106-K108 PolarHBondContact O-N 3.12Å; M106-E109 PolarHBondContact O-N 3.46Å; M106-L110 HydrophobicContact CG-CD1 4.1Å; M106-L110 WeakPolarHBondContact O-CG 3.38Å; M106-L110 PolarHBondContact O-N 2.84Å
107	V	96.7	Very high	91.8	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.024	37%	0.369	C	S	.	.	H	α-helix	trans	-64.7	-39.5	179.2	172	0	0	0	0	111.5	V78 F83 F103 N104 V105 L110 S111	V78-V107 HydrophobicContact CG1-CG2 4.19Å; V78-V107 HydrophobicContact CG2-CG1 4.28Å; V78-V107 HydrophobicContact CG2-CG2 3.55Å; F83-V107 HydrophobicContact CB-CG1 4.17Å; F83-V107 VanDerWaalsContact O-CG1 3.31Å; F83-V107 WeakPolarHBondContact O-CG1 3.5Å; F103-V107 HydrophobicContact CD1-CG2 4.15Å; F103-V107 HydrophobicContact CD2-CG2 4.34Å; F103-V107 HydrophobicContact CE1-CG2 3.7Å; F103-V107 HydrophobicContact CE2-CG2 3.91Å; F103-V107 HydrophobicContact CG-CG2 4.46Å; F103-V107 HydrophobicContact CZ-CG2 3.57Å; F103-V107 VanDerWaalsContact O-CG2 3.29Å; F103-V107 WeakPolarHBondContact O-CG2 3.48Å; F103-V107 PolarHBondContact O-N 3.37Å; N104-V107 PolarHBondContact O-N 3.49Å; V105-V107 PolarHBondContact O-N 2.95Å; V107-L110 PolarHBondContact O-N 3.46Å; V107-S111 WeakPolarHBondContact O-CB 3.39Å; V107-S111 PolarHBondContact O-N 3.26Å
108	K	94.2	Very high	91.6	Very high	147 Å²	147	73.3 Å²	73.3	64%	0.639	37%	0.37	S	S	*	.	H	α-helix	trans	-63.7	-43	176	-175.2	-176.6	176.9	-172.8	0	111.9	N104 V105 M106 S111 S112	N104-K108 WeakPolarHBondContact O-CB 3.5Å; N104-K108 PolarHBondContact O-N 2.83Å; V105-K108 PolarHBondContact O-N 3.02Å; M106-K108 VanDerWaalsContact C-N 3.34Å; M106-K108 PolarHBondContact O-N 3.12Å; K108-S111 PolarHBondContact O-N 2.92Å; K108-S112 WeakPolarHBondContact O-CB 3.36Å; K108-S112 PolarHBondContact O-N 3.43Å; K108-S112 PolarHBondContact O-OG 3.44Å
109	E	91.7	Very high	91.1	Very high	111 Å²	111	72 Å²	72	52%	0.519	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-45.4	175.2	-70.5	-58.6	145.3	0	0	111.3	V105 M106 S111 S112 I113	V105-E109 WeakPolarHBondContact O-CG 3.41Å; V105-E109 PolarHBondContact O-N 3.14Å; M106-E109 PolarHBondContact O-N 3.46Å; E109-S111 PolarHBondContact O-N 2.96Å; E109-S112 WeakPolarHBondContact O-CB 3.22Å; E109-S112 PolarHBondContact O-N 3.49Å; E109-I113 WeakPolarHBondContact O-CG1 3.42Å; E109-I113 PolarHBondContact O-N 3.34Å
110	L	93.1	Very high	90.7	Very high	65 Å²	65	71.2 Å²	71.2	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-42.1	175.4	-72.9	170.9	0	0	0	112.5	V78 F83 M106 V107 S112 I113 E114	V78-L110 HydrophobicContact CG1-CD1 4.24Å; F83-L110 HydrophobicContact CD1-CB 3.72Å; F83-L110 HydrophobicContact CE1-CB 3.58Å; F83-L110 HydrophobicContact CE1-CD1 4.11Å; F83-L110 HydrophobicContact CE1-CG 4.39Å; M106-L110 HydrophobicContact CG-CD1 4.1Å; M106-L110 WeakPolarHBondContact O-CG 3.38Å; M106-L110 PolarHBondContact O-N 2.84Å; V107-L110 PolarHBondContact O-N 3.46Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 2.92Å; L110-I113 PolarHBondContact O-N 3.09Å; L110-E114 PolarHBondContact O-N 3.1Å
111	S	92	Very high	90.3	Very high	41 Å²	41	74.9 Å²	74.9	29%	0.287	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-40.4	175.6	-172.7	0	0	0	0	111.9	V107 K108 E109 E114 T115	V107-S111 WeakPolarHBondContact O-CB 3.39Å; V107-S111 PolarHBondContact O-N 3.26Å; K108-S111 PolarHBondContact O-N 2.92Å; E109-S111 PolarHBondContact O-N 2.96Å; S111-E114 PolarHBondContact O-N 2.97Å; S111-T115 WeakPolarHBondContact O-CB 3.38Å; S111-T115 PolarHBondContact O-N 2.97Å; S111-T115 PolarHBondContact O-OG1 3.39Å
112	S	84.7	Confident	89.8	Confident	51 Å²	51	74.7 Å²	74.7	36%	0.357	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-43.9	177.7	-57.4	0	0	0	0	110.8	K108 E109 L110 T115 L116	K108-S112 WeakPolarHBondContact O-CB 3.36Å; K108-S112 PolarHBondContact O-N 3.43Å; K108-S112 PolarHBondContact O-OG 3.44Å; E109-S112 WeakPolarHBondContact O-CB 3.22Å; E109-S112 PolarHBondContact O-N 3.49Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 2.92Å; S112-T115 PolarHBondContact O-N 3.02Å; S112-L116 WeakPolarHBondContact O-CB 3.3Å; S112-L116 VanDerWaalsContact O-CG 3.28Å; S112-L116 WeakPolarHBondContact O-CG 3.46Å; S112-L116 PolarHBondContact O-N 3.25Å
113	I	87.4	Confident	89.2	Confident	103 Å²	103	72.7 Å²	72.7	53%	0.528	38%	0.382	S	S	.	.	H	α-helix	trans	-61.8	-43.7	174.5	-67.2	166.5	0	0	0	111.2	E109 L110 L116 R117	E109-I113 WeakPolarHBondContact O-CG1 3.42Å; E109-I113 PolarHBondContact O-N 3.34Å; L110-I113 PolarHBondContact O-N 3.09Å; I113-L116 PolarHBondContact O-N 3.23Å; I113-R117 WeakPolarHBondContact O-CB 3.38Å; I113-R117 PolarHBondContact O-N 3.11Å
114	E	88.2	Confident	88.7	Confident	53 Å²	53	73.1 Å²	73.1	25%	0.248	39%	0.385	C	S	.	.	H	α-helix	trans	-63.9	-42.2	177.6	178.3	165.4	-123.2	0	0	112.1	F83 L110 S111 R117 N118	F83-E114 WeakPolarHBondContact CD2-OE2 3.38Å; F83-E114 HydrophobicContact CE2-CB 4.34Å; F83-E114 WeakPolarHBondContact CE2-OE2 3.42Å; L110-E114 PolarHBondContact O-N 3.1Å; S111-E114 PolarHBondContact O-N 2.97Å; E114-R117 WeakPolarHBondContact O-CB 3.47Å; E114-R117 PolarHBondContact O-N 2.92Å; E114-R117 IonicContact OE1-CZ 3.53Å; E114-R117 IonicContact OE1-NH2 3.81Å; E114-R117 PolarHBondContact OE1-NH2 3.01Å; E114-N118 VanDerWaalsContact O-CG 3.27Å; E114-N118 PolarHBondContact O-N 3.35Å; E114-N118 PolarHBondContact O-ND2 3.34Å
115	T	84.3	Confident	88.3	Confident	69 Å²	69	75.5 Å²	75.5	42%	0.423	40%	0.403	S	S	.	.	H	α-helix	trans	-61	-49.2	176.8	-57.8	0	0	0	0	110.4	S111 S112 R117 N118 D119	S111-T115 WeakPolarHBondContact O-CB 3.38Å; S111-T115 PolarHBondContact O-N 2.97Å; S111-T115 PolarHBondContact O-OG1 3.39Å; S112-T115 PolarHBondContact O-N 3.02Å; T115-R117 VanDerWaalsContact C-N 3.29Å; T115-R117 PolarHBondContact O-N 3.5Å; T115-N118 PolarHBondContact O-N 3.43Å; T115-N118 VanDerWaalsContact O-N 3.14Å; T115-D119 WeakPolarHBondContact O-CB 3.4Å; T115-D119 PolarHBondContact O-N 2.88Å
116	L	81.9	Confident	87.8	Confident	119 Å²	119	77.6 Å²	77.6	62%	0.623	41%	0.408	S	S	*	.	H	α-helix	trans	-59.2	-39	176.1	-71.3	172.9	0	0	0	112.3	S112 I113 F120	S112-L116 WeakPolarHBondContact O-CB 3.3Å; S112-L116 VanDerWaalsContact O-CG 3.28Å; S112-L116 WeakPolarHBondContact O-CG 3.46Å; S112-L116 PolarHBondContact O-N 3.25Å; I113-L116 PolarHBondContact O-N 3.23Å; L116-F120 VanDerWaalsContact O-CB 3.24Å; L116-F120 WeakPolarHBondContact O-CB 3.23Å; L116-F120 PolarHBondContact O-N 3.2Å
117	R	85.8	Confident	87.2	Confident	138 Å²	138	74.5 Å²	74.5	52%	0.521	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-45.7	175.3	-174.6	-167	70.1	-164.5	-6.2	111.4	I113 E114 T115 F120 V121	I113-R117 WeakPolarHBondContact O-CB 3.38Å; I113-R117 PolarHBondContact O-N 3.11Å; E114-R117 WeakPolarHBondContact O-CB 3.47Å; E114-R117 PolarHBondContact O-N 2.92Å; E114-R117 IonicContact OE1-CZ 3.53Å; E114-R117 IonicContact OE1-NH2 3.81Å; E114-R117 PolarHBondContact OE1-NH2 3.01Å; T115-R117 VanDerWaalsContact C-N 3.29Å; T115-R117 PolarHBondContact O-N 3.5Å; R117-F120 WeakPolarHBondContact O-CB 3.46Å; R117-F120 PolarHBondContact O-N 2.88Å; R117-V121 WeakPolarHBondContact O-CG2 3.33Å; R117-V121 PolarHBondContact O-N 2.96Å
118	N	86.1	Confident	87	Confident	81 Å²	81	77 Å²	77	43%	0.433	40%	0.404	S	S	.	.	H	α-helix	trans	-67.2	-42	-179.5	-68.7	-18	0	0	0	111.4	E114 T115 F120 V121 S122	E114-N118 VanDerWaalsContact O-CG 3.27Å; E114-N118 PolarHBondContact O-N 3.35Å; E114-N118 PolarHBondContact O-ND2 3.34Å; T115-N118 PolarHBondContact O-N 3.43Å; T115-N118 VanDerWaalsContact O-N 3.14Å; N118-F120 VanDerWaalsContact C-N 3.32Å; N118-F120 PolarHBondContact O-N 3.18Å; N118-V121 PolarHBondContact O-N 3.3Å; N118-S122 VanDerWaalsContact O-CB 3.31Å; N118-S122 WeakPolarHBondContact O-CB 3.24Å; N118-S122 PolarHBondContact O-N 3.16Å
119	D	81.6	Confident	86.8	Confident	90 Å²	90	77.3 Å²	77.3	48%	0.481	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-40.9	174.4	-72.9	-13.8	0	0	0	111.2	T115 S122 T123	T115-D119 WeakPolarHBondContact O-CB 3.4Å; T115-D119 PolarHBondContact O-N 2.88Å; D119-S122 PolarHBondContact O-N 3.38Å; D119-T123 VanDerWaalsContact O-CB 3.32Å; D119-T123 WeakPolarHBondContact O-CB 3.25Å; D119-T123 PolarHBondContact O-N 2.82Å; D119-T123 PolarHBondContact O-OG1 3.15Å
120	F	83.7	Confident	86.6	Confident	63 Å²	63	75 Å²	75	28%	0.276	40%	0.398	S	S	.	.	H	α-helix	trans	-59.6	-52.1	173.9	177.6	-94.1	0	0	0	111.5	L116 R117 N118 S122 T123 V124 I173 K285 F286	L116-F120 VanDerWaalsContact O-CB 3.24Å; L116-F120 WeakPolarHBondContact O-CB 3.23Å; L116-F120 PolarHBondContact O-N 3.2Å; R117-F120 WeakPolarHBondContact O-CB 3.46Å; R117-F120 PolarHBondContact O-N 2.88Å; N118-F120 VanDerWaalsContact C-N 3.32Å; N118-F120 PolarHBondContact O-N 3.18Å; F120-S122 VanDerWaalsContact C-N 3.33Å; F120-S122 PolarHBondContact O-N 3.2Å; F120-T123 PolarHBondContact O-N 2.78Å; F120-V124 HydrophobicContact CD1-CG2 4.1Å; F120-V124 HydrophobicContact CD2-CG2 4.41Å; F120-V124 HydrophobicContact CE1-CG2 3.75Å; F120-V124 HydrophobicContact CE2-CG2 4.06Å; F120-V124 HydrophobicContact CG-CG2 4.41Å; F120-V124 HydrophobicContact CZ-CG2 3.71Å; F120-V124 WeakPolarHBondContact O-CB 3.46Å; F120-V124 WeakPolarHBondContact O-CG2 3.02Å; F120-V124 PolarHBondContact O-N 2.9Å; F120-I173 HydrophobicContact CZ-CG1 4.49Å; F120-I173 HydrophobicContact CZ-CG2 4.45Å; F120-K285 HydrophobicContact CD2-CD 4.36Å; F120-F286 HydrophobicContact CD2-CD2 4.4Å; F120-F286 AromaticContact CD2-CE2 3.51Å; F120-F286 HydrophobicContact CD2-CE2 3.51Å; F120-F286 HydrophobicContact CD2-CZ 4.35Å; F120-F286 AromaticContact CE2-CE2 3.61Å; F120-F286 HydrophobicContact CE2-CE2 3.61Å; F120-F286 HydrophobicContact CE2-CZ 4.05Å; F120-F286 HydrophobicContact CG-CE2 4.39Å
121	V	87	Confident	86.3	Confident	80 Å²	80	71.9 Å²	71.9	49%	0.485	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-42	179.5	172	0	0	0	0	111.5	R117 N118 S125	R117-V121 WeakPolarHBondContact O-CG2 3.33Å; R117-V121 PolarHBondContact O-N 2.96Å; N118-V121 PolarHBondContact O-N 3.3Å; V121-S125 WeakPolarHBondContact O-CB 3.45Å; V121-S125 PolarHBondContact O-N 3.16Å; V121-S125 PolarHBondContact O-OG 2.79Å
122	S	86.2	Confident	86.5	Confident	79 Å²	79	74.2 Å²	74.2	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-61.1	-47.9	177.2	-176.9	0	0	0	0	111.1	N118 D119 F120 S125 H126	N118-S122 VanDerWaalsContact O-CB 3.31Å; N118-S122 WeakPolarHBondContact O-CB 3.24Å; N118-S122 PolarHBondContact O-N 3.16Å; D119-S122 PolarHBondContact O-N 3.38Å; F120-S122 VanDerWaalsContact C-N 3.33Å; F120-S122 PolarHBondContact O-N 3.2Å; S122-S125 WeakPolarHBondContact O-CB 3.41Å; S122-S125 PolarHBondContact O-N 2.98Å; S122-H126 PolarHBondContact O-N 2.67Å
123	T	82.5	Confident	86.9	Confident	46 Å²	46	74.4 Å²	74.4	28%	0.282	40%	0.395	S	S	.	.	H	α-helix	trans	-69.4	-42.6	-177.5	-49.7	0	0	0	0	111.8	D119 F120 S125 H126 E127 F286	D119-T123 VanDerWaalsContact O-CB 3.32Å; D119-T123 WeakPolarHBondContact O-CB 3.25Å; D119-T123 PolarHBondContact O-N 2.82Å; D119-T123 PolarHBondContact O-OG1 3.15Å; F120-T123 PolarHBondContact O-N 2.78Å; T123-S125 VanDerWaalsContact C-N 3.3Å; T123-S125 PolarHBondContact O-N 3.2Å; T123-H126 WeakPolarHBondContact O-CB 3.21Å; T123-H126 PolarHBondContact O-N 2.81Å; T123-H126 VanDerWaalsContact O-N 3.16Å; T123-E127 HydrophobicContact CG2-CG 4.37Å; T123-E127 WeakPolarHBondContact O-CG 3.32Å; T123-E127 PolarHBondContact O-N 2.79Å; T123-F286 HydrophobicContact CG2-CB 3.35Å; T123-F286 HydrophobicContact CG2-CD1 3.54Å; T123-F286 HydrophobicContact CG2-CD2 3.75Å; T123-F286 HydrophobicContact CG2-CE1 4.25Å; T123-F286 HydrophobicContact CG2-CE2 4.4Å; T123-F286 HydrophobicContact CG2-CG 3.27Å
124	V	86.7	Confident	87	Confident	20 Å²	20	72.1 Å²	72.1	12%	0.121	39%	0.386	C	S	.	.	H	α-helix	trans	-53.9	-50	171	169.7	0	0	0	0	110.2	F120 H126 E127 F128 I173 F286	F120-V124 HydrophobicContact CD1-CG2 4.1Å; F120-V124 HydrophobicContact CD2-CG2 4.41Å; F120-V124 HydrophobicContact CE1-CG2 3.75Å; F120-V124 HydrophobicContact CE2-CG2 4.06Å; F120-V124 HydrophobicContact CG-CG2 4.41Å; F120-V124 HydrophobicContact CZ-CG2 3.71Å; F120-V124 WeakPolarHBondContact O-CB 3.46Å; F120-V124 WeakPolarHBondContact O-CG2 3.02Å; F120-V124 PolarHBondContact O-N 2.9Å; V124-H126 VanDerWaalsContact C-N 3.29Å; V124-H126 PolarHBondContact O-N 3.21Å; V124-E127 PolarHBondContact O-N 2.83Å; V124-F128 HydrophobicContact CG1-CD2 3.47Å; V124-F128 VanDerWaalsContact CG1-CD2 3.47Å; V124-F128 HydrophobicContact CG1-CE2 3.45Å; V124-F128 VanDerWaalsContact CG1-CE2 3.45Å; V124-F128 VanDerWaalsContact O-CD2 3.23Å; V124-F128 WeakPolarHBondContact O-CD2 3.37Å; V124-F128 PolarHBondContact O-N 3.37Å; V124-I173 HydrophobicContact CG1-CD1 3.84Å; V124-I173 HydrophobicContact CG2-CD1 3.95Å; V124-F286 HydrophobicContact CB-CZ 4.4Å; V124-F286 HydrophobicContact CG2-CE1 4.32Å; V124-F286 HydrophobicContact CG2-CE2 3.92Å; V124-F286 HydrophobicContact CG2-CZ 3.38Å
125	S	88.5	Confident	87.4	Confident	68 Å²	68	71.1 Å²	71.1	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-59.5	-40	179.7	-59.7	0	0	0	0	112.3	V121 S122 T123 K129	V121-S125 WeakPolarHBondContact O-CB 3.45Å; V121-S125 PolarHBondContact O-N 3.16Å; V121-S125 PolarHBondContact O-OG 2.79Å; S122-S125 WeakPolarHBondContact O-CB 3.41Å; S122-S125 PolarHBondContact O-N 2.98Å; T123-S125 VanDerWaalsContact C-N 3.3Å; T123-S125 PolarHBondContact O-N 3.2Å; S125-K129 WeakPolarHBondContact O-CB 3.47Å; S125-K129 PolarHBondContact O-N 3.42Å
126	H	86.1	Confident	88	Confident	110 Å²	110	74.1 Å²	74.1	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-47.1	174.8	-177	-87	0	0	0	112.3	S122 T123 V124 F128 K129 T130	S122-H126 PolarHBondContact O-N 2.67Å; T123-H126 WeakPolarHBondContact O-CB 3.21Å; T123-H126 PolarHBondContact O-N 2.81Å; T123-H126 VanDerWaalsContact O-N 3.16Å; V124-H126 VanDerWaalsContact C-N 3.29Å; V124-H126 PolarHBondContact O-N 3.21Å; H126-F128 VanDerWaalsContact C-N 3.28Å; H126-F128 PolarHBondContact O-N 3.13Å; H126-K129 PolarHBondContact O-N 3.26Å; H126-K129 VanDerWaalsContact O-N 3.16Å; H126-T130 PolarHBondContact O-N 2.81Å; H126-T130 PolarHBondContact O-OG1 3.13Å
127	E	83.9	Confident	88.7	Confident	27 Å²	27	69.7 Å²	69.7	13%	0.126	37%	0.372	C	S	.	.	H	α-helix	trans	-67.4	-26.4	179.7	-68.4	-54.9	108.9	0	0	112.7	T123 V124 P131 L169 F286	T123-E127 HydrophobicContact CG2-CG 4.37Å; T123-E127 WeakPolarHBondContact O-CG 3.32Å; T123-E127 PolarHBondContact O-N 2.79Å; V124-E127 PolarHBondContact O-N 2.83Å; E127-P131 WeakPolarHBondContact O-CD 3.34Å; E127-P131 VanDerWaalsContact O-CG 3.31Å; E127-P131 WeakPolarHBondContact O-CG 3.25Å; E127-L169 HydrophobicContact CB-CD1 4.36Å; E127-L169 HydrophobicContact CB-CD2 3.79Å; E127-F286 HydrophobicContact CG-CD1 3.95Å; E127-F286 HydrophobicContact CG-CE1 4.07Å
128	F	91	Very high	89.2	Confident	57 Å²	57	65.9 Å²	65.9	25%	0.25	36%	0.358	C	S	.	.	H	α-helix	trans	-74.9	-43.1	168.4	-88.4	-74.9	0	0	0	112.4	V124 H126 T130 P131 I132 L166 L169 T170 I173	V124-F128 HydrophobicContact CG1-CD2 3.47Å; V124-F128 VanDerWaalsContact CG1-CD2 3.47Å; V124-F128 HydrophobicContact CG1-CE2 3.45Å; V124-F128 VanDerWaalsContact CG1-CE2 3.45Å; V124-F128 VanDerWaalsContact O-CD2 3.23Å; V124-F128 WeakPolarHBondContact O-CD2 3.37Å; V124-F128 PolarHBondContact O-N 3.37Å; H126-F128 VanDerWaalsContact C-N 3.28Å; H126-F128 PolarHBondContact O-N 3.13Å; F128-T130 VanDerWaalsContact C-N 3.3Å; F128-T130 PolarHBondContact O-N 3.19Å; F128-P131 VanDerWaalsContact O-CD 3.3Å; F128-P131 WeakPolarHBondContact O-CD 3.42Å; F128-P131 WeakPolarHBondContact O-CG 3.31Å; F128-I132 HydrophobicContact CB-CD1 4.39Å; F128-I132 WeakPolarHBondContact O-CB 3.29Å; F128-I132 WeakPolarHBondContact O-CD1 3.49Å; F128-I132 VanDerWaalsContact O-CG1 3.23Å; F128-I132 WeakPolarHBondContact O-CG1 3.47Å; F128-I132 PolarHBondContact O-N 3.33Å; F128-L166 HydrophobicContact CD1-CD2 3.33Å; F128-L166 HydrophobicContact CE1-CD2 3.76Å; F128-L166 HydrophobicContact CG-CD2 4.32Å; F128-L169 HydrophobicContact CD1-CD2 4.21Å; F128-L169 HydrophobicContact CD2-CD2 3.73Å; F128-L169 HydrophobicContact CE1-CD2 4.23Å; F128-L169 HydrophobicContact CE2-CD2 3.77Å; F128-L169 HydrophobicContact CE2-CG 4.24Å; F128-L169 HydrophobicContact CG-CD2 3.94Å; F128-L169 HydrophobicContact CZ-CD2 4.01Å; F128-L169 HydrophobicContact CZ-CG 4.3Å; F128-T170 HydrophobicContact CE1-CG2 3.94Å; F128-T170 HydrophobicContact CZ-CG2 3.72Å; F128-I173 HydrophobicContact CE2-CD1 4Å; F128-I173 HydrophobicContact CZ-CD1 4.49Å
129	K	90.7	Very high	89.7	Confident	153 Å²	153	64.9 Å²	64.9	67%	0.665	36%	0.355	S	S	*	.	H	α-helix	trans	-59.9	-39.7	-175.3	-177.1	179.4	177.5	-177	0	112.3	S125 H126 I132 A133	S125-K129 WeakPolarHBondContact O-CB 3.47Å; S125-K129 PolarHBondContact O-N 3.42Å; H126-K129 PolarHBondContact O-N 3.26Å; H126-K129 VanDerWaalsContact O-N 3.16Å; K129-I132 PolarHBondContact O-N 2.96Å; K129-A133 VanDerWaalsContact O-CB 3.24Å; K129-A133 WeakPolarHBondContact O-CB 3.46Å; K129-A133 PolarHBondContact O-N 2.87Å
130	T	87.2	Confident	90.4	Very high	61 Å²	61	66 Å²	66	37%	0.374	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-55.7	-176.3	-58.6	0	0	0	0	113.9	H126 F128 I132 A133 T134	H126-T130 PolarHBondContact O-N 2.81Å; H126-T130 PolarHBondContact O-OG1 3.13Å; F128-T130 VanDerWaalsContact C-N 3.3Å; F128-T130 PolarHBondContact O-N 3.19Å; T130-I132 VanDerWaalsContact C-N 3.34Å; T130-I132 PolarHBondContact O-N 2.76Å; T130-A133 PolarHBondContact O-N 3.39Å; T130-T134 WeakPolarHBondContact O-CB 3.44Å; T130-T134 PolarHBondContact O-N 3.16Å; T130-T134 PolarHBondContact O-OG1 2.9Å
131	P	87.8	Confident	90.9	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-35	175.9	24.8	-33.8	0	0	0	112.3	E127 F128 A133 T134 I135 Q165 L166	E127-P131 WeakPolarHBondContact O-CD 3.34Å; E127-P131 VanDerWaalsContact O-CG 3.31Å; E127-P131 WeakPolarHBondContact O-CG 3.25Å; F128-P131 VanDerWaalsContact O-CD 3.3Å; F128-P131 WeakPolarHBondContact O-CD 3.42Å; F128-P131 WeakPolarHBondContact O-CG 3.31Å; P131-A133 PolarHBondContact O-N 3.02Å; P131-T134 WeakPolarHBondContact O-CB 3.5Å; P131-T134 PolarHBondContact O-N 3.46Å; P131-I135 WeakPolarHBondContact O-CB 3.32Å; P131-I135 WeakPolarHBondContact O-CD1 3.49Å; P131-I135 VanDerWaalsContact O-CG1 3.28Å; P131-I135 WeakPolarHBondContact O-CG1 3.46Å; P131-I135 PolarHBondContact O-N 3.43Å; P131-Q165 HydrophobicContact CB-CB 4.37Å; P131-Q165 HydrophobicContact CB-CG 4.42Å; P131-Q165 HydrophobicContact CG-CG 4.41Å; P131-L166 HydrophobicContact CB-CD2 4.24Å; P131-L166 HydrophobicContact CB-CG 3.98Å; P131-L166 HydrophobicContact CG-CD2 3.51Å; P131-L166 HydrophobicContact CG-CG 3.81Å
132	I	95.7	Very high	91.3	Very high	90 Å²	90	64.8 Å²	64.8	46%	0.462	35%	0.35	S	S	.	.	H	α-helix	trans	-62.4	-44.3	174.5	-68.6	170	0	0	0	111.1	F128 K129 T130 T134 I135 K136 L166	F128-I132 HydrophobicContact CB-CD1 4.39Å; F128-I132 WeakPolarHBondContact O-CB 3.29Å; F128-I132 WeakPolarHBondContact O-CD1 3.49Å; F128-I132 VanDerWaalsContact O-CG1 3.23Å; F128-I132 WeakPolarHBondContact O-CG1 3.47Å; F128-I132 PolarHBondContact O-N 3.33Å; K129-I132 PolarHBondContact O-N 2.96Å; T130-I132 VanDerWaalsContact C-N 3.34Å; T130-I132 PolarHBondContact O-N 2.76Å; I132-T134 VanDerWaalsContact C-N 3.32Å; I132-T134 PolarHBondContact O-N 3.25Å; I132-I135 PolarHBondContact O-N 3.05Å; I132-K136 VanDerWaalsContact O-CB 3.29Å; I132-K136 WeakPolarHBondContact O-CB 3.4Å; I132-K136 PolarHBondContact O-N 2.91Å; I132-L166 HydrophobicContact CG1-CD1 4.06Å; I132-L166 HydrophobicContact CG1-CD2 4.34Å
133	A	93.3	Very high	91.7	Very high	55 Å²	55	68.1 Å²	68.1	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-38.3	176.3	0	0	0	0	0	111.6	K129 T130 P131 K136 G137	K129-A133 VanDerWaalsContact O-CB 3.24Å; K129-A133 WeakPolarHBondContact O-CB 3.46Å; K129-A133 PolarHBondContact O-N 2.87Å; T130-A133 PolarHBondContact O-N 3.39Å; P131-A133 PolarHBondContact O-N 3.02Å; A133-K136 PolarHBondContact O-N 3.28Å; A133-G137 PolarHBondContact O-N 2.87Å
134	T	89.9	Confident	92.1	Very high	55 Å²	55	69.7 Å²	69.7	34%	0.337	36%	0.364	S	S	.	.	H	α-helix	trans	-62	-52.1	175.2	-57.8	0	0	0	0	110.8	T130 P131 I132 K136 G137 Y138	T130-T134 WeakPolarHBondContact O-CB 3.44Å; T130-T134 PolarHBondContact O-N 3.16Å; T130-T134 PolarHBondContact O-OG1 2.9Å; P131-T134 WeakPolarHBondContact O-CB 3.5Å; P131-T134 PolarHBondContact O-N 3.46Å; I132-T134 VanDerWaalsContact C-N 3.32Å; I132-T134 PolarHBondContact O-N 3.25Å; T134-K136 VanDerWaalsContact C-N 3.35Å; T134-K136 PolarHBondContact O-N 3.29Å; T134-G137 PolarHBondContact O-N 3.09Å; T134-Y138 HydrophobicContact CG2-CD2 3.78Å; T134-Y138 HydrophobicContact CG2-CE2 3.58Å; T134-Y138 WeakPolarHBondContact O-CD2 3.32Å; T134-Y138 PolarHBondContact O-N 3.5Å
135	I	95.9	Very high	92.3	Very high	33 Å²	33	77.4 Å²	77.4	17%	0.169	40%	0.398	C	S	.	.	H	α-helix	trans	-57	-49.6	176.3	-68.7	158.7	0	0	0	110	P131 I132 G137 Y138 V139 T163 L166	P131-I135 WeakPolarHBondContact O-CB 3.32Å; P131-I135 WeakPolarHBondContact O-CD1 3.49Å; P131-I135 VanDerWaalsContact O-CG1 3.28Å; P131-I135 WeakPolarHBondContact O-CG1 3.46Å; P131-I135 PolarHBondContact O-N 3.43Å; I132-I135 PolarHBondContact O-N 3.05Å; I135-G137 VanDerWaalsContact C-N 3.35Å; I135-G137 PolarHBondContact O-N 3.45Å; I135-Y138 PolarHBondContact O-N 3.37Å; I135-V139 HydrophobicContact CG2-CG2 4.23Å; I135-V139 WeakPolarHBondContact O-CB 3.23Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.38Å; I135-V139 PolarHBondContact O-N 2.99Å; I135-T163 HydrophobicContact CD1-CG2 3.98Å; I135-L166 HydrophobicContact CD1-CD1 3.89Å
136	K	96.6	Very high	92.6	Very high	131 Å²	131	82.7 Å²	82.7	57%	0.57	42%	0.416	S	S	*	.	H	α-helix	trans	-58.4	-45.5	179.2	-179.5	-179.2	175.1	-177.5	0	111.9	I132 A133 T134 V139 Q140	I132-K136 VanDerWaalsContact O-CB 3.29Å; I132-K136 WeakPolarHBondContact O-CB 3.4Å; I132-K136 PolarHBondContact O-N 2.91Å; A133-K136 PolarHBondContact O-N 3.28Å; T134-K136 VanDerWaalsContact C-N 3.35Å; T134-K136 PolarHBondContact O-N 3.29Å; K136-V139 PolarHBondContact O-N 2.93Å; K136-Q140 WeakPolarHBondContact O-CG 3.3Å; K136-Q140 PolarHBondContact O-N 3.42Å
137	G	96.5	Very high	92.9	Very high	26 Å²	26	78.6 Å²	78.6	27%	0.268	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-46.3	178.8	0	0	0	0	0	112.1	A133 T134 I135 Q140 L141	A133-G137 PolarHBondContact O-N 2.87Å; T134-G137 PolarHBondContact O-N 3.09Å; I135-G137 VanDerWaalsContact C-N 3.35Å; I135-G137 PolarHBondContact O-N 3.45Å; G137-Q140 WeakPolarHBondContact O-CB 3.44Å; G137-Q140 PolarHBondContact O-N 3.48Å; G137-L141 WeakPolarHBondContact O-CG 3.31Å; G137-L141 PolarHBondContact O-N 2.86Å
138	Y	96.1	Very high	93.4	Very high	59 Å²	59	79.4 Å²	79.4	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-69.6	-33.9	177.2	-73.8	-64.7	0	0	0	113.4	T134 I135 Q140 L141 L142 Y155 R158	T134-Y138 HydrophobicContact CG2-CD2 3.78Å; T134-Y138 HydrophobicContact CG2-CE2 3.58Å; T134-Y138 WeakPolarHBondContact O-CD2 3.32Å; T134-Y138 PolarHBondContact O-N 3.5Å; I135-Y138 PolarHBondContact O-N 3.37Å; Y138-Q140 VanDerWaalsContact C-N 3.3Å; Y138-Q140 PolarHBondContact O-N 3.3Å; Y138-L141 HydrophobicContact CD1-CD1 3.91Å; Y138-L141 HydrophobicContact CE1-CD1 4.2Å; Y138-L141 PolarHBondContact O-N 3.16Å; Y138-L142 WeakPolarHBondContact O-CB 3.46Å; Y138-L142 WeakPolarHBondContact O-CG 3.35Å; Y138-L142 PolarHBondContact O-N 3.49Å; Y138-Y155 AromaticContact CD1-CD1 3.41Å; Y138-Y155 HydrophobicContact CD1-CD1 3.41Å; Y138-Y155 VanDerWaalsContact CD1-CD1 3.41Å; Y138-Y155 HydrophobicContact CD1-CE1 4.15Å; Y138-Y155 AromaticContact CD1-CG 3.77Å; Y138-Y155 HydrophobicContact CD1-CG 3.77Å; Y138-Y155 AromaticContact CE1-CD1 3.53Å; Y138-Y155 HydrophobicContact CE1-CD1 3.53Å; Y138-Y155 HydrophobicContact CE1-CE1 4Å; Y138-Y155 HydrophobicContact CE1-CG 4.35Å; Y138-R158 HydrophobicContact CD1-CB 4.21Å; Y138-R158 HydrophobicContact CD2-CB 3.48Å; Y138-R158 VanDerWaalsContact CD2-CB 3.48Å; Y138-R158 HydrophobicContact CD2-CG 4.43Å; Y138-R158 HydrophobicContact CE1-CB 4.02Å; Y138-R158 HydrophobicContact CE1-CG 4.02Å; Y138-R158 HydrophobicContact CE2-CB 3.26Å; Y138-R158 HydrophobicContact CE2-CG 3.82Å; Y138-R158 HydrophobicContact CG-CB 3.97Å
139	V	96.4	Very high	93.5	Very high	60 Å²	60	85.3 Å²	85.3	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-59.4	-42.7	170.3	168.5	0	0	0	0	110.9	I135 K136 L142 Q143 M159	I135-V139 HydrophobicContact CG2-CG2 4.23Å; I135-V139 WeakPolarHBondContact O-CB 3.23Å; I135-V139 VanDerWaalsContact O-CG2 3.26Å; I135-V139 WeakPolarHBondContact O-CG2 3.38Å; I135-V139 PolarHBondContact O-N 2.99Å; K136-V139 PolarHBondContact O-N 2.93Å; V139-L142 PolarHBondContact O-N 3.43Å; V139-Q143 PolarHBondContact O-N 3.2Å; V139-M159 HydrophobicContact CG2-CE 3.39Å; V139-M159 HydrophobicContact CG2-SD 3.78Å
140	Q	96.6	Very high	93.7	Very high	112 Å²	112	84.2 Å²	84.2	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-65.7	-40.6	176.9	-70.1	176.5	-53.9	0	0	112	K136 G137 Y138 L142 Q143	K136-Q140 WeakPolarHBondContact O-CG 3.3Å; K136-Q140 PolarHBondContact O-N 3.42Å; G137-Q140 WeakPolarHBondContact O-CB 3.44Å; G137-Q140 PolarHBondContact O-N 3.48Å; Y138-Q140 VanDerWaalsContact C-N 3.3Å; Y138-Q140 PolarHBondContact O-N 3.3Å; Q140-L142 VanDerWaalsContact C-N 3.34Å; Q140-Q143 WeakPolarHBondContact O-CB 3.45Å; Q140-Q143 PolarHBondContact O-N 3.5Å
141	L	95.4	Very high	94.1	Very high	82 Å²	82	85.2 Å²	85.2	43%	0.429	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-39.3	175.9	-68.5	171.4	0	0	0	112	G137 Y138 Q143 N144 L147 Y155	G137-L141 WeakPolarHBondContact O-CG 3.31Å; G137-L141 PolarHBondContact O-N 2.86Å; Y138-L141 HydrophobicContact CD1-CD1 3.91Å; Y138-L141 HydrophobicContact CE1-CD1 4.2Å; Y138-L141 PolarHBondContact O-N 3.16Å; L141-Q143 PolarHBondContact O-N 3.36Å; L141-Q143 VanDerWaalsContact O-N 3.16Å; L141-N144 WeakPolarHBondContact O-CB 3.45Å; L141-N144 PolarHBondContact O-N 3.3Å; L141-N144 VanDerWaalsContact O-N 3.08Å; L141-L147 WeakPolarHBondContact O-CD1 3.42Å; L141-Y155 HydrophobicContact CB-CD2 3.88Å; L141-Y155 HydrophobicContact CB-CE2 3.68Å; L141-Y155 HydrophobicContact CD1-CE1 4.2Å; L141-Y155 HydrophobicContact CD1-CE2 4.4Å
142	L	94.9	Very high	94.5	Very high	37 Å²	37	90.7 Å²	90.7	19%	0.194	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.2	177.1	-80.3	174	0	0	0	114.4	Y138 V139 Q140 N144 L147 R152 Y155 L156 M159	Y138-L142 WeakPolarHBondContact O-CB 3.46Å; Y138-L142 WeakPolarHBondContact O-CG 3.35Å; Y138-L142 PolarHBondContact O-N 3.49Å; V139-L142 PolarHBondContact O-N 3.43Å; Q140-L142 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.06Å; L142-L147 HydrophobicContact CD2-CD1 4.33Å; L142-R152 HydrophobicContact CD2-CB 4.37Å; L142-R152 HydrophobicContact CD2-CG 3.73Å; L142-Y155 HydrophobicContact CD2-CD2 4.14Å; L142-Y155 HydrophobicContact CG-CD2 4.27Å; L142-L156 HydrophobicContact CD1-CD2 3.82Å; L142-L156 HydrophobicContact CD1-CG 4.33Å; L142-M159 HydrophobicContact CD1-CE 4.43Å; L142-M159 HydrophobicContact CD1-SD 3.37Å; L142-M159 WeakPolarHBondContact CD1-SD 3.39Å
143	Q	93.6	Very high	94.5	Very high	148 Å²	148	91 Å²	91	69%	0.692	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.6	174	-64.6	-179.2	-23.6	0	0	112.7	V139 Q140 L141 E145	V139-Q143 PolarHBondContact O-N 3.2Å; Q140-Q143 WeakPolarHBondContact O-CB 3.45Å; Q140-Q143 PolarHBondContact O-N 3.5Å; L141-Q143 PolarHBondContact O-N 3.36Å; L141-Q143 VanDerWaalsContact O-N 3.16Å; Q143-E145 PolarHBondContact O-N 2.92Å
144	N	92.2	Very high	94.6	Very high	80 Å²	80	92.4 Å²	92.4	43%	0.428	45%	0.448	S	S	.	.			trans	-74	121.9	173.7	-172.7	3.4	0	0	0	110.8	L141 L142 E146 L147	L141-N144 WeakPolarHBondContact O-CB 3.45Å; L141-N144 PolarHBondContact O-N 3.3Å; L141-N144 VanDerWaalsContact O-N 3.08Å; L142-N144 PolarHBondContact O-N 3.06Å; N144-E146 VanDerWaalsContact C-N 3.32Å; N144-E146 PolarHBondContact OD1-N 3.27Å; N144-E146 VanDerWaalsContact OD1-N 3.1Å; N144-L147 HydrophobicContact CB-CD1 4.45Å; N144-L147 HydrophobicContact CB-CD2 4.49Å; N144-L147 HydrophobicContact CB-CG 4.1Å; N144-L147 WeakPolarHBondContact O-CG 3.16Å
145	E	90	Very high	94.9	Very high	181 Å²	181	91.8 Å²	91.8	85%	0.846	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.9	-179.6	-63.7	-174.8	174.6	0	0	112.8	Q143 L147	Q143-E145 PolarHBondContact O-N 2.92Å; E145-L147 PolarHBondContact O-N 3.03Å
146	E	94.1	Very high	94.9	Very high	180 Å²	180	94 Å²	94	84%	0.841	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	8.2	-176.7	-60.3	-171.2	160	0	0	114.3	N144	N144-E146 VanDerWaalsContact C-N 3.32Å; N144-E146 PolarHBondContact OD1-N 3.27Å; N144-E146 VanDerWaalsContact OD1-N 3.1Å
147	L	92.5	Very high	94.8	Very high	24 Å²	24	92.5 Å²	92.5	13%	0.126	45%	0.447	C	S	.	.			trans	-69.2	135.9	-179.8	-67	174.7	0	0	0	112.4	L141 L142 N144 E145 E151 Y155	L141-L147 WeakPolarHBondContact O-CD1 3.42Å; L142-L147 HydrophobicContact CD2-CD1 4.33Å; N144-L147 HydrophobicContact CB-CD1 4.45Å; N144-L147 HydrophobicContact CB-CD2 4.49Å; N144-L147 HydrophobicContact CB-CG 4.1Å; N144-L147 WeakPolarHBondContact O-CG 3.16Å; E145-L147 PolarHBondContact O-N 3.03Å; L147-E151 HydrophobicContact CD2-CB 4.17Å; L147-Y155 HydrophobicContact CD1-CD2 3.88Å; L147-Y155 HydrophobicContact CD1-CE2 3.75Å; L147-Y155 HydrophobicContact CD2-CE2 3.68Å; L147-Y155 HydrophobicContact CG-CE2 4.39Å
148	S	94.7	Very high	94.6	Very high	44 Å²	44	96.7 Å²	96.7	31%	0.308	46%	0.455	S	S	.	.			trans	-61.6	161.3	165.5	64.6	0	0	0	0	111.4	E150 E151 R152	S148-E150 PolarHBondContact O-N 2.79Å; S148-E151 WeakPolarHBondContact CB-OE2 3.28Å; S148-E151 PolarHBondContact N-OE2 3.34Å; S148-E151 PolarHBondContact O-N 3.16Å; S148-E151 WeakPolarHBondContact OG-CB 3.35Å; S148-E151 VanDerWaalsContact OG-CD 3.26Å; S148-E151 WeakPolarHBondContact OG-CG 2.97Å; S148-E151 PolarHBondContact OG-N 3.39Å; S148-E151 VanDerWaalsContact OG-N 3.14Å; S148-E151 PolarHBondContact OG-OE2 2.96Å; S148-R152 WeakPolarHBondContact O-CB 3.42Å; S148-R152 PolarHBondContact O-N 2.92Å
149	K	94	Very high	94.5	Very high	180 Å²	180	95.8 Å²	95.8	78%	0.783	45%	0.453	S	S	*	.	H	α-helix	trans	-62	-37	175.9	-73.4	-174.9	178.1	-179.8	0	110.9	Q153	K149-Q153 WeakPolarHBondContact O-CB 3.37Å; K149-Q153 PolarHBondContact O-N 3.26Å
150	E	95.4	Very high	94.4	Very high	131 Å²	131	97.4 Å²	97.4	61%	0.612	46%	0.459	S	S	*	.	H	α-helix	trans	-66.1	-48.5	-180	-64.4	69.3	-152.8	0	0	111.2	S148 R152 Q153 I154	S148-E150 PolarHBondContact O-N 2.79Å; E150-R152 PolarHBondContact O-N 2.87Å; E150-Q153 PolarHBondContact O-N 2.69Å; E150-I154 VanDerWaalsContact O-CG1 3.3Å; E150-I154 WeakPolarHBondContact O-CG1 3.41Å; E150-I154 PolarHBondContact O-N 2.95Å
151	E	94.8	Very high	94	Very high	81 Å²	81	95 Å²	95	38%	0.379	45%	0.45	S	S	.	.	H	α-helix	trans	-62.3	-44.3	176.7	-71.9	164.5	127.4	0	0	111.9	L147 S148 Q153 I154 Y155	L147-E151 HydrophobicContact CD2-CB 4.17Å; S148-E151 WeakPolarHBondContact CB-OE2 3.28Å; S148-E151 PolarHBondContact N-OE2 3.34Å; S148-E151 PolarHBondContact O-N 3.16Å; S148-E151 WeakPolarHBondContact OG-CB 3.35Å; S148-E151 VanDerWaalsContact OG-CD 3.26Å; S148-E151 WeakPolarHBondContact OG-CG 2.97Å; S148-E151 PolarHBondContact OG-N 3.39Å; S148-E151 VanDerWaalsContact OG-N 3.14Å; S148-E151 PolarHBondContact OG-OE2 2.96Å; E151-Q153 VanDerWaalsContact C-N 3.31Å; E151-Q153 PolarHBondContact O-N 3.28Å; E151-I154 PolarHBondContact O-N 2.82Å; E151-Y155 VanDerWaalsContact O-CG 3.28Å; E151-Y155 PolarHBondContact O-N 2.88Å
152	R	95.8	Very high	93.8	Very high	116 Å²	116	91.2 Å²	91.2	44%	0.438	43%	0.431	S	S	.	.	H	α-helix	trans	-58	-45.3	176.8	-179.4	178.5	-68.5	-129.5	-1.6	111.1	L142 S148 E150 Y155 L156	L142-R152 HydrophobicContact CD2-CB 4.37Å; L142-R152 HydrophobicContact CD2-CG 3.73Å; S148-R152 WeakPolarHBondContact O-CB 3.42Å; S148-R152 PolarHBondContact O-N 2.92Å; E150-R152 PolarHBondContact O-N 2.87Å; R152-Y155 PolarHBondContact O-N 2.87Å; R152-L156 HydrophobicContact CG-CD1 4.3Å; R152-L156 WeakPolarHBondContact O-CG 3.24Å; R152-L156 PolarHBondContact O-N 2.84Å
153	Q	96.3	Very high	93.7	Very high	97 Å²	97	92.2 Å²	92.2	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-44.1	178.4	-177.4	58.4	29.1	0	0	111.6	K149 E150 E151 Y155 L156 E157	K149-Q153 WeakPolarHBondContact O-CB 3.37Å; K149-Q153 PolarHBondContact O-N 3.26Å; E150-Q153 PolarHBondContact O-N 2.69Å; E151-Q153 VanDerWaalsContact C-N 3.31Å; E151-Q153 PolarHBondContact O-N 3.28Å; Q153-Y155 VanDerWaalsContact C-N 3.31Å; Q153-Y155 PolarHBondContact O-N 2.76Å; Q153-L156 PolarHBondContact O-N 2.97Å; Q153-E157 WeakPolarHBondContact CG-OE1 3.26Å; Q153-E157 PolarHBondContact NE2-OE1 2.9Å; Q153-E157 WeakPolarHBondContact O-CG 3.32Å; Q153-E157 PolarHBondContact O-N 2.94Å
154	I	95	Very high	93.5	Very high	83 Å²	83	89.6 Å²	89.6	43%	0.426	43%	0.426	S	S	.	.	H	α-helix	trans	-57.6	-44.9	175.4	-69.1	164.6	0	0	0	110.6	E150 E151 E157 R158	E150-I154 VanDerWaalsContact O-CG1 3.3Å; E150-I154 WeakPolarHBondContact O-CG1 3.41Å; E150-I154 PolarHBondContact O-N 2.95Å; E151-I154 PolarHBondContact O-N 2.82Å; I154-E157 PolarHBondContact O-N 2.79Å; I154-R158 HydrophobicContact CG2-CG 4.38Å; I154-R158 WeakPolarHBondContact O-CG 3.28Å; I154-R158 PolarHBondContact O-N 3.3Å
155	Y	95.6	Very high	93.2	Very high	43 Å²	43	88.5 Å²	88.5	17%	0.169	42%	0.419	C	S	.	.	H	α-helix	trans	-66.1	-40.4	-179.8	-61.3	-17.1	0	0	0	112.7	Y138 L141 L142 L147 E151 R152 Q153 R158 M159	Y138-Y155 AromaticContact CD1-CD1 3.41Å; Y138-Y155 HydrophobicContact CD1-CD1 3.41Å; Y138-Y155 VanDerWaalsContact CD1-CD1 3.41Å; Y138-Y155 HydrophobicContact CD1-CE1 4.15Å; Y138-Y155 AromaticContact CD1-CG 3.77Å; Y138-Y155 HydrophobicContact CD1-CG 3.77Å; Y138-Y155 AromaticContact CE1-CD1 3.53Å; Y138-Y155 HydrophobicContact CE1-CD1 3.53Å; Y138-Y155 HydrophobicContact CE1-CE1 4Å; Y138-Y155 HydrophobicContact CE1-CG 4.35Å; L141-Y155 HydrophobicContact CB-CD2 3.88Å; L141-Y155 HydrophobicContact CB-CE2 3.68Å; L141-Y155 HydrophobicContact CD1-CE1 4.2Å; L141-Y155 HydrophobicContact CD1-CE2 4.4Å; L142-Y155 HydrophobicContact CD2-CD2 4.14Å; L142-Y155 HydrophobicContact CG-CD2 4.27Å; L147-Y155 HydrophobicContact CD1-CD2 3.88Å; L147-Y155 HydrophobicContact CD1-CE2 3.75Å; L147-Y155 HydrophobicContact CD2-CE2 3.68Å; L147-Y155 HydrophobicContact CG-CE2 4.39Å; E151-Y155 VanDerWaalsContact O-CG 3.28Å; E151-Y155 PolarHBondContact O-N 2.88Å; R152-Y155 PolarHBondContact O-N 2.87Å; Q153-Y155 VanDerWaalsContact C-N 3.31Å; Q153-Y155 PolarHBondContact O-N 2.76Å; Y155-R158 PolarHBondContact O-N 2.99Å; Y155-M159 WeakPolarHBondContact O-CG 3.32Å; Y155-M159 PolarHBondContact O-N 3.15Å
156	L	96.4	Very high	93.2	Very high	79 Å²	79	81.4 Å²	81.4	41%	0.414	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-43.5	174.7	-70.6	171.1	0	0	0	111.7	L142 R152 Q153 R158 M159 L160	L142-L156 HydrophobicContact CD1-CD2 3.82Å; L142-L156 HydrophobicContact CD1-CG 4.33Å; R152-L156 HydrophobicContact CG-CD1 4.3Å; R152-L156 WeakPolarHBondContact O-CG 3.24Å; R152-L156 PolarHBondContact O-N 2.84Å; Q153-L156 PolarHBondContact O-N 2.97Å; L156-R158 VanDerWaalsContact C-N 3.33Å; L156-R158 PolarHBondContact O-N 2.89Å; L156-M159 PolarHBondContact O-N 2.97Å; L156-L160 WeakPolarHBondContact O-CB 3.3Å; L156-L160 PolarHBondContact O-N 3.5Å
157	E	94.8	Very high	93	Very high	99 Å²	99	76.2 Å²	76.2	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-40.7	175.7	-75.6	172.5	-166.6	0	0	111.9	Q153 I154 M159 L160 D161	Q153-E157 WeakPolarHBondContact CG-OE1 3.26Å; Q153-E157 PolarHBondContact NE2-OE1 2.9Å; Q153-E157 WeakPolarHBondContact O-CG 3.32Å; Q153-E157 PolarHBondContact O-N 2.94Å; I154-E157 PolarHBondContact O-N 2.79Å; E157-M159 VanDerWaalsContact C-N 3.34Å; E157-M159 PolarHBondContact O-N 2.87Å; E157-L160 PolarHBondContact O-N 3.3Å; E157-D161 WeakPolarHBondContact O-CB 3.38Å; E157-D161 PolarHBondContact O-N 3.37Å
158	R	92	Very high	92.7	Very high	114 Å²	114	80.5 Å²	80.5	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-67.4	-33.5	177	-64.8	-71.4	-177.9	-167.8	2.5	113.1	Y138 I154 Y155 L156 D161 G162	Y138-R158 HydrophobicContact CD1-CB 4.21Å; Y138-R158 HydrophobicContact CD2-CB 3.48Å; Y138-R158 VanDerWaalsContact CD2-CB 3.48Å; Y138-R158 HydrophobicContact CD2-CG 4.43Å; Y138-R158 HydrophobicContact CE1-CB 4.02Å; Y138-R158 HydrophobicContact CE1-CG 4.02Å; Y138-R158 HydrophobicContact CE2-CB 3.26Å; Y138-R158 HydrophobicContact CE2-CG 3.82Å; Y138-R158 HydrophobicContact CG-CB 3.97Å; I154-R158 HydrophobicContact CG2-CG 4.38Å; I154-R158 WeakPolarHBondContact O-CG 3.28Å; I154-R158 PolarHBondContact O-N 3.3Å; Y155-R158 PolarHBondContact O-N 2.99Å; L156-R158 VanDerWaalsContact C-N 3.33Å; L156-R158 PolarHBondContact O-N 2.89Å; R158-D161 WeakPolarHBondContact O-CB 3.34Å; R158-G162 PolarHBondContact O-N 2.88Å
159	M	93.6	Very high	92.3	Very high	40 Å²	40	78.5 Å²	78.5	20%	0.197	37%	0.372	C	S	.	.	H	α-helix	trans	-67.3	-44.8	171.6	-70.8	170.5	52.5	0	0	111.2	V139 L142 Y155 L156 E157 D161 G162 T163	V139-M159 HydrophobicContact CG2-CE 3.39Å; V139-M159 HydrophobicContact CG2-SD 3.78Å; L142-M159 HydrophobicContact CD1-CE 4.43Å; L142-M159 HydrophobicContact CD1-SD 3.37Å; L142-M159 WeakPolarHBondContact CD1-SD 3.39Å; Y155-M159 WeakPolarHBondContact O-CG 3.32Å; Y155-M159 PolarHBondContact O-N 3.15Å; L156-M159 PolarHBondContact O-N 2.97Å; E157-M159 VanDerWaalsContact C-N 3.34Å; E157-M159 PolarHBondContact O-N 2.87Å; M159-D161 VanDerWaalsContact C-N 3.35Å; M159-D161 PolarHBondContact O-N 3.42Å; M159-G162 WeakPolarHBondContact O-CA 3.47Å; M159-G162 PolarHBondContact O-N 3.39Å; M159-G162 VanDerWaalsContact O-N 3.09Å; M159-T163 PolarHBondContact O-N 3.39Å
160	L	93.8	Very high	92.1	Very high	95 Å²	95	72.4 Å²	72.4	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-45.3	177.7	-174.8	62.4	0	0	0	111	L156 E157 G162 T163 H164	L156-L160 WeakPolarHBondContact O-CB 3.3Å; L156-L160 PolarHBondContact O-N 3.5Å; E157-L160 PolarHBondContact O-N 3.3Å; L160-G162 VanDerWaalsContact C-N 3.28Å; L160-G162 PolarHBondContact O-N 2.9Å; L160-T163 PolarHBondContact O-N 2.96Å; L160-T163 PolarHBondContact O-OG1 3.03Å; L160-H164 PolarHBondContact O-CD2 2.94Å; L160-H164 VanDerWaalsContact O-CD2 3.27Å; L160-H164 PolarHBondContact O-N 2.99Å
161	D	89.6	Confident	91.8	Very high	60 Å²	60	69.3 Å²	69.3	32%	0.321	34%	0.337	S	S	.	.	H	α-helix	trans	-50.5	-46.7	170.4	-90.6	-12.5	0	0	0	112.5	E157 R158 M159 T163 H164 Q165 K296	E157-D161 WeakPolarHBondContact O-CB 3.38Å; E157-D161 PolarHBondContact O-N 3.37Å; R158-D161 WeakPolarHBondContact O-CB 3.34Å; M159-D161 VanDerWaalsContact C-N 3.35Å; M159-D161 PolarHBondContact O-N 3.42Å; D161-T163 VanDerWaalsContact C-N 3.34Å; D161-T163 PolarHBondContact O-N 3.32Å; D161-H164 PolarHBondContact O-N 3.46Å; D161-Q165 PolarHBondContact O-N 3.41Å; D161-K296 IonicContact OD1-NZ 3.46Å; D161-K296 PolarHBondContact OD1-NZ 3.5Å; D161-K296 IonicContact OD2-NZ 2.71Å; D161-K296 PolarHBondContact OD2-NZ 3.5Å
162	G	89.8	Confident	91.4	Very high	3 Å²	3	66.1 Å²	66.1	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-39.4	177.5	0	0	0	0	0	112.6	R158 M159 L160 Q165 L166	R158-G162 PolarHBondContact O-N 2.88Å; M159-G162 WeakPolarHBondContact O-CA 3.47Å; M159-G162 PolarHBondContact O-N 3.39Å; M159-G162 VanDerWaalsContact O-N 3.09Å; L160-G162 VanDerWaalsContact C-N 3.28Å; L160-G162 PolarHBondContact O-N 2.9Å; G162-Q165 PolarHBondContact O-N 3.43Å; G162-L166 WeakPolarHBondContact O-CG 3.49Å; G162-L166 PolarHBondContact O-N 3.5Å; G162-L166 VanDerWaalsContact O-N 3.13Å
163	T	93.4	Very high	91	Very high	58 Å²	58	62.3 Å²	62.3	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-68.2	-41.4	176.9	62.1	0	0	0	0	112.2	I135 M159 L160 D161 Q165 L166 T167	I135-T163 HydrophobicContact CD1-CG2 3.98Å; M159-T163 PolarHBondContact O-N 3.39Å; L160-T163 PolarHBondContact O-N 2.96Å; L160-T163 PolarHBondContact O-OG1 3.03Å; D161-T163 VanDerWaalsContact C-N 3.34Å; D161-T163 PolarHBondContact O-N 3.32Å; T163-Q165 VanDerWaalsContact C-N 3.32Å; T163-Q165 PolarHBondContact O-N 3.49Å; T163-L166 WeakPolarHBondContact O-CB 3.47Å; T163-L166 PolarHBondContact O-N 2.92Å; T163-T167 PolarHBondContact O-N 2.93Å; T163-T167 PolarHBondContact O-OG1 3.31Å
164	H	89	Confident	90.6	Very high	93 Å²	93	62.7 Å²	62.7	43%	0.431	32%	0.316	S	S	.	.	H	α-helix	trans	-61.6	-40.8	174.4	-71.2	-52.1	0	0	0	112	L160 D161 L166 T167 H168	L160-H164 PolarHBondContact O-CD2 2.94Å; L160-H164 VanDerWaalsContact O-CD2 3.27Å; L160-H164 PolarHBondContact O-N 2.99Å; D161-H164 PolarHBondContact O-N 3.46Å; H164-L166 VanDerWaalsContact C-N 3.31Å; H164-L166 PolarHBondContact O-N 3.37Å; H164-T167 PolarHBondContact O-N 2.89Å; H164-H168 WeakPolarHBondContact O-CB 3.46Å; H164-H168 PolarHBondContact O-CD2 3.33Å; H164-H168 PolarHBondContact O-N 2.87Å
165	Q	86	Confident	90.1	Very high	58 Å²	58	60.8 Å²	60.8	27%	0.271	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-41.8	175	-176.1	175	1	0	0	112	P131 D161 G162 T163 L169	P131-Q165 HydrophobicContact CB-CB 4.37Å; P131-Q165 HydrophobicContact CB-CG 4.42Å; P131-Q165 HydrophobicContact CG-CG 4.41Å; D161-Q165 PolarHBondContact O-N 3.41Å; G162-Q165 PolarHBondContact O-N 3.43Å; T163-Q165 VanDerWaalsContact C-N 3.32Å; T163-Q165 PolarHBondContact O-N 3.49Å; Q165-L169 WeakPolarHBondContact O-CB 3.15Å; Q165-L169 PolarHBondContact O-N 3.41Å
166	L	90.9	Very high	89.5	Confident	31 Å²	31	58.9 Å²	58.9	16%	0.162	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-46.5	176.5	-73.8	174.5	0	0	0	112.2	F128 P131 I132 I135 G162 T163 H164 H168 L169 T170	F128-L166 HydrophobicContact CD1-CD2 3.33Å; F128-L166 HydrophobicContact CE1-CD2 3.76Å; F128-L166 HydrophobicContact CG-CD2 4.32Å; P131-L166 HydrophobicContact CB-CD2 4.24Å; P131-L166 HydrophobicContact CB-CG 3.98Å; P131-L166 HydrophobicContact CG-CD2 3.51Å; P131-L166 HydrophobicContact CG-CG 3.81Å; I132-L166 HydrophobicContact CG1-CD1 4.06Å; I132-L166 HydrophobicContact CG1-CD2 4.34Å; I135-L166 HydrophobicContact CD1-CD1 3.89Å; G162-L166 WeakPolarHBondContact O-CG 3.49Å; G162-L166 PolarHBondContact O-N 3.5Å; G162-L166 VanDerWaalsContact O-N 3.13Å; T163-L166 WeakPolarHBondContact O-CB 3.47Å; T163-L166 PolarHBondContact O-N 2.92Å; H164-L166 VanDerWaalsContact C-N 3.31Å; H164-L166 PolarHBondContact O-N 3.37Å; L166-H168 PolarHBondContact O-N 2.98Å; L166-L169 PolarHBondContact O-N 2.91Å; L166-T170 VanDerWaalsContact O-CG2 3.3Å; L166-T170 WeakPolarHBondContact O-CG2 3.19Å; L166-T170 PolarHBondContact O-N 3.45Å; L166-T170 PolarHBondContact O-OG1 3.42Å
167	T	90.5	Very high	88.9	Confident	72 Å²	72	57.7 Å²	57.7	44%	0.442	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.7	-58.6	0	0	0	0	111.5	T163 H164 L169 T170 D171	T163-T167 PolarHBondContact O-N 2.93Å; T163-T167 PolarHBondContact O-OG1 3.31Å; H164-T167 PolarHBondContact O-N 2.89Å; T167-L169 VanDerWaalsContact C-N 3.32Å; T167-L169 PolarHBondContact O-N 3.37Å; T167-T170 WeakPolarHBondContact CA-OG1 3.24Å; T167-T170 PolarHBondContact O-N 2.89Å; T167-T170 PolarHBondContact O-OG1 2.93Å; T167-D171 WeakPolarHBondContact O-CB 3.33Å; T167-D171 PolarHBondContact O-N 2.91Å
168	H	85.3	Confident	88.3	Confident	114 Å²	114	59.9 Å²	59.9	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-37.8	176.4	-78.6	-59.4	0	0	0	112.7	H164 L166 N172	H164-H168 WeakPolarHBondContact O-CB 3.46Å; H164-H168 PolarHBondContact O-CD2 3.33Å; H164-H168 PolarHBondContact O-N 2.87Å; L166-H168 PolarHBondContact O-N 2.98Å; H168-N172 WeakPolarHBondContact O-CB 3.37Å; H168-N172 VanDerWaalsContact O-CG 3.23Å; H168-N172 PolarHBondContact O-N 3.27Å
169	L	86.3	Confident	87.8	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-45.5	175.5	-179.2	62.2	0	0	0	111.3	E127 F128 Q165 L166 T167 N172 I173 F286 N298 L300	E127-L169 HydrophobicContact CB-CD1 4.36Å; E127-L169 HydrophobicContact CB-CD2 3.79Å; F128-L169 HydrophobicContact CD1-CD2 4.21Å; F128-L169 HydrophobicContact CD2-CD2 3.73Å; F128-L169 HydrophobicContact CE1-CD2 4.23Å; F128-L169 HydrophobicContact CE2-CD2 3.77Å; F128-L169 HydrophobicContact CE2-CG 4.24Å; F128-L169 HydrophobicContact CG-CD2 3.94Å; F128-L169 HydrophobicContact CZ-CD2 4.01Å; F128-L169 HydrophobicContact CZ-CG 4.3Å; Q165-L169 WeakPolarHBondContact O-CB 3.15Å; Q165-L169 PolarHBondContact O-N 3.41Å; L166-L169 PolarHBondContact O-N 2.91Å; T167-L169 VanDerWaalsContact C-N 3.32Å; T167-L169 PolarHBondContact O-N 3.37Å; L169-N172 PolarHBondContact O-N 2.82Å; L169-I173 HydrophobicContact CD1-CD1 4.06Å; L169-I173 HydrophobicContact CD1-CG1 4.45Å; L169-I173 HydrophobicContact CG-CD1 3.98Å; L169-I173 VanDerWaalsContact O-CG1 3.3Å; L169-I173 WeakPolarHBondContact O-CG1 3.34Å; L169-I173 PolarHBondContact O-N 3.48Å; L169-F286 HydrophobicContact CD1-CE1 4.17Å; L169-N298 HydrophobicContact CD1-CB 4.08Å; L169-L300 HydrophobicContact CD1-CD1 3.79Å
170	T	90.9	Very high	87.1	Confident	51 Å²	51	57.9 Å²	57.9	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-63.9	-42.7	179	56.4	0	0	0	0	111.6	F128 L166 T167 N172 I173 L174	F128-T170 HydrophobicContact CE1-CG2 3.94Å; F128-T170 HydrophobicContact CZ-CG2 3.72Å; L166-T170 VanDerWaalsContact O-CG2 3.3Å; L166-T170 WeakPolarHBondContact O-CG2 3.19Å; L166-T170 PolarHBondContact O-N 3.45Å; L166-T170 PolarHBondContact O-OG1 3.42Å; T167-T170 WeakPolarHBondContact CA-OG1 3.24Å; T167-T170 PolarHBondContact O-N 2.89Å; T167-T170 PolarHBondContact O-OG1 2.93Å; T170-N172 PolarHBondContact O-N 3.27Å; T170-I173 PolarHBondContact O-N 3.17Å; T170-L174 WeakPolarHBondContact O-CB 3.45Å; T170-L174 WeakPolarHBondContact O-CG 3.46Å; T170-L174 PolarHBondContact O-N 2.99Å
171	D	88	Confident	86.1	Confident	67 Å²	67	58.4 Å²	58.4	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-42.5	179.5	-69.4	-14.1	0	0	0	111.4	T167 L174 K175	T167-D171 WeakPolarHBondContact O-CB 3.33Å; T167-D171 PolarHBondContact O-N 2.91Å; D171-L174 PolarHBondContact O-N 3.39Å; D171-K175 WeakPolarHBondContact O-CB 3.32Å; D171-K175 VanDerWaalsContact O-CG 3.3Å; D171-K175 WeakPolarHBondContact O-CG 3.4Å; D171-K175 PolarHBondContact O-N 2.86Å
172	N	86.4	Confident	84.9	Confident	14 Å²	14	63.9 Å²	63.9	8%	0.075	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-42.5	176.1	-74.4	-9.3	0	0	0	111.7	H168 L169 T170 K175 L176 N298 L300	H168-N172 WeakPolarHBondContact O-CB 3.37Å; H168-N172 VanDerWaalsContact O-CG 3.23Å; H168-N172 PolarHBondContact O-N 3.27Å; L169-N172 PolarHBondContact O-N 2.82Å; T170-N172 PolarHBondContact O-N 3.27Å; N172-K175 PolarHBondContact O-N 2.89Å; N172-L176 WeakPolarHBondContact O-CB 3.46Å; N172-L176 VanDerWaalsContact O-CG 3.28Å; N172-L176 WeakPolarHBondContact O-CG 3.21Å; N172-L176 PolarHBondContact O-N 3.37Å; N172-N298 PolarHBondContact ND2-ND2 3.12Å; N172-L300 HydrophobicContact CB-CB 4.13Å; N172-L300 HydrophobicContact CB-CD1 3.84Å
173	I	88.1	Confident	83.5	Confident	35 Å²	35	64.4 Å²	64.4	18%	0.179	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-45.3	177.3	-69.6	167.4	0	0	0	110.9	F120 V124 F128 L169 T170 K175 L176 S177 L300	F120-I173 HydrophobicContact CZ-CG1 4.49Å; F120-I173 HydrophobicContact CZ-CG2 4.45Å; V124-I173 HydrophobicContact CG1-CD1 3.84Å; V124-I173 HydrophobicContact CG2-CD1 3.95Å; F128-I173 HydrophobicContact CE2-CD1 4Å; F128-I173 HydrophobicContact CZ-CD1 4.49Å; L169-I173 HydrophobicContact CD1-CD1 4.06Å; L169-I173 HydrophobicContact CD1-CG1 4.45Å; L169-I173 HydrophobicContact CG-CD1 3.98Å; L169-I173 VanDerWaalsContact O-CG1 3.3Å; L169-I173 WeakPolarHBondContact O-CG1 3.34Å; L169-I173 PolarHBondContact O-N 3.48Å; T170-I173 PolarHBondContact O-N 3.17Å; I173-K175 PolarHBondContact O-N 3.39Å; I173-L176 PolarHBondContact O-N 2.95Å; I173-S177 WeakPolarHBondContact O-CB 3.34Å; I173-S177 PolarHBondContact O-N 3.28Å; I173-L300 HydrophobicContact CG1-CD1 4.23Å
174	L	86.4	Confident	81.7	Confident	106 Å²	106	69 Å²	69	56%	0.555	35%	0.351	S	S	*	.	H	α-helix	trans	-63.8	-40.8	178.4	-72.1	173	0	0	0	111.7	T170 D171 S177 K178	T170-L174 WeakPolarHBondContact O-CB 3.45Å; T170-L174 WeakPolarHBondContact O-CG 3.46Å; T170-L174 PolarHBondContact O-N 2.99Å; D171-L174 PolarHBondContact O-N 3.39Å; L174-S177 PolarHBondContact O-N 3.01Å; L174-K178 WeakPolarHBondContact O-CG 3.41Å; L174-K178 PolarHBondContact O-N 3.41Å
175	K	84.5	Confident	80.3	Confident	43 Å²	43	68.3 Å²	68.3	19%	0.187	37%	0.37	C	S	.	.	H	α-helix	trans	-64.2	-46.4	175.8	-75.4	175.6	177.4	175	0	111.9	D171 N172 I173 S177 K178 L179 L304	D171-K175 WeakPolarHBondContact O-CB 3.32Å; D171-K175 VanDerWaalsContact O-CG 3.3Å; D171-K175 WeakPolarHBondContact O-CG 3.4Å; D171-K175 PolarHBondContact O-N 2.86Å; N172-K175 PolarHBondContact O-N 2.89Å; I173-K175 PolarHBondContact O-N 3.39Å; K175-S177 VanDerWaalsContact C-N 3.34Å; K175-S177 PolarHBondContact O-N 3.4Å; K175-K178 PolarHBondContact O-N 3.31Å; K175-L179 WeakPolarHBondContact O-CG 3.45Å; K175-L179 PolarHBondContact O-N 3.06Å; K175-L304 HydrophobicContact CB-CD1 3.92Å; K175-L304 HydrophobicContact CB-CD2 4.39Å; K175-L304 HydrophobicContact CD-CD2 4.2Å
176	L	83.7	Confident	79.7	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-58.4	-46.3	175.1	-72.7	169.6	0	0	0	111.3	N172 I173 K178 L179 E180 L300 L304	N172-L176 WeakPolarHBondContact O-CB 3.46Å; N172-L176 VanDerWaalsContact O-CG 3.28Å; N172-L176 WeakPolarHBondContact O-CG 3.21Å; N172-L176 PolarHBondContact O-N 3.37Å; I173-L176 PolarHBondContact O-N 2.95Å; L176-K178 VanDerWaalsContact C-N 3.35Å; L176-K178 PolarHBondContact O-N 3.49Å; L176-L179 PolarHBondContact O-N 2.97Å; L176-L179 VanDerWaalsContact O-N 3.12Å; L176-E180 WeakPolarHBondContact O-CG 3.39Å; L176-E180 PolarHBondContact O-N 3.23Å; L176-L300 HydrophobicContact CD1-CD1 4.34Å; L176-L300 HydrophobicContact CD1-CD2 3.87Å; L176-L300 HydrophobicContact CD1-CG 4.49Å; L176-L304 HydrophobicContact CD2-CB 4.17Å; L176-L304 HydrophobicContact CD2-CD1 3.85Å; L176-L304 HydrophobicContact CG-CD1 4.11Å
177	S	83.5	Confident	79.3	Confident	54 Å²	54	71.4 Å²	71.4	38%	0.378	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-40.9	177.6	178.1	0	0	0	0	112.7	I173 L174 K175 L179 E180 N181	I173-S177 WeakPolarHBondContact O-CB 3.34Å; I173-S177 PolarHBondContact O-N 3.28Å; L174-S177 PolarHBondContact O-N 3.01Å; K175-S177 VanDerWaalsContact C-N 3.34Å; K175-S177 PolarHBondContact O-N 3.4Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 2.75Å; S177-E180 PolarHBondContact O-N 2.93Å; S177-N181 PolarHBondContact O-N 3.49Å; S177-N181 PolarHBondContact O-ND2 2.95Å
178	K	81.8	Confident	79.2	Confident	144 Å²	144	70.2 Å²	70.2	63%	0.626	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-39.9	174	-75.2	-178.6	-179.7	-174.6	0	112.3	L174 K175 L176	L174-K178 WeakPolarHBondContact O-CG 3.41Å; L174-K178 PolarHBondContact O-N 3.41Å; K175-K178 PolarHBondContact O-N 3.31Å; L176-K178 VanDerWaalsContact C-N 3.35Å; L176-K178 PolarHBondContact O-N 3.49Å
179	L	82.3	Confident	79.6	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-71.6	-34.5	179.6	-71.8	165	0	0	0	112.9	K175 L176 S177 F230 L304 Q307 I308 L311	K175-L179 WeakPolarHBondContact O-CG 3.45Å; K175-L179 PolarHBondContact O-N 3.06Å; L176-L179 PolarHBondContact O-N 2.97Å; L176-L179 VanDerWaalsContact O-N 3.12Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 2.75Å; L179-F230 HydrophobicContact CD2-CD2 3.69Å; L179-F230 HydrophobicContact CD2-CE2 3.35Å; L179-F230 HydrophobicContact CD2-CZ 4.23Å; L179-F230 HydrophobicContact CG-CE2 3.98Å; L179-F230 HydrophobicContact CG-CZ 4.39Å; L179-L304 HydrophobicContact CD1-CD1 3.46Å; L179-L304 VanDerWaalsContact CD1-CD1 3.46Å; L179-Q307 VanDerWaalsContact C-NE2 3.29Å; L179-Q307 VanDerWaalsContact CB-CD 3.48Å; L179-Q307 HydrophobicContact CB-CG 3.89Å; L179-Q307 HydrophobicContact CD1-CB 4.33Å; L179-Q307 HydrophobicContact CD1-CG 4.14Å; L179-I308 HydrophobicContact CD1-CD1 4.39Å; L179-I308 HydrophobicContact CD1-CG1 3.61Å; L179-I308 HydrophobicContact CD2-CG1 4.27Å; L179-L311 HydrophobicContact CD2-CB 4.45Å; L179-L311 HydrophobicContact CD2-CD2 3.51Å; L179-L311 HydrophobicContact CD2-CG 4.39Å
180	E	78.1	Confident	80	Confident	103 Å²	103	74.9 Å²	74.9	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-70	-32.2	179.3	-72.9	-178.8	158.6	0	0	112.7	L176 S177 Q182 K285 Q307	L176-E180 WeakPolarHBondContact O-CG 3.39Å; L176-E180 PolarHBondContact O-N 3.23Å; S177-E180 PolarHBondContact O-N 2.93Å; E180-Q182 PolarHBondContact O-N 2.54Å; E180-K285 IonicContact OE1-NZ 2.94Å; E180-K285 PolarHBondContact OE1-NZ 3.33Å; E180-Q307 VanDerWaalsContact CG-NE2 3.26Å; E180-Q307 VanDerWaalsContact N-NE2 3.2Å
181	N	73.3	Confident	80.3	Confident	105 Å²	105	73 Å²	73	56%	0.561	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	35.6	180	-67.9	-56.5	0	0	0	113.4	S177 G183	S177-N181 PolarHBondContact O-N 3.49Å; S177-N181 PolarHBondContact O-ND2 2.95Å; N181-G183 PolarHBondContact O-N 2.91Å
182	Q	65.5	Low	80.7	Confident	175 Å²	175	73.2 Å²	73.2	82%	0.818	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	23.8	171.4	-58.8	-178.9	-18	0	0	116.9	E180 I184	E180-Q182 PolarHBondContact O-N 2.54Å; Q182-I184 PolarHBondContact O-N 3.46Å; Q182-I184 VanDerWaalsContact O-N 3.11Å
183	G	59.5	Low	81.3	Confident	14 Å²	14	72.6 Å²	72.6	14%	0.144	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	19.9	170.4	0	0	0	0	0	114.6	N181 G185 L186	N181-G183 PolarHBondContact O-N 2.91Å; G183-G185 PolarHBondContact O-N 3.48Å; G183-L186 VanDerWaalsContact O-CG 3.28Å; G183-L186 WeakPolarHBondContact O-CG 2.83Å; G183-L186 PolarHBondContact O-N 3.12Å; G183-L186 VanDerWaalsContact O-N 3.12Å
184	I	55.6	Low	81.7	Confident	154 Å²	154	71 Å²	71	79%	0.79	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	116.1	176.3	-62.6	170	0	0	0	108.5	Q182	Q182-I184 PolarHBondContact O-N 3.46Å; Q182-I184 VanDerWaalsContact O-N 3.11Å
185	G	59.4	Low	82.3	Confident	79 Å²	79	69.3 Å²	69.3	81%	0.814	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	18.1	177.7	0	0	0	0	0	115.6	G183	G183-G185 PolarHBondContact O-N 3.48Å
186	L	73.2	Confident	83	Confident	43 Å²	43	67.4 Å²	67.4	23%	0.225	35%	0.347	C	S	.	.			trans	-76.6	125.6	170.3	-63.7	176.5	0	0	0	111.2	G183 F188 F230 L311	G183-L186 VanDerWaalsContact O-CG 3.28Å; G183-L186 WeakPolarHBondContact O-CG 2.83Å; G183-L186 PolarHBondContact O-N 3.12Å; G183-L186 VanDerWaalsContact O-N 3.12Å; L186-F188 HydrophobicContact CB-CD2 4.01Å; L186-F188 HydrophobicContact CB-CE2 3.65Å; L186-F188 HydrophobicContact CD1-CE2 4.2Å; L186-F230 HydrophobicContact CD1-CD2 4.38Å; L186-F230 HydrophobicContact CD1-CE2 3.98Å; L186-F230 HydrophobicContact CD2-CD2 3.92Å; L186-F230 HydrophobicContact CD2-CE2 3.16Å; L186-F230 HydrophobicContact CD2-CZ 3.64Å; L186-F230 HydrophobicContact CG-CE2 4.22Å; L186-L311 HydrophobicContact CD1-CD1 3.82Å; L186-L311 HydrophobicContact CD1-CD2 3.29Å; L186-L311 HydrophobicContact CD1-CG 4.08Å
187	D	82.6	Confident	83.7	Confident	112 Å²	112	67.4 Å²	67.4	60%	0.599	35%	0.347	S	S	*	.			trans	-83.1	116.9	174.3	-166.1	12.9	0	0	0	109.1	N227	D187-N227 PolarHBondContact O-ND2 3.06Å
188	F	89.5	Confident	84.4	Confident	46 Å²	46	68.4 Å²	68.4	20%	0.202	34%	0.342	C	S	.	.			trans	-106.3	119.9	176.7	-82.1	-117.2	0	0	0	108.4	L186 Y225 G226 N227 H312 L336	L186-F188 HydrophobicContact CB-CD2 4.01Å; L186-F188 HydrophobicContact CB-CE2 3.65Å; L186-F188 HydrophobicContact CD1-CE2 4.2Å; F188-Y225 HydrophobicContact CB-CD1 4.5Å; F188-Y225 HydrophobicContact CB-CE1 3.8Å; F188-Y225 HydrophobicContact CB-CE2 4.23Å; F188-Y225 HydrophobicContact CD1-CE1 4.38Å; F188-Y225 WeakPolarHBondContact O-CE2 2.99Å; F188-Y225 VanDerWaalsContact O-CZ 3.31Å; F188-Y225 PolarHBondContact O-OH 2.83Å; F188-G226 WeakPolarHBondContact CA-O 3.42Å; F188-G226 VanDerWaalsContact CD1-CA 3.5Å; F188-N227 HydrophobicContact CD2-CB 4.47Å; F188-N227 HydrophobicContact CE2-CB 4.3Å; F188-H312 AromaticContact CE1-CD2 3.76Å; F188-H312 AromaticContact CE1-NE2 3.85Å; F188-L336 HydrophobicContact CD1-CD1 4.46Å; F188-L336 HydrophobicContact CE1-CD1 4.05Å
189	Q	92.9	Very high	85.2	Confident	84 Å²	84	66.5 Å²	66.5	39%	0.393	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	162.7	-178	64.2	-177.4	-7.5	0	0	111.4	Y225 G226 E228	Q189-Y225 WeakPolarHBondContact O-CA 2.97Å; Q189-G226 PolarHBondContact N-O 3.45Å; Q189-G226 PolarHBondContact O-N 2.87Å; Q189-E228 PolarHBondContact NE2-OE2 2.94Å
190	Y	95	Very high	85.9	Confident	130 Å²	130	66 Å²	66	51%	0.51	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.4	169.3	-74.2	-80.3	0	0	0	109.5	E223 Y224 Y225	Y190-E223 HydrophobicContact CD1-CG 3.89Å; Y190-E223 HydrophobicContact CG-CG 4.46Å; Y190-Y224 WeakPolarHBondContact CA-O 3.34Å; Y190-Y225 HydrophobicContact CD1-CD2 4.22Å; Y190-Y225 AromaticContact CD2-CD2 3.65Å; Y190-Y225 HydrophobicContact CD2-CD2 3.65Å; Y190-Y225 HydrophobicContact CD2-CE2 4.27Å; Y190-Y225 HydrophobicContact CE1-CD2 4.23Å; Y190-Y225 HydrophobicContact CE1-CG 4.3Å; Y190-Y225 AromaticContact CE2-CD2 3.6Å; Y190-Y225 HydrophobicContact CE2-CD2 3.6Å; Y190-Y225 HydrophobicContact CE2-CE2 4.21Å; Y190-Y225 HydrophobicContact CE2-CG 4.3Å; Y190-Y225 AromaticContact CG-CD2 3.97Å; Y190-Y225 HydrophobicContact CG-CD2 3.97Å; Y190-Y225 AromaticContact CZ-CD2 3.91Å
191	F	96.2	Very high	86.9	Confident	11 Å²	11	61.5 Å²	61.5	5%	0.048	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	168.1	174.8	69.1	-83.2	0	0	0	110.7	L193 Q196 E223 Y224 E228 L231	F191-L193 HydrophobicContact CE2-CB 4.36Å; F191-L193 HydrophobicContact CE2-CD1 4.18Å; F191-L193 HydrophobicContact CZ-CD1 4.45Å; F191-L193 PolarHBondContact O-N 3.26Å; F191-Q196 HydrophobicContact CD2-CB 4.43Å; F191-Q196 HydrophobicContact CE2-CB 4.25Å; F191-E223 WeakPolarHBondContact O-CA 3.48Å; F191-Y224 AromaticContact CE1-CD1 3.94Å; F191-Y224 HydrophobicContact CE1-CD1 3.94Å; F191-Y224 HydrophobicContact CZ-CD1 4.01Å; F191-Y224 PolarHBondContact N-O 3.01Å; F191-Y224 PolarHBondContact O-N 3.26Å; F191-E228 HydrophobicContact CB-CG 4.14Å; F191-E228 HydrophobicContact CD1-CB 3.79Å; F191-E228 HydrophobicContact CD1-CG 4.09Å; F191-E228 HydrophobicContact CD2-CB 4.3Å; F191-E228 HydrophobicContact CD2-CG 3.71Å; F191-E228 HydrophobicContact CE1-CB 4.02Å; F191-E228 HydrophobicContact CE1-CG 4.44Å; F191-E228 HydrophobicContact CE2-CG 4.1Å; F191-E228 HydrophobicContact CG-CB 3.94Å; F191-E228 HydrophobicContact CG-CG 3.71Å; F191-E228 HydrophobicContact CZ-CB 4.38Å; F191-E228 HydrophobicContact CZ-CG 4.45Å; F191-L231 HydrophobicContact CE1-CD1 4.25Å; F191-L231 HydrophobicContact CZ-CB 4.25Å; F191-L231 HydrophobicContact CZ-CD1 3.7Å
192	R	97.5	Very high	88	Confident	73 Å²	73	61.6 Å²	61.6	28%	0.275	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	96.9	-179.6	-74.2	-71.3	-58	-70.2	-6.8	110.3	D194 E195 Q196 W221	R192-D194 VanDerWaalsContact C-N 3.28Å; R192-D194 IonicContact CZ-OD1 3.91Å; R192-D194 IonicContact CZ-OD2 2.54Å; R192-D194 IonicContact NE-OD1 3.89Å; R192-D194 PolarHBondContact NE-OD1 2.95Å; R192-D194 IonicContact NE-OD2 2.9Å; R192-D194 VanDerWaalsContact NH2-CG 3.31Å; R192-D194 IonicContact NH2-OD1 3.3Å; R192-D194 PolarHBondContact NH2-OD1 3.35Å; R192-D194 VanDerWaalsContact NH2-OD1 3.16Å; R192-D194 IonicContact NH2-OD2 3.94Å; R192-D194 PolarHBondContact NH2-OD2 3.44Å; R192-D194 PolarHBondContact O-N 2.84Å; R192-E195 HydrophobicContact CB-CB 3.88Å; R192-E195 HydrophobicContact CB-CG 3.74Å; R192-E195 HydrophobicContact CG-CG 4.37Å; R192-E195 IonicContact CZ-OE1 3.65Å; R192-E195 IonicContact NH1-OE1 3.86Å; R192-E195 IonicContact NH2-OE1 2.67Å; R192-E195 PolarHBondContact NH2-OE1 3.33Å; R192-E195 PolarHBondContact O-N 2.85Å; R192-Q196 PolarHBondContact O-N 3.41Å; R192-W221 VanDerWaalsContact CZ-NE1 3.3Å; R192-W221 VanDerWaalsContact NH2-CD1 3.34Å
193	L	97.7	Very high	89.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-39.1	-179.2	178.9	60.1	0	0	0	112	F191 Q196 I197 T222 Y224 W235 L256 Q263 I265 L332	F191-L193 HydrophobicContact CE2-CB 4.36Å; F191-L193 HydrophobicContact CE2-CD1 4.18Å; F191-L193 HydrophobicContact CZ-CD1 4.45Å; F191-L193 PolarHBondContact O-N 3.26Å; L193-Q196 PolarHBondContact O-N 2.97Å; L193-I197 HydrophobicContact CD1-CD1 4.32Å; L193-I197 HydrophobicContact CG-CD1 4.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.4Å; L193-I197 PolarHBondContact O-N 3.35Å; L193-I197 VanDerWaalsContact O-N 3.13Å; L193-T222 HydrophobicContact CB-CG2 4.19Å; L193-T222 HydrophobicContact CD2-CG2 4.22Å; L193-T222 PolarHBondContact N-O 3.42Å; L193-Y224 HydrophobicContact CD2-CG 4.47Å; L193-W235 HydrophobicContact CD1-CZ2 3.59Å; L193-L256 HydrophobicContact CD2-CD1 4.2Å; L193-Q263 HydrophobicContact CD2-CB 4.17Å; L193-Q263 HydrophobicContact CD2-CG 4.21Å; L193-I265 HydrophobicContact CD2-CD1 4.18Å; L193-L332 HydrophobicContact CD2-CD1 4.34Å
194	D	98.4	Very high	91.3	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-39.6	179.1	66.6	-69.7	0	0	0	112.4	R192 I197 R198 L219 P220 T222 L256	R192-D194 VanDerWaalsContact C-N 3.28Å; R192-D194 IonicContact CZ-OD1 3.91Å; R192-D194 IonicContact CZ-OD2 2.54Å; R192-D194 IonicContact NE-OD1 3.89Å; R192-D194 PolarHBondContact NE-OD1 2.95Å; R192-D194 IonicContact NE-OD2 2.9Å; R192-D194 VanDerWaalsContact NH2-CG 3.31Å; R192-D194 IonicContact NH2-OD1 3.3Å; R192-D194 PolarHBondContact NH2-OD1 3.35Å; R192-D194 VanDerWaalsContact NH2-OD1 3.16Å; R192-D194 IonicContact NH2-OD2 3.94Å; R192-D194 PolarHBondContact NH2-OD2 3.44Å; R192-D194 PolarHBondContact O-N 2.84Å; D194-I197 PolarHBondContact O-N 3.45Å; D194-R198 WeakPolarHBondContact O-CG 3.37Å; D194-R198 PolarHBondContact O-N 3.43Å; D194-R198 IonicContact OD2-CZ 2.63Å; D194-R198 IonicContact OD2-NH1 3.87Å; D194-R198 PolarHBondContact OD2-NH1 2.99Å; D194-R198 IonicContact OD2-NH2 2.95Å; D194-L219 HydrophobicContact CB-CB 4.28Å; D194-P220 WeakPolarHBondContact CB-O 3.36Å; D194-T222 PolarHBondContact OD1-N 3.11Å; D194-L256 HydrophobicContact CB-CD2 3.69Å
195	E	98.4	Very high	93.3	Very high	72 Å²	72	55.1 Å²	55.1	34%	0.336	27%	0.273	S	S	.	.	H	α-helix	trans	-68.3	-40.7	174.4	-60.2	-57.1	164.3	0	0	111.5	R192 I197 R198 E199	R192-E195 HydrophobicContact CB-CB 3.88Å; R192-E195 HydrophobicContact CB-CG 3.74Å; R192-E195 HydrophobicContact CG-CG 4.37Å; R192-E195 IonicContact CZ-OE1 3.65Å; R192-E195 IonicContact NH1-OE1 3.86Å; R192-E195 IonicContact NH2-OE1 2.67Å; R192-E195 PolarHBondContact NH2-OE1 3.33Å; R192-E195 PolarHBondContact O-N 2.85Å; E195-I197 VanDerWaalsContact C-N 3.27Å; E195-I197 PolarHBondContact O-N 3.14Å; E195-R198 CarbonylContact O-C 3.6Å; E195-R198 WeakPolarHBondContact O-CA 3.22Å; E195-R198 WeakPolarHBondContact O-CB 3.35Å; E195-R198 PolarHBondContact O-N 2.91Å; E195-R198 IonicContact OE1-NH1 3.61Å; E195-R198 PolarHBondContact OE1-NH1 3.44Å; E195-R198 VanDerWaalsContact OE1-NH1 3.08Å; E195-R198 IonicContact OE2-CZ 3.16Å; E195-R198 IonicContact OE2-NH1 3.57Å; E195-R198 PolarHBondContact OE2-NH1 3.11Å; E195-E199 WeakPolarHBondContact O-CG 3.32Å; E195-E199 PolarHBondContact O-N 2.91Å
196	Q	98.3	Very high	95.1	Very high	3 Å²	3	55.7 Å²	55.7	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-42.1	177	-172	-177.8	69.9	0	0	112.1	F191 R192 L193 E199 V200 E228 Y232	F191-Q196 HydrophobicContact CD2-CB 4.43Å; F191-Q196 HydrophobicContact CE2-CB 4.25Å; R192-Q196 PolarHBondContact O-N 3.41Å; L193-Q196 PolarHBondContact O-N 2.97Å; Q196-E199 PolarHBondContact O-N 3.26Å; Q196-V200 PolarHBondContact O-N 3.06Å; Q196-V200 VanDerWaalsContact O-N 3.15Å; Q196-E228 PolarHBondContact NE2-O 2.9Å; Q196-Y232 HydrophobicContact CG-CD2 3.83Å
197	I	98.6	Very high	96.1	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-40.4	176.2	-66.1	167.2	0	0	0	110.5	L193 D194 E195 V200 I201 L219 W235 V254 I265	L193-I197 HydrophobicContact CD1-CD1 4.32Å; L193-I197 HydrophobicContact CG-CD1 4.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.4Å; L193-I197 PolarHBondContact O-N 3.35Å; L193-I197 VanDerWaalsContact O-N 3.13Å; D194-I197 PolarHBondContact O-N 3.45Å; E195-I197 VanDerWaalsContact C-N 3.27Å; E195-I197 PolarHBondContact O-N 3.14Å; I197-V200 PolarHBondContact O-N 2.97Å; I197-I201 HydrophobicContact CG2-CD1 3.89Å; I197-I201 WeakPolarHBondContact O-CD1 3.45Å; I197-I201 VanDerWaalsContact O-CG1 3.29Å; I197-I201 WeakPolarHBondContact O-CG1 3.47Å; I197-I201 PolarHBondContact O-N 3.2Å; I197-L219 HydrophobicContact CB-CD1 4.3Å; I197-L219 HydrophobicContact CB-CD2 4.49Å; I197-L219 HydrophobicContact CD1-CD2 4.32Å; I197-L219 HydrophobicContact CG2-CD1 3.86Å; I197-L219 HydrophobicContact CG2-CD2 4.07Å; I197-W235 HydrophobicContact CD1-CD2 4.49Å; I197-W235 HydrophobicContact CG1-CD2 4.04Å; I197-W235 HydrophobicContact CG1-CG 3.91Å; I197-V254 HydrophobicContact CG2-CG1 3.9Å; I197-I265 HydrophobicContact CD1-CG1 4.35Å; I197-I265 HydrophobicContact CD1-CG2 4.11Å
198	R	98.4	Very high	96.7	Very high	76 Å²	76	54.6 Å²	54.6	29%	0.287	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-42.1	174.4	-69.8	-173.8	-168	92.1	7.5	112.2	D194 E195 V200 I201 L202 L219	D194-R198 WeakPolarHBondContact O-CG 3.37Å; D194-R198 PolarHBondContact O-N 3.43Å; D194-R198 IonicContact OD2-CZ 2.63Å; D194-R198 IonicContact OD2-NH1 3.87Å; D194-R198 PolarHBondContact OD2-NH1 2.99Å; D194-R198 IonicContact OD2-NH2 2.95Å; E195-R198 CarbonylContact O-C 3.6Å; E195-R198 WeakPolarHBondContact O-CA 3.22Å; E195-R198 WeakPolarHBondContact O-CB 3.35Å; E195-R198 PolarHBondContact O-N 2.91Å; E195-R198 IonicContact OE1-NH1 3.61Å; E195-R198 PolarHBondContact OE1-NH1 3.44Å; E195-R198 VanDerWaalsContact OE1-NH1 3.08Å; E195-R198 IonicContact OE2-CZ 3.16Å; E195-R198 IonicContact OE2-NH1 3.57Å; E195-R198 PolarHBondContact OE2-NH1 3.11Å; R198-V200 VanDerWaalsContact C-N 3.32Å; R198-V200 PolarHBondContact O-N 3.45Å; R198-I201 PolarHBondContact O-N 2.99Å; R198-L202 WeakPolarHBondContact O-CG 3.39Å; R198-L202 PolarHBondContact O-N 2.95Å; R198-L219 HydrophobicContact CG-CD1 3.76Å; R198-L219 PolarHBondContact NH2-O 3.46Å
199	E	98.3	Very high	97	Very high	104 Å²	104	57.2 Å²	57.2	49%	0.486	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-44.2	177.3	-73.6	178.7	-179.7	0	0	111.5	E195 Q196 L202 F203 Y232	E195-E199 WeakPolarHBondContact O-CG 3.32Å; E195-E199 PolarHBondContact O-N 2.91Å; Q196-E199 PolarHBondContact O-N 3.26Å; E199-L202 PolarHBondContact O-N 3.41Å; E199-F203 WeakPolarHBondContact O-CB 3.28Å; E199-F203 PolarHBondContact O-N 3.12Å; E199-Y232 HydrophobicContact CB-CE2 4.37Å
200	V	98.3	Very high	97.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-42.2	175.6	169.5	0	0	0	0	111.9	Q196 I197 R198 L202 F203 L204 Y232 W235 L236 M239	Q196-V200 PolarHBondContact O-N 3.06Å; Q196-V200 VanDerWaalsContact O-N 3.15Å; I197-V200 PolarHBondContact O-N 2.97Å; R198-V200 VanDerWaalsContact C-N 3.32Å; R198-V200 PolarHBondContact O-N 3.45Å; V200-L202 VanDerWaalsContact C-N 3.33Å; V200-L202 PolarHBondContact O-N 3.32Å; V200-F203 PolarHBondContact O-N 2.81Å; V200-L204 HydrophobicContact CG1-CD1 3.97Å; V200-L204 WeakPolarHBondContact O-CG 3.47Å; V200-L204 PolarHBondContact O-N 3.36Å; V200-Y232 HydrophobicContact CG2-CD1 4.28Å; V200-Y232 HydrophobicContact CG2-CD2 3.7Å; V200-Y232 HydrophobicContact CG2-CE1 4.01Å; V200-Y232 HydrophobicContact CG2-CE2 3.39Å; V200-Y232 HydrophobicContact CG2-CG 4.13Å; V200-W235 HydrophobicContact CB-CB 4.31Å; V200-W235 HydrophobicContact CG1-CB 4.22Å; V200-W235 HydrophobicContact CG2-CB 4.04Å; V200-L236 HydrophobicContact CG1-CB 4.38Å; V200-L236 HydrophobicContact CG1-CD1 4.25Å; V200-M239 HydrophobicContact CG1-CB 4.1Å; V200-M239 HydrophobicContact CG1-CG 4.13Å
201	I	98.1	Very high	97	Very high	7 Å²	7	57 Å²	57	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-43.8	177.3	-70.3	163	0	0	0	110.8	I197 R198 L204 Q205 W208 L215 L217 L219 M239 V254	I197-I201 HydrophobicContact CG2-CD1 3.89Å; I197-I201 WeakPolarHBondContact O-CD1 3.45Å; I197-I201 VanDerWaalsContact O-CG1 3.29Å; I197-I201 WeakPolarHBondContact O-CG1 3.47Å; I197-I201 PolarHBondContact O-N 3.2Å; R198-I201 PolarHBondContact O-N 2.99Å; I201-L204 PolarHBondContact O-N 3.45Å; I201-Q205 PolarHBondContact O-N 3.44Å; I201-W208 PolarHBondContact O-NE1 2.9Å; I201-L215 HydrophobicContact CG2-CD1 3.47Å; I201-L215 VanDerWaalsContact CG2-CD1 3.47Å; I201-L217 HydrophobicContact CD1-CD1 4.05Å; I201-L217 HydrophobicContact CD1-CD2 3.66Å; I201-L219 HydrophobicContact CD1-CD1 4.26Å; I201-M239 HydrophobicContact CG1-CE 4.02Å; I201-V254 HydrophobicContact CD1-CG2 4.37Å
202	L	97.3	Very high	97	Very high	108 Å²	108	61.3 Å²	61.3	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-66.9	-42.4	176.6	-71.4	171.8	0	0	0	111.7	R198 E199 V200 L204 Q205	R198-L202 WeakPolarHBondContact O-CG 3.39Å; R198-L202 PolarHBondContact O-N 2.95Å; E199-L202 PolarHBondContact O-N 3.41Å; V200-L202 VanDerWaalsContact C-N 3.33Å; V200-L202 PolarHBondContact O-N 3.32Å; L202-L204 PolarHBondContact O-N 2.85Å; L202-Q205 WeakPolarHBondContact O-CB 3.39Å; L202-Q205 PolarHBondContact O-N 2.9Å
203	F	97.3	Very high	97	Very high	135 Å²	135	58.3 Å²	58.3	59%	0.592	28%	0.28	S	S	*	.	H	α-helix	trans	-59.1	-36.8	176.6	177.5	-101.7	0	0	0	112.2	E199 V200 Q205 L236	E199-F203 WeakPolarHBondContact O-CB 3.28Å; E199-F203 PolarHBondContact O-N 3.12Å; V200-F203 PolarHBondContact O-N 2.81Å; F203-Q205 VanDerWaalsContact C-N 3.32Å; F203-L236 HydrophobicContact CD1-CD1 3.73Å; F203-L236 HydrophobicContact CE1-CD1 3.9Å
204	L	97	Very high	96.9	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	4.5	178.3	-63.7	172.6	0	0	0	113.9	V200 I201 L202 P206 K207 W208 L236 M239 D240 I243	V200-L204 HydrophobicContact CG1-CD1 3.97Å; V200-L204 WeakPolarHBondContact O-CG 3.47Å; V200-L204 PolarHBondContact O-N 3.36Å; I201-L204 PolarHBondContact O-N 3.45Å; L202-L204 PolarHBondContact O-N 2.85Å; L204-P206 VanDerWaalsContact C-CD 3.5Å; L204-K207 HydrophobicContact CD2-CD 4.09Å; L204-K207 WeakPolarHBondContact O-CB 3.38Å; L204-K207 PolarHBondContact O-N 2.63Å; L204-W208 PolarHBondContact O-N 2.9Å; L204-L236 HydrophobicContact CD1-CD1 4.16Å; L204-L236 HydrophobicContact CD2-CD1 3.97Å; L204-L236 HydrophobicContact CG-CD1 4.14Å; L204-M239 HydrophobicContact CD1-CB 3.53Å; L204-D240 HydrophobicContact CD1-CB 4.4Å; L204-I243 HydrophobicContact CB-CD1 3.69Å; L204-I243 HydrophobicContact CD1-CD1 3.96Å; L204-I243 HydrophobicContact CG-CD1 4.39Å
205	Q	97.2	Very high	96.8	Very high	69 Å²	69	64 Å²	64	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-46.6	-50.3	-179.4	177.9	173.2	1.1	0	0	115.2	I201 L202 F203 K207 W208 E209	I201-Q205 PolarHBondContact O-N 3.44Å; L202-Q205 WeakPolarHBondContact O-CB 3.39Å; L202-Q205 PolarHBondContact O-N 2.9Å; F203-Q205 VanDerWaalsContact C-N 3.32Å; Q205-K207 PolarHBondContact O-N 3.36Å; Q205-W208 VanDerWaalsContact CA-CE2 3.43Å; Q205-W208 HydrophobicContact CB-CH2 4.49Å; Q205-W208 HydrophobicContact CB-CZ2 3.68Å; Q205-W208 HydrophobicContact CG-CH2 3.82Å; Q205-W208 HydrophobicContact CG-CZ2 3.49Å; Q205-W208 VanDerWaalsContact CG-CZ2 3.49Å; Q205-W208 PolarHBondContact O-N 3.11Å; Q205-E209 HydrophobicContact CG-CG 3.96Å; Q205-E209 PolarHBondContact NE2-OE1 3.39Å; Q205-E209 WeakPolarHBondContact O-CB 3.27Å; Q205-E209 WeakPolarHBondContact O-CG 3.25Å; Q205-E209 PolarHBondContact O-N 2.97Å
206	P	96.3	Very high	96.8	Very high	90 Å²	90	63.8 Å²	63.8	58%	0.584	32%	0.317	S	S	*	.	H	α-helix	trans	-57.7	-30.7	-179.4	-25.7	35.7	0	0	0	113.5	L204 Q210	L204-P206 VanDerWaalsContact C-CD 3.5Å; P206-Q210 WeakPolarHBondContact O-CB 3.38Å; P206-Q210 PolarHBondContact O-N 2.94Å
207	K	93.9	Very high	96.8	Very high	96 Å²	96	67.1 Å²	67.1	42%	0.417	34%	0.335	S	S	.	.	H	α-helix	trans	-77.3	-43.9	-177.7	-60.8	-170.4	-175.2	-178.1	0	112.3	L204 Q205 D240 I243	L204-K207 HydrophobicContact CD2-CD 4.09Å; L204-K207 WeakPolarHBondContact O-CB 3.38Å; L204-K207 PolarHBondContact O-N 2.63Å; Q205-K207 PolarHBondContact O-N 3.36Å; K207-D240 IonicContact NZ-OD1 3.38Å; K207-D240 PolarHBondContact NZ-OD1 3.17Å; K207-I243 HydrophobicContact CB-CG2 3.95Å
208	W	96	Very high	96.7	Very high	36 Å²	36	71.3 Å²	71.3	14%	0.136	36%	0.357	C	S	.	.	H	α-helix	trans	-80.4	-28.7	-177.6	59.2	-110.2	0	0	0	112.9	I201 L204 Q205 L211 N212 L213 L215 I243	I201-W208 PolarHBondContact O-NE1 2.9Å; L204-W208 PolarHBondContact O-N 2.9Å; Q205-W208 VanDerWaalsContact CA-CE2 3.43Å; Q205-W208 HydrophobicContact CB-CH2 4.49Å; Q205-W208 HydrophobicContact CB-CZ2 3.68Å; Q205-W208 HydrophobicContact CG-CH2 3.82Å; Q205-W208 HydrophobicContact CG-CZ2 3.49Å; Q205-W208 VanDerWaalsContact CG-CZ2 3.49Å; Q205-W208 PolarHBondContact O-N 3.11Å; W208-L211 CarbonylContact O-C 3.57Å; W208-L211 PolarHBondContact O-N 3.49Å; W208-N212 PolarHBondContact O-N 3.36Å; W208-N212 VanDerWaalsContact O-N 3.17Å; W208-L213 HydrophobicContact CB-CB 4.2Å; W208-L213 HydrophobicContact CB-CD1 3.89Å; W208-L213 HydrophobicContact CB-CG 4.29Å; W208-L213 PolarHBondContact O-N 3.49Å; W208-L215 HydrophobicContact CD2-CD1 4.01Å; W208-L215 HydrophobicContact CE3-CD1 4.42Å; W208-L215 HydrophobicContact CH2-CD1 4.39Å; W208-L215 HydrophobicContact CZ2-CD1 3.89Å; W208-I243 HydrophobicContact CB-CD1 3.97Å; W208-I243 HydrophobicContact CB-CG1 3.96Å; W208-I243 HydrophobicContact CB-CG2 4.08Å; W208-I243 HydrophobicContact CG-CD1 4.29Å
209	E	95.7	Very high	96.7	Very high	102 Å²	102	68.2 Å²	68.2	48%	0.477	35%	0.346	S	S	.	.	H	α-helix	trans	-66.7	-38.9	170.9	-73.7	-173.5	161.6	0	0	112.2	Q205 L211 N212	Q205-E209 HydrophobicContact CG-CG 3.96Å; Q205-E209 PolarHBondContact NE2-OE1 3.39Å; Q205-E209 WeakPolarHBondContact O-CB 3.27Å; Q205-E209 WeakPolarHBondContact O-CG 3.25Å; Q205-E209 PolarHBondContact O-N 2.97Å; E209-L211 PolarHBondContact O-N 3.39Å; E209-L211 VanDerWaalsContact O-N 3.17Å; E209-N212 WeakPolarHBondContact O-CA 3.28Å; E209-N212 PolarHBondContact O-N 2.99Å
210	Q	95.2	Very high	96.7	Very high	157 Å²	157	65.6 Å²	65.6	73%	0.734	34%	0.338	S	S	*	.	H	α-helix	trans	-57.4	-32.2	175.5	-175.8	-178.6	9	0	0	112.2	P206	P206-Q210 WeakPolarHBondContact O-CB 3.38Å; P206-Q210 PolarHBondContact O-N 2.94Å
211	L	93.8	Very high	96.7	Very high	52 Å²	52	72.7 Å²	72.7	27%	0.272	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.8	176.8	-65.8	178.9	0	0	0	113.4	W208 E209 L213 I243 K248 N249	W208-L211 CarbonylContact O-C 3.57Å; W208-L211 PolarHBondContact O-N 3.49Å; E209-L211 PolarHBondContact O-N 3.39Å; E209-L211 VanDerWaalsContact O-N 3.17Å; L211-L213 HydrophobicContact CB-CD1 4.25Å; L211-L213 HydrophobicContact CB-CD2 3.92Å; L211-L213 HydrophobicContact CB-CG 3.75Å; L211-L213 HydrophobicContact CD1-CD1 4.37Å; L211-L213 PolarHBondContact O-N 3.23Å; L211-I243 HydrophobicContact CD1-CG2 4.04Å; L211-I243 VanDerWaalsContact CD1-O 3.32Å; L211-I243 WeakPolarHBondContact CD1-O 3.15Å; L211-K248 WeakPolarHBondContact O-CA 3.21Å; L211-K248 WeakPolarHBondContact O-CG 3.42Å; L211-N249 PolarHBondContact O-N 3.33Å
212	N	95.8	Very high	96.6	Very high	101 Å²	101	72.5 Å²	72.5	54%	0.54	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	43.5	-175.8	-167.2	45.4	0	0	0	112.3	W208 E209 N249	W208-N212 PolarHBondContact O-N 3.36Å; W208-N212 VanDerWaalsContact O-N 3.17Å; E209-N212 WeakPolarHBondContact O-CA 3.28Å; E209-N212 PolarHBondContact O-N 2.99Å; N212-N249 WeakPolarHBondContact CB-OD1 3.46Å; N212-N249 PolarHBondContact ND2-OD1 3.47Å; N212-N249 WeakPolarHBondContact O-CA 3.48Å
213	L	96.5	Very high	96.5	Very high	10 Å²	10	71.9 Å²	71.9	5%	0.052	36%	0.359	C	S	.	.			trans	-77.4	144	179	-54.9	-177.5	0	0	0	110.5	W208 L211 I243 R247 S250 I252	W208-L213 HydrophobicContact CB-CB 4.2Å; W208-L213 HydrophobicContact CB-CD1 3.89Å; W208-L213 HydrophobicContact CB-CG 4.29Å; W208-L213 PolarHBondContact O-N 3.49Å; L211-L213 HydrophobicContact CB-CD1 4.25Å; L211-L213 HydrophobicContact CB-CD2 3.92Å; L211-L213 HydrophobicContact CB-CG 3.75Å; L211-L213 HydrophobicContact CD1-CD1 4.37Å; L211-L213 PolarHBondContact O-N 3.23Å; L213-I243 HydrophobicContact CD1-CB 4.42Å; L213-I243 HydrophobicContact CD1-CG1 4.4Å; L213-I243 HydrophobicContact CD1-CG2 4.12Å; L213-R247 WeakPolarHBondContact CD2-O 3.38Å; L213-S250 WeakPolarHBondContact CA-O 3.45Å; L213-I252 HydrophobicContact CD1-CD1 3.63Å; L213-I252 HydrophobicContact CD1-CG1 4.32Å
214	S	95.9	Very high	96.4	Very high	74 Å²	74	65.7 Å²	65.7	52%	0.517	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	149.1	165.9	-60.4	0	0	0	0	109.9	S250 N251 I252	S214-S250 PolarHBondContact N-O 3.4Å; S214-N251 WeakPolarHBondContact O-CA 3.33Å; S214-N251 PolarHBondContact O-OD1 3.06Å; S214-I252 PolarHBondContact O-N 2.95Å
215	L	96.8	Very high	96.3	Very high	47 Å²	47	68.7 Å²	68.7	25%	0.246	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.8	177	-64.3	-178.8	0	0	0	109.8	I201 W208 L217 I252	I201-L215 HydrophobicContact CG2-CD1 3.47Å; I201-L215 VanDerWaalsContact CG2-CD1 3.47Å; W208-L215 HydrophobicContact CD2-CD1 4.01Å; W208-L215 HydrophobicContact CE3-CD1 4.42Å; W208-L215 HydrophobicContact CH2-CD1 4.39Å; W208-L215 HydrophobicContact CZ2-CD1 3.89Å; L215-L217 HydrophobicContact CB-CD2 4.24Å; L215-L217 HydrophobicContact CB-CG 4.3Å; L215-I252 WeakPolarHBondContact CA-O 3.13Å; L215-I252 HydrophobicContact CD2-CB 3.81Å; L215-I252 HydrophobicContact CD2-CG2 4.37Å
216	D	97.4	Very high	96.1	Very high	67 Å²	67	65.4 Å²	65.4	36%	0.358	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113	170	-177.2	14.9	0	0	0	108.9	I252 R253 V254 Y255	D216-I252 PolarHBondContact N-O 2.99Å; D216-R253 HydrophobicContact CB-CB 4.32Å; D216-R253 HydrophobicContact CB-CG 3.93Å; D216-R253 CarbonylContact O-C 3.58Å; D216-R253 WeakPolarHBondContact O-CA 3.35Å; D216-V254 PolarHBondContact O-N 3.41Å; D216-Y255 PolarHBondContact OD2-OH 2.94Å
217	L	98.1	Very high	95.9	Very high	73 Å²	73	61.7 Å²	61.7	38%	0.382	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122	-170.5	-52.3	-178.7	0	0	0	110.3	I201 L215 V254	I201-L217 HydrophobicContact CD1-CD1 4.05Å; I201-L217 HydrophobicContact CD1-CD2 3.66Å; L215-L217 HydrophobicContact CB-CD2 4.24Å; L215-L217 HydrophobicContact CB-CG 4.3Å; L217-V254 WeakPolarHBondContact CA-O 3.46Å; L217-V254 HydrophobicContact CD2-CB 3.73Å; L217-V254 HydrophobicContact CD2-CG2 3.84Å
218	D	98.3	Very high	95.9	Very high	90 Å²	90	60.2 Å²	60.2	48%	0.481	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	92.9	166.3	-173.1	9	0	0	0	108	P220 V254 Y255 L256	D218-P220 WeakPolarHBondContact O-CD 3.48Å; D218-V254 PolarHBondContact N-O 2.9Å; D218-Y255 HydrophobicContact CB-CD1 3.52Å; D218-Y255 HydrophobicContact CB-CE1 4Å; D218-Y255 CarbonylContact O-C 3.55Å; D218-Y255 WeakPolarHBondContact O-CA 3.47Å; D218-L256 PolarHBondContact O-N 3.27Å
219	L	98	Very high	95.7	Very high	11 Å²	11	64.6 Å²	64.6	6%	0.058	32%	0.319	C	S	.	.			trans	-121.8	75.1	-173.7	-65.2	176.8	0	0	0	109	D194 I197 R198 I201 V254 L256	D194-L219 HydrophobicContact CB-CB 4.28Å; I197-L219 HydrophobicContact CB-CD1 4.3Å; I197-L219 HydrophobicContact CB-CD2 4.49Å; I197-L219 HydrophobicContact CD1-CD2 4.32Å; I197-L219 HydrophobicContact CG2-CD1 3.86Å; I197-L219 HydrophobicContact CG2-CD2 4.07Å; R198-L219 HydrophobicContact CG-CD1 3.76Å; R198-L219 PolarHBondContact NH2-O 3.46Å; I201-L219 HydrophobicContact CD1-CD1 4.26Å; L219-V254 HydrophobicContact CD2-CG1 4Å; L219-L256 HydrophobicContact CD2-CB 3.6Å; L219-L256 HydrophobicContact CD2-CD2 4.35Å
220	P	97.6	Very high	95.5	Very high	49 Å²	49	60.2 Å²	60.2	32%	0.318	30%	0.299	S	S	.	.			trans	-62.4	156.3	178.4	28.7	-35.8	0	0	0	110.9	D194 D218 T222 L256	D194-P220 WeakPolarHBondContact CB-O 3.36Å; D218-P220 WeakPolarHBondContact O-CD 3.48Å; P220-T222 PolarHBondContact O-N 2.93Å; P220-T222 VanDerWaalsContact O-N 3.15Å; P220-T222 PolarHBondContact O-OG1 3.15Å; P220-L256 WeakPolarHBondContact CD-O 3.42Å; P220-L256 VanDerWaalsContact CG-O 3.24Å; P220-L256 WeakPolarHBondContact CG-O 3.49Å
221	W	97.6	Very high	95.5	Very high	150 Å²	150	52.7 Å²	52.7	57%	0.568	26%	0.264	S	S	*	.			trans	-49.5	123.4	175.1	-176.2	99.2	0	0	0	110.4	R192 E223 N258	R192-W221 VanDerWaalsContact CZ-NE1 3.3Å; R192-W221 VanDerWaalsContact NH2-CD1 3.34Å; W221-E223 HydrophobicContact CH2-CB 3.4Å; W221-E223 HydrophobicContact CH2-CG 4.46Å; W221-E223 HydrophobicContact CZ2-CB 3.88Å; W221-E223 HydrophobicContact CZ3-CB 3.94Å; W221-N258 PolarHBondContact O-ND2 3.08Å
222	T	97	Very high	95.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.012	26%	0.262	C	S	.	.			trans	-146.4	107.8	-175	-53.9	0	0	0	0	110.2	L193 D194 P220 L256 N258 Q263	L193-T222 HydrophobicContact CB-CG2 4.19Å; L193-T222 HydrophobicContact CD2-CG2 4.22Å; L193-T222 PolarHBondContact N-O 3.42Å; D194-T222 PolarHBondContact OD1-N 3.11Å; P220-T222 PolarHBondContact O-N 2.93Å; P220-T222 VanDerWaalsContact O-N 3.15Å; P220-T222 PolarHBondContact O-OG1 3.15Å; T222-L256 HydrophobicContact CG2-CD1 4.33Å; T222-L256 HydrophobicContact CG2-CD2 4.21Å; T222-L256 VanDerWaalsContact OG1-CD2 3.25Å; T222-L256 WeakPolarHBondContact OG1-CD2 3.37Å; T222-N258 WeakPolarHBondContact CG2-OD1 3.41Å; T222-N258 PolarHBondContact OG1-ND2 3Å; T222-N258 PolarHBondContact OG1-OD1 2.96Å; T222-Q263 HydrophobicContact CG2-CG 3.57Å
223	E	95.5	Very high	95.5	Very high	95 Å²	95	49.4 Å²	49.4	44%	0.444	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.6	167.9	-172.6	174.4	89.2	0	0	109.7	Y190 F191 W221	Y190-E223 HydrophobicContact CD1-CG 3.89Å; Y190-E223 HydrophobicContact CG-CG 4.46Å; F191-E223 WeakPolarHBondContact O-CA 3.48Å; W221-E223 HydrophobicContact CH2-CB 3.4Å; W221-E223 HydrophobicContact CH2-CG 4.46Å; W221-E223 HydrophobicContact CZ2-CB 3.88Å; W221-E223 HydrophobicContact CZ3-CB 3.94Å
224	Y	95.6	Very high	95.5	Very high	5 Å²	5	49 Å²	49	2%	0.02	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	143.3	-177.1	-176.4	-104	0	0	0	110.8	Y190 F191 L193 L231 Q263 H312 L332 L336	Y190-Y224 WeakPolarHBondContact CA-O 3.34Å; F191-Y224 AromaticContact CE1-CD1 3.94Å; F191-Y224 HydrophobicContact CE1-CD1 3.94Å; F191-Y224 HydrophobicContact CZ-CD1 4.01Å; F191-Y224 PolarHBondContact N-O 3.01Å; F191-Y224 PolarHBondContact O-N 3.26Å; L193-Y224 HydrophobicContact CD2-CG 4.47Å; Y224-L231 HydrophobicContact CD1-CD1 3.71Å; Y224-L231 HydrophobicContact CE1-CD1 3.46Å; Y224-L231 VanDerWaalsContact CE1-CD1 3.46Å; Y224-Q263 HydrophobicContact CD2-CG 4.35Å; Y224-Q263 VanDerWaalsContact CE2-OE1 3.25Å; Y224-H312 AromaticContact CE1-CD2 3.94Å; Y224-L332 HydrophobicContact CE1-CD1 4.15Å; Y224-L332 HydrophobicContact CE2-CB 3.72Å; Y224-L332 HydrophobicContact CE2-CD1 4.32Å; Y224-L336 HydrophobicContact CE1-CD1 4.47Å; Y224-L336 WeakPolarHBondContact OH-CD1 3.16Å
225	Y	93.8	Very high	95.6	Very high	66 Å²	66	45.5 Å²	45.5	26%	0.259	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.2	175.2	-173.2	-108.6	0	0	0	110.1	F188 Q189 Y190 L336	F188-Y225 HydrophobicContact CB-CD1 4.5Å; F188-Y225 HydrophobicContact CB-CE1 3.8Å; F188-Y225 HydrophobicContact CB-CE2 4.23Å; F188-Y225 HydrophobicContact CD1-CE1 4.38Å; F188-Y225 WeakPolarHBondContact O-CE2 2.99Å; F188-Y225 VanDerWaalsContact O-CZ 3.31Å; F188-Y225 PolarHBondContact O-OH 2.83Å; Q189-Y225 WeakPolarHBondContact O-CA 2.97Å; Y190-Y225 HydrophobicContact CD1-CD2 4.22Å; Y190-Y225 AromaticContact CD2-CD2 3.65Å; Y190-Y225 HydrophobicContact CD2-CD2 3.65Å; Y190-Y225 HydrophobicContact CD2-CE2 4.27Å; Y190-Y225 HydrophobicContact CE1-CD2 4.23Å; Y190-Y225 HydrophobicContact CE1-CG 4.3Å; Y190-Y225 AromaticContact CE2-CD2 3.6Å; Y190-Y225 HydrophobicContact CE2-CD2 3.6Å; Y190-Y225 HydrophobicContact CE2-CE2 4.21Å; Y190-Y225 HydrophobicContact CE2-CG 4.3Å; Y190-Y225 AromaticContact CG-CD2 3.97Å; Y190-Y225 HydrophobicContact CG-CD2 3.97Å; Y190-Y225 AromaticContact CZ-CD2 3.91Å; Y225-L336 HydrophobicContact CD1-CB 4.35Å; Y225-L336 WeakPolarHBondContact O-CD1 3.21Å
226	G	93.5	Very high	95.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-178.8	-172.8	0	0	0	0	0	113.2	F188 Q189 E228	F188-G226 WeakPolarHBondContact CA-O 3.42Å; F188-G226 VanDerWaalsContact CD1-CA 3.5Å; Q189-G226 PolarHBondContact N-O 3.45Å; Q189-G226 PolarHBondContact O-N 2.87Å; G226-E228 PolarHBondContact O-N 2.87Å
227	N	92.1	Very high	95.4	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.064	20%	0.2	C	C	.	.			trans	-83.2	104.4	166.9	-172.6	-81.7	0	0	0	109.6	D187 F188 E229 F230 L231 H312	D187-N227 PolarHBondContact O-ND2 3.06Å; F188-N227 HydrophobicContact CD2-CB 4.47Å; F188-N227 HydrophobicContact CE2-CB 4.3Å; N227-E229 PolarHBondContact O-N 3.23Å; N227-F230 HydrophobicContact CB-CB 4.26Å; N227-F230 HydrophobicContact CB-CD2 4.4Å; N227-F230 PolarHBondContact O-N 3.33Å; N227-F230 VanDerWaalsContact OD1-CB 3.24Å; N227-F230 WeakPolarHBondContact OD1-CB 3.39Å; N227-F230 VanDerWaalsContact OD1-CG 3.22Å; N227-F230 WeakPolarHBondContact OD1-CG 3.46Å; N227-F230 PolarHBondContact OD1-N 3.32Å; N227-L231 PolarHBondContact O-N 3.09Å; N227-H312 PolarHBondContact N-NE2 3.36Å
228	E	93.5	Very high	95.3	Very high	65 Å²	65	39.3 Å²	39.3	30%	0.304	18%	0.182	S	C	.	.	H	α-helix	trans	-59.9	-47.5	-175.4	-172.8	174.2	-170.3	0	0	112.1	Q189 F191 Q196 G226 F230 L231 Y232	Q189-E228 PolarHBondContact NE2-OE2 2.94Å; F191-E228 HydrophobicContact CB-CG 4.14Å; F191-E228 HydrophobicContact CD1-CB 3.79Å; F191-E228 HydrophobicContact CD1-CG 4.09Å; F191-E228 HydrophobicContact CD2-CB 4.3Å; F191-E228 HydrophobicContact CD2-CG 3.71Å; F191-E228 HydrophobicContact CE1-CB 4.02Å; F191-E228 HydrophobicContact CE1-CG 4.44Å; F191-E228 HydrophobicContact CE2-CG 4.1Å; F191-E228 HydrophobicContact CG-CB 3.94Å; F191-E228 HydrophobicContact CG-CG 3.71Å; F191-E228 HydrophobicContact CZ-CB 4.38Å; F191-E228 HydrophobicContact CZ-CG 4.45Å; Q196-E228 PolarHBondContact NE2-O 2.9Å; G226-E228 PolarHBondContact O-N 2.87Å; E228-F230 VanDerWaalsContact C-N 3.34Å; E228-F230 PolarHBondContact O-N 3.42Å; E228-L231 PolarHBondContact O-N 2.93Å; E228-Y232 WeakPolarHBondContact O-CB 3.31Å; E228-Y232 PolarHBondContact O-N 2.88Å
229	E	91	Very high	95.3	Very high	128 Å²	128	35 Å²	35	60%	0.598	16%	0.159	S	C	*	.	H	α-helix	trans	-58.6	-44.5	-179.2	-173.4	-167.2	152.8	0	0	112	N227 Y232 Q233	N227-E229 PolarHBondContact O-N 3.23Å; E229-Y232 WeakPolarHBondContact O-CB 3.45Å; E229-Y232 PolarHBondContact O-N 3.42Å; E229-Q233 PolarHBondContact O-N 3.42Å
230	F	91.6	Very high	95.1	Very high	10 Å²	10	36.6 Å²	36.6	4%	0.044	17%	0.168	C	C	.	.	H	α-helix	trans	-71	-41.9	179.9	-74.3	-5.5	0	0	0	111.9	L179 L186 N227 E228 Y232 Q233 V234 I308 L311	L179-F230 HydrophobicContact CD2-CD2 3.69Å; L179-F230 HydrophobicContact CD2-CE2 3.35Å; L179-F230 HydrophobicContact CD2-CZ 4.23Å; L179-F230 HydrophobicContact CG-CE2 3.98Å; L179-F230 HydrophobicContact CG-CZ 4.39Å; L186-F230 HydrophobicContact CD1-CD2 4.38Å; L186-F230 HydrophobicContact CD1-CE2 3.98Å; L186-F230 HydrophobicContact CD2-CD2 3.92Å; L186-F230 HydrophobicContact CD2-CE2 3.16Å; L186-F230 HydrophobicContact CD2-CZ 3.64Å; L186-F230 HydrophobicContact CG-CE2 4.22Å; N227-F230 HydrophobicContact CB-CB 4.26Å; N227-F230 HydrophobicContact CB-CD2 4.4Å; N227-F230 PolarHBondContact O-N 3.33Å; N227-F230 VanDerWaalsContact OD1-CB 3.24Å; N227-F230 WeakPolarHBondContact OD1-CB 3.39Å; N227-F230 VanDerWaalsContact OD1-CG 3.22Å; N227-F230 WeakPolarHBondContact OD1-CG 3.46Å; N227-F230 PolarHBondContact OD1-N 3.32Å; E228-F230 VanDerWaalsContact C-N 3.34Å; E228-F230 PolarHBondContact O-N 3.42Å; F230-Y232 VanDerWaalsContact C-N 3.31Å; F230-Y232 PolarHBondContact O-N 3.01Å; F230-Q233 VanDerWaalsContact O-CB 3.32Å; F230-Q233 WeakPolarHBondContact O-CB 3.35Å; F230-Q233 PolarHBondContact O-N 3.45Å; F230-Q233 VanDerWaalsContact O-N 3.09Å; F230-V234 PolarHBondContact O-N 2.92Å; F230-V234 VanDerWaalsContact O-N 3.16Å; F230-I308 HydrophobicContact CB-CD1 3.97Å; F230-I308 HydrophobicContact CB-CG1 4.05Å; F230-I308 HydrophobicContact CB-CG2 3.67Å; F230-I308 HydrophobicContact CG-CD1 4.38Å; F230-I308 HydrophobicContact CG-CG1 4.36Å; F230-I308 WeakPolarHBondContact O-CD1 3.42Å; F230-L311 HydrophobicContact CD2-CD2 3.96Å; F230-L311 HydrophobicContact CE2-CD2 4.34Å
231	L	95.7	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.9	-35.7	175.9	-73.8	175.8	0	0	0	112.2	F191 Y224 N227 E228 Q233 V234 W235 I308 I309 L332	F191-L231 HydrophobicContact CE1-CD1 4.25Å; F191-L231 HydrophobicContact CZ-CB 4.25Å; F191-L231 HydrophobicContact CZ-CD1 3.7Å; Y224-L231 HydrophobicContact CD1-CD1 3.71Å; Y224-L231 HydrophobicContact CE1-CD1 3.46Å; Y224-L231 VanDerWaalsContact CE1-CD1 3.46Å; N227-L231 PolarHBondContact O-N 3.09Å; E228-L231 PolarHBondContact O-N 2.93Å; L231-Q233 PolarHBondContact O-N 2.85Å; L231-V234 HydrophobicContact CD2-CG2 4.23Å; L231-V234 VanDerWaalsContact O-CB 3.32Å; L231-V234 WeakPolarHBondContact O-CB 3.45Å; L231-V234 PolarHBondContact O-N 3.28Å; L231-W235 HydrophobicContact CB-CZ2 4.35Å; L231-W235 HydrophobicContact CD2-CZ2 4.04Å; L231-W235 PolarHBondContact O-N 3.14Å; L231-W235 VanDerWaalsContact O-N 3.13Å; L231-W235 PolarHBondContact O-NE1 3.12Å; L231-I308 HydrophobicContact CD2-CG2 4.13Å; L231-I309 HydrophobicContact CD2-CD1 3.89Å; L231-L332 HydrophobicContact CD1-CD1 4.14Å; L231-L332 HydrophobicContact CD2-CD1 4.1Å; L231-L332 HydrophobicContact CD2-CD2 4.39Å
232	Y	96.1	Very high	94.8	Very high	60 Å²	60	28.5 Å²	28.5	24%	0.235	13%	0.133	C	C	.	.	H	α-helix	trans	-53.9	-42.8	170.6	-172.4	-85.4	0	0	0	111.6	Q196 E199 V200 E228 E229 F230 V234 W235 L236	Q196-Y232 HydrophobicContact CG-CD2 3.83Å; E199-Y232 HydrophobicContact CB-CE2 4.37Å; V200-Y232 HydrophobicContact CG2-CD1 4.28Å; V200-Y232 HydrophobicContact CG2-CD2 3.7Å; V200-Y232 HydrophobicContact CG2-CE1 4.01Å; V200-Y232 HydrophobicContact CG2-CE2 3.39Å; V200-Y232 HydrophobicContact CG2-CG 4.13Å; E228-Y232 WeakPolarHBondContact O-CB 3.31Å; E228-Y232 PolarHBondContact O-N 2.88Å; E229-Y232 WeakPolarHBondContact O-CB 3.45Å; E229-Y232 PolarHBondContact O-N 3.42Å; F230-Y232 VanDerWaalsContact C-N 3.31Å; F230-Y232 PolarHBondContact O-N 3.01Å; Y232-V234 VanDerWaalsContact C-N 3.35Å; Y232-V234 PolarHBondContact O-N 2.99Å; Y232-W235 PolarHBondContact O-N 3.39Å; Y232-L236 HydrophobicContact CE1-CD2 4.46Å; Y232-L236 WeakPolarHBondContact O-CB 3.44Å; Y232-L236 PolarHBondContact O-N 2.88Å
233	Q	92.9	Very high	94.7	Very high	24 Å²	24	28.6 Å²	28.6	11%	0.112	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-35.7	177.5	-170.3	67.8	46.4	0	0	112.9	E229 F230 L231 L236 N237 L304 I308	E229-Q233 PolarHBondContact O-N 3.42Å; F230-Q233 VanDerWaalsContact O-CB 3.32Å; F230-Q233 WeakPolarHBondContact O-CB 3.35Å; F230-Q233 PolarHBondContact O-N 3.45Å; F230-Q233 VanDerWaalsContact O-N 3.09Å; L231-Q233 PolarHBondContact O-N 2.85Å; Q233-L236 PolarHBondContact O-N 2.78Å; Q233-N237 PolarHBondContact NE2-OD1 3.43Å; Q233-N237 VanDerWaalsContact NE2-OD1 3.1Å; Q233-N237 WeakPolarHBondContact O-CB 3.43Å; Q233-N237 VanDerWaalsContact O-CG 3.23Å; Q233-N237 PolarHBondContact O-N 3.06Å; Q233-N237 PolarHBondContact O-ND2 2.99Å; Q233-L304 HydrophobicContact CG-CD2 3.7Å; Q233-I308 HydrophobicContact CB-CD1 4.2Å; Q233-I308 HydrophobicContact CG-CD1 4.45Å
234	V	97.1	Very high	94.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.9	-53.1	174.1	176.2	0	0	0	0	109.5	F230 L231 Y232 L236 N237 L238 A305 I308 I309	F230-V234 PolarHBondContact O-N 2.92Å; F230-V234 VanDerWaalsContact O-N 3.16Å; L231-V234 HydrophobicContact CD2-CG2 4.23Å; L231-V234 VanDerWaalsContact O-CB 3.32Å; L231-V234 WeakPolarHBondContact O-CB 3.45Å; L231-V234 PolarHBondContact O-N 3.28Å; Y232-V234 VanDerWaalsContact C-N 3.35Å; Y232-V234 PolarHBondContact O-N 2.99Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.12Å; V234-N237 PolarHBondContact O-N 3.18Å; V234-L238 HydrophobicContact CG1-CD1 3.78Å; V234-L238 HydrophobicContact CG1-CG 4.34Å; V234-L238 WeakPolarHBondContact O-CG 3.45Å; V234-L238 PolarHBondContact O-N 3.33Å; V234-A305 HydrophobicContact CG1-CB 4.17Å; V234-A305 HydrophobicContact CG2-CB 4.44Å; V234-I308 HydrophobicContact CG2-CB 3.68Å; V234-I308 HydrophobicContact CG2-CD1 4.16Å; V234-I308 HydrophobicContact CG2-CG2 3.43Å; V234-I308 VanDerWaalsContact CG2-CG2 3.43Å; V234-I309 HydrophobicContact CG1-CD1 4.05Å; V234-I309 HydrophobicContact CG1-CG1 4.11Å; V234-I309 HydrophobicContact CG2-CD1 4.19Å; V234-I309 HydrophobicContact CG2-CG1 4.22Å
235	W	98.3	Very high	94.3	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-41.1	-177.9	-45.9	135.1	0	0	0	111.2	L193 I197 V200 L231 Y232 N237 L238 M239 I265 I309 I330 L332	L193-W235 HydrophobicContact CD1-CZ2 3.59Å; I197-W235 HydrophobicContact CD1-CD2 4.49Å; I197-W235 HydrophobicContact CG1-CD2 4.04Å; I197-W235 HydrophobicContact CG1-CG 3.91Å; V200-W235 HydrophobicContact CB-CB 4.31Å; V200-W235 HydrophobicContact CG1-CB 4.22Å; V200-W235 HydrophobicContact CG2-CB 4.04Å; L231-W235 HydrophobicContact CB-CZ2 4.35Å; L231-W235 HydrophobicContact CD2-CZ2 4.04Å; L231-W235 PolarHBondContact O-N 3.14Å; L231-W235 VanDerWaalsContact O-N 3.13Å; L231-W235 PolarHBondContact O-NE1 3.12Å; Y232-W235 PolarHBondContact O-N 3.39Å; W235-N237 PolarHBondContact O-N 3.43Å; W235-L238 HydrophobicContact CE3-CD1 4.31Å; W235-L238 HydrophobicContact CZ3-CD1 4.37Å; W235-L238 PolarHBondContact O-N 3.34Å; W235-M239 VanDerWaalsContact O-CB 3.26Å; W235-M239 WeakPolarHBondContact O-CB 3.5Å; W235-M239 WeakPolarHBondContact O-CG 3.5Å; W235-M239 PolarHBondContact O-N 2.75Å; W235-I265 HydrophobicContact CH2-CD1 4.02Å; W235-I265 HydrophobicContact CH2-CG1 4.24Å; W235-I265 HydrophobicContact CZ3-CB 4.38Å; W235-I265 HydrophobicContact CZ3-CG2 4.22Å; W235-I309 HydrophobicContact CH2-CD1 4.43Å; W235-I330 HydrophobicContact CH2-CG2 4.14Å; W235-I330 HydrophobicContact CZ3-CB 4.43Å; W235-I330 HydrophobicContact CZ3-CD1 4.25Å; W235-I330 HydrophobicContact CZ3-CG1 4.21Å; W235-I330 HydrophobicContact CZ3-CG2 4.38Å; W235-L332 HydrophobicContact CH2-CD1 4.17Å; W235-L332 HydrophobicContact CZ2-CD1 4.14Å
236	L	95.7	Very high	94.2	Very high	34 Å²	34	26.6 Å²	26.6	18%	0.178	13%	0.125	C	C	.	.	H	α-helix	trans	-58.8	-47.4	176.3	-172.9	68.5	0	0	0	111.3	V200 F203 L204 Y232 Q233 V234 D240	V200-L236 HydrophobicContact CG1-CB 4.38Å; V200-L236 HydrophobicContact CG1-CD1 4.25Å; F203-L236 HydrophobicContact CD1-CD1 3.73Å; F203-L236 HydrophobicContact CE1-CD1 3.9Å; L204-L236 HydrophobicContact CD1-CD1 4.16Å; L204-L236 HydrophobicContact CD2-CD1 3.97Å; L204-L236 HydrophobicContact CG-CD1 4.14Å; Y232-L236 HydrophobicContact CE1-CD2 4.46Å; Y232-L236 WeakPolarHBondContact O-CB 3.44Å; Y232-L236 PolarHBondContact O-N 2.88Å; Q233-L236 PolarHBondContact O-N 2.78Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.12Å; L236-D240 WeakPolarHBondContact O-CB 3.48Å; L236-D240 PolarHBondContact O-N 2.72Å
237	N	93.8	Very high	94.2	Very high	22 Å²	22	32 Å²	32	12%	0.118	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-40.5	179.6	-72.9	-19.4	0	0	0	112.3	Q233 V234 W235 N241 G301	Q233-N237 PolarHBondContact NE2-OD1 3.43Å; Q233-N237 VanDerWaalsContact NE2-OD1 3.1Å; Q233-N237 WeakPolarHBondContact O-CB 3.43Å; Q233-N237 VanDerWaalsContact O-CG 3.23Å; Q233-N237 PolarHBondContact O-N 3.06Å; Q233-N237 PolarHBondContact O-ND2 2.99Å; V234-N237 PolarHBondContact O-N 3.18Å; W235-N237 PolarHBondContact O-N 3.43Å; N237-N241 WeakPolarHBondContact O-CB 3.49Å; N237-N241 VanDerWaalsContact O-CG 3.23Å; N237-N241 PolarHBondContact O-N 2.88Å; N237-N241 PolarHBondContact O-ND2 3.04Å; N237-N241 VanDerWaalsContact O-ND2 3.09Å; N237-G301 WeakPolarHBondContact ND2-CA 3.37Å; N237-G301 PolarHBondContact ND2-O 2.94Å
238	L	97.2	Very high	94.3	Very high	1 Å²	1	38 Å²	38	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-72.5	-45.3	-179.4	-66.9	177.6	0	0	0	112.3	V234 W235 N241 A242 I267 L302 I316 F328 I330	V234-L238 HydrophobicContact CG1-CD1 3.78Å; V234-L238 HydrophobicContact CG1-CG 4.34Å; V234-L238 WeakPolarHBondContact O-CG 3.45Å; V234-L238 PolarHBondContact O-N 3.33Å; W235-L238 HydrophobicContact CE3-CD1 4.31Å; W235-L238 HydrophobicContact CZ3-CD1 4.37Å; W235-L238 PolarHBondContact O-N 3.34Å; L238-N241 PolarHBondContact O-N 3.35Å; L238-A242 WeakPolarHBondContact O-CB 3.31Å; L238-A242 PolarHBondContact O-N 3.46Å; L238-I267 HydrophobicContact CB-CD1 3.61Å; L238-I267 HydrophobicContact CD1-CD1 3.98Å; L238-I267 HydrophobicContact CG-CD1 4.47Å; L238-L302 HydrophobicContact CD2-CD2 3.48Å; L238-L302 VanDerWaalsContact CD2-CD2 3.48Å; L238-I316 HydrophobicContact CD1-CD1 4.18Å; L238-I316 HydrophobicContact CD2-CD1 4.03Å; L238-F328 HydrophobicContact CD2-CB 4.29Å; L238-F328 HydrophobicContact CD2-CD1 3.8Å; L238-F328 HydrophobicContact CD2-CE1 4.25Å; L238-F328 HydrophobicContact CD2-CG 3.97Å; L238-I330 HydrophobicContact CD1-CD1 3.42Å; L238-I330 VanDerWaalsContact CD1-CD1 3.42Å; L238-I330 HydrophobicContact CD1-CG1 4.02Å
239	M	97.5	Very high	94.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-67.5	-41.4	177.9	-72.4	-57.3	-54.8	0	0	111.8	V200 I201 L204 W235 N241 A242 I243 I252 V254 I267	V200-M239 HydrophobicContact CG1-CB 4.1Å; V200-M239 HydrophobicContact CG1-CG 4.13Å; I201-M239 HydrophobicContact CG1-CE 4.02Å; L204-M239 HydrophobicContact CD1-CB 3.53Å; W235-M239 VanDerWaalsContact O-CB 3.26Å; W235-M239 WeakPolarHBondContact O-CB 3.5Å; W235-M239 WeakPolarHBondContact O-CG 3.5Å; W235-M239 PolarHBondContact O-N 2.75Å; M239-N241 VanDerWaalsContact C-N 3.29Å; M239-N241 PolarHBondContact O-N 3.19Å; M239-A242 PolarHBondContact O-N 3.38Å; M239-I243 WeakPolarHBondContact O-CD1 3.44Å; M239-I243 VanDerWaalsContact O-CG1 3.22Å; M239-I243 WeakPolarHBondContact O-CG1 3.48Å; M239-I243 PolarHBondContact O-N 2.91Å; M239-I252 HydrophobicContact CE-CG2 4.05Å; M239-V254 HydrophobicContact CE-CG2 4.13Å; M239-V254 HydrophobicContact SD-CG2 3.72Å; M239-I267 HydrophobicContact CG-CD1 4.28Å; M239-I267 HydrophobicContact SD-CD1 3.98Å; M239-I267 HydrophobicContact SD-CG1 4.23Å; M239-I267 HydrophobicContact SD-CG2 3.74Å
240	D	94.2	Very high	94.6	Very high	44 Å²	44	34.2 Å²	34.2	24%	0.235	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-41.6	176	-168.9	66.9	0	0	0	111.1	L204 K207 L236 I243 K244	L204-D240 HydrophobicContact CD1-CB 4.4Å; K207-D240 IonicContact NZ-OD1 3.38Å; K207-D240 PolarHBondContact NZ-OD1 3.17Å; L236-D240 WeakPolarHBondContact O-CB 3.48Å; L236-D240 PolarHBondContact O-N 2.72Å; D240-I243 PolarHBondContact O-N 2.82Å; D240-K244 WeakPolarHBondContact O-CB 3.46Å; D240-K244 PolarHBondContact O-N 2.96Å
241	N	92.8	Very high	94.9	Very high	27 Å²	27	35.4 Å²	35.4	14%	0.144	17%	0.165	C	C	.	.	H	α-helix	trans	-64.1	-45.8	173.8	-77.8	-28.7	0	0	0	112.4	N237 L238 M239 I243 K244 Y245 L302	N237-N241 WeakPolarHBondContact O-CB 3.49Å; N237-N241 VanDerWaalsContact O-CG 3.23Å; N237-N241 PolarHBondContact O-N 2.88Å; N237-N241 PolarHBondContact O-ND2 3.04Å; N237-N241 VanDerWaalsContact O-ND2 3.09Å; L238-N241 PolarHBondContact O-N 3.35Å; M239-N241 VanDerWaalsContact C-N 3.29Å; M239-N241 PolarHBondContact O-N 3.19Å; N241-I243 VanDerWaalsContact C-N 3.29Å; N241-I243 PolarHBondContact O-N 3.4Å; N241-K244 PolarHBondContact O-N 3.05Å; N241-Y245 HydrophobicContact CB-CD2 4.23Å; N241-Y245 HydrophobicContact CB-CE2 4.25Å; N241-Y245 WeakPolarHBondContact O-CD2 3.29Å; N241-Y245 PolarHBondContact O-N 3.27Å; N241-L302 WeakPolarHBondContact ND2-CG 3.49Å
242	A	95.6	Very high	95	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-56.5	-45.4	177.8	0	0	0	0	0	111	L238 M239 S246 I252 I267 D269	L238-A242 WeakPolarHBondContact O-CB 3.31Å; L238-A242 PolarHBondContact O-N 3.46Å; M239-A242 PolarHBondContact O-N 3.38Å; A242-S246 WeakPolarHBondContact O-CB 3.49Å; A242-S246 PolarHBondContact O-N 3.11Å; A242-S246 PolarHBondContact O-OG 3Å; A242-I252 HydrophobicContact CB-CD1 3.93Å; A242-I252 HydrophobicContact CB-CG1 4.44Å; A242-I252 HydrophobicContact CB-CG2 4.21Å; A242-I267 HydrophobicContact CB-CG2 3.96Å; A242-D269 HydrophobicContact CB-CB 4.05Å
243	I	95.1	Very high	95.1	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-48.8	177.8	-62.8	165.4	0	0	0	111	L204 K207 W208 L211 L213 M239 D240 N241 Y245 S246 I252	L204-I243 HydrophobicContact CB-CD1 3.69Å; L204-I243 HydrophobicContact CD1-CD1 3.96Å; L204-I243 HydrophobicContact CG-CD1 4.39Å; K207-I243 HydrophobicContact CB-CG2 3.95Å; W208-I243 HydrophobicContact CB-CD1 3.97Å; W208-I243 HydrophobicContact CB-CG1 3.96Å; W208-I243 HydrophobicContact CB-CG2 4.08Å; W208-I243 HydrophobicContact CG-CD1 4.29Å; L211-I243 HydrophobicContact CD1-CG2 4.04Å; L211-I243 VanDerWaalsContact CD1-O 3.32Å; L211-I243 WeakPolarHBondContact CD1-O 3.15Å; L213-I243 HydrophobicContact CD1-CB 4.42Å; L213-I243 HydrophobicContact CD1-CG1 4.4Å; L213-I243 HydrophobicContact CD1-CG2 4.12Å; M239-I243 WeakPolarHBondContact O-CD1 3.44Å; M239-I243 VanDerWaalsContact O-CG1 3.22Å; M239-I243 WeakPolarHBondContact O-CG1 3.48Å; M239-I243 PolarHBondContact O-N 2.91Å; D240-I243 PolarHBondContact O-N 2.82Å; N241-I243 VanDerWaalsContact C-N 3.29Å; N241-I243 PolarHBondContact O-N 3.4Å; I243-Y245 VanDerWaalsContact C-N 3.29Å; I243-Y245 PolarHBondContact O-N 3.36Å; I243-S246 PolarHBondContact O-N 3.1Å; I243-I252 HydrophobicContact CB-CD1 4.4Å; I243-I252 HydrophobicContact CG1-CD1 3.72Å
244	K	90.6	Very high	95.4	Very high	59 Å²	59	36.1 Å²	36.1	26%	0.257	17%	0.166	S	C	.	.	H	α-helix	trans	-60.4	-36.5	-175.5	179.5	-177.4	176.6	-171.8	0	113.1	D240 N241 T295 K296	D240-K244 WeakPolarHBondContact O-CB 3.46Å; D240-K244 PolarHBondContact O-N 2.96Å; N241-K244 PolarHBondContact O-N 3.05Å; K244-T295 WeakPolarHBondContact CE-OG1 3.48Å; K244-T295 PolarHBondContact NZ-O 2.85Å; K244-T295 VanDerWaalsContact NZ-O 3.13Å; K244-T295 PolarHBondContact NZ-OG1 2.86Å; K244-K296 PolarHBondContact NZ-O 3.47Å
245	Y	91.4	Very high	95.4	Very high	53 Å²	53	39.3 Å²	39.3	21%	0.208	18%	0.179	C	C	.	.	H	α-helix	trans	-101.8	-6	-176.7	-60.2	-62.5	0	0	0	113.9	N241 I243 G271 I272 S292	N241-Y245 HydrophobicContact CB-CD2 4.23Å; N241-Y245 HydrophobicContact CB-CE2 4.25Å; N241-Y245 WeakPolarHBondContact O-CD2 3.29Å; N241-Y245 PolarHBondContact O-N 3.27Å; I243-Y245 VanDerWaalsContact C-N 3.29Å; I243-Y245 PolarHBondContact O-N 3.36Å; Y245-G271 WeakPolarHBondContact O-CA 3.42Å; Y245-I272 HydrophobicContact CD1-CD1 4.01Å; Y245-I272 HydrophobicContact CD1-CG1 4.5Å; Y245-I272 PolarHBondContact O-N 3.05Å; Y245-S292 VanDerWaalsContact OH-CB 3.24Å; Y245-S292 WeakPolarHBondContact OH-CB 3.46Å
246	S	93.6	Very high	95.4	Very high	12 Å²	12	39.4 Å²	39.4	8%	0.084	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-65.7	147.5	172.1	-78.2	0	0	0	0	112.2	A242 I243 I252	A242-S246 WeakPolarHBondContact O-CB 3.49Å; A242-S246 PolarHBondContact O-N 3.11Å; A242-S246 PolarHBondContact O-OG 3Å; I243-S246 PolarHBondContact O-N 3.1Å; S246-I252 WeakPolarHBondContact OG-CG1 3.41Å
247	R	92.7	Very high	95.5	Very high	112 Å²	112	44.3 Å²	44.3	42%	0.423	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-75.1	151.9	170.7	-63.9	174	-176.3	148.9	1.8	110	L213 S250 E270 N323	L213-R247 WeakPolarHBondContact CD2-O 3.38Å; R247-S250 PolarHBondContact N-OG 3.1Å; R247-S250 VanDerWaalsContact O-CB 3.25Å; R247-S250 WeakPolarHBondContact O-CB 3.39Å; R247-S250 PolarHBondContact O-N 2.95Å; R247-S250 PolarHBondContact O-OG 2.94Å; R247-E270 PolarHBondContact N-O 2.87Å; R247-N323 PolarHBondContact NH1-O 2.97Å; R247-N323 PolarHBondContact NH2-O 3.29Å; R247-N323 PolarHBondContact NH2-OD1 3.39Å; R247-N323 VanDerWaalsContact NH2-OD1 3.11Å
248	K	94.4	Very high	95.5	Very high	140 Å²	140	46.2 Å²	46.2	61%	0.609	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	140.6	171.8	-166.8	-179.5	179.9	171.5	0	110.4	L211 S250	L211-K248 WeakPolarHBondContact O-CA 3.21Å; L211-K248 WeakPolarHBondContact O-CG 3.42Å; K248-S250 VanDerWaalsContact C-N 3.27Å; K248-S250 PolarHBondContact O-N 3.49Å
249	N	95.7	Very high	95.2	Very high	103 Å²	103	49.4 Å²	49.4	55%	0.551	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	27.6	-177.6	-43	-62.7	0	0	0	114.6	L211 N212	L211-N249 PolarHBondContact O-N 3.33Å; N212-N249 WeakPolarHBondContact CB-OD1 3.46Å; N212-N249 PolarHBondContact ND2-OD1 3.47Å; N212-N249 WeakPolarHBondContact O-CA 3.48Å
250	S	95.4	Very high	94.7	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.07	27%	0.27	C	S	.	.			trans	-104.3	178.6	176.4	72	0	0	0	0	111.9	L213 S214 R247 K248	L213-S250 WeakPolarHBondContact CA-O 3.45Å; S214-S250 PolarHBondContact N-O 3.4Å; R247-S250 PolarHBondContact N-OG 3.1Å; R247-S250 VanDerWaalsContact O-CB 3.25Å; R247-S250 WeakPolarHBondContact O-CB 3.39Å; R247-S250 PolarHBondContact O-N 2.95Å; R247-S250 PolarHBondContact O-OG 2.94Å; K248-S250 VanDerWaalsContact C-N 3.27Å; K248-S250 PolarHBondContact O-N 3.49Å
251	N	96.2	Very high	94.4	Very high	35 Å²	35	58.5 Å²	58.5	19%	0.187	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.5	-177.7	-168	34.1	0	0	0	112.3	S214 R253 E270	S214-N251 WeakPolarHBondContact O-CA 3.33Å; S214-N251 PolarHBondContact O-OD1 3.06Å; N251-R253 VanDerWaalsContact ND2-CG 3.32Å; N251-R253 WeakPolarHBondContact ND2-CG 3.24Å; N251-E270 PolarHBondContact N-OE2 2.85Å; N251-E270 VanDerWaalsContact N-OE2 3.14Å; N251-E270 PolarHBondContact O-N 2.92Å
252	I	98.1	Very high	94.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.4	164	-61.9	171.3	0	0	0	108.1	L213 S214 L215 D216 M239 A242 I243 S246 V254 I267 S268 D269	L213-I252 HydrophobicContact CD1-CD1 3.63Å; L213-I252 HydrophobicContact CD1-CG1 4.32Å; S214-I252 PolarHBondContact O-N 2.95Å; L215-I252 WeakPolarHBondContact CA-O 3.13Å; L215-I252 HydrophobicContact CD2-CB 3.81Å; L215-I252 HydrophobicContact CD2-CG2 4.37Å; D216-I252 PolarHBondContact N-O 2.99Å; M239-I252 HydrophobicContact CE-CG2 4.05Å; A242-I252 HydrophobicContact CB-CD1 3.93Å; A242-I252 HydrophobicContact CB-CG1 4.44Å; A242-I252 HydrophobicContact CB-CG2 4.21Å; I243-I252 HydrophobicContact CB-CD1 4.4Å; I243-I252 HydrophobicContact CG1-CD1 3.72Å; S246-I252 WeakPolarHBondContact OG-CG1 3.41Å; I252-V254 HydrophobicContact CG2-CG2 4.28Å; I252-I267 HydrophobicContact CG2-CG2 4.44Å; I252-S268 CarbonylContact C-O 3.57Å; I252-S268 VanDerWaalsContact CA-O 3.28Å; I252-S268 WeakPolarHBondContact CA-O 3.46Å; I252-D269 HydrophobicContact CG1-CB 4.44Å
253	R	98.4	Very high	94.6	Very high	99 Å²	99	57.8 Å²	57.8	37%	0.374	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.3	180	-51.5	-175.4	-89.1	166.9	-5.2	110.4	D216 N251 Y255 I267 S268	D216-R253 HydrophobicContact CB-CB 4.32Å; D216-R253 HydrophobicContact CB-CG 3.93Å; D216-R253 CarbonylContact O-C 3.58Å; D216-R253 WeakPolarHBondContact O-CA 3.35Å; N251-R253 VanDerWaalsContact ND2-CG 3.32Å; N251-R253 WeakPolarHBondContact ND2-CG 3.24Å; R253-Y255 HydrophobicContact CB-CD2 4.23Å; R253-Y255 HydrophobicContact CB-CE2 3.52Å; R253-Y255 WeakPolarHBondContact CD-OH 3.45Å; R253-Y255 HydrophobicContact CG-CE2 4.39Å; R253-I267 WeakPolarHBondContact O-CA 3.47Å; R253-S268 PolarHBondContact N-O 3.41Å; R253-S268 PolarHBondContact O-N 2.91Å
254	V	98.7	Very high	94.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	112	178.4	-170.1	0	0	0	0	109	I197 I201 D216 L217 D218 L219 M239 I252 M266 I267	I197-V254 HydrophobicContact CG2-CG1 3.9Å; I201-V254 HydrophobicContact CD1-CG2 4.37Å; D216-V254 PolarHBondContact O-N 3.41Å; L217-V254 WeakPolarHBondContact CA-O 3.46Å; L217-V254 HydrophobicContact CD2-CB 3.73Å; L217-V254 HydrophobicContact CD2-CG2 3.84Å; D218-V254 PolarHBondContact N-O 2.9Å; L219-V254 HydrophobicContact CD2-CG1 4Å; M239-V254 HydrophobicContact CE-CG2 4.13Å; M239-V254 HydrophobicContact SD-CG2 3.72Å; I252-V254 HydrophobicContact CG2-CG2 4.28Å; V254-M266 CarbonylContact C-O 3.53Å; V254-M266 VanDerWaalsContact CA-O 3.3Å; V254-M266 WeakPolarHBondContact CA-O 3.25Å; V254-I267 HydrophobicContact CG1-CG1 4.14Å; V254-I267 HydrophobicContact CG2-CG1 4.48Å
255	Y	98.4	Very high	95.1	Very high	67 Å²	67	55.7 Å²	55.7	26%	0.263	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.9	178.6	-59.4	-82	0	0	0	109.9	D216 D218 R253 I265 M266	D216-Y255 PolarHBondContact OD2-OH 2.94Å; D218-Y255 HydrophobicContact CB-CD1 3.52Å; D218-Y255 HydrophobicContact CB-CE1 4Å; D218-Y255 CarbonylContact O-C 3.55Å; D218-Y255 WeakPolarHBondContact O-CA 3.47Å; R253-Y255 HydrophobicContact CB-CD2 4.23Å; R253-Y255 HydrophobicContact CB-CE2 3.52Å; R253-Y255 WeakPolarHBondContact CD-OH 3.45Å; R253-Y255 HydrophobicContact CG-CE2 4.39Å; Y255-I265 CarbonylContact O-C 3.53Å; Y255-I265 VanDerWaalsContact O-CA 3.31Å; Y255-I265 WeakPolarHBondContact O-CA 3.39Å; Y255-M266 PolarHBondContact N-O 2.96Å; Y255-M266 PolarHBondContact O-N 3.2Å
256	L	98.5	Very high	95.5	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.1	169.3	166.1	61.5	0	0	0	108.1	L193 D194 D218 L219 P220 T222 Q263 T264 I265	L193-L256 HydrophobicContact CD2-CD1 4.2Å; D194-L256 HydrophobicContact CB-CD2 3.69Å; D218-L256 PolarHBondContact O-N 3.27Å; L219-L256 HydrophobicContact CD2-CB 3.6Å; L219-L256 HydrophobicContact CD2-CD2 4.35Å; P220-L256 WeakPolarHBondContact CD-O 3.42Å; P220-L256 VanDerWaalsContact CG-O 3.24Å; P220-L256 WeakPolarHBondContact CG-O 3.49Å; T222-L256 HydrophobicContact CG2-CD1 4.33Å; T222-L256 HydrophobicContact CG2-CD2 4.21Å; T222-L256 VanDerWaalsContact OG1-CD2 3.25Å; T222-L256 WeakPolarHBondContact OG1-CD2 3.37Å; L256-Q263 HydrophobicContact CD1-CB 4.07Å; L256-T264 CarbonylContact C-O 3.47Å; L256-T264 WeakPolarHBondContact CA-O 3.49Å; L256-I265 HydrophobicContact CD1-CD1 4.19Å; L256-I265 HydrophobicContact CD1-CG1 3.68Å
257	K	97.2	Very high	95.7	Very high	136 Å²	136	55.3 Å²	55.3	59%	0.591	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.9	178.1	-175.8	-175.4	177.4	-171.7	0	110.1	Q263 T264	K257-Q263 CarbonylContact O-C 3.59Å; K257-Q263 WeakPolarHBondContact O-CA 3.37Å; K257-T264 PolarHBondContact N-O 3.31Å; K257-T264 PolarHBondContact O-N 3.03Å
258	N	94.5	Very high	96	Very high	63 Å²	63	50.6 Å²	50.6	34%	0.337	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.2	173.7	-56.7	-32.7	0	0	0	110	W221 T222	W221-N258 PolarHBondContact O-ND2 3.08Å; T222-N258 WeakPolarHBondContact CG2-OD1 3.41Å; T222-N258 PolarHBondContact OG1-ND2 3Å; T222-N258 PolarHBondContact OG1-OD1 2.96Å
259	D	91	Very high	96.1	Very high	67 Å²	67	44.4 Å²	44.4	36%	0.358	23%	0.229	S	C	.	.			trans	-138	-179.3	167.1	65.1	40.6	0	0	0	111	A261 G262	D259-A261 PolarHBondContact O-N 3.3Å; D259-A261 WeakPolarHBondContact OD1-CA 3.48Å; D259-A261 WeakPolarHBondContact OD1-CB 3.23Å; D259-A261 PolarHBondContact OD1-N 2.86Å; D259-G262 PolarHBondContact N-O 3.16Å; D259-G262 PolarHBondContact O-N 3.4Å; D259-G262 PolarHBondContact OD1-N 2.87Å
260	N	86	Confident	96	Very high	175 Å²	175	43.4 Å²	43.4	94%	0.936	22%	0.22	S	C	*	.	S	Bend	trans	-65.2	-22.8	-178.3	-67.8	-16.7	0	0	0	113.2
261	A	89	Confident	95.8	Very high	62 Å²	62	42.9 Å²	42.9	51%	0.512	22%	0.217	S	C	.	.	S	Bend	trans	-85.7	-35.1	179.6	0	0	0	0	0	111.5	D259 F331 S334	D259-A261 PolarHBondContact O-N 3.3Å; D259-A261 WeakPolarHBondContact OD1-CA 3.48Å; D259-A261 WeakPolarHBondContact OD1-CB 3.23Å; D259-A261 PolarHBondContact OD1-N 2.86Å; A261-F331 HydrophobicContact CB-CE2 4.24Å; A261-F331 HydrophobicContact CB-CZ 4.02Å; A261-S334 PolarHBondContact O-N 3.49Å
262	G	94.9	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-164.2	-175	0	0	0	0	0	115.4	D259 L332 S334	D259-G262 PolarHBondContact N-O 3.16Å; D259-G262 PolarHBondContact O-N 3.4Å; D259-G262 PolarHBondContact OD1-N 2.87Å; G262-L332 CarbonylContact C-O 3.43Å; G262-L332 WeakPolarHBondContact CA-O 3.47Å; G262-S334 WeakPolarHBondContact CA-OG 3.45Å
263	Q	97.2	Very high	95.2	Very high	13 Å²	13	45.1 Å²	45.1	6%	0.061	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.4	175.1	-63	67.7	40.6	0	0	108.3	L193 T222 Y224 L256 K257 I265 F331 L332 S334	L193-Q263 HydrophobicContact CD2-CB 4.17Å; L193-Q263 HydrophobicContact CD2-CG 4.21Å; T222-Q263 HydrophobicContact CG2-CG 3.57Å; Y224-Q263 HydrophobicContact CD2-CG 4.35Å; Y224-Q263 VanDerWaalsContact CE2-OE1 3.25Å; L256-Q263 HydrophobicContact CD1-CB 4.07Å; K257-Q263 CarbonylContact O-C 3.59Å; K257-Q263 WeakPolarHBondContact O-CA 3.37Å; Q263-I265 HydrophobicContact CB-CD1 4.15Å; Q263-F331 WeakPolarHBondContact O-CA 3.37Å; Q263-L332 HydrophobicContact CB-CB 4.43Å; Q263-L332 PolarHBondContact N-O 3.03Å; Q263-L332 PolarHBondContact O-N 3.28Å; Q263-L332 PolarHBondContact OE1-O 3.08Å; Q263-S334 PolarHBondContact NE2-OG 2.96Å; Q263-S334 VanDerWaalsContact NE2-OG 3.12Å
264	T	98.2	Very high	94.8	Very high	19 Å²	19	41.5 Å²	41.5	12%	0.117	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.8	171.2	-63.7	0	0	0	0	109.2	L256 K257 M266 K329 I330	L256-T264 CarbonylContact C-O 3.47Å; L256-T264 WeakPolarHBondContact CA-O 3.49Å; K257-T264 PolarHBondContact N-O 3.31Å; K257-T264 PolarHBondContact O-N 3.03Å; T264-M266 HydrophobicContact CG2-CG 4.3Å; T264-K329 HydrophobicContact CG2-CD 4.49Å; T264-K329 HydrophobicContact CG2-CG 4.2Å; T264-I330 CarbonylContact C-O 3.6Å; T264-I330 WeakPolarHBondContact CA-O 3.2Å
265	I	98.6	Very high	94.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	132	177	-53.2	89.6	0	0	0	108.2	L193 I197 W235 Y255 L256 Q263 I267 K329 I330 L332	L193-I265 HydrophobicContact CD2-CD1 4.18Å; I197-I265 HydrophobicContact CD1-CG1 4.35Å; I197-I265 HydrophobicContact CD1-CG2 4.11Å; W235-I265 HydrophobicContact CH2-CD1 4.02Å; W235-I265 HydrophobicContact CH2-CG1 4.24Å; W235-I265 HydrophobicContact CZ3-CB 4.38Å; W235-I265 HydrophobicContact CZ3-CG2 4.22Å; Y255-I265 CarbonylContact O-C 3.53Å; Y255-I265 VanDerWaalsContact O-CA 3.31Å; Y255-I265 WeakPolarHBondContact O-CA 3.39Å; L256-I265 HydrophobicContact CD1-CD1 4.19Å; L256-I265 HydrophobicContact CD1-CG1 3.68Å; Q263-I265 HydrophobicContact CB-CD1 4.15Å; I265-I267 HydrophobicContact CG2-CG1 4.5Å; I265-K329 WeakPolarHBondContact O-CA 3.38Å; I265-I330 HydrophobicContact CB-CB 4.26Å; I265-I330 HydrophobicContact CD1-CG2 4.44Å; I265-I330 PolarHBondContact N-O 3.29Å; I265-I330 PolarHBondContact O-N 3.29Å; I265-L332 HydrophobicContact CD1-CD1 4.15Å; I265-L332 HydrophobicContact CD1-CG 4.42Å
266	M	98.5	Very high	94.2	Very high	57 Å²	57	48.9 Å²	48.9	28%	0.281	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.4	177.2	-68.4	-179.5	52.4	0	0	109.7	V254 Y255 T264 N327 F328 K329	V254-M266 CarbonylContact C-O 3.53Å; V254-M266 VanDerWaalsContact CA-O 3.3Å; V254-M266 WeakPolarHBondContact CA-O 3.25Å; Y255-M266 PolarHBondContact N-O 2.96Å; Y255-M266 PolarHBondContact O-N 3.2Å; T264-M266 HydrophobicContact CG2-CG 4.3Å; M266-N327 WeakPolarHBondContact CE-ND2 3.41Å; M266-F328 CarbonylContact C-O 3.59Å; M266-F328 VanDerWaalsContact CA-O 3.32Å; M266-F328 WeakPolarHBondContact CA-O 3.35Å; M266-K329 HydrophobicContact CG-CB 4.36Å; M266-K329 HydrophobicContact CG-CG 4.08Å
267	I	98.5	Very high	93.7	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	111.6	173.8	-61	170.7	0	0	0	107.1	L238 M239 A242 I252 R253 V254 I265 N327 F328	L238-I267 HydrophobicContact CB-CD1 3.61Å; L238-I267 HydrophobicContact CD1-CD1 3.98Å; L238-I267 HydrophobicContact CG-CD1 4.47Å; M239-I267 HydrophobicContact CG-CD1 4.28Å; M239-I267 HydrophobicContact SD-CD1 3.98Å; M239-I267 HydrophobicContact SD-CG1 4.23Å; M239-I267 HydrophobicContact SD-CG2 3.74Å; A242-I267 HydrophobicContact CB-CG2 3.96Å; I252-I267 HydrophobicContact CG2-CG2 4.44Å; R253-I267 WeakPolarHBondContact O-CA 3.47Å; V254-I267 HydrophobicContact CG1-CG1 4.14Å; V254-I267 HydrophobicContact CG2-CG1 4.48Å; I265-I267 HydrophobicContact CG2-CG1 4.5Å; I267-N327 WeakPolarHBondContact O-CA 3.35Å; I267-F328 PolarHBondContact N-O 3.12Å; I267-F328 PolarHBondContact O-N 3.12Å
268	S	97.9	Very high	93.3	Very high	13 Å²	13	49 Å²	49	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.4	-178.6	-65.3	0	0	0	0	111.1	I252 R253 S326 N327	I252-S268 CarbonylContact C-O 3.57Å; I252-S268 VanDerWaalsContact CA-O 3.28Å; I252-S268 WeakPolarHBondContact CA-O 3.46Å; R253-S268 PolarHBondContact N-O 3.41Å; R253-S268 PolarHBondContact O-N 2.91Å; S268-S326 CarbonylContact C-O 3.51Å; S268-S326 VanDerWaalsContact CA-O 3.27Å; S268-S326 WeakPolarHBondContact CA-O 3.13Å; S268-N327 PolarHBondContact OG-OD1 2.8Å
269	D	96.6	Very high	93.2	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.053	26%	0.257	C	S	.	.			trans	-108.2	158.9	173	74.8	-93.6	0	0	0	111.9	A242 I252 G271 G325 S326	A242-D269 HydrophobicContact CB-CB 4.05Å; I252-D269 HydrophobicContact CG1-CB 4.44Å; D269-G271 VanDerWaalsContact OD2-CA 3.23Å; D269-G271 WeakPolarHBondContact OD2-CA 3.48Å; D269-G271 PolarHBondContact OD2-N 3.41Å; D269-G325 WeakPolarHBondContact O-CA 3.38Å; D269-G325 WeakPolarHBondContact OD2-CA 3.29Å; D269-S326 PolarHBondContact N-O 3.44Å; D269-S326 PolarHBondContact O-N 3.04Å; D269-S326 WeakPolarHBondContact OD1-CA 3.45Å; D269-S326 WeakPolarHBondContact OD1-CB 3.23Å; D269-S326 PolarHBondContact OD1-N 3.39Å; D269-S326 VanDerWaalsContact OD1-N 3.1Å; D269-S326 VanDerWaalsContact OD1-O 3.11Å; D269-S326 PolarHBondContact OD1-OG 3.35Å; D269-S326 PolarHBondContact OD2-N 3.04Å
270	E	94.3	Very high	93.2	Very high	81 Å²	81	49.2 Å²	49.2	38%	0.379	27%	0.271	S	S	.	.			trans	-108.1	56.2	172.5	-75.3	-179.4	173.9	0	0	111.1	R247 N251	R247-E270 PolarHBondContact N-O 2.87Å; N251-E270 PolarHBondContact N-OE2 2.85Å; N251-E270 VanDerWaalsContact N-OE2 3.14Å; N251-E270 PolarHBondContact O-N 2.92Å
271	G	91.1	Very high	93.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-101.1	-158.9	-173.9	0	0	0	0	0	116.9	Y245 D269 G273 G325	Y245-G271 WeakPolarHBondContact O-CA 3.42Å; D269-G271 VanDerWaalsContact OD2-CA 3.23Å; D269-G271 WeakPolarHBondContact OD2-CA 3.48Å; D269-G271 PolarHBondContact OD2-N 3.41Å; G271-G273 PolarHBondContact O-N 3.26Å; G271-G325 VanDerWaalsContact N-CA 3.29Å; G271-G325 PolarHBondContact O-N 2.92Å; G271-G325 VanDerWaalsContact O-N 3.16Å
272	I	90.1	Very high	93.4	Very high	71 Å²	71	45.1 Å²	45.1	36%	0.364	23%	0.23	S	C	.	.	S	Bend	trans	-64.5	-22.4	176.9	58.2	169.7	0	0	0	113	Y245 N323	Y245-I272 HydrophobicContact CD1-CD1 4.01Å; Y245-I272 HydrophobicContact CD1-CG1 4.5Å; Y245-I272 PolarHBondContact O-N 3.05Å; I272-N323 PolarHBondContact O-N 2.89Å
273	G	91.1	Very high	93.3	Very high	10 Å²	10	46.4 Å²	46.4	10%	0.103	24%	0.236	C	C	.	.			trans	60.5	-172	-172.8	0	0	0	0	0	113.3	G271 S320 S321	G271-G273 PolarHBondContact O-N 3.26Å; G273-S320 VanDerWaalsContact CA-OG 3.26Å; G273-S320 WeakPolarHBondContact CA-OG 3.34Å; G273-S321 WeakPolarHBondContact CA-O 3.42Å
274	M	91.6	Very high	92.9	Very high	24 Å²	24	48.9 Å²	48.9	12%	0.118	25%	0.25	C	C	.	.			trans	-135.4	150.3	-174.8	-64.8	178.2	-74	0	0	110.4	V278 I282 V318 S320 P322 F328	M274-V278 HydrophobicContact CB-CB 4.11Å; M274-V278 HydrophobicContact CB-CG1 3.84Å; M274-V278 HydrophobicContact CG-CG1 3.76Å; M274-V278 HydrophobicContact SD-CG1 3.84Å; M274-I282 HydrophobicContact SD-CB 4.31Å; M274-I282 HydrophobicContact SD-CD1 3.68Å; M274-I282 HydrophobicContact SD-CG1 3.74Å; M274-V318 HydrophobicContact CE-CG1 4.47Å; M274-V318 HydrophobicContact CE-CG2 3.62Å; M274-S320 PolarHBondContact N-OG 2.81Å; M274-P322 VanDerWaalsContact O-CD 3.25Å; M274-P322 WeakPolarHBondContact O-CD 3.25Å; M274-F328 HydrophobicContact CE-CZ 4.26Å
275	T	91.8	Very high	92.3	Very high	66 Å²	66	52 Å²	52	41%	0.405	26%	0.261	S	S	.	.			trans	-72.1	163.5	163.9	57.6	0	0	0	0	109.7	D277 V278 A279 P322	T275-D277 PolarHBondContact O-N 2.88Å; T275-V278 PolarHBondContact O-N 2.91Å; T275-V278 VanDerWaalsContact O-N 3.14Å; T275-V278 VanDerWaalsContact OG1-CG2 3.24Å; T275-V278 WeakPolarHBondContact OG1-CG2 3.16Å; T275-A279 PolarHBondContact O-N 2.88Å; T275-P322 HydrophobicContact CG2-CG 4.1Å
276	E	90.8	Very high	91.4	Very high	155 Å²	155	53.1 Å²	53.1	72%	0.724	27%	0.267	S	S	*	.	H	α-helix	trans	-56.7	-48.8	177.9	-168.5	168.6	-167.2	0	0	111.4	V278 A279 D280	E276-V278 PolarHBondContact O-N 3.47Å; E276-V278 VanDerWaalsContact O-N 3.12Å; E276-A279 WeakPolarHBondContact O-CB 3.42Å; E276-A279 PolarHBondContact O-N 3.44Å; E276-D280 PolarHBondContact O-N 2.97Å
277	D	89.7	Confident	90.6	Very high	122 Å²	122	52.6 Å²	52.6	65%	0.652	26%	0.262	S	S	*	.	H	α-helix	trans	-56.1	-33.5	176.9	-54.6	-39.4	0	0	0	113.8	T275 R281	T275-D277 PolarHBondContact O-N 2.88Å; D277-R281 WeakPolarHBondContact O-CG 3.42Å
278	V	88.5	Confident	89.4	Confident	20 Å²	20	54.5 Å²	54.5	12%	0.121	27%	0.271	C	S	.	.	H	α-helix	trans	-78.2	-42.2	178.1	171.5	0	0	0	0	110.1	M274 T275 E276 D280 R281 I282 Y287	M274-V278 HydrophobicContact CB-CB 4.11Å; M274-V278 HydrophobicContact CB-CG1 3.84Å; M274-V278 HydrophobicContact CG-CG1 3.76Å; M274-V278 HydrophobicContact SD-CG1 3.84Å; T275-V278 PolarHBondContact O-N 2.91Å; T275-V278 VanDerWaalsContact O-N 3.14Å; T275-V278 VanDerWaalsContact OG1-CG2 3.24Å; T275-V278 WeakPolarHBondContact OG1-CG2 3.16Å; E276-V278 PolarHBondContact O-N 3.47Å; E276-V278 VanDerWaalsContact O-N 3.12Å; V278-D280 VanDerWaalsContact C-N 3.3Å; V278-D280 PolarHBondContact O-N 3.4Å; V278-R281 PolarHBondContact O-N 2.7Å; V278-I282 HydrophobicContact CG1-CD1 4.17Å; V278-I282 WeakPolarHBondContact O-CB 3.49Å; V278-I282 PolarHBondContact O-N 2.9Å; V278-Y287 HydrophobicContact CG1-CE1 4.14Å; V278-Y287 WeakPolarHBondContact CG2-OH 3.46Å
279	A	91.4	Very high	88.1	Confident	15 Å²	15	54.7 Å²	54.7	12%	0.124	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-36.9	179.1	0	0	0	0	0	112.1	T275 E276 R281 I282 V318	T275-A279 PolarHBondContact O-N 2.88Å; E276-A279 WeakPolarHBondContact O-CB 3.42Å; E276-A279 PolarHBondContact O-N 3.44Å; A279-R281 VanDerWaalsContact C-N 3.27Å; A279-R281 PolarHBondContact O-N 2.9Å; A279-I282 WeakPolarHBondContact O-CG2 3.29Å; A279-V318 HydrophobicContact CB-CG1 4.1Å
280	D	90.4	Very high	86.4	Confident	120 Å²	120	59.7 Å²	59.7	64%	0.642	30%	0.299	S	S	*	.	H	α-helix	trans	-66	-30.2	178.1	-74.7	-13.4	0	0	0	113	E276 V278	E276-D280 PolarHBondContact O-N 2.97Å; V278-D280 VanDerWaalsContact C-N 3.3Å; V278-D280 PolarHBondContact O-N 3.4Å
281	R	89.4	Confident	84.6	Confident	129 Å²	129	60.2 Å²	60.2	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-105.9	-1.9	-174.1	-61.9	-170.1	65.6	-168.9	-2	114.2	D277 V278 A279 F283 D284 Y287	D277-R281 WeakPolarHBondContact O-CG 3.42Å; V278-R281 PolarHBondContact O-N 2.7Å; A279-R281 VanDerWaalsContact C-N 3.27Å; A279-R281 PolarHBondContact O-N 2.9Å; R281-F283 PolarHBondContact O-N 3.46Å; R281-D284 IonicContact NE-OD2 2.76Å; R281-D284 PolarHBondContact NE-OD2 2.86Å; R281-D284 IonicContact NH2-OD2 3.08Å; R281-D284 VanDerWaalsContact O-CB 3.25Å; R281-D284 WeakPolarHBondContact O-CB 3.35Å; R281-D284 PolarHBondContact O-N 3.15Å; R281-Y287 HydrophobicContact CB-CD1 4.09Å; R281-Y287 HydrophobicContact CB-CD2 3.98Å; R281-Y287 HydrophobicContact CB-CE1 3.9Å; R281-Y287 HydrophobicContact CB-CE2 3.8Å; R281-Y287 HydrophobicContact CB-CG 4.11Å; R281-Y287 VanDerWaalsContact O-CD1 3.31Å; R281-Y287 WeakPolarHBondContact O-CD1 3.34Å
282	I	91	Very high	82.9	Confident	22 Å²	22	60.4 Å²	60.4	11%	0.113	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.2	-169.7	-155.7	63.6	0	0	0	113.8	M274 V278 A279 Y287 L302 V318	M274-I282 HydrophobicContact SD-CB 4.31Å; M274-I282 HydrophobicContact SD-CD1 3.68Å; M274-I282 HydrophobicContact SD-CG1 3.74Å; V278-I282 HydrophobicContact CG1-CD1 4.17Å; V278-I282 WeakPolarHBondContact O-CB 3.49Å; V278-I282 PolarHBondContact O-N 2.9Å; A279-I282 WeakPolarHBondContact O-CG2 3.29Å; I282-Y287 HydrophobicContact CD1-CD1 4.26Å; I282-Y287 HydrophobicContact CD1-CE1 4.33Å; I282-L302 HydrophobicContact CD1-CD1 4.37Å; I282-L302 HydrophobicContact CG1-CD1 3.5Å; I282-L302 VanDerWaalsContact CG1-CD1 3.5Å; I282-L302 HydrophobicContact CG2-CD1 4.44Å; I282-L302 WeakPolarHBondContact O-CB 3.39Å; I282-V318 HydrophobicContact CG2-CG1 4.03Å
283	F	92.9	Very high	81.1	Confident	26 Å²	26	65.2 Å²	65.2	11%	0.114	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-1.1	176.2	-56.2	-73.1	0	0	0	113.6	R281 L302 A303 K306 I316 V318 F328	R281-F283 PolarHBondContact O-N 3.46Å; F283-L302 HydrophobicContact CD1-CB 4.06Å; F283-L302 HydrophobicContact CE1-CB 4.49Å; F283-L302 HydrophobicContact CE1-CD2 4.5Å; F283-A303 WeakPolarHBondContact O-CA 3.46Å; F283-A303 VanDerWaalsContact O-CB 3.32Å; F283-A303 WeakPolarHBondContact O-CB 3.28Å; F283-K306 HydrophobicContact CB-CB 4.22Å; F283-K306 HydrophobicContact CB-CD 3.51Å; F283-K306 HydrophobicContact CB-CG 4.46Å; F283-K306 HydrophobicContact CD1-CB 3.97Å; F283-K306 HydrophobicContact CD1-CD 4.48Å; F283-K306 HydrophobicContact CG-CB 4.33Å; F283-K306 HydrophobicContact CG-CD 4Å; F283-I316 HydrophobicContact CD1-CG2 4.33Å; F283-I316 HydrophobicContact CE1-CD1 3.67Å; F283-I316 HydrophobicContact CE1-CG1 3.76Å; F283-I316 HydrophobicContact CE1-CG2 3.95Å; F283-I316 HydrophobicContact CZ-CD1 4.17Å; F283-I316 HydrophobicContact CZ-CG1 3.78Å; F283-I316 HydrophobicContact CZ-CG2 4.21Å; F283-V318 HydrophobicContact CE2-CG1 4.11Å; F283-V318 HydrophobicContact CZ-CB 4.4Å; F283-V318 HydrophobicContact CZ-CG1 4.41Å; F283-F328 HydrophobicContact CE1-CD1 4.4Å; F283-F328 HydrophobicContact CE1-CE1 4.13Å; F283-F328 HydrophobicContact CZ-CD1 4.15Å; F283-F328 AromaticContact CZ-CE1 3.97Å; F283-F328 HydrophobicContact CZ-CE1 3.97Å
284	D	88.5	Confident	79.1	Confident	65 Å²	65	74.1 Å²	74.1	35%	0.348	36%	0.358	S	S	.	.	S	Bend	trans	-69.5	142	175	-66.8	-12.2	0	0	0	110	R281 F286 Y287	R281-D284 IonicContact NE-OD2 2.76Å; R281-D284 PolarHBondContact NE-OD2 2.86Å; R281-D284 IonicContact NH2-OD2 3.08Å; R281-D284 VanDerWaalsContact O-CB 3.25Å; R281-D284 WeakPolarHBondContact O-CB 3.35Å; R281-D284 PolarHBondContact O-N 3.15Å; D284-F286 PolarHBondContact O-N 2.88Å; D284-Y287 WeakPolarHBondContact O-CB 3.28Å; D284-Y287 PolarHBondContact O-N 3.43Å
285	K	85.2	Confident	77.4	Confident	84 Å²	84	75.3 Å²	75.3	37%	0.365	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	132.4	178.2	-65.1	173.9	-174.6	170.5	0	110.2	F120 E180 Y287 L300 A303	F120-K285 HydrophobicContact CD2-CD 4.36Å; E180-K285 IonicContact OE1-NZ 2.94Å; E180-K285 PolarHBondContact OE1-NZ 3.33Å; K285-Y287 PolarHBondContact O-N 3.37Å; K285-Y287 VanDerWaalsContact O-N 3.16Å; K285-L300 HydrophobicContact CB-CD2 4.11Å; K285-A303 HydrophobicContact CB-CB 4.44Å; K285-A303 HydrophobicContact CG-CB 3.82Å
286	F	79.9	Confident	76	Confident	25 Å²	25	78.9 Å²	78.9	11%	0.11	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	5.9	-179.1	-56.9	-79.9	0	0	0	115.7	F120 T123 V124 E127 L169 D284 Q288 N298 G299 L300	F120-F286 HydrophobicContact CD2-CD2 4.4Å; F120-F286 AromaticContact CD2-CE2 3.51Å; F120-F286 HydrophobicContact CD2-CE2 3.51Å; F120-F286 HydrophobicContact CD2-CZ 4.35Å; F120-F286 AromaticContact CE2-CE2 3.61Å; F120-F286 HydrophobicContact CE2-CE2 3.61Å; F120-F286 HydrophobicContact CE2-CZ 4.05Å; F120-F286 HydrophobicContact CG-CE2 4.39Å; T123-F286 HydrophobicContact CG2-CB 3.35Å; T123-F286 HydrophobicContact CG2-CD1 3.54Å; T123-F286 HydrophobicContact CG2-CD2 3.75Å; T123-F286 HydrophobicContact CG2-CE1 4.25Å; T123-F286 HydrophobicContact CG2-CE2 4.4Å; T123-F286 HydrophobicContact CG2-CG 3.27Å; V124-F286 HydrophobicContact CB-CZ 4.4Å; V124-F286 HydrophobicContact CG2-CE1 4.32Å; V124-F286 HydrophobicContact CG2-CE2 3.92Å; V124-F286 HydrophobicContact CG2-CZ 3.38Å; E127-F286 HydrophobicContact CG-CD1 3.95Å; E127-F286 HydrophobicContact CG-CE1 4.07Å; L169-F286 HydrophobicContact CD1-CE1 4.17Å; D284-F286 PolarHBondContact O-N 2.88Å; F286-Q288 PolarHBondContact O-N 3.28Å; F286-N298 WeakPolarHBondContact CD1-O 3.49Å; F286-G299 WeakPolarHBondContact CA-O 3.4Å; F286-G299 PolarHBondContact N-O 2.94Å; F286-L300 HydrophobicContact CD1-CD2 3.95Å; F286-L300 HydrophobicContact CD1-CG 4.05Å; F286-L300 HydrophobicContact CD2-CD2 3.94Å; F286-L300 HydrophobicContact CE1-CD1 3.76Å; F286-L300 HydrophobicContact CE1-CD2 3.77Å; F286-L300 HydrophobicContact CE1-CG 3.76Å; F286-L300 HydrophobicContact CE2-CD2 3.78Å; F286-L300 HydrophobicContact CG-CD2 4Å; F286-L300 HydrophobicContact CZ-CD1 3.88Å; F286-L300 HydrophobicContact CZ-CD2 3.66Å; F286-L300 HydrophobicContact CZ-CG 4.06Å
287	Y	82.1	Confident	74.9	Confident	46 Å²	46	73.1 Å²	73.1	18%	0.18	36%	0.359	C	S	.	.			trans	-70.4	128.4	177.6	-176.2	-95.2	0	0	0	110.6	V278 R281 I282 D284 K285	V278-Y287 HydrophobicContact CG1-CE1 4.14Å; V278-Y287 WeakPolarHBondContact CG2-OH 3.46Å; R281-Y287 HydrophobicContact CB-CD1 4.09Å; R281-Y287 HydrophobicContact CB-CD2 3.98Å; R281-Y287 HydrophobicContact CB-CE1 3.9Å; R281-Y287 HydrophobicContact CB-CE2 3.8Å; R281-Y287 HydrophobicContact CB-CG 4.11Å; R281-Y287 VanDerWaalsContact O-CD1 3.31Å; R281-Y287 WeakPolarHBondContact O-CD1 3.34Å; I282-Y287 HydrophobicContact CD1-CD1 4.26Å; I282-Y287 HydrophobicContact CD1-CE1 4.33Å; D284-Y287 WeakPolarHBondContact O-CB 3.28Å; D284-Y287 PolarHBondContact O-N 3.43Å; K285-Y287 PolarHBondContact O-N 3.37Å; K285-Y287 VanDerWaalsContact O-N 3.16Å
288	Q	74.1	Confident	74	Confident	41 Å²	41	68.1 Å²	68.1	19%	0.192	33%	0.332	C	S	.	.			trans	-139.2	129.2	175.9	-67.6	-168.2	62.2	0	0	108.2	F286 S292 G297 N298	F286-Q288 PolarHBondContact O-N 3.28Å; Q288-S292 WeakPolarHBondContact CB-OG 3.27Å; Q288-G297 PolarHBondContact NE2-O 3.31Å; Q288-G297 PolarHBondContact OE1-O 2.84Å; Q288-N298 VanDerWaalsContact NE2-C 3.29Å
289	S	69.5	Low	73.7	Confident	17 Å²	17	68 Å²	68	12%	0.119	34%	0.335	C	S	.	.			trans	-66.9	157.5	171.8	67.2	0	0	0	0	110.7	T291 S292 R293	S289-T291 PolarHBondContact O-N 2.86Å; S289-T291 PolarHBondContact OG-OG1 3.44Å; S289-S292 PolarHBondContact N-OG 2.78Å; S289-S292 CarbonylContact O-C 3.56Å; S289-S292 WeakPolarHBondContact O-CA 3.08Å; S289-S292 PolarHBondContact O-N 3.04Å; S289-S292 PolarHBondContact O-OG 3.46Å; S289-S292 PolarHBondContact OG-N 3.41Å; S289-S292 PolarHBondContact OG-OG 3.48Å; S289-R293 PolarHBondContact O-N 2.97Å
290	D	60.6	Low	73.4	Confident	115 Å²	115	67.3 Å²	67.3	62%	0.615	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.9	178.8	-73.7	-2.7	0	0	0	113.1	S292 R293	D290-S292 VanDerWaalsContact C-N 3.32Å; D290-R293 PolarHBondContact O-N 3.46Å; D290-R293 IonicContact OD1-CZ 3.16Å; D290-R293 IonicContact OD1-NE 2.79Å; D290-R293 PolarHBondContact OD1-NE 2.9Å; D290-R293 IonicContact OD1-NH2 3.13Å; D290-R293 PolarHBondContact OD1-NH2 3.35Å; D290-R293 IonicContact OD2-NH2 2.61Å; D290-R293 PolarHBondContact OD2-NH2 3.46Å; D290-R293 VanDerWaalsContact OD2-NH2 3.13Å
291	T	57.1	Low	73.4	Confident	91 Å²	91	62.2 Å²	62.2	56%	0.558	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-35.5	172.6	37.7	0	0	0	0	112.3	S289	S289-T291 PolarHBondContact O-N 2.86Å; S289-T291 PolarHBondContact OG-OG1 3.44Å
292	S	54.2	Low	73.5	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.028	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-80.3	-19.7	178.5	65.3	0	0	0	0	113.7	Y245 Q288 S289 D290 K294 T295	Y245-S292 VanDerWaalsContact OH-CB 3.24Å; Y245-S292 WeakPolarHBondContact OH-CB 3.46Å; Q288-S292 WeakPolarHBondContact CB-OG 3.27Å; S289-S292 PolarHBondContact N-OG 2.78Å; S289-S292 CarbonylContact O-C 3.56Å; S289-S292 WeakPolarHBondContact O-CA 3.08Å; S289-S292 PolarHBondContact O-N 3.04Å; S289-S292 PolarHBondContact O-OG 3.46Å; S289-S292 PolarHBondContact OG-N 3.41Å; S289-S292 PolarHBondContact OG-OG 3.48Å; D290-S292 VanDerWaalsContact C-N 3.32Å; S292-K294 PolarHBondContact O-N 2.9Å; S292-K294 VanDerWaalsContact O-N 3.08Å; S292-T295 WeakPolarHBondContact CA-OG1 3.14Å; S292-T295 CarbonylContact O-C 3.5Å; S292-T295 WeakPolarHBondContact O-CA 3.48Å; S292-T295 PolarHBondContact O-N 3.33Å; S292-T295 PolarHBondContact O-OG1 2.95Å
293	R	53.4	Low	73.5	Confident	173 Å²	173	56.2 Å²	56.2	65%	0.653	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-57.6	-24.1	175.8	-70	-167	-86	152.8	-6.6	113.4	S289 D290 T295	S289-R293 PolarHBondContact O-N 2.97Å; D290-R293 PolarHBondContact O-N 3.46Å; D290-R293 IonicContact OD1-CZ 3.16Å; D290-R293 IonicContact OD1-NE 2.79Å; D290-R293 PolarHBondContact OD1-NE 2.9Å; D290-R293 IonicContact OD1-NH2 3.13Å; D290-R293 PolarHBondContact OD1-NH2 3.35Å; D290-R293 IonicContact OD2-NH2 2.61Å; D290-R293 PolarHBondContact OD2-NH2 3.46Å; D290-R293 VanDerWaalsContact OD2-NH2 3.13Å; R293-T295 VanDerWaalsContact C-N 3.32Å
294	K	49.7	Very low	73.4	Confident	197 Å²	197	55 Å²	55	86%	0.857	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-75.4	-20.6	173	-68.6	-173.6	178.6	-179.3	0	113.5	S292	S292-K294 PolarHBondContact O-N 2.9Å; S292-K294 VanDerWaalsContact O-N 3.08Å
295	T	54.9	Low	73.7	Confident	48 Å²	48	51.9 Å²	51.9	29%	0.294	26%	0.262	S	S	.	.	S	Bend	trans	-111.4	121.7	-172.9	57.3	0	0	0	0	110.9	K244 S292 R293 G297	K244-T295 WeakPolarHBondContact CE-OG1 3.48Å; K244-T295 PolarHBondContact NZ-O 2.85Å; K244-T295 VanDerWaalsContact NZ-O 3.13Å; K244-T295 PolarHBondContact NZ-OG1 2.86Å; S292-T295 WeakPolarHBondContact CA-OG1 3.14Å; S292-T295 CarbonylContact O-C 3.5Å; S292-T295 WeakPolarHBondContact O-CA 3.48Å; S292-T295 PolarHBondContact O-N 3.33Å; S292-T295 PolarHBondContact O-OG1 2.95Å; R293-T295 VanDerWaalsContact C-N 3.32Å; T295-G297 PolarHBondContact O-N 2.78Å
296	K	61.8	Low	74.2	Confident	141 Å²	141	51.3 Å²	51.3	61%	0.613	26%	0.26	S	S	*	.	S	Bend	trans	-42.4	122.3	-176.7	-67.2	-178	175.6	-177.9	0	112.5	D161 K244	D161-K296 IonicContact OD1-NZ 3.46Å; D161-K296 PolarHBondContact OD1-NZ 3.5Å; D161-K296 IonicContact OD2-NZ 2.71Å; D161-K296 PolarHBondContact OD2-NZ 3.5Å; K244-K296 PolarHBondContact NZ-O 3.47Å
297	G	68.5	Low	74.7	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	26%	0.262	S	S	.	.			trans	177.1	152.8	177.1	0	0	0	0	0	110	Q288 T295	Q288-G297 PolarHBondContact NE2-O 3.31Å; Q288-G297 PolarHBondContact OE1-O 2.84Å; T295-G297 PolarHBondContact O-N 2.78Å
298	N	71.5	Confident	75.2	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.091	25%	0.253	C	S	.	.			trans	-105.5	2	176.7	58.6	21.1	0	0	0	112.7	L169 N172 F286 Q288 L300	L169-N298 HydrophobicContact CD1-CB 4.08Å; N172-N298 PolarHBondContact ND2-ND2 3.12Å; F286-N298 WeakPolarHBondContact CD1-O 3.49Å; Q288-N298 VanDerWaalsContact NE2-C 3.29Å; N298-L300 PolarHBondContact O-N 3.32Å; N298-L300 WeakPolarHBondContact OD1-CB 3.47Å; N298-L300 PolarHBondContact OD1-N 3.33Å
299	G	81.2	Confident	76.2	Confident	18 Å²	18	47.5 Å²	47.5	19%	0.186	24%	0.244	C	C	.	.	S	Bend	trans	69.7	13.7	-178.5	0	0	0	0	0	115	F286	F286-G299 WeakPolarHBondContact CA-O 3.4Å; F286-G299 PolarHBondContact N-O 2.94Å
300	L	86	Confident	77.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.			trans	-95.5	-17.7	177.8	-65.5	178.6	0	0	0	113.9	L169 N172 I173 L176 K285 F286 N298 L302 A303 L304	L169-L300 HydrophobicContact CD1-CD1 3.79Å; N172-L300 HydrophobicContact CB-CB 4.13Å; N172-L300 HydrophobicContact CB-CD1 3.84Å; I173-L300 HydrophobicContact CG1-CD1 4.23Å; L176-L300 HydrophobicContact CD1-CD1 4.34Å; L176-L300 HydrophobicContact CD1-CD2 3.87Å; L176-L300 HydrophobicContact CD1-CG 4.49Å; K285-L300 HydrophobicContact CB-CD2 4.11Å; F286-L300 HydrophobicContact CD1-CD2 3.95Å; F286-L300 HydrophobicContact CD1-CG 4.05Å; F286-L300 HydrophobicContact CD2-CD2 3.94Å; F286-L300 HydrophobicContact CE1-CD1 3.76Å; F286-L300 HydrophobicContact CE1-CD2 3.77Å; F286-L300 HydrophobicContact CE1-CG 3.76Å; F286-L300 HydrophobicContact CE2-CD2 3.78Å; F286-L300 HydrophobicContact CG-CD2 4Å; F286-L300 HydrophobicContact CZ-CD1 3.88Å; F286-L300 HydrophobicContact CZ-CD2 3.66Å; F286-L300 HydrophobicContact CZ-CG 4.06Å; N298-L300 PolarHBondContact O-N 3.32Å; N298-L300 WeakPolarHBondContact OD1-CB 3.47Å; N298-L300 PolarHBondContact OD1-N 3.33Å; L300-L302 PolarHBondContact O-N 3.07Å; L300-A303 PolarHBondContact O-N 3.43Å; L300-L304 VanDerWaalsContact O-CB 3.29Å; L300-L304 WeakPolarHBondContact O-CB 3.26Å; L300-L304 PolarHBondContact O-N 2.84Å
301	G	88.9	Confident	78.6	Confident	14 Å²	14	48 Å²	48	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-47.4	-172.4	0	0	0	0	0	113.8	N237 L304 A305	N237-G301 WeakPolarHBondContact ND2-CA 3.37Å; N237-G301 PolarHBondContact ND2-O 2.94Å; G301-L304 PolarHBondContact O-N 3.3Å; G301-A305 WeakPolarHBondContact O-CB 3.3Å; G301-A305 PolarHBondContact O-N 3.48Å
302	L	93.2	Very high	80.3	Confident	16 Å²	16	43.7 Å²	43.7	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-76.2	-33.5	-179.5	-70.7	174.9	0	0	0	112.8	L238 N241 I282 F283 L300 L304 A305 K306 F328	L238-L302 HydrophobicContact CD2-CD2 3.48Å; L238-L302 VanDerWaalsContact CD2-CD2 3.48Å; N241-L302 WeakPolarHBondContact ND2-CG 3.49Å; I282-L302 HydrophobicContact CD1-CD1 4.37Å; I282-L302 HydrophobicContact CG1-CD1 3.5Å; I282-L302 VanDerWaalsContact CG1-CD1 3.5Å; I282-L302 HydrophobicContact CG2-CD1 4.44Å; I282-L302 WeakPolarHBondContact O-CB 3.39Å; F283-L302 HydrophobicContact CD1-CB 4.06Å; F283-L302 HydrophobicContact CE1-CB 4.49Å; F283-L302 HydrophobicContact CE1-CD2 4.5Å; L300-L302 PolarHBondContact O-N 3.07Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L302-A305 PolarHBondContact O-N 2.81Å; L302-K306 WeakPolarHBondContact O-CB 3.29Å; L302-K306 PolarHBondContact O-N 2.95Å; L302-F328 HydrophobicContact CD1-CE1 4.27Å; L302-F328 HydrophobicContact CD1-CZ 4.18Å; L302-F328 HydrophobicContact CD2-CE1 4.02Å; L302-F328 HydrophobicContact CD2-CZ 4.37Å
303	A	90.2	Very high	82	Confident	8 Å²	8	48.4 Å²	48.4	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-44.2	171	0	0	0	0	0	111.3	F283 K285 L300 K306 Q307	F283-A303 WeakPolarHBondContact O-CA 3.46Å; F283-A303 VanDerWaalsContact O-CB 3.32Å; F283-A303 WeakPolarHBondContact O-CB 3.28Å; K285-A303 HydrophobicContact CB-CB 4.44Å; K285-A303 HydrophobicContact CG-CB 3.82Å; L300-A303 PolarHBondContact O-N 3.43Å; A303-K306 PolarHBondContact O-N 3.37Å; A303-Q307 PolarHBondContact O-N 2.91Å
304	L	91	Very high	84	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-44.1	174.3	-178.1	64.6	0	0	0	111.3	K175 L176 L179 Q233 L300 G301 L302 K306 Q307 I308	K175-L304 HydrophobicContact CB-CD1 3.92Å; K175-L304 HydrophobicContact CB-CD2 4.39Å; K175-L304 HydrophobicContact CD-CD2 4.2Å; L176-L304 HydrophobicContact CD2-CB 4.17Å; L176-L304 HydrophobicContact CD2-CD1 3.85Å; L176-L304 HydrophobicContact CG-CD1 4.11Å; L179-L304 HydrophobicContact CD1-CD1 3.46Å; L179-L304 VanDerWaalsContact CD1-CD1 3.46Å; Q233-L304 HydrophobicContact CG-CD2 3.7Å; L300-L304 VanDerWaalsContact O-CB 3.29Å; L300-L304 WeakPolarHBondContact O-CB 3.26Å; L300-L304 PolarHBondContact O-N 2.84Å; G301-L304 PolarHBondContact O-N 3.3Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L304-K306 PolarHBondContact O-N 3.48Å; L304-Q307 PolarHBondContact O-N 3.42Å; L304-I308 HydrophobicContact CD1-CD1 4.01Å; L304-I308 HydrophobicContact CD1-CG1 4.35Å; L304-I308 HydrophobicContact CG-CD1 3.82Å; L304-I308 VanDerWaalsContact O-CG1 3.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.25Å; L304-I308 PolarHBondContact O-N 3.36Å
305	A	95	Very high	86.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-46.6	176.7	0	0	0	0	0	111.6	V234 G301 L302 Q307 I308 I309	V234-A305 HydrophobicContact CG1-CB 4.17Å; V234-A305 HydrophobicContact CG2-CB 4.44Å; G301-A305 WeakPolarHBondContact O-CB 3.3Å; G301-A305 PolarHBondContact O-N 3.48Å; L302-A305 PolarHBondContact O-N 2.81Å; A305-Q307 PolarHBondContact O-N 3.27Å; A305-I308 PolarHBondContact O-N 2.88Å; A305-I309 VanDerWaalsContact O-CG1 3.28Å; A305-I309 WeakPolarHBondContact O-CG1 3.46Å; A305-I309 PolarHBondContact O-N 3.12Å
306	K	94.9	Very high	88.4	Confident	72 Å²	72	33.1 Å²	33.1	31%	0.313	18%	0.179	S	C	.	.	H	α-helix	trans	-58.3	-49.4	176	177.6	178.2	169.4	-170.8	0	111.6	F283 L302 A303 L304 I308 I309 E310 I316	F283-K306 HydrophobicContact CB-CB 4.22Å; F283-K306 HydrophobicContact CB-CD 3.51Å; F283-K306 HydrophobicContact CB-CG 4.46Å; F283-K306 HydrophobicContact CD1-CB 3.97Å; F283-K306 HydrophobicContact CD1-CD 4.48Å; F283-K306 HydrophobicContact CG-CB 4.33Å; F283-K306 HydrophobicContact CG-CD 4Å; L302-K306 WeakPolarHBondContact O-CB 3.29Å; L302-K306 PolarHBondContact O-N 2.95Å; A303-K306 PolarHBondContact O-N 3.37Å; L304-K306 PolarHBondContact O-N 3.48Å; K306-I308 VanDerWaalsContact C-N 3.32Å; K306-I308 PolarHBondContact O-N 3.02Å; K306-I309 PolarHBondContact O-N 2.96Å; K306-I309 VanDerWaalsContact O-N 3.15Å; K306-E310 WeakPolarHBondContact CE-OE1 3.5Å; K306-E310 HydrophobicContact CG-CG 4.34Å; K306-E310 IonicContact NZ-OE1 2.96Å; K306-E310 WeakPolarHBondContact O-CG 3.25Å; K306-E310 PolarHBondContact O-N 3.34Å; K306-I316 HydrophobicContact CB-CG2 3.92Å; K306-I316 HydrophobicContact CG-CG2 3.99Å
307	Q	90.8	Very high	90.1	Very high	32 Å²	32	33.1 Å²	33.1	15%	0.15	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-38	-178.2	-168.4	172.6	1	0	0	112.6	L179 E180 A303 L304 A305 E310 L311	L179-Q307 VanDerWaalsContact C-NE2 3.29Å; L179-Q307 VanDerWaalsContact CB-CD 3.48Å; L179-Q307 HydrophobicContact CB-CG 3.89Å; L179-Q307 HydrophobicContact CD1-CB 4.33Å; L179-Q307 HydrophobicContact CD1-CG 4.14Å; E180-Q307 VanDerWaalsContact CG-NE2 3.26Å; E180-Q307 VanDerWaalsContact N-NE2 3.2Å; A303-Q307 PolarHBondContact O-N 2.91Å; L304-Q307 PolarHBondContact O-N 3.42Å; A305-Q307 PolarHBondContact O-N 3.27Å; Q307-E310 PolarHBondContact O-N 3.44Å; Q307-L311 WeakPolarHBondContact O-CB 3.43Å; Q307-L311 PolarHBondContact O-N 3.31Å
308	I	92.7	Very high	91.4	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-42.7	174.3	-67.8	167.2	0	0	0	110.8	L179 F230 L231 Q233 V234 L304 A305 K306 L311 H312	L179-I308 HydrophobicContact CD1-CD1 4.39Å; L179-I308 HydrophobicContact CD1-CG1 3.61Å; L179-I308 HydrophobicContact CD2-CG1 4.27Å; F230-I308 HydrophobicContact CB-CD1 3.97Å; F230-I308 HydrophobicContact CB-CG1 4.05Å; F230-I308 HydrophobicContact CB-CG2 3.67Å; F230-I308 HydrophobicContact CG-CD1 4.38Å; F230-I308 HydrophobicContact CG-CG1 4.36Å; F230-I308 WeakPolarHBondContact O-CD1 3.42Å; L231-I308 HydrophobicContact CD2-CG2 4.13Å; Q233-I308 HydrophobicContact CB-CD1 4.2Å; Q233-I308 HydrophobicContact CG-CD1 4.45Å; V234-I308 HydrophobicContact CG2-CB 3.68Å; V234-I308 HydrophobicContact CG2-CD1 4.16Å; V234-I308 HydrophobicContact CG2-CG2 3.43Å; V234-I308 VanDerWaalsContact CG2-CG2 3.43Å; L304-I308 HydrophobicContact CD1-CD1 4.01Å; L304-I308 HydrophobicContact CD1-CG1 4.35Å; L304-I308 HydrophobicContact CG-CD1 3.82Å; L304-I308 VanDerWaalsContact O-CG1 3.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.25Å; L304-I308 PolarHBondContact O-N 3.36Å; A305-I308 PolarHBondContact O-N 2.88Å; K306-I308 VanDerWaalsContact C-N 3.32Å; K306-I308 PolarHBondContact O-N 3.02Å; I308-L311 WeakPolarHBondContact O-CB 3.36Å; I308-L311 PolarHBondContact O-N 3.49Å; I308-H312 PolarHBondContact O-N 3.26Å; I308-H312 PolarHBondContact O-ND1 3.36Å
309	I	94.9	Very high	92.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-42.1	177.9	-69	-58.3	0	0	0	111.2	L231 V234 W235 A305 K306 L311 H312 H313 G314 I316 I330 L332	L231-I309 HydrophobicContact CD2-CD1 3.89Å; V234-I309 HydrophobicContact CG1-CD1 4.05Å; V234-I309 HydrophobicContact CG1-CG1 4.11Å; V234-I309 HydrophobicContact CG2-CD1 4.19Å; V234-I309 HydrophobicContact CG2-CG1 4.22Å; W235-I309 HydrophobicContact CH2-CD1 4.43Å; A305-I309 VanDerWaalsContact O-CG1 3.28Å; A305-I309 WeakPolarHBondContact O-CG1 3.46Å; A305-I309 PolarHBondContact O-N 3.12Å; K306-I309 PolarHBondContact O-N 2.96Å; K306-I309 VanDerWaalsContact O-N 3.15Å; I309-L311 VanDerWaalsContact C-N 3.35Å; I309-L311 PolarHBondContact O-N 2.87Å; I309-H312 CarbonylContact O-C 3.58Å; I309-H312 WeakPolarHBondContact O-CA 3.49Å; I309-H312 PolarHBondContact O-N 3.31Å; I309-H313 PolarHBondContact O-N 2.92Å; I309-G314 VanDerWaalsContact CG2-C 3.44Å; I309-G314 WeakPolarHBondContact O-CA 3.26Å; I309-G314 PolarHBondContact O-N 3.32Å; I309-I316 HydrophobicContact CG2-CB 4.31Å; I309-I330 HydrophobicContact CD1-CG2 3.45Å; I309-I330 VanDerWaalsContact CD1-CG2 3.45Å; I309-I330 HydrophobicContact CG1-CG2 4.03Å; I309-I330 HydrophobicContact CG2-CG2 4.28Å; I309-L332 HydrophobicContact CD1-CD2 3.69Å; I309-L332 HydrophobicContact CD1-CG 4.39Å
310	E	92.2	Very high	93.2	Very high	100 Å²	100	37.4 Å²	37.4	47%	0.467	19%	0.193	S	C	.	.	H	α-helix	trans	-64.9	-37.1	176.8	-73.3	174.2	165	0	0	112.5	K306 Q307 H312 H313	K306-E310 WeakPolarHBondContact CE-OE1 3.5Å; K306-E310 HydrophobicContact CG-CG 4.34Å; K306-E310 IonicContact NZ-OE1 2.96Å; K306-E310 WeakPolarHBondContact O-CG 3.25Å; K306-E310 PolarHBondContact O-N 3.34Å; Q307-E310 PolarHBondContact O-N 3.44Å; E310-H312 PolarHBondContact O-N 2.87Å; E310-H313 WeakPolarHBondContact O-CA 3.45Å; E310-H313 PolarHBondContact O-N 3.45Å
311	L	88.7	Confident	93.6	Very high	42 Å²	42	39.5 Å²	39.5	22%	0.22	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-33.6	170.8	174.6	79.6	0	0	0	111.8	L179 L186 F230 Q307 I308 I309 H313	L179-L311 HydrophobicContact CD2-CB 4.45Å; L179-L311 HydrophobicContact CD2-CD2 3.51Å; L179-L311 HydrophobicContact CD2-CG 4.39Å; L186-L311 HydrophobicContact CD1-CD1 3.82Å; L186-L311 HydrophobicContact CD1-CD2 3.29Å; L186-L311 HydrophobicContact CD1-CG 4.08Å; F230-L311 HydrophobicContact CD2-CD2 3.96Å; F230-L311 HydrophobicContact CE2-CD2 4.34Å; Q307-L311 WeakPolarHBondContact O-CB 3.43Å; Q307-L311 PolarHBondContact O-N 3.31Å; I308-L311 WeakPolarHBondContact O-CB 3.36Å; I308-L311 PolarHBondContact O-N 3.49Å; I309-L311 VanDerWaalsContact C-N 3.35Å; I309-L311 PolarHBondContact O-N 2.87Å; L311-H313 PolarHBondContact O-N 3.25Å
312	H	91.7	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	15.6	173.8	-67.9	82.8	0	0	0	112.9	F188 Y224 N227 I308 I309 E310 G314 L332 P333 L336	F188-H312 AromaticContact CE1-CD2 3.76Å; F188-H312 AromaticContact CE1-NE2 3.85Å; Y224-H312 AromaticContact CE1-CD2 3.94Å; N227-H312 PolarHBondContact N-NE2 3.36Å; I308-H312 PolarHBondContact O-N 3.26Å; I308-H312 PolarHBondContact O-ND1 3.36Å; I309-H312 CarbonylContact O-C 3.58Å; I309-H312 WeakPolarHBondContact O-CA 3.49Å; I309-H312 PolarHBondContact O-N 3.31Å; E310-H312 PolarHBondContact O-N 2.87Å; H312-G314 PolarHBondContact O-N 2.94Å; H312-L332 HydrophobicContact CB-CD2 3.82Å; H312-P333 WeakPolarHBondContact O-CD 3.01Å; H312-P333 WeakPolarHBondContact O-CG 3.26Å; H312-L336 HydrophobicContact CB-CD1 4.13Å; H312-L336 WeakPolarHBondContact O-CD2 3.28Å
313	H	91.4	Very high	93.6	Very high	104 Å²	104	46.8 Å²	46.8	48%	0.481	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	22.1	-173.3	-52.9	-44.5	0	0	0	114	I309 E310 L311 P333 L336 S339	I309-H313 PolarHBondContact O-N 2.92Å; E310-H313 WeakPolarHBondContact O-CA 3.45Å; E310-H313 PolarHBondContact O-N 3.45Å; L311-H313 PolarHBondContact O-N 3.25Å; H313-P333 HydrophobicContact CB-CG 4.16Å; H313-L336 HydrophobicContact CB-CD2 4.27Å; H313-L336 WeakPolarHBondContact CD2-CD2 3.43Å; H313-S339 VanDerWaalsContact NE2-CB 3.27Å; H313-S339 WeakPolarHBondContact NE2-CB 3.45Å
314	G	95.6	Very high	93.7	Very high	7 Å²	7	54.2 Å²	54.2	7%	0.072	28%	0.278	C	S	.	.			trans	-86.3	-179.1	178.7	0	0	0	0	0	112.1	I309 H312 F331	I309-G314 VanDerWaalsContact CG2-C 3.44Å; I309-G314 WeakPolarHBondContact O-CA 3.26Å; I309-G314 PolarHBondContact O-N 3.32Å; H312-G314 PolarHBondContact O-N 2.94Å; G314-F331 CarbonylContact C-O 3.59Å; G314-F331 WeakPolarHBondContact CA-O 3.28Å
315	T	97.5	Very high	93.8	Very high	69 Å²	69	54.4 Å²	54.4	42%	0.423	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.2	172.2	63.5	0	0	0	0	110	I330 F331	T315-I330 CarbonylContact O-C 3.44Å; T315-I330 VanDerWaalsContact O-CA 3.32Å; T315-I330 WeakPolarHBondContact O-CA 3.41Å; T315-F331 PolarHBondContact N-O 2.99Å; T315-F331 PolarHBondContact O-N 3.44Å
316	I	98.1	Very high	93.9	Very high	20 Å²	20	55 Å²	55	10%	0.103	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.9	170	-176.4	162.9	0	0	0	108.6	L238 F283 K306 I309 F328 K329 I330	L238-I316 HydrophobicContact CD1-CD1 4.18Å; L238-I316 HydrophobicContact CD2-CD1 4.03Å; F283-I316 HydrophobicContact CD1-CG2 4.33Å; F283-I316 HydrophobicContact CE1-CD1 3.67Å; F283-I316 HydrophobicContact CE1-CG1 3.76Å; F283-I316 HydrophobicContact CE1-CG2 3.95Å; F283-I316 HydrophobicContact CZ-CD1 4.17Å; F283-I316 HydrophobicContact CZ-CG1 3.78Å; F283-I316 HydrophobicContact CZ-CG2 4.21Å; K306-I316 HydrophobicContact CB-CG2 3.92Å; K306-I316 HydrophobicContact CG-CG2 3.99Å; I309-I316 HydrophobicContact CG2-CB 4.31Å; I316-F328 HydrophobicContact CD1-CD1 4.4Å; I316-K329 WeakPolarHBondContact CA-O 3.2Å; I316-I330 HydrophobicContact CB-CG1 4.39Å; I316-I330 HydrophobicContact CD1-CD1 4.48Å; I316-I330 HydrophobicContact CD1-CG1 3.96Å; I316-I330 HydrophobicContact CG1-CG1 3.99Å
317	K	97.3	Very high	94	Very high	141 Å²	141	53.4 Å²	53.4	61%	0.613	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	153.3	177	-63	-173.7	-179.4	-175.6	0	109.3	F328 K329	K317-F328 CarbonylContact O-C 3.54Å; K317-F328 WeakPolarHBondContact O-CA 3.28Å; K317-K329 PolarHBondContact N-O 3.15Å; K317-K329 PolarHBondContact O-N 3.5Å
318	V	97.1	Very high	94.3	Very high	29 Å²	29	52.3 Å²	52.3	18%	0.176	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.9	173.3	65.4	0	0	0	0	109.9	M274 A279 I282 F283 N327 F328	M274-V318 HydrophobicContact CE-CG1 4.47Å; M274-V318 HydrophobicContact CE-CG2 3.62Å; A279-V318 HydrophobicContact CB-CG1 4.1Å; I282-V318 HydrophobicContact CG2-CG1 4.03Å; F283-V318 HydrophobicContact CE2-CG1 4.11Å; F283-V318 HydrophobicContact CZ-CB 4.4Å; F283-V318 HydrophobicContact CZ-CG1 4.41Å; V318-N327 WeakPolarHBondContact CA-O 3.46Å; V318-F328 HydrophobicContact CB-CD1 3.96Å; V318-F328 HydrophobicContact CB-CE1 3.86Å; V318-F328 HydrophobicContact CB-CZ 4.34Å; V318-F328 HydrophobicContact CG2-CD1 4.05Å; V318-F328 HydrophobicContact CG2-CD2 4.23Å; V318-F328 HydrophobicContact CG2-CE1 3.82Å; V318-F328 HydrophobicContact CG2-CE2 4.01Å; V318-F328 HydrophobicContact CG2-CG 4.25Å; V318-F328 HydrophobicContact CG2-CZ 3.8Å
319	N	95.5	Very high	94.6	Very high	114 Å²	114	57.1 Å²	57.1	61%	0.61	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.6	164.1	-174.3	-50.8	0	0	0	107.1	N327	N319-N327 PolarHBondContact N-O 3.09Å; N319-N327 PolarHBondContact O-N 3.06Å
320	S	95.5	Very high	94.8	Very high	17 Å²	17	57.1 Å²	57.1	12%	0.119	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.4	-176.4	-170.6	0	0	0	0	109.2	G273 M274 G325 S326	G273-S320 VanDerWaalsContact CA-OG 3.26Å; G273-S320 WeakPolarHBondContact CA-OG 3.34Å; M274-S320 PolarHBondContact N-OG 2.81Å; S320-G325 PolarHBondContact OG-O 3.41Å; S320-S326 PolarHBondContact OG-OG 2.89Å
321	S	93.3	Very high	95.1	Very high	44 Å²	44	55.1 Å²	55.1	31%	0.308	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	145.5	172.1	-69.3	0	0	0	0	109	G273 N323 K324 G325	G273-S321 WeakPolarHBondContact CA-O 3.42Å; S321-N323 PolarHBondContact O-N 3.47Å; S321-K324 PolarHBondContact O-N 3.28Å; S321-G325 PolarHBondContact N-O 3.33Å
322	P	92.1	Very high	95.5	Very high	73 Å²	73	53.1 Å²	53.1	47%	0.474	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	131.4	-179.8	-26.2	35.9	0	0	0	111.1	M274 T275 K324	M274-P322 VanDerWaalsContact O-CD 3.25Å; M274-P322 WeakPolarHBondContact O-CD 3.25Å; T275-P322 HydrophobicContact CG2-CG 4.1Å; P322-K324 PolarHBondContact O-N 3.43Å
323	N	89.8	Confident	95.7	Very high	109 Å²	109	54.2 Å²	54.2	58%	0.583	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	9.9	-178.7	-67	-50.9	0	0	0	117.3	R247 I272 S321	R247-N323 PolarHBondContact NH1-O 2.97Å; R247-N323 PolarHBondContact NH2-O 3.29Å; R247-N323 PolarHBondContact NH2-OD1 3.39Å; R247-N323 VanDerWaalsContact NH2-OD1 3.11Å; I272-N323 PolarHBondContact O-N 2.89Å; S321-N323 PolarHBondContact O-N 3.47Å
324	K	91.7	Very high	95.4	Very high	165 Å²	165	51.6 Å²	51.6	72%	0.717	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-0.2	175	-60	-171.5	-177.9	175.6	0	113.5	S321 P322	S321-K324 PolarHBondContact O-N 3.28Å; P322-K324 PolarHBondContact O-N 3.43Å
325	G	93.6	Very high	94.1	Very high	4 Å²	4	57.5 Å²	57.5	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	78.6	-165.4	-173.4	0	0	0	0	0	113.2	D269 G271 S320 S321	D269-G325 WeakPolarHBondContact O-CA 3.38Å; D269-G325 WeakPolarHBondContact OD2-CA 3.29Å; G271-G325 VanDerWaalsContact N-CA 3.29Å; G271-G325 PolarHBondContact O-N 2.92Å; G271-G325 VanDerWaalsContact O-N 3.16Å; S320-G325 PolarHBondContact OG-O 3.41Å; S321-G325 PolarHBondContact N-O 3.33Å
326	S	96.7	Very high	92.5	Very high	12 Å²	12	55 Å²	55	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.2	-176.7	-39.2	0	0	0	0	111.3	S268 D269 S320	S268-S326 CarbonylContact C-O 3.51Å; S268-S326 VanDerWaalsContact CA-O 3.27Å; S268-S326 WeakPolarHBondContact CA-O 3.13Å; D269-S326 PolarHBondContact N-O 3.44Å; D269-S326 PolarHBondContact O-N 3.04Å; D269-S326 WeakPolarHBondContact OD1-CA 3.45Å; D269-S326 WeakPolarHBondContact OD1-CB 3.23Å; D269-S326 PolarHBondContact OD1-N 3.39Å; D269-S326 VanDerWaalsContact OD1-N 3.1Å; D269-S326 VanDerWaalsContact OD1-O 3.11Å; D269-S326 PolarHBondContact OD1-OG 3.35Å; D269-S326 PolarHBondContact OD2-N 3.04Å; S320-S326 PolarHBondContact OG-OG 2.89Å
327	N	97.6	Very high	90.4	Very high	39 Å²	39	61.1 Å²	61.1	21%	0.209	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	107.3	175.6	172.5	39	0	0	0	109.1	M266 I267 S268 V318 N319	M266-N327 WeakPolarHBondContact CE-ND2 3.41Å; I267-N327 WeakPolarHBondContact O-CA 3.35Å; S268-N327 PolarHBondContact OG-OD1 2.8Å; V318-N327 WeakPolarHBondContact CA-O 3.46Å; N319-N327 PolarHBondContact N-O 3.09Å; N319-N327 PolarHBondContact O-N 3.06Å
328	F	98.4	Very high	87.8	Confident	8 Å²	8	61.7 Å²	61.7	4%	0.035	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121	172.5	-71.4	-93.2	0	0	0	109.1	L238 M266 I267 M274 F283 L302 I316 K317 V318 I330	L238-F328 HydrophobicContact CD2-CB 4.29Å; L238-F328 HydrophobicContact CD2-CD1 3.8Å; L238-F328 HydrophobicContact CD2-CE1 4.25Å; L238-F328 HydrophobicContact CD2-CG 3.97Å; M266-F328 CarbonylContact C-O 3.59Å; M266-F328 VanDerWaalsContact CA-O 3.32Å; M266-F328 WeakPolarHBondContact CA-O 3.35Å; I267-F328 PolarHBondContact N-O 3.12Å; I267-F328 PolarHBondContact O-N 3.12Å; M274-F328 HydrophobicContact CE-CZ 4.26Å; F283-F328 HydrophobicContact CE1-CD1 4.4Å; F283-F328 HydrophobicContact CE1-CE1 4.13Å; F283-F328 HydrophobicContact CZ-CD1 4.15Å; F283-F328 AromaticContact CZ-CE1 3.97Å; F283-F328 HydrophobicContact CZ-CE1 3.97Å; L302-F328 HydrophobicContact CD1-CE1 4.27Å; L302-F328 HydrophobicContact CD1-CZ 4.18Å; L302-F328 HydrophobicContact CD2-CE1 4.02Å; L302-F328 HydrophobicContact CD2-CZ 4.37Å; I316-F328 HydrophobicContact CD1-CD1 4.4Å; K317-F328 CarbonylContact O-C 3.54Å; K317-F328 WeakPolarHBondContact O-CA 3.28Å; V318-F328 HydrophobicContact CB-CD1 3.96Å; V318-F328 HydrophobicContact CB-CE1 3.86Å; V318-F328 HydrophobicContact CB-CZ 4.34Å; V318-F328 HydrophobicContact CG2-CD1 4.05Å; V318-F328 HydrophobicContact CG2-CD2 4.23Å; V318-F328 HydrophobicContact CG2-CE1 3.82Å; V318-F328 HydrophobicContact CG2-CE2 4.01Å; V318-F328 HydrophobicContact CG2-CG 4.25Å; V318-F328 HydrophobicContact CG2-CZ 3.8Å; F328-I330 HydrophobicContact CB-CD1 4.3Å
329	K	98.4	Very high	85	Confident	102 Å²	102	66.7 Å²	66.7	44%	0.443	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.3	175.8	-176.2	178.1	-179.1	-179.7	0	109.4	T264 I265 M266 I316 K317	T264-K329 HydrophobicContact CG2-CD 4.49Å; T264-K329 HydrophobicContact CG2-CG 4.2Å; I265-K329 WeakPolarHBondContact O-CA 3.38Å; M266-K329 HydrophobicContact CG-CB 4.36Å; M266-K329 HydrophobicContact CG-CG 4.08Å; I316-K329 WeakPolarHBondContact CA-O 3.2Å; K317-K329 PolarHBondContact N-O 3.15Å; K317-K329 PolarHBondContact O-N 3.5Å
330	I	98.6	Very high	84.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.1	177.3	-57.3	89.4	0	0	0	107.8	W235 L238 T264 I265 I309 T315 I316 F328 L332	W235-I330 HydrophobicContact CH2-CG2 4.14Å; W235-I330 HydrophobicContact CZ3-CB 4.43Å; W235-I330 HydrophobicContact CZ3-CD1 4.25Å; W235-I330 HydrophobicContact CZ3-CG1 4.21Å; W235-I330 HydrophobicContact CZ3-CG2 4.38Å; L238-I330 HydrophobicContact CD1-CD1 3.42Å; L238-I330 VanDerWaalsContact CD1-CD1 3.42Å; L238-I330 HydrophobicContact CD1-CG1 4.02Å; T264-I330 CarbonylContact C-O 3.6Å; T264-I330 WeakPolarHBondContact CA-O 3.2Å; I265-I330 HydrophobicContact CB-CB 4.26Å; I265-I330 HydrophobicContact CD1-CG2 4.44Å; I265-I330 PolarHBondContact N-O 3.29Å; I265-I330 PolarHBondContact O-N 3.29Å; I309-I330 HydrophobicContact CD1-CG2 3.45Å; I309-I330 VanDerWaalsContact CD1-CG2 3.45Å; I309-I330 HydrophobicContact CG1-CG2 4.03Å; I309-I330 HydrophobicContact CG2-CG2 4.28Å; T315-I330 CarbonylContact O-C 3.44Å; T315-I330 VanDerWaalsContact O-CA 3.32Å; T315-I330 WeakPolarHBondContact O-CA 3.41Å; I316-I330 HydrophobicContact CB-CG1 4.39Å; I316-I330 HydrophobicContact CD1-CD1 4.48Å; I316-I330 HydrophobicContact CD1-CG1 3.96Å; I316-I330 HydrophobicContact CG1-CG1 3.99Å; F328-I330 HydrophobicContact CB-CD1 4.3Å; I330-L332 HydrophobicContact CG2-CG 4.22Å
331	F	98.1	Very high	83.9	Confident	58 Å²	58	66.8 Å²	66.8	25%	0.254	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.7	169.1	174.1	-101.8	0	0	0	108.7	A261 Q263 G314 T315 P333	A261-F331 HydrophobicContact CB-CE2 4.24Å; A261-F331 HydrophobicContact CB-CZ 4.02Å; Q263-F331 WeakPolarHBondContact O-CA 3.37Å; G314-F331 CarbonylContact C-O 3.59Å; G314-F331 WeakPolarHBondContact CA-O 3.28Å; T315-F331 PolarHBondContact N-O 2.99Å; T315-F331 PolarHBondContact O-N 3.44Å; F331-P333 HydrophobicContact CE1-CB 4.26Å
332	L	97.5	Very high	83.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.9	174.5	-70	176.9	0	0	0	108.6	L193 Y224 L231 W235 G262 Q263 I265 I309 H312 I330	L193-L332 HydrophobicContact CD2-CD1 4.34Å; Y224-L332 HydrophobicContact CE1-CD1 4.15Å; Y224-L332 HydrophobicContact CE2-CB 3.72Å; Y224-L332 HydrophobicContact CE2-CD1 4.32Å; L231-L332 HydrophobicContact CD1-CD1 4.14Å; L231-L332 HydrophobicContact CD2-CD1 4.1Å; L231-L332 HydrophobicContact CD2-CD2 4.39Å; W235-L332 HydrophobicContact CH2-CD1 4.17Å; W235-L332 HydrophobicContact CZ2-CD1 4.14Å; G262-L332 CarbonylContact C-O 3.43Å; G262-L332 WeakPolarHBondContact CA-O 3.47Å; Q263-L332 HydrophobicContact CB-CB 4.43Å; Q263-L332 PolarHBondContact N-O 3.03Å; Q263-L332 PolarHBondContact O-N 3.28Å; Q263-L332 PolarHBondContact OE1-O 3.08Å; I265-L332 HydrophobicContact CD1-CD1 4.15Å; I265-L332 HydrophobicContact CD1-CG 4.42Å; I309-L332 HydrophobicContact CD1-CD2 3.69Å; I309-L332 HydrophobicContact CD1-CG 4.39Å; H312-L332 HydrophobicContact CB-CD2 3.82Å; I330-L332 HydrophobicContact CG2-CG 4.22Å
333	P	95.4	Very high	82.9	Confident	24 Å²	24	67.8 Å²	67.8	16%	0.156	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.9	-180	29.4	-33.7	0	0	0	112	H312 H313 F331 N335	H312-P333 WeakPolarHBondContact O-CD 3.01Å; H312-P333 WeakPolarHBondContact O-CG 3.26Å; H313-P333 HydrophobicContact CB-CG 4.16Å; F331-P333 HydrophobicContact CE1-CB 4.26Å; P333-N335 VanDerWaalsContact C-N 3.28Å; P333-N335 PolarHBondContact O-N 3.45Å
334	S	85.2	Confident	82.4	Confident	48 Å²	48	65.3 Å²	65.3	34%	0.336	34%	0.342	S	S	.	.	S	Bend	trans	-68.3	-21.3	-178.4	-67.4	0	0	0	0	114.5	A261 G262 Q263	A261-S334 PolarHBondContact O-N 3.49Å; G262-S334 WeakPolarHBondContact CA-OG 3.45Å; Q263-S334 PolarHBondContact NE2-OG 2.96Å; Q263-S334 VanDerWaalsContact NE2-OG 3.12Å
335	N	68.3	Low	81.8	Confident	131 Å²	131	58.6 Å²	58.6	70%	0.701	32%	0.317	S	S	*	.			trans	-119.2	88.3	-173.5	-82.8	-33.7	0	0	0	111.8	P333	P333-N335 VanDerWaalsContact C-N 3.28Å; P333-N335 PolarHBondContact O-N 3.45Å
336	L	64.3	Low	81	Confident	17 Å²	17	62.5 Å²	62.5	9%	0.089	34%	0.336	C	S	.	.			trans	-87.4	-7.9	165.2	-79.8	160.2	0	0	0	113.1	F188 Y224 Y225 H312 H313 N338	F188-L336 HydrophobicContact CD1-CD1 4.46Å; F188-L336 HydrophobicContact CE1-CD1 4.05Å; Y224-L336 HydrophobicContact CE1-CD1 4.47Å; Y224-L336 WeakPolarHBondContact OH-CD1 3.16Å; Y225-L336 HydrophobicContact CD1-CB 4.35Å; Y225-L336 WeakPolarHBondContact O-CD1 3.21Å; H312-L336 HydrophobicContact CB-CD1 4.13Å; H312-L336 WeakPolarHBondContact O-CD2 3.28Å; H313-L336 HydrophobicContact CB-CD2 4.27Å; H313-L336 WeakPolarHBondContact CD2-CD2 3.43Å; L336-N338 PolarHBondContact O-N 2.96Å; L336-N338 VanDerWaalsContact O-N 3.11Å
337	K	54.3	Low	79.7	Confident	148 Å²	148	66.4 Å²	66.4	64%	0.643	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.8	-167.5	-143.7	-179.5	-174.9	-177.2	0	115.2
338	N	41.9	Very low	78.3	Confident	154 Å²	154	68.7 Å²	68.7	82%	0.824	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	8.6	-169.4	-74.2	-10.6	0	0	0	114.4	L336	L336-N338 PolarHBondContact O-N 2.96Å; L336-N338 VanDerWaalsContact O-N 3.11Å
339	S	38.9	Very low	76.4	Confident	134 Å²	134	74.2 Å²	74.2	94%	0.937	40%	0.398	S	S	*	.			trans	-101.2	0	169.3	-56.5	0	0	0	0	108.8	H313	H313-S339 VanDerWaalsContact NE2-CB 3.27Å; H313-S339 WeakPolarHBondContact NE2-CB 3.45Å

Retrieved 339 of 339 residues in 341.7 ms (Link to these results)

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