A0A096NEA7_PAPAN Loading...

ATP-dependent RNA helicase

Probable ATP-binding RNA helicase. Has ATPase activity and is involved in the maturation of precursor large subunit rRNAs. RNA helicase.

AlphaFold DB , UniProt , Accession A0A096NEA7, Species PAPAN (Papio anubis, Olive baboon), Gene DDX55, Length 600 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	37.8	Very low	65.8	Low	210 Å²	210	100.2 Å²	100.2	100%	1.034	53%	0.526	S	S	*	.				0	-21.9	0	-86.3	176.6	-126.7	0	0	112.6	H3	M1-H3 VanDerWaalsContact C-N 3.31Å; M1-H3 PolarHBondContact O-N 2.87Å
2	E	32.7	Very low	67.6	Low	171 Å²	171	93.2 Å²	93.2	80%	0.799	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.4	-172	-66.9	176.5	161	0	0	116.5
3	H	41.4	Very low	69.1	Low	177 Å²	177	92.7 Å²	92.7	82%	0.819	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	0.4	-173.7	-61.7	-60.4	0	0	0	116	M1	M1-H3 VanDerWaalsContact C-N 3.31Å; M1-H3 PolarHBondContact O-N 2.87Å
4	V	55.8	Low	70.4	Confident	60 Å²	60	87.2 Å²	87.2	36%	0.364	47%	0.467	S	S	.	.	S	Bend	trans	-118.9	-2.7	-173.9	-168	0	0	0	0	113.1	P34	V4-P34 WeakPolarHBondContact O-CD 3.45Å
5	T	57.7	Low	71.7	Confident	54 Å²	54	87.9 Å²	87.9	33%	0.331	48%	0.481	S	S	.	.			trans	-122.9	133.7	-170.4	56.2	0	0	0	0	112.5	Y31 M32	T5-Y31 HydrophobicContact CG2-CG 4.36Å; T5-M32 CarbonylContact C-O 3.58Å; T5-M32 WeakPolarHBondContact CA-O 3.48Å
6	E	69.1	Low	73.1	Confident	105 Å²	105	83 Å²	83	49%	0.491	45%	0.454	S	S	.	.			trans	-103.6	45.6	178	-81.7	-164.3	175.9	0	0	112.8	M32 P34 S37	E6-M32 PolarHBondContact N-O 3.13Å; E6-P34 HydrophobicContact CG-CB 4.01Å; E6-P34 HydrophobicContact CG-CG 3.97Å; E6-S37 WeakPolarHBondContact CB-OG 3.15Å; E6-S37 WeakPolarHBondContact OE2-CB 3.44Å; E6-S37 PolarHBondContact OE2-OG 2.96Å
7	G	78.8	Confident	74.3	Confident	30 Å²	30	81.9 Å²	81.9	31%	0.309	45%	0.445	S	S	.	.			trans	92.5	-176	176.1	0	0	0	0	0	114.8	Y31 M32	G7-Y31 WeakPolarHBondContact O-CA 3.28Å; G7-M32 PolarHBondContact O-N 3.1Å
8	S	87.1	Confident	75.3	Confident	44 Å²	44	82.5 Å²	82.5	31%	0.308	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-82.5	157.3	-177	68.3	0	0	0	0	111.6	E10 S11 M32	S8-E10 PolarHBondContact O-N 3.06Å; S8-E10 VanDerWaalsContact O-N 3.13Å; S8-S11 PolarHBondContact O-N 3.3Å; S8-S11 PolarHBondContact O-OG 3.18Å; S8-M32 WeakPolarHBondContact O-CE 3.35Å
9	W	89.6	Confident	76.3	Confident	15 Å²	15	84.8 Å²	84.8	6%	0.057	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-59.7	-25.2	177.2	-62.5	97.1	0	0	0	114	S11 L12 L16 L21 L24 F29 M32 Q36 I40 I65	W9-S11 VanDerWaalsContact C-N 3.33Å; W9-L12 HydrophobicContact CE3-CD1 4.34Å; W9-L16 HydrophobicContact CE3-CD1 4.06Å; W9-L21 HydrophobicContact CB-CD2 3.6Å; W9-L21 HydrophobicContact CG-CD2 4.43Å; W9-L24 HydrophobicContact CD2-CD1 3.55Å; W9-L24 HydrophobicContact CE3-CD1 3.75Å; W9-L24 HydrophobicContact CG-CD1 3.94Å; W9-L24 HydrophobicContact CH2-CD1 4.36Å; W9-L24 HydrophobicContact CH2-CD2 4.03Å; W9-L24 HydrophobicContact CZ2-CD1 4.18Å; W9-L24 HydrophobicContact CZ2-CD2 3.7Å; W9-L24 HydrophobicContact CZ3-CD1 4.15Å; W9-F29 PolarHBondContact NE1-O 2.72Å; W9-M32 HydrophobicContact CD2-CG 3.38Å; W9-M32 HydrophobicContact CD2-SD 4.11Å; W9-M32 HydrophobicContact CE3-CG 3.31Å; W9-M32 HydrophobicContact CE3-SD 3.59Å; W9-M32 VanDerWaalsContact CE3-SD 3.59Å; W9-M32 HydrophobicContact CG-CG 4.05Å; W9-M32 HydrophobicContact CH2-CG 3.81Å; W9-M32 HydrophobicContact CZ2-CG 3.88Å; W9-M32 HydrophobicContact CZ3-CG 3.53Å; W9-M32 HydrophobicContact CZ3-SD 3.96Å; W9-Q36 HydrophobicContact CH2-CB 4.44Å; W9-Q36 VanDerWaalsContact CH2-OE1 3.31Å; W9-I40 HydrophobicContact CZ3-CD1 3.74Å; W9-I65 HydrophobicContact CE3-CD1 4.16Å; W9-I65 HydrophobicContact CH2-CD1 3.57Å; W9-I65 HydrophobicContact CZ3-CD1 3.29Å
10	E	86.1	Confident	77.2	Confident	160 Å²	160	80.6 Å²	80.6	75%	0.748	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-76.6	-19.7	178.8	-65.7	174.8	168.5	0	0	112.8	S8 L12	S8-E10 PolarHBondContact O-N 3.06Å; S8-E10 VanDerWaalsContact O-N 3.13Å; E10-L12 PolarHBondContact O-N 3.37Å
11	S	87.4	Confident	77.9	Confident	76 Å²	76	78.1 Å²	78.1	53%	0.531	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-81.4	2.4	176.8	73	0	0	0	0	113.3	S8 W9	S8-S11 PolarHBondContact O-N 3.3Å; S8-S11 PolarHBondContact O-OG 3.18Å; W9-S11 VanDerWaalsContact C-N 3.33Å
12	L	87.5	Confident	80.5	Confident	16 Å²	16	69.1 Å²	69.1	8%	0.084	38%	0.38	C	S	.	.	S	Bend	trans	-64.3	141.1	175.2	-78.7	173.1	0	0	0	110.7	W9 E10 V14 L16 M32 I40 P41	W9-L12 HydrophobicContact CE3-CD1 4.34Å; E10-L12 PolarHBondContact O-N 3.37Å; L12-V14 HydrophobicContact CB-CG2 4.28Å; L12-V14 WeakPolarHBondContact CB-O 3.5Å; L12-V14 PolarHBondContact O-N 2.88Å; L12-L16 HydrophobicContact CD1-CD1 3.76Å; L12-L16 HydrophobicContact CD1-CD2 4.32Å; L12-L16 HydrophobicContact CD1-CG 4.05Å; L12-M32 HydrophobicContact CD1-SD 3.57Å; L12-M32 VanDerWaalsContact CD1-SD 3.57Å; L12-M32 HydrophobicContact CD2-CE 3.72Å; L12-M32 HydrophobicContact CD2-SD 3.45Å; L12-M32 WeakPolarHBondContact CD2-SD 3.12Å; L12-M32 HydrophobicContact CG-CE 3.72Å; L12-M32 HydrophobicContact CG-SD 3.4Å; L12-M32 WeakPolarHBondContact CG-SD 3.28Å; L12-I40 HydrophobicContact CD1-CG2 4.09Å; L12-P41 HydrophobicContact CD2-CG 3.85Å
13	P	87.3	Confident	83.3	Confident	87 Å²	87	61 Å²	61	57%	0.565	34%	0.342	S	S	*	.	S	Bend	trans	-72.8	7.7	175.3	34.3	-39.2	0	0	0	112.9	P41 R45	P13-P41 HydrophobicContact CG-CB 3.75Å; P13-P41 HydrophobicContact CG-CG 3.66Å; P13-R45 PolarHBondContact O-NH2 3.18Å
14	V	87.3	Confident	85.7	Confident	16 Å²	16	52.6 Å²	52.6	10%	0.097	30%	0.303	C	S	.	.	S	Bend	trans	-129.8	127.5	172.8	-68.7	0	0	0	0	107.2	L12 I40 P41 M44 R45	L12-V14 HydrophobicContact CB-CG2 4.28Å; L12-V14 WeakPolarHBondContact CB-O 3.5Å; L12-V14 PolarHBondContact O-N 2.88Å; V14-I40 HydrophobicContact CG2-CG2 4.39Å; V14-P41 HydrophobicContact CG1-CB 4.35Å; V14-P41 HydrophobicContact CG2-CB 4.28Å; V14-P41 HydrophobicContact CG2-CG 4.3Å; V14-M44 HydrophobicContact CB-CE 4.04Å; V14-M44 HydrophobicContact CB-SD 4.29Å; V14-M44 HydrophobicContact CG2-CE 4.05Å; V14-M44 HydrophobicContact CG2-SD 3.65Å; V14-R45 HydrophobicContact CG1-CG 4.48Å
15	S	90.4	Very high	87.4	Confident	97 Å²	97	58.4 Å²	58.4	68%	0.678	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-67	139.3	175.2	179.9	0	0	0	0	109.7	R73	S15-R73 PolarHBondContact O-NH2 3.19Å
16	L	93	Very high	89	Confident	10 Å²	10	61.1 Å²	61.1	5%	0.052	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-103	148.4	173.5	-61.5	-176.8	0	0	0	110.1	W9 L12 L21 M44 I65 E69	W9-L16 HydrophobicContact CE3-CD1 4.06Å; L12-L16 HydrophobicContact CD1-CD1 3.76Å; L12-L16 HydrophobicContact CD1-CD2 4.32Å; L12-L16 HydrophobicContact CD1-CG 4.05Å; L16-L21 HydrophobicContact CB-CD2 4.1Å; L16-L21 HydrophobicContact CB-CG 4.14Å; L16-L21 HydrophobicContact CD1-CD2 4Å; L16-M44 HydrophobicContact CD2-CE 4.32Å; L16-M44 HydrophobicContact CD2-SD 3.98Å; L16-I65 HydrophobicContact CD1-CG2 4.2Å; L16-I65 HydrophobicContact CD2-CG2 3.87Å; L16-E69 HydrophobicContact CD2-CG 3.88Å
17	H	94.1	Very high	89.9	Confident	65 Å²	65	58.3 Å²	58.3	30%	0.301	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-62.6	137.3	178.4	-172.8	-82.7	0	0	0	110.6	R19 V20 L21 E69 L72 F109	H17-R19 PolarHBondContact ND1-N 3.44Å; H17-R19 PolarHBondContact O-N 2.97Å; H17-V20 HydrophobicContact CB-CG2 4.18Å; H17-V20 WeakPolarHBondContact O-CA 3.45Å; H17-V20 WeakPolarHBondContact O-CB 3.44Å; H17-V20 PolarHBondContact O-N 2.74Å; H17-L21 PolarHBondContact O-N 3.01Å; H17-E69 VanDerWaalsContact CB-OE1 3.3Å; H17-E69 WeakPolarHBondContact CB-OE1 3.32Å; H17-E69 PolarHBondContact N-OE1 3.02Å; H17-L72 HydrophobicContact CB-CD1 4.13Å; H17-F109 AromaticContact CE1-CE1 3.88Å; H17-F109 AromaticContact ND1-CE1 3.69Å; H17-F109 AromaticContact ND1-CZ 3.89Å
18	P	93.3	Very high	90.3	Very high	92 Å²	92	59.4 Å²	59.4	60%	0.597	33%	0.326	S	S	*	.	H	α-helix	trans	-54.9	-35.3	-174.1	-29.3	35.1	0	0	0	114.7	L21 G22	P18-L21 PolarHBondContact O-N 3.03Å; P18-G22 PolarHBondContact O-N 3.26Å
19	R	93.8	Very high	90.4	Very high	126 Å²	126	61.1 Å²	61.1	48%	0.475	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-29.9	176.1	-65	-175.2	-171.5	177.5	2.5	113.7	H17 G22 A23 H108 F109	H17-R19 PolarHBondContact ND1-N 3.44Å; H17-R19 PolarHBondContact O-N 2.97Å; R19-G22 PolarHBondContact O-N 3.39Å; R19-A23 PolarHBondContact O-N 3.41Å; R19-H108 HydrophobicContact CB-CB 4.32Å; R19-H108 VanDerWaalsContact CD-O 3.28Å; R19-H108 WeakPolarHBondContact CD-O 3.18Å; R19-H108 PolarHBondContact NH1-O 2.76Å; R19-F109 HydrophobicContact CB-CE1 3.79Å; R19-F109 HydrophobicContact CB-CE2 4.28Å; R19-F109 HydrophobicContact CB-CZ 3.5Å; R19-F109 HydrophobicContact CG-CE1 4.45Å
20	V	93.7	Very high	90	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-67.8	-45	172.7	176.5	0	0	0	0	109.6	H17 G22 A23 L24 I65 F105 F109	H17-V20 HydrophobicContact CB-CG2 4.18Å; H17-V20 WeakPolarHBondContact O-CA 3.45Å; H17-V20 WeakPolarHBondContact O-CB 3.44Å; H17-V20 PolarHBondContact O-N 2.74Å; V20-G22 VanDerWaalsContact C-N 3.27Å; V20-G22 PolarHBondContact O-N 3.39Å; V20-A23 PolarHBondContact O-N 2.63Å; V20-L24 HydrophobicContact CG1-CD1 4.2Å; V20-L24 WeakPolarHBondContact O-CG 3.4Å; V20-L24 PolarHBondContact O-N 3.15Å; V20-I65 HydrophobicContact CG1-CG1 4.29Å; V20-I65 HydrophobicContact CG1-CG2 4.16Å; V20-F105 HydrophobicContact CG1-CD1 4.28Å; V20-F105 HydrophobicContact CG1-CE1 4.1Å; V20-F109 HydrophobicContact CG2-CE2 4.01Å; V20-F109 HydrophobicContact CG2-CZ 3.76Å
21	L	92.1	Very high	90.1	Very high	30 Å²	30	62.9 Å²	62.9	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-34.7	174.4	-63.6	174.5	0	0	0	112.4	W9 L16 H17 P18 L24 R25	W9-L21 HydrophobicContact CB-CD2 3.6Å; W9-L21 HydrophobicContact CG-CD2 4.43Å; L16-L21 HydrophobicContact CB-CD2 4.1Å; L16-L21 HydrophobicContact CB-CG 4.14Å; L16-L21 HydrophobicContact CD1-CD2 4Å; H17-L21 PolarHBondContact O-N 3.01Å; P18-L21 PolarHBondContact O-N 3.03Å; L21-L24 HydrophobicContact CD2-CD1 4.41Å; L21-R25 WeakPolarHBondContact O-CG 3.03Å; L21-R25 PolarHBondContact O-N 3.38Å; L21-R25 VanDerWaalsContact O-N 3.15Å; L21-R25 PolarHBondContact O-NE 3.41Å
22	G	91.6	Very high	90.2	Very high	20 Å²	20	59.4 Å²	59.4	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-50	171.9	0	0	0	0	0	112.2	P18 R19 V20 L24 R25 E26	P18-G22 PolarHBondContact O-N 3.26Å; R19-G22 PolarHBondContact O-N 3.39Å; V20-G22 VanDerWaalsContact C-N 3.27Å; V20-G22 PolarHBondContact O-N 3.39Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 3.47Å; G22-R25 WeakPolarHBondContact O-CB 3.41Å; G22-R25 PolarHBondContact O-N 2.99Å; G22-R25 VanDerWaalsContact O-N 3.16Å; G22-E26 PolarHBondContact O-N 3.36Å
23	A	92.6	Very high	90.3	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.008	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-39.3	177	0	0	0	0	0	112.7	R19 V20 R25 E26 L27 F105	R19-A23 PolarHBondContact O-N 3.41Å; V20-A23 PolarHBondContact O-N 2.63Å; A23-R25 VanDerWaalsContact C-N 3.34Å; A23-R25 PolarHBondContact O-N 3.38Å; A23-E26 PolarHBondContact O-N 3.27Å; A23-L27 WeakPolarHBondContact O-CB 3.5Å; A23-L27 VanDerWaalsContact O-CG 3.29Å; A23-L27 WeakPolarHBondContact O-CG 3.39Å; A23-L27 PolarHBondContact O-N 3.24Å; A23-F105 HydrophobicContact CB-CD1 3.52Å; A23-F105 HydrophobicContact CB-CE1 3.74Å; A23-F105 HydrophobicContact CB-CG 4.2Å
24	L	92	Very high	90.4	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-38.4	175.7	-72.8	165.3	0	0	0	112.8	W9 V20 L21 G22 L27 G28 F29 L61 I65 F105	W9-L24 HydrophobicContact CD2-CD1 3.55Å; W9-L24 HydrophobicContact CE3-CD1 3.75Å; W9-L24 HydrophobicContact CG-CD1 3.94Å; W9-L24 HydrophobicContact CH2-CD1 4.36Å; W9-L24 HydrophobicContact CH2-CD2 4.03Å; W9-L24 HydrophobicContact CZ2-CD1 4.18Å; W9-L24 HydrophobicContact CZ2-CD2 3.7Å; W9-L24 HydrophobicContact CZ3-CD1 4.15Å; V20-L24 HydrophobicContact CG1-CD1 4.2Å; V20-L24 WeakPolarHBondContact O-CG 3.4Å; V20-L24 PolarHBondContact O-N 3.15Å; L21-L24 HydrophobicContact CD2-CD1 4.41Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 3.47Å; L24-L27 PolarHBondContact O-N 3.16Å; L24-G28 PolarHBondContact O-N 2.98Å; L24-F29 PolarHBondContact O-N 3.04Å; L24-L61 HydrophobicContact CD2-CD1 4.18Å; L24-I65 HydrophobicContact CD1-CD1 4.14Å; L24-I65 HydrophobicContact CD2-CD1 4.08Å; L24-F105 HydrophobicContact CD2-CE1 4.17Å; L24-F105 HydrophobicContact CD2-CZ 3.93Å; L24-F105 HydrophobicContact CG-CE1 4.05Å; L24-F105 HydrophobicContact CG-CZ 4.31Å
25	R	90.1	Very high	90.5	Very high	181 Å²	181	56.6 Å²	56.6	68%	0.683	30%	0.298	S	S	*	.	H	α-helix	trans	-66.4	-43.2	174	-77.2	-178.5	-84.6	170.1	-11.3	112	L21 G22 A23 L27 G28	L21-R25 WeakPolarHBondContact O-CG 3.03Å; L21-R25 PolarHBondContact O-N 3.38Å; L21-R25 VanDerWaalsContact O-N 3.15Å; L21-R25 PolarHBondContact O-NE 3.41Å; G22-R25 WeakPolarHBondContact O-CB 3.41Å; G22-R25 PolarHBondContact O-N 2.99Å; G22-R25 VanDerWaalsContact O-N 3.16Å; A23-R25 VanDerWaalsContact C-N 3.34Å; A23-R25 PolarHBondContact O-N 3.38Å; R25-L27 VanDerWaalsContact C-N 3.26Å; R25-L27 PolarHBondContact O-N 2.91Å; R25-G28 PolarHBondContact O-N 3.32Å
26	E	91.1	Very high	90.6	Very high	111 Å²	111	52.3 Å²	52.3	52%	0.519	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-36.4	174.7	-71.9	176.1	-168.9	0	0	112.5	G22 A23 G28 K107 H108	G22-E26 PolarHBondContact O-N 3.36Å; A23-E26 PolarHBondContact O-N 3.27Å; E26-G28 PolarHBondContact O-N 2.99Å; E26-K107 VanDerWaalsContact OE2-CE 3.28Å; E26-K107 WeakPolarHBondContact OE2-CE 3.41Å; E26-K107 IonicContact OE2-NZ 2.61Å; E26-K107 PolarHBondContact OE2-NZ 2.86Å; E26-H108 IonicContact OE1-CE1 3.13Å; E26-H108 PolarHBondContact OE1-CE1 3.22Å; E26-H108 IonicContact OE1-NE2 2.72Å; E26-H108 PolarHBondContact OE1-NE2 2.82Å; E26-H108 IonicContact OE2-CE1 3.96Å; E26-H108 IonicContact OE2-NE2 2.69Å; E26-H108 PolarHBondContact OE2-NE2 3.06Å
27	L	88.2	Confident	90.5	Very high	47 Å²	47	52.7 Å²	52.7	25%	0.246	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-6.1	176.3	-71.1	171.4	0	0	0	113.4	A23 L24 R25 F29 H104 F105	A23-L27 WeakPolarHBondContact O-CB 3.5Å; A23-L27 VanDerWaalsContact O-CG 3.29Å; A23-L27 WeakPolarHBondContact O-CG 3.39Å; A23-L27 PolarHBondContact O-N 3.24Å; L24-L27 PolarHBondContact O-N 3.16Å; R25-L27 VanDerWaalsContact C-N 3.26Å; R25-L27 PolarHBondContact O-N 2.91Å; L27-F29 HydrophobicContact CB-CD2 3.53Å; L27-F29 HydrophobicContact CB-CE2 3.67Å; L27-F29 HydrophobicContact CB-CG 4.42Å; L27-F29 HydrophobicContact CD1-CD2 4.28Å; L27-F29 HydrophobicContact CD1-CE2 4.22Å; L27-F29 HydrophobicContact CG-CE2 4.43Å; L27-H104 HydrophobicContact CD1-CB 4.18Å; L27-H104 HydrophobicContact CD2-CB 4Å; L27-H104 HydrophobicContact CG-CB 4.36Å; L27-F105 HydrophobicContact CD1-CE2 3.72Å; L27-F105 HydrophobicContact CD1-CZ 3.74Å
28	G	88.3	Confident	90.4	Very high	52 Å²	52	51.2 Å²	51.2	54%	0.536	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	29.4	-179.9	0	0	0	0	0	113.8	L24 R25 E26 P30	L24-G28 PolarHBondContact O-N 2.98Å; R25-G28 PolarHBondContact O-N 3.32Å; E26-G28 PolarHBondContact O-N 2.99Å; G28-P30 VanDerWaalsContact C-CD 3.41Å; G28-P30 WeakPolarHBondContact O-CD 3.28Å
29	F	87.9	Confident	90.4	Very high	80 Å²	80	46.8 Å²	46.8	35%	0.351	24%	0.241	S	C	.	.			trans	-106.4	81.8	176.9	-60.2	-47.5	0	0	0	111	W9 L24 L27 Y31 L61	W9-F29 PolarHBondContact NE1-O 2.72Å; L24-F29 PolarHBondContact O-N 3.04Å; L27-F29 HydrophobicContact CB-CD2 3.53Å; L27-F29 HydrophobicContact CB-CE2 3.67Å; L27-F29 HydrophobicContact CB-CG 4.42Å; L27-F29 HydrophobicContact CD1-CD2 4.28Å; L27-F29 HydrophobicContact CD1-CE2 4.22Å; L27-F29 HydrophobicContact CG-CE2 4.43Å; F29-Y31 VanDerWaalsContact C-N 3.31Å; F29-Y31 PolarHBondContact O-N 3.02Å; F29-L61 HydrophobicContact CD2-CD1 3.71Å; F29-L61 HydrophobicContact CE2-CD1 3.94Å; F29-L61 HydrophobicContact CG-CD1 4.4Å
30	P	82.4	Confident	90.4	Very high	81 Å²	81	40.8 Å²	40.8	53%	0.526	22%	0.218	S	C	.	.			trans	-72.3	-22.8	-178	27	-34	0	0	0	113.9	G28	G28-P30 VanDerWaalsContact C-CD 3.41Å; G28-P30 WeakPolarHBondContact O-CD 3.28Å
31	Y	88.1	Confident	90.4	Very high	131 Å²	131	41.4 Å²	41.4	51%	0.514	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-131	156	-175.2	-54	-73.8	0	0	0	111.8	T5 G7 F29	T5-Y31 HydrophobicContact CG2-CG 4.36Å; G7-Y31 WeakPolarHBondContact O-CA 3.28Å; F29-Y31 VanDerWaalsContact C-N 3.31Å; F29-Y31 PolarHBondContact O-N 3.02Å
32	M	90.3	Very high	90.4	Very high	3 Å²	3	42 Å²	42	2%	0.015	23%	0.225	C	C	.	.			trans	-87	149.3	177.9	-64.9	-178.3	-63.6	0	0	112	T5 E6 G7 S8 W9 L12 Q36	T5-M32 CarbonylContact C-O 3.58Å; T5-M32 WeakPolarHBondContact CA-O 3.48Å; E6-M32 PolarHBondContact N-O 3.13Å; G7-M32 PolarHBondContact O-N 3.1Å; S8-M32 WeakPolarHBondContact O-CE 3.35Å; W9-M32 HydrophobicContact CD2-CG 3.38Å; W9-M32 HydrophobicContact CD2-SD 4.11Å; W9-M32 HydrophobicContact CE3-CG 3.31Å; W9-M32 HydrophobicContact CE3-SD 3.59Å; W9-M32 VanDerWaalsContact CE3-SD 3.59Å; W9-M32 HydrophobicContact CG-CG 4.05Å; W9-M32 HydrophobicContact CH2-CG 3.81Å; W9-M32 HydrophobicContact CZ2-CG 3.88Å; W9-M32 HydrophobicContact CZ3-CG 3.53Å; W9-M32 HydrophobicContact CZ3-SD 3.96Å; L12-M32 HydrophobicContact CD1-SD 3.57Å; L12-M32 VanDerWaalsContact CD1-SD 3.57Å; L12-M32 HydrophobicContact CD2-CE 3.72Å; L12-M32 HydrophobicContact CD2-SD 3.45Å; L12-M32 WeakPolarHBondContact CD2-SD 3.12Å; L12-M32 HydrophobicContact CG-CE 3.72Å; L12-M32 HydrophobicContact CG-SD 3.4Å; L12-M32 WeakPolarHBondContact CG-SD 3.28Å; M32-Q36 HydrophobicContact CB-CB 4.28Å
33	T	88.7	Confident	90.5	Very high	26 Å²	26	41 Å²	41	16%	0.16	22%	0.215	C	C	.	.			trans	-82.5	157.3	165	70.2	0	0	0	0	111.2	V35 Q36 S37 S57	T33-V35 PolarHBondContact O-N 2.92Å; T33-V35 VanDerWaalsContact O-N 3.14Å; T33-V35 WeakPolarHBondContact OG1-CG1 3.43Å; T33-Q36 WeakPolarHBondContact O-CA 3.35Å; T33-Q36 WeakPolarHBondContact O-CB 3.43Å; T33-Q36 PolarHBondContact O-N 3.14Å; T33-Q36 VanDerWaalsContact OG1-CG 3.28Å; T33-Q36 WeakPolarHBondContact OG1-CG 3.24Å; T33-Q36 PolarHBondContact OG1-NE2 3.06Å; T33-Q36 PolarHBondContact OG1-OE1 3.38Å; T33-S37 PolarHBondContact O-N 2.89Å; T33-S37 PolarHBondContact O-OG 3.33Å; T33-S57 WeakPolarHBondContact CB-O 3.46Å; T33-S57 PolarHBondContact OG1-O 3Å
34	P	88.4	Confident	90.4	Very high	33 Å²	33	42 Å²	42	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-56.1	-31.6	-179.3	-24.4	25.7	0	0	0	114.9	V4 E6 S37 A38 V225	V4-P34 WeakPolarHBondContact O-CD 3.45Å; E6-P34 HydrophobicContact CG-CB 4.01Å; E6-P34 HydrophobicContact CG-CG 3.97Å; P34-S37 WeakPolarHBondContact CA-OG 3.1Å; P34-S37 PolarHBondContact O-OG 2.53Å; P34-A38 VanDerWaalsContact O-CB 3.24Å; P34-A38 WeakPolarHBondContact O-CB 3.43Å; P34-A38 PolarHBondContact O-N 3.2Å; P34-V225 HydrophobicContact CB-CG1 3.64Å
35	V	89.6	Confident	90.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-72	-32.9	175	67.3	0	0	0	0	111.5	T33 T39 A53 S57 K59 V225	T33-V35 PolarHBondContact O-N 2.92Å; T33-V35 VanDerWaalsContact O-N 3.14Å; T33-V35 WeakPolarHBondContact OG1-CG1 3.43Å; V35-T39 WeakPolarHBondContact O-CB 3.16Å; V35-T39 PolarHBondContact O-N 3.32Å; V35-T39 PolarHBondContact O-OG1 2.98Å; V35-T39 VanDerWaalsContact O-OG1 3.06Å; V35-A53 HydrophobicContact CB-CB 3.92Å; V35-A53 HydrophobicContact CG1-CB 4.42Å; V35-A53 HydrophobicContact CG2-CB 3.7Å; V35-S57 WeakPolarHBondContact CG1-O 3.48Å; V35-K59 HydrophobicContact CG1-CG 4.48Å; V35-K59 HydrophobicContact CG2-CG 4.34Å; V35-V225 HydrophobicContact CB-CB 4.43Å; V35-V225 HydrophobicContact CB-CG2 4.07Å; V35-V225 HydrophobicContact CG2-CG2 4.34Å
36	Q	93.2	Very high	90.1	Very high	7 Å²	7	45.4 Å²	45.4	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-71.1	-49.8	178.6	-66.5	161.5	0.7	0	0	110.8	W9 M32 T33 A38 T39 I40 G58 A62	W9-Q36 HydrophobicContact CH2-CB 4.44Å; W9-Q36 VanDerWaalsContact CH2-OE1 3.31Å; M32-Q36 HydrophobicContact CB-CB 4.28Å; T33-Q36 WeakPolarHBondContact O-CA 3.35Å; T33-Q36 WeakPolarHBondContact O-CB 3.43Å; T33-Q36 PolarHBondContact O-N 3.14Å; T33-Q36 VanDerWaalsContact OG1-CG 3.28Å; T33-Q36 WeakPolarHBondContact OG1-CG 3.24Å; T33-Q36 PolarHBondContact OG1-NE2 3.06Å; T33-Q36 PolarHBondContact OG1-OE1 3.38Å; Q36-A38 VanDerWaalsContact C-N 3.31Å; Q36-A38 PolarHBondContact O-N 2.95Å; Q36-T39 PolarHBondContact O-N 2.67Å; Q36-I40 HydrophobicContact CB-CD1 3.92Å; Q36-I40 VanDerWaalsContact O-CB 3.26Å; Q36-I40 WeakPolarHBondContact O-CB 3.23Å; Q36-I40 WeakPolarHBondContact O-CD1 3.34Å; Q36-I40 WeakPolarHBondContact O-CG1 3.34Å; Q36-I40 PolarHBondContact O-N 3.2Å; Q36-G58 PolarHBondContact NE2-O 3.41Å; Q36-A62 HydrophobicContact CG-CB 4.06Å
37	S	91.5	Very high	90	Very high	18 Å²	18	44.7 Å²	44.7	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-40.2	177.4	52.1	0	0	0	0	112.4	E6 T33 P34 P41	E6-S37 WeakPolarHBondContact CB-OG 3.15Å; E6-S37 WeakPolarHBondContact OE2-CB 3.44Å; E6-S37 PolarHBondContact OE2-OG 2.96Å; T33-S37 PolarHBondContact O-N 2.89Å; T33-S37 PolarHBondContact O-OG 3.33Å; P34-S37 WeakPolarHBondContact CA-OG 3.1Å; P34-S37 PolarHBondContact O-OG 2.53Å; S37-P41 WeakPolarHBondContact O-CD 3.3Å; S37-P41 WeakPolarHBondContact O-CG 3.45Å
38	A	90.9	Very high	90.3	Very high	34 Å²	34	42.8 Å²	42.8	28%	0.281	23%	0.227	S	C	.	.	H	α-helix	trans	-74.9	-41.4	179.7	0	0	0	0	0	113	P34 Q36 L42 V223 V225	P34-A38 VanDerWaalsContact O-CB 3.24Å; P34-A38 WeakPolarHBondContact O-CB 3.43Å; P34-A38 PolarHBondContact O-N 3.2Å; Q36-A38 VanDerWaalsContact C-N 3.31Å; Q36-A38 PolarHBondContact O-N 2.95Å; A38-L42 WeakPolarHBondContact O-CD1 3.23Å; A38-V223 HydrophobicContact CB-CG1 3.65Å; A38-V225 HydrophobicContact CB-CG2 4.35Å
39	T	93.2	Very high	90.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-84	-42.5	-172.8	-64.7	0	0	0	0	113.5	V35 Q36 L42 F43 V49 A62 F201	V35-T39 WeakPolarHBondContact O-CB 3.16Å; V35-T39 PolarHBondContact O-N 3.32Å; V35-T39 PolarHBondContact O-OG1 2.98Å; V35-T39 VanDerWaalsContact O-OG1 3.06Å; Q36-T39 PolarHBondContact O-N 2.67Å; T39-L42 PolarHBondContact O-N 3.15Å; T39-F43 HydrophobicContact CG2-CB 4.49Å; T39-F43 WeakPolarHBondContact O-CB 3.26Å; T39-F43 PolarHBondContact O-N 3.47Å; T39-V49 HydrophobicContact CG2-CG1 3.88Å; T39-A62 HydrophobicContact CG2-CB 4.37Å; T39-F201 HydrophobicContact CG2-CE1 3.88Å; T39-F201 HydrophobicContact CG2-CZ 3.87Å
40	I	94.7	Very high	90.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-49.8	-170.2	-69.6	170.4	0	0	0	112.4	W9 L12 V14 Q36 L42 F43 M44 I65 P66	W9-I40 HydrophobicContact CZ3-CD1 3.74Å; L12-I40 HydrophobicContact CD1-CG2 4.09Å; V14-I40 HydrophobicContact CG2-CG2 4.39Å; Q36-I40 HydrophobicContact CB-CD1 3.92Å; Q36-I40 VanDerWaalsContact O-CB 3.26Å; Q36-I40 WeakPolarHBondContact O-CB 3.23Å; Q36-I40 WeakPolarHBondContact O-CD1 3.34Å; Q36-I40 WeakPolarHBondContact O-CG1 3.34Å; Q36-I40 PolarHBondContact O-N 3.2Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.44Å; I40-F43 PolarHBondContact O-N 3.49Å; I40-M44 HydrophobicContact CG2-SD 3.75Å; I40-M44 WeakPolarHBondContact O-CB 3.48Å; I40-M44 WeakPolarHBondContact O-CG 3.47Å; I40-M44 PolarHBondContact O-N 2.8Å; I40-I65 HydrophobicContact CD1-CB 4.36Å; I40-I65 HydrophobicContact CD1-CD1 4.01Å; I40-I65 HydrophobicContact CD1-CG2 4.4Å; I40-I65 HydrophobicContact CG2-CG2 4.41Å; I40-P66 HydrophobicContact CB-CG 4.24Å; I40-P66 HydrophobicContact CG1-CG 3.99Å; I40-P66 HydrophobicContact CG2-CG 4.18Å
41	P	92.8	Very high	91.1	Very high	12 Å²	12	33.3 Å²	33.3	8%	0.078	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-38.5	179.9	-25.6	36.7	0	0	0	113.9	L12 P13 V14 S37 R45	L12-P41 HydrophobicContact CD2-CG 3.85Å; P13-P41 HydrophobicContact CG-CB 3.75Å; P13-P41 HydrophobicContact CG-CG 3.66Å; V14-P41 HydrophobicContact CG1-CB 4.35Å; V14-P41 HydrophobicContact CG2-CB 4.28Å; V14-P41 HydrophobicContact CG2-CG 4.3Å; S37-P41 WeakPolarHBondContact O-CD 3.3Å; S37-P41 WeakPolarHBondContact O-CG 3.45Å; P41-R45 WeakPolarHBondContact O-CB 3.48Å; P41-R45 VanDerWaalsContact O-CG 3.23Å; P41-R45 WeakPolarHBondContact O-CG 3.44Å; P41-R45 PolarHBondContact O-N 3.31Å
42	L	92.6	Very high	91.1	Very high	43 Å²	43	29.1 Å²	29.1	23%	0.225	15%	0.15	C	C	.	.	H	α-helix	trans	-68.2	-45.2	-179.3	-65.4	174.5	0	0	0	110.4	A38 T39 I40 M44 R45 K47 V49 V221 V223	A38-L42 WeakPolarHBondContact O-CD1 3.23Å; T39-L42 PolarHBondContact O-N 3.15Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.44Å; L42-M44 VanDerWaalsContact C-N 3.32Å; L42-M44 PolarHBondContact O-N 3.14Å; L42-R45 PolarHBondContact O-N 3.22Å; L42-K47 HydrophobicContact CD2-CD 4.45Å; L42-K47 WeakPolarHBondContact O-CB 3.47Å; L42-V49 HydrophobicContact CB-CG2 4.03Å; L42-V221 HydrophobicContact CD1-CB 4.47Å; L42-V221 HydrophobicContact CD1-CG1 3.77Å; L42-V223 HydrophobicContact CD1-CG2 3.57Å
43	F	92.9	Very high	90.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.4	-33.7	-177.3	-157.9	-163	0	0	0	111.8	T39 I40 V49 F63 P66 V167 V169 R197 F201	T39-F43 HydrophobicContact CG2-CB 4.49Å; T39-F43 WeakPolarHBondContact O-CB 3.26Å; T39-F43 PolarHBondContact O-N 3.47Å; I40-F43 PolarHBondContact O-N 3.49Å; F43-V49 HydrophobicContact CB-CG2 3.96Å; F43-V49 HydrophobicContact CD2-CG2 4.2Å; F43-V49 HydrophobicContact CG-CG2 4.3Å; F43-F63 HydrophobicContact CE1-CB 4.19Å; F43-P66 HydrophobicContact CB-CB 4.07Å; F43-P66 HydrophobicContact CB-CG 4.15Å; F43-P66 HydrophobicContact CD1-CB 3.53Å; F43-P66 HydrophobicContact CD1-CG 3.86Å; F43-P66 HydrophobicContact CE1-CB 4.28Å; F43-P66 HydrophobicContact CG-CB 4.03Å; F43-P66 HydrophobicContact CG-CG 4.43Å; F43-V167 HydrophobicContact CE1-CG1 4.29Å; F43-V167 HydrophobicContact CE2-CG1 4.34Å; F43-V167 HydrophobicContact CZ-CG1 3.64Å; F43-V169 HydrophobicContact CE1-CG2 4.18Å; F43-V169 HydrophobicContact CZ-CG2 4.13Å; F43-R197 HydrophobicContact CE2-CB 4.09Å; F43-F201 HydrophobicContact CE1-CE2 4.4Å; F43-F201 HydrophobicContact CE1-CZ 4.5Å
44	M	91.5	Very high	90.2	Very high	21 Å²	21	28.8 Å²	28.8	10%	0.103	15%	0.148	C	C	.	.	H	α-helix	trans	-71.8	-24.8	173.7	-71	178.5	61.8	0	0	113.9	V14 L16 I40 L42 N46 P66 E69 R73	V14-M44 HydrophobicContact CB-CE 4.04Å; V14-M44 HydrophobicContact CB-SD 4.29Å; V14-M44 HydrophobicContact CG2-CE 4.05Å; V14-M44 HydrophobicContact CG2-SD 3.65Å; L16-M44 HydrophobicContact CD2-CE 4.32Å; L16-M44 HydrophobicContact CD2-SD 3.98Å; I40-M44 HydrophobicContact CG2-SD 3.75Å; I40-M44 WeakPolarHBondContact O-CB 3.48Å; I40-M44 WeakPolarHBondContact O-CG 3.47Å; I40-M44 PolarHBondContact O-N 2.8Å; L42-M44 VanDerWaalsContact C-N 3.32Å; L42-M44 PolarHBondContact O-N 3.14Å; M44-N46 VanDerWaalsContact C-N 3.28Å; M44-N46 PolarHBondContact O-N 2.96Å; M44-P66 HydrophobicContact CG-CB 4.03Å; M44-P66 HydrophobicContact CG-CG 4.36Å; M44-E69 HydrophobicContact CE-CB 3.63Å; M44-E69 HydrophobicContact CE-CG 3.76Å; M44-E69 HydrophobicContact CG-CB 4.42Å; M44-E69 HydrophobicContact SD-CB 4.04Å; M44-E69 HydrophobicContact SD-CG 4.01Å; M44-R73 VanDerWaalsContact CE-CZ 3.48Å
45	R	89.3	Confident	89.5	Confident	142 Å²	142	27.7 Å²	27.7	54%	0.536	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	35.5	-179	-71.7	176.6	-178.1	-175.3	1.3	113.5	P13 V14 P41 L42 K47	P13-R45 PolarHBondContact O-NH2 3.18Å; V14-R45 HydrophobicContact CG1-CG 4.48Å; P41-R45 WeakPolarHBondContact O-CB 3.48Å; P41-R45 VanDerWaalsContact O-CG 3.23Å; P41-R45 WeakPolarHBondContact O-CG 3.44Å; P41-R45 PolarHBondContact O-N 3.31Å; L42-R45 PolarHBondContact O-N 3.22Å; R45-K47 VanDerWaalsContact C-N 3.26Å; R45-K47 PolarHBondContact O-N 3.4Å
46	N	85.6	Confident	88.6	Confident	111 Å²	111	29 Å²	29	59%	0.594	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	22.5	176.5	-54.1	-28.6	0	0	0	115.7	M44 R197	M44-N46 VanDerWaalsContact C-N 3.28Å; M44-N46 PolarHBondContact O-N 2.96Å; N46-R197 PolarHBondContact OD1-NE 3.11Å; N46-R197 PolarHBondContact OD1-NH2 3.36Å
47	K	90.1	Very high	87.9	Confident	96 Å²	96	29.7 Å²	29.7	42%	0.417	16%	0.16	S	C	.	.			trans	-98.9	143.8	175.5	-56.5	-161.3	-179.4	-174.3	0	111.1	L42 R45 V221	L42-K47 HydrophobicContact CD2-CD 4.45Å; L42-K47 WeakPolarHBondContact O-CB 3.47Å; R45-K47 VanDerWaalsContact C-N 3.26Å; R45-K47 PolarHBondContact O-N 3.4Å; K47-V221 HydrophobicContact CB-CG2 4.3Å; K47-V221 HydrophobicContact CD-CG2 3.4Å; K47-V221 VanDerWaalsContact CD-CG2 3.4Å; K47-V221 HydrophobicContact CG-CG2 4.47Å
48	D	93.8	Very high	87.6	Confident	8 Å²	8	30.1 Å²	30.1	4%	0.043	17%	0.167	C	C	.	.			trans	-72.3	140.7	162.4	-75.8	6	0	0	0	108.8	R197 T198 L217 R218 P220 V221	D48-R197 VanDerWaalsContact OD1-CA 3.27Å; D48-R197 WeakPolarHBondContact OD1-CA 3.37Å; D48-T198 VanDerWaalsContact CA-O 3.31Å; D48-T198 WeakPolarHBondContact CA-O 3.19Å; D48-T198 WeakPolarHBondContact CB-O 3.44Å; D48-T198 PolarHBondContact OD1-N 2.89Å; D48-L217 HydrophobicContact CB-CB 3.99Å; D48-L217 HydrophobicContact CB-CD2 4.06Å; D48-L217 HydrophobicContact CB-CG 4Å; D48-L217 VanDerWaalsContact OD2-CA 3.28Å; D48-L217 WeakPolarHBondContact OD2-CA 3.29Å; D48-R218 PolarHBondContact OD2-N 2.99Å; D48-P220 HydrophobicContact CB-CB 4.42Å; D48-P220 WeakPolarHBondContact O-CA 3.41Å; D48-V221 PolarHBondContact O-N 3.28Å
49	V	93.1	Very high	87.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.4	-175.4	-178.6	0	0	0	0	109.9	T39 L42 F43 A51 T198 G199 L200 V221 V223	T39-V49 HydrophobicContact CG2-CG1 3.88Å; L42-V49 HydrophobicContact CB-CG2 4.03Å; F43-V49 HydrophobicContact CB-CG2 3.96Å; F43-V49 HydrophobicContact CD2-CG2 4.2Å; F43-V49 HydrophobicContact CG-CG2 4.3Å; V49-A51 HydrophobicContact CG1-CB 4.22Å; V49-T198 PolarHBondContact N-O 2.69Å; V49-G199 CarbonylContact O-C 3.54Å; V49-G199 WeakPolarHBondContact O-CA 3.21Å; V49-L200 PolarHBondContact O-N 3.28Å; V49-V221 WeakPolarHBondContact CA-O 3.36Å; V49-V223 HydrophobicContact CG1-CG2 3.97Å
50	A	92.3	Very high	87.6	Confident	12 Å²	12	30.8 Å²	30.8	10%	0.099	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	103.7	164.5	0	0	0	0	0	108	L200 V213 L217 V221 R222 V223	A50-L200 CarbonylContact C-O 3.31Å; A50-L200 WeakPolarHBondContact CA-O 3.43Å; A50-V213 HydrophobicContact CB-CG1 4.49Å; A50-V213 HydrophobicContact CB-CG2 4.01Å; A50-L217 HydrophobicContact CB-CD2 4.27Å; A50-V221 PolarHBondContact N-O 2.86Å; A50-R222 WeakPolarHBondContact O-CA 3.5Å; A50-V223 PolarHBondContact O-N 3.26Å
51	A	90.6	Very high	87.6	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.017	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.5	-177.4	0	0	0	0	0	111.1	V49 L200 F201 S202 V223	V49-A51 HydrophobicContact CG1-CB 4.22Å; A51-L200 PolarHBondContact N-O 3.35Å; A51-F201 HydrophobicContact CB-CD1 3.63Å; A51-F201 HydrophobicContact CB-CE1 3.64Å; A51-F201 HydrophobicContact CB-CG 4.43Å; A51-F201 HydrophobicContact CB-CZ 4.44Å; A51-S202 PolarHBondContact O-N 2.93Å; A51-V223 CarbonylContact C-O 3.32Å; A51-V223 WeakPolarHBondContact CA-O 3.35Å
52	E	87.4	Confident	87.6	Confident	43 Å²	43	30.8 Å²	30.8	20%	0.201	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.1	172.4	-175.7	-169.1	-162.9	0	0	109	S202 V223 S224 V225	E52-S202 WeakPolarHBondContact CA-O 3.42Å; E52-V223 PolarHBondContact N-O 3.47Å; E52-S224 PolarHBondContact OE2-OG 3.37Å; E52-V225 PolarHBondContact O-N 2.93Å
53	A	83.6	Confident	87.8	Confident	2 Å²	2	28.8 Å²	28.8	2%	0.017	16%	0.155	C	C	.	.			trans	-153.9	151.3	173.8	0	0	0	0	0	110.6	V35 S57 K59 S202 A203 V225	V35-A53 HydrophobicContact CB-CB 3.92Å; V35-A53 HydrophobicContact CG1-CB 4.42Å; V35-A53 HydrophobicContact CG2-CB 3.7Å; A53-S57 VanDerWaalsContact CB-OG 3.31Å; A53-S57 WeakPolarHBondContact CB-OG 3.22Å; A53-K59 HydrophobicContact CB-CD 4.29Å; A53-K59 HydrophobicContact CB-CG 4.24Å; A53-K59 PolarHBondContact O-NZ 3.07Å; A53-S202 PolarHBondContact N-O 3.03Å; A53-A203 WeakPolarHBondContact O-CA 3.49Å; A53-V225 HydrophobicContact CB-CB 4.36Å
54	V	76.6	Confident	88	Confident	20 Å²	20	28.8 Å²	28.8	12%	0.121	16%	0.155	C	C	.	.			trans	-55.3	157.5	-179.7	-62.4	0	0	0	0	113	S57 K59	V54-S57 VanDerWaalsContact O-CB 3.28Å; V54-S57 WeakPolarHBondContact O-CB 3.44Å; V54-S57 PolarHBondContact O-N 2.75Å; V54-S57 PolarHBondContact O-OG 3.29Å; V54-K59 PolarHBondContact O-NZ 3.26Å
55	T	74.4	Confident	88.2	Confident	9 Å²	9	27.8 Å²	27.8	6%	0.055	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	141.6	173.8	44.9	0	0	0	0	110.2	S57 A203 G357	T55-S57 VanDerWaalsContact C-N 3.29Å; T55-S57 PolarHBondContact O-N 3.06Å; T55-A203 HydrophobicContact CG2-CB 3.91Å; T55-G357 WeakPolarHBondContact OG1-CA 3.26Å
56	G	71.5	Confident	88.5	Confident	28 Å²	28	21 Å²	21	29%	0.289	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	4.9	-176.9	0	0	0	0	0	115.8	G58	G56-G58 PolarHBondContact O-N 2.67Å
57	S	78.1	Confident	89	Confident	23 Å²	23	15.7 Å²	15.7	16%	0.161	10%	0.096	C	C	.	.	S	Bend	trans	-75	-0.2	178.1	64.7	0	0	0	0	115.5	T33 V35 A53 V54 T55	T33-S57 WeakPolarHBondContact CB-O 3.46Å; T33-S57 PolarHBondContact OG1-O 3Å; V35-S57 WeakPolarHBondContact CG1-O 3.48Å; A53-S57 VanDerWaalsContact CB-OG 3.31Å; A53-S57 WeakPolarHBondContact CB-OG 3.22Å; V54-S57 VanDerWaalsContact O-CB 3.28Å; V54-S57 WeakPolarHBondContact O-CB 3.44Å; V54-S57 PolarHBondContact O-N 2.75Å; V54-S57 PolarHBondContact O-OG 3.29Å; T55-S57 VanDerWaalsContact C-N 3.29Å; T55-S57 PolarHBondContact O-N 3.06Å
58	G	85.5	Confident	89.2	Confident	26 Å²	26	11.1 Å²	11.1	27%	0.268	8%	0.076	S	C	.	.			trans	84.6	24.4	-178.8	0	0	0	0	0	115.3	Q36 G56 T60 L61	Q36-G58 PolarHBondContact NE2-O 3.41Å; G56-G58 PolarHBondContact O-N 2.67Å; G58-T60 PolarHBondContact O-N 2.97Å; G58-L61 PolarHBondContact O-N 3.2Å
59	K	90.3	Very high	89.3	Confident	20 Å²	20	11 Å²	11	9%	0.087	8%	0.075	C	C	.	.	H	α-helix	trans	-52	-34.6	177.7	-71.6	-172.2	-70.1	-78.6	0	114.2	V35 A53 V54 L61 A62 F63 F201	V35-K59 HydrophobicContact CG1-CG 4.48Å; V35-K59 HydrophobicContact CG2-CG 4.34Å; A53-K59 HydrophobicContact CB-CD 4.29Å; A53-K59 HydrophobicContact CB-CG 4.24Å; A53-K59 PolarHBondContact O-NZ 3.07Å; V54-K59 PolarHBondContact O-NZ 3.26Å; K59-L61 PolarHBondContact O-N 3.18Å; K59-A62 WeakPolarHBondContact O-CA 3.15Å; K59-A62 VanDerWaalsContact O-CB 3.25Å; K59-A62 WeakPolarHBondContact O-CB 3.49Å; K59-A62 PolarHBondContact O-N 3.36Å; K59-F63 WeakPolarHBondContact O-CD1 2.99Å; K59-F63 PolarHBondContact O-N 3.44Å; K59-F201 HydrophobicContact CB-CD1 4.28Å; K59-F201 HydrophobicContact CD-CB 4.39Å; K59-F201 HydrophobicContact CD-CD1 4.45Å; K59-F201 HydrophobicContact CG-CD1 4.48Å
60	T	93.1	Very high	89.4	Confident	28 Å²	28	11.4 Å²	11.4	17%	0.172	8%	0.077	C	C	.	.	H	α-helix	trans	-57	-47.4	-178.2	-49.9	0	0	0	0	112.3	G58 A62 F63 V64 I98 V101	G58-T60 PolarHBondContact O-N 2.97Å; T60-A62 VanDerWaalsContact C-N 3.26Å; T60-A62 PolarHBondContact O-N 3.29Å; T60-F63 HydrophobicContact CG2-CE2 4.22Å; T60-F63 HydrophobicContact CG2-CZ 3.96Å; T60-F63 WeakPolarHBondContact O-CD2 3.28Å; T60-F63 PolarHBondContact O-N 3.26Å; T60-V64 HydrophobicContact CG2-CG2 4.11Å; T60-V64 WeakPolarHBondContact O-CB 3.34Å; T60-V64 VanDerWaalsContact O-CG2 3.28Å; T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.26Å; T60-I98 HydrophobicContact CG2-CG1 4.25Å; T60-V101 HydrophobicContact CG2-CB 4.26Å; T60-V101 HydrophobicContact CG2-CG1 4.01Å; T60-V101 HydrophobicContact CG2-CG2 4.41Å
61	L	94.1	Very high	89.5	Confident	13 Å²	13	11.1 Å²	11.1	7%	0.068	7%	0.074	C	C	.	.	H	α-helix	trans	-68.7	-27.4	176.8	-66	-179.2	0	0	0	112.4	L24 F29 G58 K59 F63 I65 V101 F105	L24-L61 HydrophobicContact CD2-CD1 4.18Å; F29-L61 HydrophobicContact CD2-CD1 3.71Å; F29-L61 HydrophobicContact CE2-CD1 3.94Å; F29-L61 HydrophobicContact CG-CD1 4.4Å; G58-L61 PolarHBondContact O-N 3.2Å; K59-L61 PolarHBondContact O-N 3.18Å; L61-F63 PolarHBondContact O-N 3.35Å; L61-I65 HydrophobicContact CB-CD1 4.12Å; L61-I65 WeakPolarHBondContact O-CB 3.21Å; L61-I65 WeakPolarHBondContact O-CG1 3.42Å; L61-I65 PolarHBondContact O-N 3.36Å; L61-V101 HydrophobicContact CD2-CG1 3.95Å; L61-F105 HydrophobicContact CD2-CE2 3.69Å; L61-F105 HydrophobicContact CD2-CZ 3.68Å
62	A	94.3	Very high	89.6	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65	-20.6	178.1	0	0	0	0	0	113.2	Q36 T39 K59 T60 P66 F201	Q36-A62 HydrophobicContact CG-CB 4.06Å; T39-A62 HydrophobicContact CG2-CB 4.37Å; K59-A62 WeakPolarHBondContact O-CA 3.15Å; K59-A62 VanDerWaalsContact O-CB 3.25Å; K59-A62 WeakPolarHBondContact O-CB 3.49Å; K59-A62 PolarHBondContact O-N 3.36Å; T60-A62 VanDerWaalsContact C-N 3.26Å; T60-A62 PolarHBondContact O-N 3.29Å; A62-P66 WeakPolarHBondContact O-CD 3.49Å; A62-P66 VanDerWaalsContact O-CG 3.29Å; A62-P66 WeakPolarHBondContact O-CG 3.25Å; A62-F201 HydrophobicContact CB-CE1 4.14Å
63	F	95.6	Very high	89.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-110.5	-30.9	171	59.9	-108	0	0	0	114.8	F43 K59 T60 L61 I65 P66 I67 I87 I98 V169 D171 F201	F43-F63 HydrophobicContact CE1-CB 4.19Å; K59-F63 WeakPolarHBondContact O-CD1 2.99Å; K59-F63 PolarHBondContact O-N 3.44Å; T60-F63 HydrophobicContact CG2-CE2 4.22Å; T60-F63 HydrophobicContact CG2-CZ 3.96Å; T60-F63 WeakPolarHBondContact O-CD2 3.28Å; T60-F63 PolarHBondContact O-N 3.26Å; L61-F63 PolarHBondContact O-N 3.35Å; F63-I65 PolarHBondContact O-N 2.99Å; F63-P66 WeakPolarHBondContact O-CD 3.45Å; F63-I67 HydrophobicContact CD2-CD1 4.31Å; F63-I67 WeakPolarHBondContact O-CD1 3.32Å; F63-I67 VanDerWaalsContact O-CG1 3.23Å; F63-I67 WeakPolarHBondContact O-CG1 3.23Å; F63-I67 PolarHBondContact O-N 2.77Å; F63-I67 VanDerWaalsContact O-N 3.08Å; F63-I87 HydrophobicContact CD2-CD1 4.35Å; F63-I87 HydrophobicContact CE2-CD1 4.13Å; F63-I87 HydrophobicContact CE2-CG2 4.17Å; F63-I98 HydrophobicContact CE2-CG2 4.19Å; F63-I98 HydrophobicContact CZ-CD1 4.19Å; F63-I98 HydrophobicContact CZ-CG1 4.43Å; F63-V169 HydrophobicContact CB-CG1 4.25Å; F63-V169 HydrophobicContact CB-CG2 4.06Å; F63-V169 HydrophobicContact CD1-CG1 4.09Å; F63-V169 HydrophobicContact CD2-CG1 4.09Å; F63-V169 HydrophobicContact CE1-CG1 4.39Å; F63-V169 HydrophobicContact CE2-CG1 4.44Å; F63-V169 HydrophobicContact CG-CG1 3.92Å; F63-V169 HydrophobicContact CG-CG2 4.44Å; F63-D171 HydrophobicContact CE1-CB 4.31Å; F63-D171 HydrophobicContact CZ-CB 4.38Å; F63-F201 HydrophobicContact CB-CD2 4.29Å; F63-F201 HydrophobicContact CB-CE1 4.3Å; F63-F201 HydrophobicContact CB-CE2 3.56Å; F63-F201 HydrophobicContact CB-CZ 3.58Å; F63-F201 HydrophobicContact CD1-CD1 4.04Å; F63-F201 AromaticContact CD1-CD2 3.79Å; F63-F201 HydrophobicContact CD1-CD2 3.79Å; F63-F201 HydrophobicContact CD1-CE1 4.13Å; F63-F201 AromaticContact CD1-CE2 3.9Å; F63-F201 HydrophobicContact CD1-CE2 3.9Å; F63-F201 AromaticContact CD1-CG 3.88Å; F63-F201 HydrophobicContact CD1-CG 3.88Å; F63-F201 HydrophobicContact CD1-CZ 4.09Å; F63-F201 HydrophobicContact CE1-CG 4.44Å; F63-F201 HydrophobicContact CG-CD2 4.41Å; F63-F201 HydrophobicContact CG-CE2 4.15Å; F63-F201 HydrophobicContact CG-CZ 4.35Å
64	V	96.4	Very high	90.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.9	-43.1	178.4	167	0	0	0	0	111.2	T60 I67 L68 L102 F105	T60-V64 HydrophobicContact CG2-CG2 4.11Å; T60-V64 WeakPolarHBondContact O-CB 3.34Å; T60-V64 VanDerWaalsContact O-CG2 3.28Å; T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.26Å; V64-I67 PolarHBondContact O-N 3.04Å; V64-L68 HydrophobicContact CG1-CD1 4.1Å; V64-L68 WeakPolarHBondContact O-CG 3.46Å; V64-L68 PolarHBondContact O-N 3.18Å; V64-L102 HydrophobicContact CG1-CD1 3.88Å; V64-F105 HydrophobicContact CG1-CD2 3.92Å; V64-F105 HydrophobicContact CG1-CE2 4.15Å; V64-F105 HydrophobicContact CG1-CG 4.47Å
65	I	95.8	Very high	90.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.7	-52.1	-179.1	-66.3	165.4	0	0	0	111	W9 L16 V20 L24 I40 L61 F63 I67 L68 E69	W9-I65 HydrophobicContact CE3-CD1 4.16Å; W9-I65 HydrophobicContact CH2-CD1 3.57Å; W9-I65 HydrophobicContact CZ3-CD1 3.29Å; L16-I65 HydrophobicContact CD1-CG2 4.2Å; L16-I65 HydrophobicContact CD2-CG2 3.87Å; V20-I65 HydrophobicContact CG1-CG1 4.29Å; V20-I65 HydrophobicContact CG1-CG2 4.16Å; L24-I65 HydrophobicContact CD1-CD1 4.14Å; L24-I65 HydrophobicContact CD2-CD1 4.08Å; I40-I65 HydrophobicContact CD1-CB 4.36Å; I40-I65 HydrophobicContact CD1-CD1 4.01Å; I40-I65 HydrophobicContact CD1-CG2 4.4Å; I40-I65 HydrophobicContact CG2-CG2 4.41Å; L61-I65 HydrophobicContact CB-CD1 4.12Å; L61-I65 WeakPolarHBondContact O-CB 3.21Å; L61-I65 WeakPolarHBondContact O-CG1 3.42Å; L61-I65 PolarHBondContact O-N 3.36Å; F63-I65 PolarHBondContact O-N 2.99Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.31Å; I65-L68 PolarHBondContact O-N 2.75Å; I65-E69 HydrophobicContact CG2-CG 4.36Å; I65-E69 WeakPolarHBondContact O-CG 3.48Å; I65-E69 PolarHBondContact O-N 3.42Å
66	P	95.7	Very high	91.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.4	-40.1	175.2	-30.3	38.4	0	0	0	113.7	I40 F43 M44 A62 F63 L68 E69 I70	I40-P66 HydrophobicContact CB-CG 4.24Å; I40-P66 HydrophobicContact CG1-CG 3.99Å; I40-P66 HydrophobicContact CG2-CG 4.18Å; F43-P66 HydrophobicContact CB-CB 4.07Å; F43-P66 HydrophobicContact CB-CG 4.15Å; F43-P66 HydrophobicContact CD1-CB 3.53Å; F43-P66 HydrophobicContact CD1-CG 3.86Å; F43-P66 HydrophobicContact CE1-CB 4.28Å; F43-P66 HydrophobicContact CG-CB 4.03Å; F43-P66 HydrophobicContact CG-CG 4.43Å; M44-P66 HydrophobicContact CG-CB 4.03Å; M44-P66 HydrophobicContact CG-CG 4.36Å; A62-P66 WeakPolarHBondContact O-CD 3.49Å; A62-P66 VanDerWaalsContact O-CG 3.29Å; A62-P66 WeakPolarHBondContact O-CG 3.25Å; F63-P66 WeakPolarHBondContact O-CD 3.45Å; P66-L68 VanDerWaalsContact C-N 3.33Å; P66-L68 PolarHBondContact O-N 3.04Å; P66-E69 PolarHBondContact O-N 3.19Å; P66-I70 HydrophobicContact CB-CD1 4.33Å; P66-I70 VanDerWaalsContact O-CB 3.24Å; P66-I70 WeakPolarHBondContact O-CB 3.28Å; P66-I70 WeakPolarHBondContact O-CD1 3.24Å; P66-I70 WeakPolarHBondContact O-CG1 3.04Å; P66-I70 PolarHBondContact O-N 3.48Å
67	I	96.4	Very high	92.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-54.3	-52.2	176.5	-75.5	165.5	0	0	0	110.2	F63 V64 I65 I70 L71 A85 I87 I137 V167 V169	F63-I67 HydrophobicContact CD2-CD1 4.31Å; F63-I67 WeakPolarHBondContact O-CD1 3.32Å; F63-I67 VanDerWaalsContact O-CG1 3.23Å; F63-I67 WeakPolarHBondContact O-CG1 3.23Å; F63-I67 PolarHBondContact O-N 2.77Å; F63-I67 VanDerWaalsContact O-N 3.08Å; V64-I67 PolarHBondContact O-N 3.04Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.31Å; I67-I70 PolarHBondContact O-N 2.96Å; I67-L71 HydrophobicContact CG2-CD1 4.14Å; I67-L71 VanDerWaalsContact O-CG 3.27Å; I67-L71 WeakPolarHBondContact O-CG 3.29Å; I67-L71 PolarHBondContact O-N 3.23Å; I67-A85 HydrophobicContact CG1-CB 4.33Å; I67-A85 HydrophobicContact CG2-CB 3.56Å; I67-I87 HydrophobicContact CD1-CD1 3.69Å; I67-I87 HydrophobicContact CD1-CG1 3.7Å; I67-I137 HydrophobicContact CG2-CD1 4.1Å; I67-I137 HydrophobicContact CG2-CG1 4.45Å; I67-I137 HydrophobicContact CG2-CG2 4.48Å; I67-V167 HydrophobicContact CG1-CB 4.32Å; I67-V167 HydrophobicContact CG1-CG1 3.78Å; I67-V169 HydrophobicContact CD1-CG2 3.88Å; I67-V169 HydrophobicContact CG1-CG2 4.47Å
68	L	95.6	Very high	93	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-46.9	-177.9	-66.3	166.2	0	0	0	111.7	V64 I65 P66 I70 L71 L72 L102 F105 T106 F112 I137	V64-L68 HydrophobicContact CG1-CD1 4.1Å; V64-L68 WeakPolarHBondContact O-CG 3.46Å; V64-L68 PolarHBondContact O-N 3.18Å; I65-L68 PolarHBondContact O-N 2.75Å; P66-L68 VanDerWaalsContact C-N 3.33Å; P66-L68 PolarHBondContact O-N 3.04Å; L68-I70 VanDerWaalsContact C-N 3.33Å; L68-I70 PolarHBondContact O-N 2.87Å; L68-L71 PolarHBondContact O-N 3.32Å; L68-L72 WeakPolarHBondContact O-CB 3.35Å; L68-L72 WeakPolarHBondContact O-CG 3.27Å; L68-L72 PolarHBondContact O-N 3.38Å; L68-L102 HydrophobicContact CD2-CD1 4.43Å; L68-F105 HydrophobicContact CD1-CB 3.35Å; L68-F105 HydrophobicContact CD1-CD1 3.93Å; L68-F105 HydrophobicContact CD1-CG 3.7Å; L68-T106 HydrophobicContact CD2-CG2 4.21Å; L68-F112 HydrophobicContact CD2-CD2 4.33Å; L68-I137 HydrophobicContact CD2-CD1 3.95Å
69	E	95.2	Very high	93.2	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-41.6	179	-73.7	-64.4	147	0	0	112.8	L16 H17 M44 I65 P66 L72 R73	L16-E69 HydrophobicContact CD2-CG 3.88Å; H17-E69 VanDerWaalsContact CB-OE1 3.3Å; H17-E69 WeakPolarHBondContact CB-OE1 3.32Å; H17-E69 PolarHBondContact N-OE1 3.02Å; M44-E69 HydrophobicContact CE-CB 3.63Å; M44-E69 HydrophobicContact CE-CG 3.76Å; M44-E69 HydrophobicContact CG-CB 4.42Å; M44-E69 HydrophobicContact SD-CB 4.04Å; M44-E69 HydrophobicContact SD-CG 4.01Å; I65-E69 HydrophobicContact CG2-CG 4.36Å; I65-E69 WeakPolarHBondContact O-CG 3.48Å; I65-E69 PolarHBondContact O-N 3.42Å; P66-E69 PolarHBondContact O-N 3.19Å; E69-L72 PolarHBondContact O-N 3.2Å; E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 VanDerWaalsContact O-CG 3.23Å; E69-R73 WeakPolarHBondContact O-CG 3.27Å; E69-R73 PolarHBondContact O-N 3.03Å; E69-R73 VanDerWaalsContact O-N 3.14Å; E69-R73 IonicContact OE2-CZ 2.93Å; E69-R73 IonicContact OE2-NE 2.8Å; E69-R73 PolarHBondContact OE2-NE 3.34Å; E69-R73 IonicContact OE2-NH2 3.04Å; E69-R73 PolarHBondContact OE2-NH2 3.08Å
70	I	94.3	Very high	93.1	Very high	9 Å²	9	54.4 Å²	54.4	5%	0.046	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-47.4	178.7	-70.8	168.5	0	0	0	110.1	P66 I67 L68 L72 R73 D166 V167	P66-I70 HydrophobicContact CB-CD1 4.33Å; P66-I70 VanDerWaalsContact O-CB 3.24Å; P66-I70 WeakPolarHBondContact O-CB 3.28Å; P66-I70 WeakPolarHBondContact O-CD1 3.24Å; P66-I70 WeakPolarHBondContact O-CG1 3.04Å; P66-I70 PolarHBondContact O-N 3.48Å; I67-I70 PolarHBondContact O-N 2.96Å; L68-I70 VanDerWaalsContact C-N 3.33Å; L68-I70 PolarHBondContact O-N 2.87Å; I70-L72 VanDerWaalsContact C-N 3.33Å; I70-L72 PolarHBondContact O-N 3.41Å; I70-R73 PolarHBondContact O-N 3.41Å; I70-D166 HydrophobicContact CG2-CB 4.11Å; I70-V167 HydrophobicContact CB-CG2 4.25Å; I70-V167 HydrophobicContact CD1-CG2 3.81Å; I70-V167 HydrophobicContact CG2-CG2 3.77Å
71	L	94.5	Very high	92.8	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-32.5	-179.7	-63.5	-175	0	0	0	112.5	I67 L68 R74 L78 A85 F112 I137	I67-L71 HydrophobicContact CG2-CD1 4.14Å; I67-L71 VanDerWaalsContact O-CG 3.27Å; I67-L71 WeakPolarHBondContact O-CG 3.29Å; I67-L71 PolarHBondContact O-N 3.23Å; L68-L71 PolarHBondContact O-N 3.32Å; L71-R74 WeakPolarHBondContact O-CG 3.19Å; L71-L78 HydrophobicContact CD1-CD1 4.37Å; L71-L78 HydrophobicContact CD2-CD1 4.01Å; L71-A85 HydrophobicContact CD1-CB 4.19Å; L71-F112 HydrophobicContact CB-CE1 3.86Å; L71-F112 HydrophobicContact CB-CE2 4.38Å; L71-F112 HydrophobicContact CB-CZ 3.62Å; L71-I137 HydrophobicContact CD1-CD1 4.05Å; L71-I137 HydrophobicContact CD1-CG1 3.77Å
72	L	93.6	Very high	92.8	Very high	43 Å²	43	58.3 Å²	58.3	23%	0.225	27%	0.266	C	S	.	.	H	α-helix	trans	-70.5	-29	176.7	-74.6	168.5	0	0	0	113.4	H17 L68 E69 I70 R74 F109 F112	H17-L72 HydrophobicContact CB-CD1 4.13Å; L68-L72 WeakPolarHBondContact O-CB 3.35Å; L68-L72 WeakPolarHBondContact O-CG 3.27Å; L68-L72 PolarHBondContact O-N 3.38Å; E69-L72 PolarHBondContact O-N 3.2Å; I70-L72 VanDerWaalsContact C-N 3.33Å; I70-L72 PolarHBondContact O-N 3.41Å; L72-R74 VanDerWaalsContact C-N 3.34Å; L72-F109 HydrophobicContact CD1-CD1 4.16Å; L72-F109 HydrophobicContact CD1-CE1 3.57Å; L72-F109 HydrophobicContact CD1-CZ 3.8Å; L72-F109 HydrophobicContact CD2-CD1 3.79Å; L72-F109 HydrophobicContact CD2-CE1 3.93Å; L72-F109 HydrophobicContact CG-CE1 4.39Å; L72-F112 HydrophobicContact CD2-CE2 3.56Å; L72-F112 HydrophobicContact CD2-CZ 3.78Å; L72-F112 HydrophobicContact CG-CE2 3.74Å; L72-F112 HydrophobicContact CG-CZ 3.96Å
73	R	92.3	Very high	92.9	Very high	139 Å²	139	58.3 Å²	58.3	53%	0.525	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	4	-178.3	-68.9	173.1	-162.2	-141.4	-3.8	114	S15 M44 E69 I70 E75	S15-R73 PolarHBondContact O-NH2 3.19Å; M44-R73 VanDerWaalsContact CE-CZ 3.48Å; E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 VanDerWaalsContact O-CG 3.23Å; E69-R73 WeakPolarHBondContact O-CG 3.27Å; E69-R73 PolarHBondContact O-N 3.03Å; E69-R73 VanDerWaalsContact O-N 3.14Å; E69-R73 IonicContact OE2-CZ 2.93Å; E69-R73 IonicContact OE2-NE 2.8Å; E69-R73 PolarHBondContact OE2-NE 3.34Å; E69-R73 IonicContact OE2-NH2 3.04Å; E69-R73 PolarHBondContact OE2-NH2 3.08Å; I70-R73 PolarHBondContact O-N 3.41Å; R73-E75 PolarHBondContact O-N 3.36Å
74	R	90.8	Very high	92.9	Very high	59 Å²	59	58.3 Å²	58.3	22%	0.223	27%	0.266	C	S	.	.			trans	-64	136.2	175.6	-65.4	177.8	73.3	131.1	4.4	109.7	L71 L72 E76 S164 D166	L71-R74 WeakPolarHBondContact O-CG 3.19Å; L72-R74 VanDerWaalsContact C-N 3.34Å; R74-E76 VanDerWaalsContact C-N 3.35Å; R74-E76 VanDerWaalsContact CB-O 3.31Å; R74-E76 WeakPolarHBondContact CB-O 3.48Å; R74-S164 PolarHBondContact NH1-O 3.4Å; R74-S164 PolarHBondContact NH2-O 3.4Å; R74-S164 VanDerWaalsContact NH2-O 3.16Å; R74-D166 VanDerWaalsContact CD-OD2 3.26Å; R74-D166 WeakPolarHBondContact CD-OD2 3.48Å; R74-D166 IonicContact CZ-OD1 4Å; R74-D166 IonicContact CZ-OD2 3.47Å; R74-D166 IonicContact NE-OD2 2.65Å; R74-D166 PolarHBondContact NE-OD2 2.96Å; R74-D166 IonicContact NH1-OD1 2.63Å; R74-D166 IonicContact NH1-OD2 3.76Å; R74-D166 PolarHBondContact NH1-OD2 3.24Å; R74-D166 IonicContact NH2-OD1 3.43Å; R74-D166 IonicContact NH2-OD2 3.04Å
75	E	87.8	Confident	93	Very high	204 Å²	204	58.3 Å²	58.3	95%	0.953	27%	0.266	S	S	*	.	S	Bend	trans	-62.4	-46.5	171.6	-64.8	176.6	-178.2	0	0	110.1	R73	R73-E75 PolarHBondContact O-N 3.36Å
76	E	89.6	Confident	93.1	Very high	158 Å²	158	58.3 Å²	58.3	74%	0.738	27%	0.267	S	S	*	.	S	Bend	trans	-95.9	124.8	174.1	-65	-172.1	175	0	0	111.8	R74	R74-E76 VanDerWaalsContact C-N 3.35Å; R74-E76 VanDerWaalsContact CB-O 3.31Å; R74-E76 WeakPolarHBondContact CB-O 3.48Å
77	K	89.6	Confident	93.2	Very high	192 Å²	192	58.3 Å²	58.3	84%	0.835	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-68	138.4	175.1	-65.8	-178.6	-178.5	175.3	0	110.7	K79	K77-K79 PolarHBondContact O-N 3.47Å
78	L	91.9	Very high	93.3	Very high	24 Å²	24	58.3 Å²	58.3	13%	0.126	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-64.6	133.4	175.4	-75.4	170.7	0	0	0	111.6	L71 Q82 N136	L71-L78 HydrophobicContact CD1-CD1 4.37Å; L71-L78 HydrophobicContact CD2-CD1 4.01Å; L78-Q82 HydrophobicContact CD2-CB 3.82Å; L78-N136 HydrophobicContact CD1-CB 4.21Å
79	K	91.4	Very high	93.2	Very high	142 Å²	142	58.3 Å²	58.3	62%	0.617	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-72.8	159.6	167.2	-61.2	178.3	-176.9	178	0	110	K77 S81 Q82 N136	K77-K79 PolarHBondContact O-N 3.47Å; K79-S81 VanDerWaalsContact C-N 3.25Å; K79-S81 PolarHBondContact O-N 3.34Å; K79-Q82 HydrophobicContact CB-CB 4.38Å; K79-Q82 HydrophobicContact CB-CG 4.08Å; K79-Q82 WeakPolarHBondContact O-CB 3.31Å; K79-Q82 PolarHBondContact O-N 3.2Å; K79-N136 PolarHBondContact O-ND2 3.32Å
80	K	87.3	Confident	92.9	Very high	121 Å²	121	58.4 Å²	58.4	53%	0.526	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-37.9	179.8	-173.7	177.2	-179.9	-179.7	0	113.6	Q82 Q132 G134	K80-Q82 VanDerWaalsContact C-N 3.33Å; K80-Q132 WeakPolarHBondContact CE-O 3.47Å; K80-Q132 PolarHBondContact NZ-O 2.91Å; K80-G134 WeakPolarHBondContact O-CA 3.42Å
81	S	87.1	Confident	92.5	Very high	67 Å²	67	58.6 Å²	58.6	47%	0.469	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-4.5	179.3	56.2	0	0	0	0	114.2	K79 C161	K79-S81 VanDerWaalsContact C-N 3.25Å; K79-S81 PolarHBondContact O-N 3.34Å; S81-C161 WeakPolarHBondContact O-CB 3.5Å; S81-C161 PolarHBondContact O-SG 3.31Å
82	Q	94.3	Very high	92.2	Very high	55 Å²	55	61.6 Å²	61.6	26%	0.257	28%	0.28	S	S	.	.			trans	-94.9	133.9	-177.4	-79	178.7	-29.8	0	0	111	L78 K79 K80 N136 S164	L78-Q82 HydrophobicContact CD2-CB 3.82Å; K79-Q82 HydrophobicContact CB-CB 4.38Å; K79-Q82 HydrophobicContact CB-CG 4.08Å; K79-Q82 WeakPolarHBondContact O-CB 3.31Å; K79-Q82 PolarHBondContact O-N 3.2Å; K80-Q82 VanDerWaalsContact C-N 3.33Å; Q82-N136 WeakPolarHBondContact O-CA 3.25Å; Q82-N136 PolarHBondContact O-ND2 3.01Å; Q82-S164 WeakPolarHBondContact CB-OG 3.28Å
83	V	96.6	Very high	91.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	27%	0.27	C	S	.	.			trans	-95.1	125.4	176.7	-174.7	0	0	0	0	108.2	I86 F130 I138 L158 C161 V162 S164 L165	V83-I86 HydrophobicContact CG1-CD1 4.25Å; V83-I86 HydrophobicContact CG1-CG1 3.78Å; V83-F130 HydrophobicContact CG2-CE2 4.28Å; V83-F130 HydrophobicContact CG2-CZ 4.28Å; V83-I138 HydrophobicContact CB-CD1 4.32Å; V83-I138 HydrophobicContact CG1-CD1 3.65Å; V83-I138 HydrophobicContact CG1-CG1 3.94Å; V83-I138 HydrophobicContact CG2-CD1 3.65Å; V83-I138 HydrophobicContact CG2-CG1 4.44Å; V83-L158 HydrophobicContact CG2-CD1 4.19Å; V83-C161 HydrophobicContact CG2-CB 4.02Å; V83-C161 PolarHBondContact N-O 3.06Å; V83-V162 HydrophobicContact CB-CG1 4.08Å; V83-V162 HydrophobicContact CG1-CG1 4.41Å; V83-V162 HydrophobicContact CG2-CG1 4.11Å; V83-S164 CarbonylContact O-C 3.5Å; V83-S164 VanDerWaalsContact O-C 3.31Å; V83-S164 PolarHBondContact O-OG 3.15Å; V83-L165 HydrophobicContact CG1-CD1 3.92Å; V83-L165 WeakPolarHBondContact O-CA 3.31Å; V83-L165 PolarHBondContact O-N 3.23Å
84	G	96.1	Very high	91.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.246	C	C	.	.			trans	-101.1	-32.6	177.3	0	0	0	0	0	113.4	N136 D166 V167	G84-N136 PolarHBondContact N-O 3.27Å; G84-D166 PolarHBondContact O-N 2.75Å; G84-V167 PolarHBondContact O-N 2.78Å
85	A	97.7	Very high	91.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.1	178.6	0	0	0	0	0	113.1	I67 L71 N136 I137 I138 V167	I67-A85 HydrophobicContact CG1-CB 4.33Å; I67-A85 HydrophobicContact CG2-CB 3.56Å; L71-A85 HydrophobicContact CD1-CB 4.19Å; A85-N136 PolarHBondContact N-O 2.97Å; A85-N136 VanDerWaalsContact N-O 3.08Å; A85-I137 HydrophobicContact CB-CG1 4.49Å; A85-I137 HydrophobicContact CB-CG2 4.26Å; A85-I137 WeakPolarHBondContact O-CA 3.36Å; A85-I138 PolarHBondContact O-N 3.29Å; A85-V167 VanDerWaalsContact CA-O 3.26Å; A85-V167 WeakPolarHBondContact CA-O 3.4Å; A85-V167 HydrophobicContact CB-CB 4.13Å
86	I	98.1	Very high	91.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.4	173.4	-64.7	169.3	0	0	0	109	V83 I88 I138 L145 V162 L165 V167 L168 V169 L192	V83-I86 HydrophobicContact CG1-CD1 4.25Å; V83-I86 HydrophobicContact CG1-CG1 3.78Å; I86-I88 HydrophobicContact CG2-CD1 4.4Å; I86-I88 HydrophobicContact CG2-CG1 3.82Å; I86-I138 CarbonylContact C-O 3.53Å; I86-I138 WeakPolarHBondContact CA-O 3.25Å; I86-I138 HydrophobicContact CG1-CB 4.2Å; I86-I138 HydrophobicContact CG1-CD1 4.37Å; I86-L145 HydrophobicContact CG2-CD2 3.74Å; I86-V162 HydrophobicContact CD1-CG1 3.97Å; I86-L165 HydrophobicContact CB-CD1 4.23Å; I86-L165 HydrophobicContact CD1-CD1 3.81Å; I86-L165 HydrophobicContact CD1-CD2 4.12Å; I86-L165 HydrophobicContact CG1-CD1 3.63Å; I86-V167 PolarHBondContact N-O 2.77Å; I86-L168 HydrophobicContact CB-CD1 4.14Å; I86-L168 HydrophobicContact CG2-CD1 4.11Å; I86-L168 CarbonylContact O-C 3.58Å; I86-L168 WeakPolarHBondContact O-CA 3.46Å; I86-V169 PolarHBondContact O-N 3.48Å; I86-L192 HydrophobicContact CD1-CD2 3.82Å
87	I	98.2	Very high	91.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.5	172	-57.3	160.9	0	0	0	108.2	F63 I67 I98 I138 V139 A140 V169	F63-I87 HydrophobicContact CD2-CD1 4.35Å; F63-I87 HydrophobicContact CE2-CD1 4.13Å; F63-I87 HydrophobicContact CE2-CG2 4.17Å; I67-I87 HydrophobicContact CD1-CD1 3.69Å; I67-I87 HydrophobicContact CD1-CG1 3.7Å; I87-I98 HydrophobicContact CD1-CG2 3.98Å; I87-I98 HydrophobicContact CG2-CD1 4.23Å; I87-I98 HydrophobicContact CG2-CG2 4.25Å; I87-I138 PolarHBondContact N-O 3.22Å; I87-V139 HydrophobicContact CB-CG2 4.49Å; I87-V139 HydrophobicContact CD1-CG2 4.1Å; I87-A140 PolarHBondContact O-N 3.4Å; I87-V169 HydrophobicContact CB-CB 4.44Å; I87-V169 HydrophobicContact CG1-CB 4.11Å; I87-V169 HydrophobicContact CG2-CB 4.3Å; I87-V169 HydrophobicContact CG2-CG1 4.18Å
88	I	96.9	Very high	91.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.2	177	-54	-177	0	0	0	108.8	I86 A140 P142 L145 L168 V169 L170 D171 L176 I188	I86-I88 HydrophobicContact CG2-CD1 4.4Å; I86-I88 HydrophobicContact CG2-CG1 3.82Å; I88-A140 WeakPolarHBondContact CA-O 3.15Å; I88-P142 HydrophobicContact CG2-CB 4.43Å; I88-P142 HydrophobicContact CG2-CG 3.66Å; I88-L145 HydrophobicContact CD1-CD2 3.8Å; I88-L145 HydrophobicContact CG1-CD2 3.88Å; I88-L168 HydrophobicContact CD1-CD1 3.98Å; I88-L168 HydrophobicContact CG1-CD1 4.22Å; I88-V169 PolarHBondContact N-O 3.49Å; I88-L170 HydrophobicContact CB-CD2 3.9Å; I88-L170 HydrophobicContact CD1-CD2 3.89Å; I88-L170 HydrophobicContact CG1-CD2 4.21Å; I88-D171 PolarHBondContact O-N 3.42Å; I88-L176 HydrophobicContact CG2-CD1 4.25Å; I88-L176 HydrophobicContact CG2-CD2 4.23Å; I88-I188 HydrophobicContact CD1-CD1 4.34Å; I88-I188 HydrophobicContact CD1-CG2 4.05Å
89	T	93.9	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.			trans	-141.5	147.2	-177.8	175.2	0	0	0	0	111.4	T91 L94 A95 I98 A140 T141 P142	T89-T91 PolarHBondContact O-N 3.38Å; T89-L94 WeakPolarHBondContact OG1-CD2 3.41Å; T89-L94 WeakPolarHBondContact OG1-CG 3.39Å; T89-A95 HydrophobicContact CG2-CB 3.5Å; T89-A95 VanDerWaalsContact CG2-CB 3.5Å; T89-I98 HydrophobicContact CG2-CD1 4.2Å; T89-A140 PolarHBondContact N-O 3.27Å; T89-T141 WeakPolarHBondContact O-CA 2.94Å; T89-P142 VanDerWaalsContact O-CD 3.3Å; T89-P142 WeakPolarHBondContact O-CD 3.38Å
90	P	89.3	Confident	92.2	Very high	5 Å²	5	21.6 Å²	21.6	3%	0.032	11%	0.107	C	C	.	.	S	Bend	trans	-71.9	-25.4	-167.9	26.9	-39.3	0	0	0	115.4	D171 E172 R175 L176 M179	P90-D171 VanDerWaalsContact CD-O 3.29Å; P90-D171 WeakPolarHBondContact CD-O 3.47Å; P90-E172 HydrophobicContact CG-CB 3.81Å; P90-R175 HydrophobicContact CB-CB 4.18Å; P90-R175 HydrophobicContact CB-CG 3.67Å; P90-R175 HydrophobicContact CG-CB 3.93Å; P90-R175 HydrophobicContact CG-CG 3.7Å; P90-L176 HydrophobicContact CB-CD2 3.88Å; P90-L176 HydrophobicContact CB-CG 4.26Å; P90-M179 HydrophobicContact CB-SD 3.99Å
91	T	86.3	Confident	92.5	Very high	14 Å²	14	17.5 Å²	17.5	9%	0.086	9%	0.092	C	C	.	.			trans	-124.3	153.5	-172	69.7	0	0	0	0	112.3	T89 E93 L94 A95	T89-T91 PolarHBondContact O-N 3.38Å; T91-E93 VanDerWaalsContact C-N 3.3Å; T91-E93 PolarHBondContact O-N 3.18Å; T91-L94 VanDerWaalsContact OG1-CB 3.22Å; T91-L94 WeakPolarHBondContact OG1-CB 3.28Å; T91-L94 PolarHBondContact OG1-N 2.91Å; T91-A95 WeakPolarHBondContact O-CB 3.45Å; T91-A95 PolarHBondContact O-N 2.94Å; T91-A95 VanDerWaalsContact O-N 3.08Å
92	R	86.8	Confident	92.9	Very high	70 Å²	70	14.3 Å²	14.3	26%	0.264	7%	0.07	S	C	.	.	H	α-helix	trans	-68.2	-35.7	179.9	-56	-176.6	-172	172.2	-5.1	111.1	A95 V96 I118 G119 T141	R92-A95 PolarHBondContact O-N 2.98Å; R92-V96 VanDerWaalsContact O-CG2 3.28Å; R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 3.07Å; R92-I118 HydrophobicContact CB-CB 4.23Å; R92-I118 HydrophobicContact CB-CD1 4.25Å; R92-I118 HydrophobicContact CB-CG2 4.36Å; R92-I118 HydrophobicContact CG-CB 4.12Å; R92-G119 WeakPolarHBondContact CD-O 3.3Å; R92-G119 PolarHBondContact NE-O 2.89Å; R92-G119 PolarHBondContact NH1-O 3.42Å; R92-G119 VanDerWaalsContact NH1-O 3.1Å; R92-T141 HydrophobicContact CG-CG2 4.22Å
93	E	84.4	Confident	92.9	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-66	-46.9	-179.8	-66.4	61.7	-139.3	0	0	110.6	T91 A95 V96 Q97 R307 I332	T91-E93 VanDerWaalsContact C-N 3.3Å; T91-E93 PolarHBondContact O-N 3.18Å; E93-A95 VanDerWaalsContact C-N 3.35Å; E93-V96 PolarHBondContact O-N 2.97Å; E93-Q97 PolarHBondContact O-N 2.76Å; E93-R307 VanDerWaalsContact CD-NH2 3.29Å; E93-R307 IonicContact OE1-CZ 3.78Å; E93-R307 IonicContact OE1-NE 3.08Å; E93-R307 PolarHBondContact OE1-NE 2.64Å; E93-R307 IonicContact OE1-NH2 3.61Å; E93-R307 PolarHBondContact OE1-NH2 3.24Å; E93-R307 IonicContact OE2-CZ 2.92Å; E93-R307 IonicContact OE2-NE 3.7Å; E93-R307 IonicContact OE2-NH2 2.77Å; E93-R307 PolarHBondContact OE2-NH2 2.77Å; E93-I332 HydrophobicContact CB-CD1 3.42Å; E93-I332 VanDerWaalsContact CB-CD1 3.42Å; E93-I332 HydrophobicContact CB-CG1 3.65Å; E93-I332 HydrophobicContact CG-CD1 3.7Å; E93-I332 HydrophobicContact CG-CG1 4.47Å
94	L	86.8	Confident	92.7	Very high	3 Å²	3	17.5 Å²	17.5	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-65	-39.8	176.2	-178.9	54.1	0	0	0	111.3	T89 T91 V96 Q97 I98 D171 E172 G331	T89-L94 WeakPolarHBondContact OG1-CD2 3.41Å; T89-L94 WeakPolarHBondContact OG1-CG 3.39Å; T91-L94 VanDerWaalsContact OG1-CB 3.22Å; T91-L94 WeakPolarHBondContact OG1-CB 3.28Å; T91-L94 PolarHBondContact OG1-N 2.91Å; L94-V96 PolarHBondContact O-N 3.18Å; L94-Q97 PolarHBondContact O-N 3.47Å; L94-I98 HydrophobicContact CD1-CD1 4.03Å; L94-I98 HydrophobicContact CD1-CG1 4.11Å; L94-I98 HydrophobicContact CG-CD1 3.92Å; L94-I98 HydrophobicContact CG-CG1 4.46Å; L94-I98 WeakPolarHBondContact O-CG1 3.16Å; L94-I98 PolarHBondContact O-N 2.85Å; L94-D171 WeakPolarHBondContact CD2-OD2 3.34Å; L94-E172 HydrophobicContact CD2-CG 3.78Å; L94-G331 WeakPolarHBondContact CD1-O 3.33Å
95	A	92.1	Very high	92.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.4	-45.7	174.4	0	0	0	0	0	112.6	T89 T91 R92 E93 Q97 I98 D99 L116 I118 V139 T141	T89-A95 HydrophobicContact CG2-CB 3.5Å; T89-A95 VanDerWaalsContact CG2-CB 3.5Å; T91-A95 WeakPolarHBondContact O-CB 3.45Å; T91-A95 PolarHBondContact O-N 2.94Å; T91-A95 VanDerWaalsContact O-N 3.08Å; R92-A95 PolarHBondContact O-N 2.98Å; E93-A95 VanDerWaalsContact C-N 3.35Å; A95-Q97 VanDerWaalsContact C-N 3.32Å; A95-Q97 PolarHBondContact O-N 2.8Å; A95-I98 PolarHBondContact O-N 2.83Å; A95-D99 WeakPolarHBondContact O-CB 3.31Å; A95-D99 PolarHBondContact O-N 3.23Å; A95-L116 HydrophobicContact CB-CD1 3.74Å; A95-I118 HydrophobicContact CB-CG2 3.54Å; A95-V139 HydrophobicContact CB-CG1 4.14Å; A95-V139 WeakPolarHBondContact O-CG1 3.44Å; A95-T141 HydrophobicContact CB-CG2 4.48Å
96	V	91.1	Very high	92.4	Very high	16 Å²	16	18.3 Å²	18.3	10%	0.097	9%	0.094	C	C	.	.	H	α-helix	trans	-60	-43.9	175	170.8	0	0	0	0	110.8	R92 E93 L94 D99 E100 L116 I118 M312	R92-V96 VanDerWaalsContact O-CG2 3.28Å; R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 3.07Å; E93-V96 PolarHBondContact O-N 2.97Å; L94-V96 PolarHBondContact O-N 3.18Å; V96-D99 PolarHBondContact O-N 2.8Å; V96-E100 WeakPolarHBondContact O-CG 3.41Å; V96-E100 PolarHBondContact O-N 3.01Å; V96-L116 HydrophobicContact CB-CD2 4.43Å; V96-L116 HydrophobicContact CG2-CD2 3.74Å; V96-I118 HydrophobicContact CG2-CD1 3.96Å; V96-M312 HydrophobicContact CG1-CE 3.84Å
97	Q	89.9	Confident	92.1	Very high	17 Å²	17	24 Å²	24	8%	0.079	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-41.1	179.6	-176.8	-172.8	-44.8	0	0	112.5	E93 L94 A95 E100 V101 G331 D333	E93-Q97 PolarHBondContact O-N 2.76Å; L94-Q97 PolarHBondContact O-N 3.47Å; A95-Q97 VanDerWaalsContact C-N 3.32Å; A95-Q97 PolarHBondContact O-N 2.8Å; Q97-E100 PolarHBondContact O-N 2.87Å; Q97-V101 WeakPolarHBondContact O-CG2 3.33Å; Q97-V101 PolarHBondContact O-N 2.94Å; Q97-G331 PolarHBondContact OE1-O 3.4Å; Q97-D333 VanDerWaalsContact NE2-CB 3.26Å
98	I	94.3	Very high	91.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-42.1	175.9	-67.1	166.5	0	0	0	110.3	T60 F63 I87 T89 L94 A95 V101 L102 V139 D171	T60-I98 HydrophobicContact CG2-CG1 4.25Å; F63-I98 HydrophobicContact CE2-CG2 4.19Å; F63-I98 HydrophobicContact CZ-CD1 4.19Å; F63-I98 HydrophobicContact CZ-CG1 4.43Å; I87-I98 HydrophobicContact CD1-CG2 3.98Å; I87-I98 HydrophobicContact CG2-CD1 4.23Å; I87-I98 HydrophobicContact CG2-CG2 4.25Å; T89-I98 HydrophobicContact CG2-CD1 4.2Å; L94-I98 HydrophobicContact CD1-CD1 4.03Å; L94-I98 HydrophobicContact CD1-CG1 4.11Å; L94-I98 HydrophobicContact CG-CD1 3.92Å; L94-I98 HydrophobicContact CG-CG1 4.46Å; L94-I98 WeakPolarHBondContact O-CG1 3.16Å; L94-I98 PolarHBondContact O-N 2.85Å; A95-I98 PolarHBondContact O-N 2.83Å; I98-V101 PolarHBondContact O-N 2.95Å; I98-L102 VanDerWaalsContact O-CB 3.29Å; I98-L102 WeakPolarHBondContact O-CB 3.46Å; I98-L102 PolarHBondContact O-N 2.74Å; I98-V139 HydrophobicContact CB-CG1 4.04Å; I98-V139 HydrophobicContact CG2-CG1 3.95Å; I98-V139 HydrophobicContact CG2-CG2 4.08Å; I98-D171 WeakPolarHBondContact CD1-OD2 3.45Å
99	D	95.4	Very high	91.6	Very high	29 Å²	29	26.3 Å²	26.3	16%	0.155	13%	0.129	C	C	.	.	H	α-helix	trans	-62	-40.6	176	-178.9	65.9	0	0	0	112.1	A95 V96 L102 S103 Q114 L116 V139	A95-D99 WeakPolarHBondContact O-CB 3.31Å; A95-D99 PolarHBondContact O-N 3.23Å; V96-D99 PolarHBondContact O-N 2.8Å; D99-L102 PolarHBondContact O-N 3.39Å; D99-S103 WeakPolarHBondContact O-CB 3.26Å; D99-S103 PolarHBondContact O-N 3.32Å; D99-Q114 PolarHBondContact O-NE2 3.04Å; D99-Q114 PolarHBondContact OD1-NE2 2.91Å; D99-L116 HydrophobicContact CB-CB 4.32Å; D99-L116 HydrophobicContact CB-CD1 4.06Å; D99-L116 HydrophobicContact CB-CD2 4.28Å; D99-L116 HydrophobicContact CB-CG 4.44Å; D99-V139 HydrophobicContact CB-CG2 4.47Å
100	E	92.9	Very high	91.3	Very high	54 Å²	54	31.7 Å²	31.7	25%	0.252	17%	0.165	S	C	.	.	H	α-helix	trans	-60.9	-49.6	171.9	-76.7	176.6	-172.7	0	0	111.5	V96 Q97 L102 S103 H104 M312 R315	V96-E100 WeakPolarHBondContact O-CG 3.41Å; V96-E100 PolarHBondContact O-N 3.01Å; Q97-E100 PolarHBondContact O-N 2.87Å; E100-L102 VanDerWaalsContact C-N 3.32Å; E100-L102 PolarHBondContact O-N 3.04Å; E100-S103 WeakPolarHBondContact O-CB 3.06Å; E100-S103 PolarHBondContact O-N 2.83Å; E100-S103 PolarHBondContact O-OG 3.09Å; E100-H104 PolarHBondContact O-CD2 2.85Å; E100-H104 PolarHBondContact O-N 2.99Å; E100-M312 WeakPolarHBondContact OE1-CE 3.19Å; E100-R315 IonicContact OE2-CZ 3.52Å; E100-R315 IonicContact OE2-NH1 3.31Å; E100-R315 PolarHBondContact OE2-NH1 3.22Å
101	V	93.6	Very high	91.3	Very high	35 Å²	35	36 Å²	36	21%	0.212	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-46.2	177.4	171.9	0	0	0	0	110.5	T60 L61 Q97 I98 S103 H104 F105	T60-V101 HydrophobicContact CG2-CB 4.26Å; T60-V101 HydrophobicContact CG2-CG1 4.01Å; T60-V101 HydrophobicContact CG2-CG2 4.41Å; L61-V101 HydrophobicContact CD2-CG1 3.95Å; Q97-V101 WeakPolarHBondContact O-CG2 3.33Å; Q97-V101 PolarHBondContact O-N 2.94Å; I98-V101 PolarHBondContact O-N 2.95Å; V101-S103 VanDerWaalsContact C-N 3.29Å; V101-S103 PolarHBondContact O-N 2.85Å; V101-H104 WeakPolarHBondContact O-CB 3.4Å; V101-H104 PolarHBondContact O-N 3.38Å; V101-F105 HydrophobicContact CG1-CE2 4.27Å; V101-F105 VanDerWaalsContact O-CD2 3.27Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å
102	L	95.4	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-38.6	178.5	-173.3	66.3	0	0	0	111.7	V64 L68 I98 D99 E100 H104 F105 T106 Q114 I137 V139	V64-L102 HydrophobicContact CG1-CD1 3.88Å; L68-L102 HydrophobicContact CD2-CD1 4.43Å; I98-L102 VanDerWaalsContact O-CB 3.29Å; I98-L102 WeakPolarHBondContact O-CB 3.46Å; I98-L102 PolarHBondContact O-N 2.74Å; D99-L102 PolarHBondContact O-N 3.39Å; E100-L102 VanDerWaalsContact C-N 3.32Å; E100-L102 PolarHBondContact O-N 3.04Å; L102-H104 VanDerWaalsContact C-N 3.26Å; L102-H104 PolarHBondContact O-N 3.27Å; L102-F105 PolarHBondContact O-N 3.18Å; L102-T106 HydrophobicContact CD1-CG2 4.09Å; L102-T106 HydrophobicContact CG-CG2 3.86Å; L102-T106 PolarHBondContact O-N 3.35Å; L102-T106 PolarHBondContact O-OG1 2.54Å; L102-Q114 HydrophobicContact CD2-CB 3.93Å; L102-Q114 VanDerWaalsContact CG-OE1 3.23Å; L102-I137 HydrophobicContact CD1-CD1 4.18Å; L102-I137 HydrophobicContact CD2-CB 4.05Å; L102-I137 HydrophobicContact CD2-CD1 4.39Å; L102-I137 HydrophobicContact CD2-CG2 3.48Å; L102-I137 VanDerWaalsContact CD2-CG2 3.48Å; L102-V139 HydrophobicContact CD2-CG2 4.09Å
103	S	94.3	Very high	91.9	Very high	44 Å²	44	34 Å²	34	31%	0.308	18%	0.179	S	C	.	.	H	α-helix	trans	-60.5	-32.9	-179.8	79.3	0	0	0	0	113.4	D99 E100 V101 F105 T106 K107	D99-S103 WeakPolarHBondContact O-CB 3.26Å; D99-S103 PolarHBondContact O-N 3.32Å; E100-S103 WeakPolarHBondContact O-CB 3.06Å; E100-S103 PolarHBondContact O-N 2.83Å; E100-S103 PolarHBondContact O-OG 3.09Å; V101-S103 VanDerWaalsContact C-N 3.29Å; V101-S103 PolarHBondContact O-N 2.85Å; S103-F105 PolarHBondContact O-N 3.3Å; S103-T106 WeakPolarHBondContact CA-OG1 3.32Å; S103-K107 WeakPolarHBondContact O-CB 3.23Å; S103-K107 WeakPolarHBondContact O-CG 3.26Å; S103-K107 PolarHBondContact O-N 3.4Å
104	H	93.8	Very high	92.4	Very high	78 Å²	78	35.4 Å²	35.4	36%	0.361	19%	0.185	S	C	.	.	H	α-helix	trans	-64.7	-24.3	175.7	-72	-72.4	0	0	0	112.7	L27 E100 V101 L102 K107 H108	L27-H104 HydrophobicContact CD1-CB 4.18Å; L27-H104 HydrophobicContact CD2-CB 4Å; L27-H104 HydrophobicContact CG-CB 4.36Å; E100-H104 PolarHBondContact O-CD2 2.85Å; E100-H104 PolarHBondContact O-N 2.99Å; V101-H104 WeakPolarHBondContact O-CB 3.4Å; V101-H104 PolarHBondContact O-N 3.38Å; L102-H104 VanDerWaalsContact C-N 3.26Å; L102-H104 PolarHBondContact O-N 3.27Å; H104-K107 WeakPolarHBondContact O-CE 3.28Å; H104-K107 WeakPolarHBondContact O-CG 3.48Å; H104-H108 PolarHBondContact O-CD2 3.04Å
105	F	94.6	Very high	92.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-94.5	-49.2	175.1	-64.4	-91.9	0	0	0	111.7	V20 A23 L24 L27 L61 V64 L68 V101 L102 S103 K107 H108 F109	V20-F105 HydrophobicContact CG1-CD1 4.28Å; V20-F105 HydrophobicContact CG1-CE1 4.1Å; A23-F105 HydrophobicContact CB-CD1 3.52Å; A23-F105 HydrophobicContact CB-CE1 3.74Å; A23-F105 HydrophobicContact CB-CG 4.2Å; L24-F105 HydrophobicContact CD2-CE1 4.17Å; L24-F105 HydrophobicContact CD2-CZ 3.93Å; L24-F105 HydrophobicContact CG-CE1 4.05Å; L24-F105 HydrophobicContact CG-CZ 4.31Å; L27-F105 HydrophobicContact CD1-CE2 3.72Å; L27-F105 HydrophobicContact CD1-CZ 3.74Å; L61-F105 HydrophobicContact CD2-CE2 3.69Å; L61-F105 HydrophobicContact CD2-CZ 3.68Å; V64-F105 HydrophobicContact CG1-CD2 3.92Å; V64-F105 HydrophobicContact CG1-CE2 4.15Å; V64-F105 HydrophobicContact CG1-CG 4.47Å; L68-F105 HydrophobicContact CD1-CB 3.35Å; L68-F105 HydrophobicContact CD1-CD1 3.93Å; L68-F105 HydrophobicContact CD1-CG 3.7Å; V101-F105 HydrophobicContact CG1-CE2 4.27Å; V101-F105 VanDerWaalsContact O-CD2 3.27Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å; L102-F105 PolarHBondContact O-N 3.18Å; S103-F105 PolarHBondContact O-N 3.3Å; F105-K107 PolarHBondContact O-N 3.45Å; F105-H108 WeakPolarHBondContact O-CB 3.47Å; F105-H108 PolarHBondContact O-N 2.99Å; F105-F109 WeakPolarHBondContact O-CD2 3.43Å
106	T	92.4	Very high	93	Very high	16 Å²	16	35.6 Å²	35.6	10%	0.098	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-25.8	-174.3	54.1	0	0	0	0	112.9	L68 L102 S103 H108 F109 Q114 I137	L68-T106 HydrophobicContact CD2-CG2 4.21Å; L102-T106 HydrophobicContact CD1-CG2 4.09Å; L102-T106 HydrophobicContact CG-CG2 3.86Å; L102-T106 PolarHBondContact O-N 3.35Å; L102-T106 PolarHBondContact O-OG1 2.54Å; S103-T106 WeakPolarHBondContact CA-OG1 3.32Å; T106-H108 PolarHBondContact O-N 2.96Å; T106-H108 VanDerWaalsContact O-N 3.11Å; T106-F109 CarbonylContact O-C 3.57Å; T106-F109 WeakPolarHBondContact O-CA 3.45Å; T106-F109 PolarHBondContact O-N 2.64Å; T106-Q114 PolarHBondContact OG1-OE1 3.29Å; T106-I137 HydrophobicContact CG2-CD1 4.25Å
107	K	92.6	Very high	93.2	Very high	120 Å²	120	34.8 Å²	34.8	52%	0.522	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.1	170.9	72.1	179.1	-171.2	170.3	0	113.9	E26 S103 H104 F105	E26-K107 VanDerWaalsContact OE2-CE 3.28Å; E26-K107 WeakPolarHBondContact OE2-CE 3.41Å; E26-K107 IonicContact OE2-NZ 2.61Å; E26-K107 PolarHBondContact OE2-NZ 2.86Å; S103-K107 WeakPolarHBondContact O-CB 3.23Å; S103-K107 WeakPolarHBondContact O-CG 3.26Å; S103-K107 PolarHBondContact O-N 3.4Å; H104-K107 WeakPolarHBondContact O-CE 3.28Å; H104-K107 WeakPolarHBondContact O-CG 3.48Å; F105-K107 PolarHBondContact O-N 3.45Å
108	H	92.2	Very high	93.3	Very high	48 Å²	48	34.1 Å²	34.1	22%	0.222	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.5	177.5	-66	-69.4	0	0	0	113.2	R19 E26 H104 F105 T106	R19-H108 HydrophobicContact CB-CB 4.32Å; R19-H108 VanDerWaalsContact CD-O 3.28Å; R19-H108 WeakPolarHBondContact CD-O 3.18Å; R19-H108 PolarHBondContact NH1-O 2.76Å; E26-H108 IonicContact OE1-CE1 3.13Å; E26-H108 PolarHBondContact OE1-CE1 3.22Å; E26-H108 IonicContact OE1-NE2 2.72Å; E26-H108 PolarHBondContact OE1-NE2 2.82Å; E26-H108 IonicContact OE2-CE1 3.96Å; E26-H108 IonicContact OE2-NE2 2.69Å; E26-H108 PolarHBondContact OE2-NE2 3.06Å; H104-H108 PolarHBondContact O-CD2 3.04Å; F105-H108 WeakPolarHBondContact O-CB 3.47Å; F105-H108 PolarHBondContact O-N 2.99Å; T106-H108 PolarHBondContact O-N 2.96Å; T106-H108 VanDerWaalsContact O-N 3.11Å
109	F	91.8	Very high	92.9	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	19%	0.186	C	C	.	.			trans	-131.3	76.5	-175.8	-58.9	-73.3	0	0	0	110.7	H17 R19 V20 L72 F105 T106 Q111 F112	H17-F109 AromaticContact CE1-CE1 3.88Å; H17-F109 AromaticContact ND1-CE1 3.69Å; H17-F109 AromaticContact ND1-CZ 3.89Å; R19-F109 HydrophobicContact CB-CE1 3.79Å; R19-F109 HydrophobicContact CB-CE2 4.28Å; R19-F109 HydrophobicContact CB-CZ 3.5Å; R19-F109 HydrophobicContact CG-CE1 4.45Å; V20-F109 HydrophobicContact CG2-CE2 4.01Å; V20-F109 HydrophobicContact CG2-CZ 3.76Å; L72-F109 HydrophobicContact CD1-CD1 4.16Å; L72-F109 HydrophobicContact CD1-CE1 3.57Å; L72-F109 HydrophobicContact CD1-CZ 3.8Å; L72-F109 HydrophobicContact CD2-CD1 3.79Å; L72-F109 HydrophobicContact CD2-CE1 3.93Å; L72-F109 HydrophobicContact CG-CE1 4.39Å; F105-F109 WeakPolarHBondContact O-CD2 3.43Å; T106-F109 CarbonylContact O-C 3.57Å; T106-F109 WeakPolarHBondContact O-CA 3.45Å; T106-F109 PolarHBondContact O-N 2.64Å; F109-Q111 VanDerWaalsContact CA-OE1 3.3Å; F109-Q111 PolarHBondContact O-N 3.33Å; F109-F112 HydrophobicContact CB-CD2 3.68Å; F109-F112 HydrophobicContact CB-CE2 4.26Å; F109-F112 HydrophobicContact CG-CD2 4.3Å; F109-F112 HydrophobicContact CG-CE2 4.5Å; F109-F112 PolarHBondContact O-N 3.16Å
110	P	87.8	Confident	92.2	Very high	114 Å²	114	35.2 Å²	35.2	74%	0.74	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-14.4	-175.4	26.8	-36	0	0	0	114	F112	P110-F112 VanDerWaalsContact C-N 3.25Å; P110-F112 PolarHBondContact O-N 3.18Å
111	Q	88.4	Confident	91.6	Very high	95 Å²	95	37.6 Å²	37.6	44%	0.444	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-14.9	172.9	69.4	-91.2	35.8	0	0	114.1	F109	F109-Q111 VanDerWaalsContact CA-OE1 3.3Å; F109-Q111 PolarHBondContact O-N 3.33Å
112	F	92.1	Very high	91.3	Very high	23 Å²	23	40.3 Å²	40.3	10%	0.101	22%	0.217	C	C	.	.			trans	-106.8	130.1	179.4	-61.9	-43	0	0	0	111.2	L68 L71 L72 F109 P110 N136	L68-F112 HydrophobicContact CD2-CD2 4.33Å; L71-F112 HydrophobicContact CB-CE1 3.86Å; L71-F112 HydrophobicContact CB-CE2 4.38Å; L71-F112 HydrophobicContact CB-CZ 3.62Å; L72-F112 HydrophobicContact CD2-CE2 3.56Å; L72-F112 HydrophobicContact CD2-CZ 3.78Å; L72-F112 HydrophobicContact CG-CE2 3.74Å; L72-F112 HydrophobicContact CG-CZ 3.96Å; F109-F112 HydrophobicContact CB-CD2 3.68Å; F109-F112 HydrophobicContact CB-CE2 4.26Å; F109-F112 HydrophobicContact CG-CD2 4.3Å; F109-F112 HydrophobicContact CG-CE2 4.5Å; F109-F112 PolarHBondContact O-N 3.16Å; P110-F112 VanDerWaalsContact C-N 3.25Å; P110-F112 PolarHBondContact O-N 3.18Å; F112-N136 HydrophobicContact CD1-CB 4.48Å
113	S	93.6	Very high	90.9	Very high	20 Å²	20	41.3 Å²	41.3	14%	0.14	22%	0.223	C	C	.	.			trans	-98.5	141.2	166.9	55.1	0	0	0	0	110.2	Q133 G135 N136 I137	S113-Q133 VanDerWaalsContact CB-O 3.25Å; S113-Q133 WeakPolarHBondContact CB-O 3.49Å; S113-G135 PolarHBondContact OG-N 3.24Å; S113-G135 VanDerWaalsContact OG-N 3.11Å; S113-N136 PolarHBondContact N-OD1 2.74Å; S113-N136 WeakPolarHBondContact O-CB 3.46Å; S113-N136 PolarHBondContact O-N 2.9Å; S113-N136 PolarHBondContact OG-N 2.99Å; S113-N136 PolarHBondContact OG-OD1 3.25Å; S113-I137 PolarHBondContact O-N 2.87Å
114	Q	94.9	Very high	90.7	Very high	30 Å²	30	40.6 Å²	40.6	14%	0.14	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	146.3	170.4	75.7	-178.5	43.4	0	0	110.6	D99 L102 T106 I137	D99-Q114 PolarHBondContact O-NE2 3.04Å; D99-Q114 PolarHBondContact OD1-NE2 2.91Å; L102-Q114 HydrophobicContact CD2-CB 3.93Å; L102-Q114 VanDerWaalsContact CG-OE1 3.23Å; T106-Q114 PolarHBondContact OG1-OE1 3.29Å; Q114-I137 VanDerWaalsContact CA-O 3.25Å; Q114-I137 WeakPolarHBondContact CA-O 3.29Å
115	I	95.3	Very high	90.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.4	175.2	-163.3	165.4	0	0	0	111.2	W117 R129 F130 I137 I138 V139	I115-W117 HydrophobicContact CD1-CZ2 4.31Å; I115-W117 VanDerWaalsContact CD1-NE1 3.33Å; I115-W117 HydrophobicContact CG2-CD2 4.48Å; I115-W117 HydrophobicContact CG2-CZ2 4.38Å; I115-R129 HydrophobicContact CD1-CB 4.32Å; I115-R129 HydrophobicContact CD1-CG 4.21Å; I115-F130 HydrophobicContact CD1-CB 3.82Å; I115-F130 HydrophobicContact CD1-CD2 4.26Å; I115-F130 HydrophobicContact CG2-CD2 4.43Å; I115-I137 PolarHBondContact N-O 2.99Å; I115-I138 HydrophobicContact CG2-CB 4.33Å; I115-I138 HydrophobicContact CG2-CG1 3.79Å; I115-I138 HydrophobicContact CG2-CG2 4.33Å; I115-V139 PolarHBondContact O-N 3.49Å
116	L	96.1	Very high	90.4	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.4	179.8	176.4	65.7	0	0	0	110.4	A95 V96 D99 I118 V139	A95-L116 HydrophobicContact CB-CD1 3.74Å; V96-L116 HydrophobicContact CB-CD2 4.43Å; V96-L116 HydrophobicContact CG2-CD2 3.74Å; D99-L116 HydrophobicContact CB-CB 4.32Å; D99-L116 HydrophobicContact CB-CD1 4.06Å; D99-L116 HydrophobicContact CB-CD2 4.28Å; D99-L116 HydrophobicContact CB-CG 4.44Å; L116-I118 HydrophobicContact CD1-CG2 3.73Å; L116-I118 HydrophobicContact CD2-CD1 4.27Å; L116-I118 HydrophobicContact CG-CG1 4.44Å; L116-I118 HydrophobicContact CG-CG2 4.1Å; L116-V139 CarbonylContact C-O 3.6Å; L116-V139 WeakPolarHBondContact CA-O 3.26Å; L116-V139 HydrophobicContact CD1-CB 4.14Å; L116-V139 HydrophobicContact CD1-CG1 4.11Å
117	W	95.2	Very high	90.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	97.3	-178.2	-77.5	-14.3	0	0	0	111.9	I115 F130 I138 V139 A140 T141 R144 L145 M148 L156 L158	I115-W117 HydrophobicContact CD1-CZ2 4.31Å; I115-W117 VanDerWaalsContact CD1-NE1 3.33Å; I115-W117 HydrophobicContact CG2-CD2 4.48Å; I115-W117 HydrophobicContact CG2-CZ2 4.38Å; W117-F130 HydrophobicContact CH2-CD2 4.08Å; W117-F130 HydrophobicContact CH2-CE2 4.36Å; W117-F130 HydrophobicContact CZ2-CB 4.09Å; W117-F130 AromaticContact CZ2-CD2 3.69Å; W117-F130 HydrophobicContact CZ2-CD2 3.69Å; W117-F130 HydrophobicContact CZ2-CE2 4.4Å; W117-F130 HydrophobicContact CZ2-CG 4.05Å; W117-I138 HydrophobicContact CD2-CG2 4.18Å; W117-I138 HydrophobicContact CE3-CD1 4.29Å; W117-I138 HydrophobicContact CE3-CG2 3.62Å; W117-I138 HydrophobicContact CH2-CD1 3.89Å; W117-I138 HydrophobicContact CZ3-CD1 3.64Å; W117-I138 HydrophobicContact CZ3-CG2 4.05Å; W117-V139 PolarHBondContact N-O 3.47Å; W117-A140 HydrophobicContact CB-CB 3.84Å; W117-A140 WeakPolarHBondContact O-CA 3.26Å; W117-A140 WeakPolarHBondContact O-CB 3.18Å; W117-T141 PolarHBondContact O-N 3.42Å; W117-R144 HydrophobicContact CB-CG 3.86Å; W117-L145 HydrophobicContact CE3-CD1 3.76Å; W117-L145 HydrophobicContact CZ3-CD1 3.76Å; W117-M148 HydrophobicContact CD2-CG 3.8Å; W117-M148 HydrophobicContact CE3-CB 4.11Å; W117-M148 HydrophobicContact CE3-CG 3.71Å; W117-M148 HydrophobicContact CG-CG 4.39Å; W117-M148 HydrophobicContact CH2-CB 4.14Å; W117-M148 HydrophobicContact CH2-CG 4.16Å; W117-M148 HydrophobicContact CZ2-CG 4.23Å; W117-M148 HydrophobicContact CZ2-SD 4.45Å; W117-M148 HydrophobicContact CZ3-CB 3.84Å; W117-M148 HydrophobicContact CZ3-CG 3.88Å; W117-L156 HydrophobicContact CH2-CD2 4.35Å; W117-L156 HydrophobicContact CZ2-CD2 4.4Å; W117-L158 HydrophobicContact CH2-CD1 3.84Å; W117-L158 HydrophobicContact CH2-CD2 3.9Å; W117-L158 HydrophobicContact CZ3-CD1 4.16Å; W117-L158 HydrophobicContact CZ3-CD2 3.62Å
118	I	92.9	Very high	90.3	Very high	3 Å²	3	41 Å²	41	2%	0.015	23%	0.226	C	C	.	.			trans	-125.7	147.1	-178.2	57.3	171	0	0	0	111.3	R92 A95 V96 L116 T141 R144	R92-I118 HydrophobicContact CB-CB 4.23Å; R92-I118 HydrophobicContact CB-CD1 4.25Å; R92-I118 HydrophobicContact CB-CG2 4.36Å; R92-I118 HydrophobicContact CG-CB 4.12Å; A95-I118 HydrophobicContact CB-CG2 3.54Å; V96-I118 HydrophobicContact CG2-CD1 3.96Å; L116-I118 HydrophobicContact CD1-CG2 3.73Å; L116-I118 HydrophobicContact CD2-CD1 4.27Å; L116-I118 HydrophobicContact CG-CG1 4.44Å; L116-I118 HydrophobicContact CG-CG2 4.1Å; I118-T141 HydrophobicContact CG2-CG2 4.12Å; I118-R144 PolarHBondContact O-NH1 2.88Å
119	G	85.1	Confident	90.3	Very high	15 Å²	15	43.1 Å²	43.1	16%	0.155	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	160.6	175.9	0	0	0	0	0	113.5	R92	R92-G119 WeakPolarHBondContact CD-O 3.3Å; R92-G119 PolarHBondContact NE-O 2.89Å; R92-G119 PolarHBondContact NH1-O 3.42Å; R92-G119 VanDerWaalsContact NH1-O 3.1Å
120	G	80.7	Confident	90.3	Very high	37 Å²	37	43.6 Å²	43.6	38%	0.381	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	-2.1	174	0	0	0	0	0	115.9
121	R	81.9	Confident	90.4	Very high	103 Å²	103	42.8 Å²	42.8	39%	0.389	22%	0.219	S	C	.	.	S	Bend	trans	-101.5	163.2	164.3	-64.3	-177	178.5	173.2	-1.2	110.6	P123 R144	R121-P123 VanDerWaalsContact O-CD 3.29Å; R121-P123 WeakPolarHBondContact O-CD 3.34Å; R121-R144 PolarHBondContact O-NH1 2.82Å; R121-R144 VanDerWaalsContact O-NH1 3.14Å; R121-R144 PolarHBondContact O-NH2 3.45Å
122	N	86.5	Confident	90.5	Very high	92 Å²	92	43.5 Å²	43.5	49%	0.492	22%	0.223	S	C	.	.			trans	-66.3	119.8	174	-172.6	-16.3	0	0	0	109.6	G124 E125	N122-G124 PolarHBondContact O-N 3.01Å; N122-G124 PolarHBondContact OD1-N 2.89Å; N122-E125 HydrophobicContact CB-CB 4.5Å; N122-E125 HydrophobicContact CB-CG 4.02Å; N122-E125 PolarHBondContact O-N 3.37Å
123	P	87.9	Confident	90.3	Very high	22 Å²	22	47 Å²	47	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-29.1	178.1	-25.1	36.6	0	0	0	114.3	R121 E125 D126 V127 M148	R121-P123 VanDerWaalsContact O-CD 3.29Å; R121-P123 WeakPolarHBondContact O-CD 3.34Å; P123-E125 VanDerWaalsContact C-N 3.31Å; P123-E125 PolarHBondContact O-N 2.83Å; P123-D126 WeakPolarHBondContact O-CB 3.49Å; P123-D126 PolarHBondContact O-N 2.8Å; P123-D126 VanDerWaalsContact O-N 3.16Å; P123-V127 PolarHBondContact O-N 3.32Å; P123-V127 VanDerWaalsContact O-N 3.1Å; P123-M148 HydrophobicContact CB-CE 3.72Å
124	G	89	Confident	90.2	Very high	29 Å²	29	46 Å²	46	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-34.7	178.1	0	0	0	0	0	112.8	N122 D126 V127 E128	N122-G124 PolarHBondContact O-N 3.01Å; N122-G124 PolarHBondContact OD1-N 2.89Å; G124-D126 VanDerWaalsContact C-N 3.32Å; G124-D126 PolarHBondContact O-N 2.81Å; G124-V127 PolarHBondContact O-N 3.11Å; G124-E128 PolarHBondContact O-N 3.2Å
125	E	89.9	Confident	90.1	Very high	124 Å²	124	44.6 Å²	44.6	58%	0.579	23%	0.226	S	C	*	.	H	α-helix	trans	-65.1	-36.8	173.3	-67.6	170.5	-162.9	0	0	111.5	N122 P123 E128 R129	N122-E125 HydrophobicContact CB-CB 4.5Å; N122-E125 HydrophobicContact CB-CG 4.02Å; N122-E125 PolarHBondContact O-N 3.37Å; P123-E125 VanDerWaalsContact C-N 3.31Å; P123-E125 PolarHBondContact O-N 2.83Å; E125-E128 PolarHBondContact O-N 3.29Å; E125-R129 VanDerWaalsContact O-CB 3.25Å; E125-R129 WeakPolarHBondContact O-CB 3.25Å; E125-R129 PolarHBondContact O-N 3.16Å
126	D	92	Very high	90.1	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.032	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-39.3	177.5	-72	-27.8	0	0	0	111.5	P123 G124 F130 R144 M148	P123-D126 WeakPolarHBondContact O-CB 3.49Å; P123-D126 PolarHBondContact O-N 2.8Å; P123-D126 VanDerWaalsContact O-N 3.16Å; G124-D126 VanDerWaalsContact C-N 3.32Å; G124-D126 PolarHBondContact O-N 2.81Å; D126-F130 WeakPolarHBondContact O-CB 3.47Å; D126-F130 PolarHBondContact O-N 3.38Å; D126-R144 IonicContact OD2-CZ 2.64Å; D126-R144 IonicContact OD2-NH1 3.33Å; D126-R144 PolarHBondContact OD2-NH1 2.87Å; D126-M148 HydrophobicContact CB-SD 4.23Å
127	V	91.9	Very high	90.2	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-49.2	174.4	169.5	0	0	0	0	110.6	P123 G124 F130 K131 M148 L156	P123-V127 PolarHBondContact O-N 3.32Å; P123-V127 VanDerWaalsContact O-N 3.1Å; G124-V127 PolarHBondContact O-N 3.11Å; V127-F130 PolarHBondContact O-N 2.98Å; V127-K131 HydrophobicContact CG1-CD 4.36Å; V127-K131 WeakPolarHBondContact O-CG 3.41Å; V127-K131 PolarHBondContact O-N 3.27Å; V127-M148 HydrophobicContact CG2-SD 4.14Å; V127-L156 HydrophobicContact CG1-CB 4.07Å; V127-L156 HydrophobicContact CG2-CB 4.33Å; V127-L156 HydrophobicContact CG2-CD2 4.01Å
128	E	91.3	Very high	90.3	Very high	88 Å²	88	44.5 Å²	44.5	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-64.8	-42.6	-179	-172.8	54.1	-147.6	0	0	111.4	G124 E125 F130 K131 Q132	G124-E128 PolarHBondContact O-N 3.2Å; E125-E128 PolarHBondContact O-N 3.29Å; E128-F130 VanDerWaalsContact C-N 3.31Å; E128-F130 PolarHBondContact O-N 3.43Å; E128-K131 PolarHBondContact O-N 2.9Å; E128-Q132 WeakPolarHBondContact O-CG 3.4Å; E128-Q132 PolarHBondContact O-N 3.42Å; E128-Q132 WeakPolarHBondContact OE1-CG 3.45Å; E128-Q132 PolarHBondContact OE1-NE2 2.97Å
129	R	91.3	Very high	90.5	Very high	92 Å²	92	44.3 Å²	44.3	35%	0.347	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-41.1	175.3	-171.3	177.2	-179.1	-170.4	-1.1	112	I115 E125 Q132 Q133	I115-R129 HydrophobicContact CD1-CB 4.32Å; I115-R129 HydrophobicContact CD1-CG 4.21Å; E125-R129 VanDerWaalsContact O-CB 3.25Å; E125-R129 WeakPolarHBondContact O-CB 3.25Å; E125-R129 PolarHBondContact O-N 3.16Å; R129-Q132 PolarHBondContact O-N 2.78Å; R129-Q133 HydrophobicContact CG-CG 4.35Å; R129-Q133 WeakPolarHBondContact O-CB 3.46Å; R129-Q133 PolarHBondContact O-N 2.96Å
130	F	92.9	Very high	91.1	Very high	10 Å²	10	43.6 Å²	43.6	4%	0.044	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-42.9	175.9	-176.9	-91.5	0	0	0	111.9	V83 I115 W117 D126 V127 E128 Q132 G134 L156 C161	V83-F130 HydrophobicContact CG2-CE2 4.28Å; V83-F130 HydrophobicContact CG2-CZ 4.28Å; I115-F130 HydrophobicContact CD1-CB 3.82Å; I115-F130 HydrophobicContact CD1-CD2 4.26Å; I115-F130 HydrophobicContact CG2-CD2 4.43Å; W117-F130 HydrophobicContact CH2-CD2 4.08Å; W117-F130 HydrophobicContact CH2-CE2 4.36Å; W117-F130 HydrophobicContact CZ2-CB 4.09Å; W117-F130 AromaticContact CZ2-CD2 3.69Å; W117-F130 HydrophobicContact CZ2-CD2 3.69Å; W117-F130 HydrophobicContact CZ2-CE2 4.4Å; W117-F130 HydrophobicContact CZ2-CG 4.05Å; D126-F130 WeakPolarHBondContact O-CB 3.47Å; D126-F130 PolarHBondContact O-N 3.38Å; V127-F130 PolarHBondContact O-N 2.98Å; E128-F130 VanDerWaalsContact C-N 3.31Å; E128-F130 PolarHBondContact O-N 3.43Å; F130-Q132 VanDerWaalsContact C-N 3.33Å; F130-Q132 PolarHBondContact O-N 2.89Å; F130-G134 WeakPolarHBondContact O-CA 3.05Å; F130-G134 PolarHBondContact O-N 3.31Å; F130-L156 HydrophobicContact CB-CD1 4.5Å; F130-L156 HydrophobicContact CD1-CD1 3.24Å; F130-L156 HydrophobicContact CE1-CD1 3.54Å; F130-L156 HydrophobicContact CG-CD1 3.98Å; F130-L156 HydrophobicContact CZ-CD1 4.46Å; F130-C161 HydrophobicContact CZ-CB 4.23Å
131	K	89.9	Confident	91.7	Very high	97 Å²	97	42.4 Å²	42.4	42%	0.422	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-43.6	175.7	-69.8	174.5	-177.3	172.2	0	111.5	V127 E128 E154 G155	V127-K131 HydrophobicContact CG1-CD 4.36Å; V127-K131 WeakPolarHBondContact O-CG 3.41Å; V127-K131 PolarHBondContact O-N 3.27Å; E128-K131 PolarHBondContact O-N 2.9Å; K131-E154 PolarHBondContact NZ-O 3.49Å; K131-G155 WeakPolarHBondContact CE-O 3.37Å
132	Q	89.7	Confident	92.3	Very high	111 Å²	111	37.5 Å²	37.5	52%	0.519	18%	0.184	S	C	.	.	H	α-helix	trans	-76.7	-36.6	-176.6	-70.2	179.9	9.3	0	0	114.2	K80 E128 R129 F130	K80-Q132 WeakPolarHBondContact CE-O 3.47Å; K80-Q132 PolarHBondContact NZ-O 2.91Å; E128-Q132 WeakPolarHBondContact O-CG 3.4Å; E128-Q132 PolarHBondContact O-N 3.42Å; E128-Q132 WeakPolarHBondContact OE1-CG 3.45Å; E128-Q132 PolarHBondContact OE1-NE2 2.97Å; R129-Q132 PolarHBondContact O-N 2.78Å; F130-Q132 VanDerWaalsContact C-N 3.33Å; F130-Q132 PolarHBondContact O-N 2.89Å
133	Q	89.3	Confident	92.7	Very high	95 Å²	95	34.8 Å²	34.8	44%	0.444	18%	0.178	S	C	.	.	H	α-helix	trans	-111.6	-19.8	-170.1	-60.2	-178.4	-10.1	0	0	112.8	S113 R129	S113-Q133 VanDerWaalsContact CB-O 3.25Å; S113-Q133 WeakPolarHBondContact CB-O 3.49Å; R129-Q133 HydrophobicContact CG-CG 4.35Å; R129-Q133 WeakPolarHBondContact O-CB 3.46Å; R129-Q133 PolarHBondContact O-N 2.96Å
134	G	90.4	Very high	92.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.01	18%	0.175	C	C	.	.			trans	79.9	-174.1	-167.1	0	0	0	0	0	112.2	K80 F130	K80-G134 WeakPolarHBondContact O-CA 3.42Å; F130-G134 WeakPolarHBondContact O-CA 3.05Å; F130-G134 PolarHBondContact O-N 3.31Å
135	G	92.3	Very high	93.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.			trans	-164.3	64.1	176.8	0	0	0	0	0	111.5	S113 I137	S113-G135 PolarHBondContact OG-N 3.24Å; S113-G135 VanDerWaalsContact OG-N 3.11Å; G135-I137 PolarHBondContact O-N 2.97Å
136	N	95.9	Very high	93.5	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.021	14%	0.139	C	C	.	.	S	Bend	trans	-61.1	-34.2	178.9	-56.6	120.2	0	0	0	111.8	L78 K79 Q82 G84 A85 F112 S113	L78-N136 HydrophobicContact CD1-CB 4.21Å; K79-N136 PolarHBondContact O-ND2 3.32Å; Q82-N136 WeakPolarHBondContact O-CA 3.25Å; Q82-N136 PolarHBondContact O-ND2 3.01Å; G84-N136 PolarHBondContact N-O 3.27Å; A85-N136 PolarHBondContact N-O 2.97Å; A85-N136 VanDerWaalsContact N-O 3.08Å; F112-N136 HydrophobicContact CD1-CB 4.48Å; S113-N136 PolarHBondContact N-OD1 2.74Å; S113-N136 WeakPolarHBondContact O-CB 3.46Å; S113-N136 PolarHBondContact O-N 2.9Å; S113-N136 PolarHBondContact OG-N 2.99Å; S113-N136 PolarHBondContact OG-OD1 3.25Å
137	I	97.5	Very high	93.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	121.2	173.4	-51	173.8	0	0	0	108.7	I67 L68 L71 A85 L102 T106 S113 Q114 I115 G135	I67-I137 HydrophobicContact CG2-CD1 4.1Å; I67-I137 HydrophobicContact CG2-CG1 4.45Å; I67-I137 HydrophobicContact CG2-CG2 4.48Å; L68-I137 HydrophobicContact CD2-CD1 3.95Å; L71-I137 HydrophobicContact CD1-CD1 4.05Å; L71-I137 HydrophobicContact CD1-CG1 3.77Å; A85-I137 HydrophobicContact CB-CG1 4.49Å; A85-I137 HydrophobicContact CB-CG2 4.26Å; A85-I137 WeakPolarHBondContact O-CA 3.36Å; L102-I137 HydrophobicContact CD1-CD1 4.18Å; L102-I137 HydrophobicContact CD2-CB 4.05Å; L102-I137 HydrophobicContact CD2-CD1 4.39Å; L102-I137 HydrophobicContact CD2-CG2 3.48Å; L102-I137 VanDerWaalsContact CD2-CG2 3.48Å; T106-I137 HydrophobicContact CG2-CD1 4.25Å; S113-I137 PolarHBondContact O-N 2.87Å; Q114-I137 VanDerWaalsContact CA-O 3.25Å; Q114-I137 WeakPolarHBondContact CA-O 3.29Å; I115-I137 PolarHBondContact N-O 2.99Å; G135-I137 PolarHBondContact O-N 2.97Å
138	I	97.7	Very high	93.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.9	179.4	-58.8	177.7	0	0	0	109	V83 A85 I86 I87 I115 W117 A140 L158	V83-I138 HydrophobicContact CB-CD1 4.32Å; V83-I138 HydrophobicContact CG1-CD1 3.65Å; V83-I138 HydrophobicContact CG1-CG1 3.94Å; V83-I138 HydrophobicContact CG2-CD1 3.65Å; V83-I138 HydrophobicContact CG2-CG1 4.44Å; A85-I138 PolarHBondContact O-N 3.29Å; I86-I138 CarbonylContact C-O 3.53Å; I86-I138 WeakPolarHBondContact CA-O 3.25Å; I86-I138 HydrophobicContact CG1-CB 4.2Å; I86-I138 HydrophobicContact CG1-CD1 4.37Å; I87-I138 PolarHBondContact N-O 3.22Å; I115-I138 HydrophobicContact CG2-CB 4.33Å; I115-I138 HydrophobicContact CG2-CG1 3.79Å; I115-I138 HydrophobicContact CG2-CG2 4.33Å; W117-I138 HydrophobicContact CD2-CG2 4.18Å; W117-I138 HydrophobicContact CE3-CD1 4.29Å; W117-I138 HydrophobicContact CE3-CG2 3.62Å; W117-I138 HydrophobicContact CH2-CD1 3.89Å; W117-I138 HydrophobicContact CZ3-CD1 3.64Å; W117-I138 HydrophobicContact CZ3-CG2 4.05Å; I138-A140 HydrophobicContact CG2-CB 4.05Å; I138-L158 HydrophobicContact CD1-CD1 4.3Å
139	V	97.9	Very high	93.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.3	166.6	-174.3	0	0	0	0	107.9	I87 A95 I98 D99 L102 I115 L116 W117	I87-V139 HydrophobicContact CB-CG2 4.49Å; I87-V139 HydrophobicContact CD1-CG2 4.1Å; A95-V139 HydrophobicContact CB-CG1 4.14Å; A95-V139 WeakPolarHBondContact O-CG1 3.44Å; I98-V139 HydrophobicContact CB-CG1 4.04Å; I98-V139 HydrophobicContact CG2-CG1 3.95Å; I98-V139 HydrophobicContact CG2-CG2 4.08Å; D99-V139 HydrophobicContact CB-CG2 4.47Å; L102-V139 HydrophobicContact CD2-CG2 4.09Å; I115-V139 PolarHBondContact O-N 3.49Å; L116-V139 CarbonylContact C-O 3.6Å; L116-V139 WeakPolarHBondContact CA-O 3.26Å; L116-V139 HydrophobicContact CD1-CB 4.14Å; L116-V139 HydrophobicContact CD1-CG1 4.11Å; W117-V139 PolarHBondContact N-O 3.47Å
140	A	96.7	Very high	93.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	154.5	-172	0	0	0	0	0	115.5	I87 I88 T89 W117 I138 L145	I87-A140 PolarHBondContact O-N 3.4Å; I88-A140 WeakPolarHBondContact CA-O 3.15Å; T89-A140 PolarHBondContact N-O 3.27Å; W117-A140 HydrophobicContact CB-CB 3.84Å; W117-A140 WeakPolarHBondContact O-CA 3.26Å; W117-A140 WeakPolarHBondContact O-CB 3.18Å; I138-A140 HydrophobicContact CG2-CB 4.05Å; A140-L145 HydrophobicContact CB-CB 3.84Å; A140-L145 HydrophobicContact CB-CD1 4.5Å; A140-L145 HydrophobicContact CB-CD2 4.33Å; A140-L145 HydrophobicContact CB-CG 4.45Å
141	T	94.7	Very high	93.2	Very high	12 Å²	12	32 Å²	32	7%	0.074	15%	0.15	C	C	.	.			trans	-86.2	142.5	162.2	54.3	0	0	0	0	110.5	T89 R92 A95 W117 I118 G143 R144 L145	T89-T141 WeakPolarHBondContact O-CA 2.94Å; R92-T141 HydrophobicContact CG-CG2 4.22Å; A95-T141 HydrophobicContact CB-CG2 4.48Å; W117-T141 PolarHBondContact O-N 3.42Å; I118-T141 HydrophobicContact CG2-CG2 4.12Å; T141-G143 PolarHBondContact O-N 2.63Å; T141-R144 PolarHBondContact O-N 3.39Å; T141-R144 VanDerWaalsContact O-N 3.11Å; T141-L145 PolarHBondContact O-N 3.11Å; T141-L145 VanDerWaalsContact O-N 3.08Å
142	P	94.4	Very high	92.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-48.6	-54.9	-172.7	-27.5	29.6	0	0	0	114.2	I88 T89 R144 L145 E146 L176 F181 I188	I88-P142 HydrophobicContact CG2-CB 4.43Å; I88-P142 HydrophobicContact CG2-CG 3.66Å; T89-P142 VanDerWaalsContact O-CD 3.3Å; T89-P142 WeakPolarHBondContact O-CD 3.38Å; P142-R144 VanDerWaalsContact C-N 3.3Å; P142-R144 PolarHBondContact O-N 2.78Å; P142-L145 PolarHBondContact O-N 2.91Å; P142-L145 VanDerWaalsContact O-N 3.14Å; P142-E146 WeakPolarHBondContact O-CB 3.39Å; P142-E146 PolarHBondContact O-N 2.85Å; P142-L176 HydrophobicContact CG-CD2 3.45Å; P142-L176 VanDerWaalsContact CG-CD2 3.45Å; P142-F181 HydrophobicContact CB-CB 4.08Å; P142-F181 HydrophobicContact CB-CD1 4.11Å; P142-F181 HydrophobicContact CB-CG 4.06Å; P142-F181 HydrophobicContact CG-CB 3.99Å; P142-F181 HydrophobicContact CG-CD1 4.35Å; P142-F181 HydrophobicContact CG-CD2 4.01Å; P142-F181 HydrophobicContact CG-CG 3.89Å; P142-I188 HydrophobicContact CB-CD1 4.43Å
143	G	93.1	Very high	92	Very high	35 Å²	35	33.3 Å²	33.3	36%	0.361	17%	0.174	S	C	.	.	H	α-helix	trans	-64	-29.7	-175.5	0	0	0	0	0	114.6	T141 D147	T141-G143 PolarHBondContact O-N 2.63Å; G143-D147 WeakPolarHBondContact O-CB 3.46Å; G143-D147 PolarHBondContact O-N 2.79Å
144	R	93.7	Very high	91.5	Very high	20 Å²	20	32.9 Å²	32.9	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-76.7	-41	174.5	177.7	57.4	57.3	103.5	-6.5	110.9	W117 I118 R121 D126 T141 P142 E146 D147 M148	W117-R144 HydrophobicContact CB-CG 3.86Å; I118-R144 PolarHBondContact O-NH1 2.88Å; R121-R144 PolarHBondContact O-NH1 2.82Å; R121-R144 VanDerWaalsContact O-NH1 3.14Å; R121-R144 PolarHBondContact O-NH2 3.45Å; D126-R144 IonicContact OD2-CZ 2.64Å; D126-R144 IonicContact OD2-NH1 3.33Å; D126-R144 PolarHBondContact OD2-NH1 2.87Å; T141-R144 PolarHBondContact O-N 3.39Å; T141-R144 VanDerWaalsContact O-N 3.11Å; P142-R144 VanDerWaalsContact C-N 3.3Å; P142-R144 PolarHBondContact O-N 2.78Å; R144-E146 VanDerWaalsContact C-N 3.33Å; R144-D147 PolarHBondContact O-N 3.34Å; R144-M148 WeakPolarHBondContact O-CG 3.49Å; R144-M148 PolarHBondContact O-N 3.18Å
145	L	95.9	Very high	90.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-43.2	176.8	-179.8	57.5	0	0	0	111.4	I86 I88 W117 A140 T141 P142 M148 F149 L158 I188	I86-L145 HydrophobicContact CG2-CD2 3.74Å; I88-L145 HydrophobicContact CD1-CD2 3.8Å; I88-L145 HydrophobicContact CG1-CD2 3.88Å; W117-L145 HydrophobicContact CE3-CD1 3.76Å; W117-L145 HydrophobicContact CZ3-CD1 3.76Å; A140-L145 HydrophobicContact CB-CB 3.84Å; A140-L145 HydrophobicContact CB-CD1 4.5Å; A140-L145 HydrophobicContact CB-CD2 4.33Å; A140-L145 HydrophobicContact CB-CG 4.45Å; T141-L145 PolarHBondContact O-N 3.11Å; T141-L145 VanDerWaalsContact O-N 3.08Å; P142-L145 PolarHBondContact O-N 2.91Å; P142-L145 VanDerWaalsContact O-N 3.14Å; L145-M148 WeakPolarHBondContact O-CB 3.34Å; L145-M148 PolarHBondContact O-N 3.21Å; L145-F149 HydrophobicContact CD1-CD2 4.41Å; L145-F149 HydrophobicContact CD1-CE2 3.86Å; L145-F149 HydrophobicContact CG-CD2 4.37Å; L145-F149 HydrophobicContact CG-CE2 3.92Å; L145-F149 VanDerWaalsContact O-CD2 3.26Å; L145-F149 WeakPolarHBondContact O-CD2 3.4Å; L145-F149 PolarHBondContact O-N 2.79Å; L145-L158 HydrophobicContact CD1-CD2 4.24Å; L145-I188 HydrophobicContact CB-CD1 4.16Å; L145-I188 HydrophobicContact CD2-CD1 4.03Å; L145-I188 HydrophobicContact CD2-CG1 4.47Å; L145-I188 HydrophobicContact CD2-CG2 4.03Å; L145-I188 HydrophobicContact CG-CD1 4.11Å; L145-I188 HydrophobicContact CG-CG1 4.35Å
146	E	94.4	Very high	90.6	Very high	26 Å²	26	35.5 Å²	35.5	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-44.6	175.4	-169.9	-170.9	166.9	0	0	112.2	P142 R144 M148 F149 R150 S184 T187 I188	P142-E146 WeakPolarHBondContact O-CB 3.39Å; P142-E146 PolarHBondContact O-N 2.85Å; R144-E146 VanDerWaalsContact C-N 3.33Å; E146-M148 VanDerWaalsContact C-N 3.3Å; E146-M148 PolarHBondContact O-N 3.29Å; E146-F149 PolarHBondContact O-N 3.25Å; E146-R150 IonicContact OE1-CZ 3.05Å; E146-R150 IonicContact OE1-NE 2.66Å; E146-R150 IonicContact OE1-NH2 3.7Å; E146-R150 PolarHBondContact OE1-NH2 3.13Å; E146-S184 WeakPolarHBondContact OE2-CA 3.48Å; E146-S184 WeakPolarHBondContact OE2-CB 3.47Å; E146-S184 PolarHBondContact OE2-OG 3.38Å; E146-T187 HydrophobicContact CG-CG2 4.14Å; E146-I188 HydrophobicContact CB-CD1 4.28Å; E146-I188 HydrophobicContact CB-CG1 4.16Å
147	D	92.8	Very high	90.3	Very high	48 Å²	48	37.8 Å²	37.8	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-57.4	-42.3	174	-178.7	18.8	0	0	0	111.2	G143 R144 F149 R150 R151	G143-D147 WeakPolarHBondContact O-CB 3.46Å; G143-D147 PolarHBondContact O-N 2.79Å; R144-D147 PolarHBondContact O-N 3.34Å; D147-F149 VanDerWaalsContact C-N 3.31Å; D147-F149 PolarHBondContact O-N 2.74Å; D147-R150 PolarHBondContact O-N 2.8Å; D147-R151 WeakPolarHBondContact O-CG 3.37Å; D147-R151 PolarHBondContact O-N 2.97Å; D147-R151 IonicContact OD1-CZ 2.68Å; D147-R151 IonicContact OD1-NE 3.37Å; D147-R151 PolarHBondContact OD1-NE 2.73Å; D147-R151 IonicContact OD1-NH2 3.56Å; D147-R151 PolarHBondContact OD1-NH2 3.4Å; D147-R151 VanDerWaalsContact OD1-NH2 3.16Å; D147-R151 IonicContact OD2-CZ 3.9Å; D147-R151 IonicContact OD2-NE 2.86Å; D147-R151 PolarHBondContact OD2-NE 3.15Å; D147-R151 IonicContact OD2-NH2 3.63Å; D147-R151 PolarHBondContact OD2-NH2 3.02Å; D147-R151 VanDerWaalsContact OD2-NH2 3.08Å
148	M	93.4	Very high	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-33.3	178	-66.1	-61.3	100.4	0	0	113.5	W117 P123 D126 V127 R144 L145 E146 R150 R151 L156 L158	W117-M148 HydrophobicContact CD2-CG 3.8Å; W117-M148 HydrophobicContact CE3-CB 4.11Å; W117-M148 HydrophobicContact CE3-CG 3.71Å; W117-M148 HydrophobicContact CG-CG 4.39Å; W117-M148 HydrophobicContact CH2-CB 4.14Å; W117-M148 HydrophobicContact CH2-CG 4.16Å; W117-M148 HydrophobicContact CZ2-CG 4.23Å; W117-M148 HydrophobicContact CZ2-SD 4.45Å; W117-M148 HydrophobicContact CZ3-CB 3.84Å; W117-M148 HydrophobicContact CZ3-CG 3.88Å; P123-M148 HydrophobicContact CB-CE 3.72Å; D126-M148 HydrophobicContact CB-SD 4.23Å; V127-M148 HydrophobicContact CG2-SD 4.14Å; R144-M148 WeakPolarHBondContact O-CG 3.49Å; R144-M148 PolarHBondContact O-N 3.18Å; L145-M148 WeakPolarHBondContact O-CB 3.34Å; L145-M148 PolarHBondContact O-N 3.21Å; E146-M148 VanDerWaalsContact C-N 3.3Å; E146-M148 PolarHBondContact O-N 3.29Å; M148-R150 PolarHBondContact O-N 3.34Å; M148-R151 VanDerWaalsContact CE-CD 3.45Å; M148-R151 PolarHBondContact O-N 3.05Å; M148-L156 HydrophobicContact CB-CD2 4.19Å; M148-L156 HydrophobicContact SD-CD2 4.04Å; M148-L158 HydrophobicContact CB-CD2 3.88Å
149	F	91.9	Very high	89.7	Confident	12 Å²	12	39.4 Å²	39.4	5%	0.053	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-25.8	174.5	-80.8	-72.6	0	0	0	113.2	L145 E146 D147 L158 V162 I188 F191 L192	L145-F149 HydrophobicContact CD1-CD2 4.41Å; L145-F149 HydrophobicContact CD1-CE2 3.86Å; L145-F149 HydrophobicContact CG-CD2 4.37Å; L145-F149 HydrophobicContact CG-CE2 3.92Å; L145-F149 VanDerWaalsContact O-CD2 3.26Å; L145-F149 WeakPolarHBondContact O-CD2 3.4Å; L145-F149 PolarHBondContact O-N 2.79Å; E146-F149 PolarHBondContact O-N 3.25Å; D147-F149 VanDerWaalsContact C-N 3.31Å; D147-F149 PolarHBondContact O-N 2.74Å; F149-L158 HydrophobicContact CD1-CB 4.04Å; F149-L158 HydrophobicContact CD1-CD2 3.81Å; F149-L158 HydrophobicContact CD1-CG 3.87Å; F149-L158 HydrophobicContact CD2-CD2 3.94Å; F149-L158 HydrophobicContact CE1-CB 4.22Å; F149-L158 HydrophobicContact CE1-CD2 3.76Å; F149-L158 HydrophobicContact CE1-CG 3.63Å; F149-L158 HydrophobicContact CE2-CD2 3.9Å; F149-L158 HydrophobicContact CG-CD2 3.89Å; F149-L158 HydrophobicContact CG-CG 4.46Å; F149-L158 HydrophobicContact CZ-CD2 3.8Å; F149-L158 HydrophobicContact CZ-CG 4.03Å; F149-V162 HydrophobicContact CE1-CG1 4.2Å; F149-V162 HydrophobicContact CE1-CG2 4Å; F149-V162 HydrophobicContact CZ-CG1 4.1Å; F149-V162 HydrophobicContact CZ-CG2 4.4Å; F149-I188 HydrophobicContact CD2-CG1 4.48Å; F149-I188 HydrophobicContact CE2-CG1 4.47Å; F149-I188 HydrophobicContact CE2-CG2 4.06Å; F149-F191 HydrophobicContact CB-CD2 4.04Å; F149-F191 HydrophobicContact CB-CE2 4.04Å; F149-F191 HydrophobicContact CB-CG 4.41Å; F149-F191 HydrophobicContact CB-CZ 4.4Å; F149-F191 HydrophobicContact CD1-CB 3.7Å; F149-F191 HydrophobicContact CD1-CD1 4.09Å; F149-F191 HydrophobicContact CD1-CD2 4.05Å; F149-F191 AromaticContact CD1-CG 3.68Å; F149-F191 HydrophobicContact CD1-CG 3.68Å; F149-F191 HydrophobicContact CD2-CD2 4.36Å; F149-F191 HydrophobicContact CE1-CB 3.55Å; F149-F191 HydrophobicContact CE1-CG 4.09Å; F149-F191 HydrophobicContact CG-CB 4.3Å; F149-F191 AromaticContact CG-CD2 3.9Å; F149-F191 HydrophobicContact CG-CD2 3.9Å; F149-F191 HydrophobicContact CG-CE2 4.41Å; F149-F191 HydrophobicContact CG-CG 4.04Å; F149-F191 HydrophobicContact CZ-CB 4.04Å; F149-L192 HydrophobicContact CZ-CD2 3.79Å
150	R	88.8	Confident	89.3	Confident	167 Å²	167	41.7 Å²	41.7	63%	0.63	24%	0.239	S	C	*	.	H	α-helix	trans	-87.2	-10.3	-178	-61.6	178.5	-175.3	-166.8	-0.5	113.3	E146 D147 M148 K152	E146-R150 IonicContact OE1-CZ 3.05Å; E146-R150 IonicContact OE1-NE 2.66Å; E146-R150 IonicContact OE1-NH2 3.7Å; E146-R150 PolarHBondContact OE1-NH2 3.13Å; D147-R150 PolarHBondContact O-N 2.8Å; M148-R150 PolarHBondContact O-N 3.34Å; R150-K152 VanDerWaalsContact C-N 3.28Å; R150-K152 PolarHBondContact O-N 3.09Å
151	R	86.1	Confident	89.1	Confident	43 Å²	43	42.6 Å²	42.6	16%	0.162	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-88.5	29.5	-174.1	-72.8	-179.9	-174.9	-99.5	-9.5	115.2	D147 M148 A153 E154 L156	D147-R151 WeakPolarHBondContact O-CG 3.37Å; D147-R151 PolarHBondContact O-N 2.97Å; D147-R151 IonicContact OD1-CZ 2.68Å; D147-R151 IonicContact OD1-NE 3.37Å; D147-R151 PolarHBondContact OD1-NE 2.73Å; D147-R151 IonicContact OD1-NH2 3.56Å; D147-R151 PolarHBondContact OD1-NH2 3.4Å; D147-R151 VanDerWaalsContact OD1-NH2 3.16Å; D147-R151 IonicContact OD2-CZ 3.9Å; D147-R151 IonicContact OD2-NE 2.86Å; D147-R151 PolarHBondContact OD2-NE 3.15Å; D147-R151 IonicContact OD2-NH2 3.63Å; D147-R151 PolarHBondContact OD2-NH2 3.02Å; D147-R151 VanDerWaalsContact OD2-NH2 3.08Å; M148-R151 VanDerWaalsContact CE-CD 3.45Å; M148-R151 PolarHBondContact O-N 3.05Å; R151-A153 PolarHBondContact O-N 3.33Å; R151-E154 HydrophobicContact CB-CB 4.39Å; R151-E154 IonicContact CZ-OE1 2.88Å; R151-E154 IonicContact CZ-OE2 2.78Å; R151-E154 IonicContact NH1-OE1 3.61Å; R151-E154 PolarHBondContact NH1-OE1 3.45Å; R151-E154 IonicContact NH1-OE2 2.63Å; R151-E154 PolarHBondContact NH1-OE2 3.27Å; R151-E154 PolarHBondContact O-N 2.85Å; R151-L156 PolarHBondContact O-N 3.06Å
152	K	83.3	Confident	89.1	Confident	129 Å²	129	42 Å²	42	56%	0.561	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-56.2	-37.6	175.6	-172.5	170	-176	153.6	0	112.6	R150 E154 G155 L156 D157	R150-K152 VanDerWaalsContact C-N 3.28Å; R150-K152 PolarHBondContact O-N 3.09Å; K152-E154 PolarHBondContact O-N 2.98Å; K152-G155 PolarHBondContact O-N 2.98Å; K152-L156 WeakPolarHBondContact CA-O 3.43Å; K152-D157 WeakPolarHBondContact CD-OD1 3.28Å; K152-D157 VanDerWaalsContact CE-OD1 3.29Å; K152-D157 WeakPolarHBondContact CE-OD1 3.27Å; K152-D157 HydrophobicContact CG-CB 4.4Å; K152-D157 IonicContact NZ-OD1 2.77Å; K152-D157 PolarHBondContact NZ-OD1 2.97Å; K152-D157 IonicContact NZ-OD2 2.9Å; K152-D157 PolarHBondContact NZ-OD2 3.18Å
153	A	71.9	Confident	89.1	Confident	107 Å²	107	51.5 Å²	51.5	88%	0.884	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-64	-22.7	177.5	0	0	0	0	0	113.7	R151 G155	R151-A153 PolarHBondContact O-N 3.33Å; A153-G155 PolarHBondContact O-N 2.98Å
154	E	78.9	Confident	89	Confident	87 Å²	87	50.6 Å²	50.6	41%	0.407	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-90.2	10.1	176.8	-62	171.7	-145	0	0	111.8	K131 R151 K152	K131-E154 PolarHBondContact NZ-O 3.49Å; R151-E154 HydrophobicContact CB-CB 4.39Å; R151-E154 IonicContact CZ-OE1 2.88Å; R151-E154 IonicContact CZ-OE2 2.78Å; R151-E154 IonicContact NH1-OE1 3.61Å; R151-E154 PolarHBondContact NH1-OE1 3.45Å; R151-E154 IonicContact NH1-OE2 2.63Å; R151-E154 PolarHBondContact NH1-OE2 3.27Å; R151-E154 PolarHBondContact O-N 2.85Å; K152-E154 PolarHBondContact O-N 2.98Å
155	G	77.6	Confident	89.1	Confident	51 Å²	51	49.8 Å²	49.8	53%	0.526	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	17.9	178	0	0	0	0	0	114.6	K131 K152 A153	K131-G155 WeakPolarHBondContact CE-O 3.37Å; K152-G155 PolarHBondContact O-N 2.98Å; A153-G155 PolarHBondContact O-N 2.98Å
156	L	86	Confident	89	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	27%	0.273	C	S	.	.			trans	-108.2	93	171.6	-178.1	63.6	0	0	0	110.5	W117 V127 F130 M148 R151 K152 L158	W117-L156 HydrophobicContact CH2-CD2 4.35Å; W117-L156 HydrophobicContact CZ2-CD2 4.4Å; V127-L156 HydrophobicContact CG1-CB 4.07Å; V127-L156 HydrophobicContact CG2-CB 4.33Å; V127-L156 HydrophobicContact CG2-CD2 4.01Å; F130-L156 HydrophobicContact CB-CD1 4.5Å; F130-L156 HydrophobicContact CD1-CD1 3.24Å; F130-L156 HydrophobicContact CE1-CD1 3.54Å; F130-L156 HydrophobicContact CG-CD1 3.98Å; F130-L156 HydrophobicContact CZ-CD1 4.46Å; M148-L156 HydrophobicContact CB-CD2 4.19Å; M148-L156 HydrophobicContact SD-CD2 4.04Å; R151-L156 PolarHBondContact O-N 3.06Å; K152-L156 WeakPolarHBondContact CA-O 3.43Å; L156-L158 HydrophobicContact CG-CB 4.22Å; L156-L158 PolarHBondContact O-N 2.88Å
157	D	89.4	Confident	89.1	Confident	52 Å²	52	50.3 Å²	50.3	28%	0.278	27%	0.267	S	S	.	.			trans	-85.3	65	173.1	-167.6	30.2	0	0	0	111.3	K152 A159 S160 C161	K152-D157 WeakPolarHBondContact CD-OD1 3.28Å; K152-D157 VanDerWaalsContact CE-OD1 3.29Å; K152-D157 WeakPolarHBondContact CE-OD1 3.27Å; K152-D157 HydrophobicContact CG-CB 4.4Å; K152-D157 IonicContact NZ-OD1 2.77Å; K152-D157 PolarHBondContact NZ-OD1 2.97Å; K152-D157 IonicContact NZ-OD2 2.9Å; K152-D157 PolarHBondContact NZ-OD2 3.18Å; D157-A159 PolarHBondContact O-N 2.86Å; D157-S160 PolarHBondContact O-N 2.78Å; D157-S160 VanDerWaalsContact OD2-CB 3.26Å; D157-S160 WeakPolarHBondContact OD2-CB 3.42Å; D157-S160 PolarHBondContact OD2-OG 3.41Å; D157-C161 PolarHBondContact O-N 3.05Å; D157-C161 PolarHBondContact O-SG 3.06Å
158	L	91.3	Very high	89.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-33.5	-175.5	-175.7	59.6	0	0	0	112.6	V83 W117 I138 L145 M148 F149 L156 S160 C161 V162	V83-L158 HydrophobicContact CG2-CD1 4.19Å; W117-L158 HydrophobicContact CH2-CD1 3.84Å; W117-L158 HydrophobicContact CH2-CD2 3.9Å; W117-L158 HydrophobicContact CZ3-CD1 4.16Å; W117-L158 HydrophobicContact CZ3-CD2 3.62Å; I138-L158 HydrophobicContact CD1-CD1 4.3Å; L145-L158 HydrophobicContact CD1-CD2 4.24Å; M148-L158 HydrophobicContact CB-CD2 3.88Å; F149-L158 HydrophobicContact CD1-CB 4.04Å; F149-L158 HydrophobicContact CD1-CD2 3.81Å; F149-L158 HydrophobicContact CD1-CG 3.87Å; F149-L158 HydrophobicContact CD2-CD2 3.94Å; F149-L158 HydrophobicContact CE1-CB 4.22Å; F149-L158 HydrophobicContact CE1-CD2 3.76Å; F149-L158 HydrophobicContact CE1-CG 3.63Å; F149-L158 HydrophobicContact CE2-CD2 3.9Å; F149-L158 HydrophobicContact CG-CD2 3.89Å; F149-L158 HydrophobicContact CG-CG 4.46Å; F149-L158 HydrophobicContact CZ-CD2 3.8Å; F149-L158 HydrophobicContact CZ-CG 4.03Å; L156-L158 HydrophobicContact CG-CB 4.22Å; L156-L158 PolarHBondContact O-N 2.88Å; L158-S160 PolarHBondContact O-N 2.87Å; L158-C161 HydrophobicContact CD1-CB 4.14Å; L158-C161 WeakPolarHBondContact O-CA 3.22Å; L158-C161 WeakPolarHBondContact O-CB 3.26Å; L158-C161 PolarHBondContact O-N 2.85Å; L158-V162 HydrophobicContact CD1-CG1 4.03Å; L158-V162 HydrophobicContact CG-CG1 4.2Å; L158-V162 PolarHBondContact O-N 3.17Å
159	A	91	Very high	89.5	Confident	33 Å²	33	48 Å²	48	27%	0.273	26%	0.255	S	S	.	.	H	α-helix	trans	-57.7	-36.2	176.5	0	0	0	0	0	112.5	D157 V162 F191	D157-A159 PolarHBondContact O-N 2.86Å; A159-V162 WeakPolarHBondContact O-CG2 3.26Å; A159-F191 HydrophobicContact CB-CD1 4.18Å
160	S	91.1	Very high	89.6	Confident	48 Å²	48	47.6 Å²	47.6	34%	0.336	25%	0.253	S	S	.	.	H	α-helix	trans	-75.5	-36.4	174.2	-67.5	0	0	0	0	112	D157 L158 V162 R163	D157-S160 PolarHBondContact O-N 2.78Å; D157-S160 VanDerWaalsContact OD2-CB 3.26Å; D157-S160 WeakPolarHBondContact OD2-CB 3.42Å; D157-S160 PolarHBondContact OD2-OG 3.41Å; L158-S160 PolarHBondContact O-N 2.87Å; S160-V162 VanDerWaalsContact C-N 3.33Å; S160-V162 PolarHBondContact O-N 3.12Å; S160-R163 WeakPolarHBondContact O-CB 3.46Å; S160-R163 WeakPolarHBondContact O-CG 3.46Å; S160-R163 PolarHBondContact O-N 3.38Å
161	C	92	Very high	89.8	Confident	19 Å²	19	39.9 Å²	39.9	13%	0.128	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-33	178.2	-62.7	0	0	0	0	113.4	S81 V83 F130 D157 L158 S164	S81-C161 WeakPolarHBondContact O-CB 3.5Å; S81-C161 PolarHBondContact O-SG 3.31Å; V83-C161 HydrophobicContact CG2-CB 4.02Å; V83-C161 PolarHBondContact N-O 3.06Å; F130-C161 HydrophobicContact CZ-CB 4.23Å; D157-C161 PolarHBondContact O-N 3.05Å; D157-C161 PolarHBondContact O-SG 3.06Å; L158-C161 HydrophobicContact CD1-CB 4.14Å; L158-C161 WeakPolarHBondContact O-CA 3.22Å; L158-C161 WeakPolarHBondContact O-CB 3.26Å; L158-C161 PolarHBondContact O-N 2.85Å; C161-S164 PolarHBondContact O-OG 3.22Å
162	V	94.9	Very high	89.9	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-86.3	1.6	-178.9	-59.1	0	0	0	0	114.3	V83 I86 F149 L158 A159 S160 S164 L165 L192 P193	V83-V162 HydrophobicContact CB-CG1 4.08Å; V83-V162 HydrophobicContact CG1-CG1 4.41Å; V83-V162 HydrophobicContact CG2-CG1 4.11Å; I86-V162 HydrophobicContact CD1-CG1 3.97Å; F149-V162 HydrophobicContact CE1-CG1 4.2Å; F149-V162 HydrophobicContact CE1-CG2 4Å; F149-V162 HydrophobicContact CZ-CG1 4.1Å; F149-V162 HydrophobicContact CZ-CG2 4.4Å; L158-V162 HydrophobicContact CD1-CG1 4.03Å; L158-V162 HydrophobicContact CG-CG1 4.2Å; L158-V162 PolarHBondContact O-N 3.17Å; A159-V162 WeakPolarHBondContact O-CG2 3.26Å; S160-V162 VanDerWaalsContact C-N 3.33Å; S160-V162 PolarHBondContact O-N 3.12Å; V162-S164 PolarHBondContact O-N 2.91Å; V162-L165 HydrophobicContact CB-CB 4.46Å; V162-L165 WeakPolarHBondContact O-CB 3.39Å; V162-L165 PolarHBondContact O-N 3.49Å; V162-L192 HydrophobicContact CB-CD2 4.19Å; V162-L192 HydrophobicContact CG1-CD2 4.32Å; V162-L192 HydrophobicContact CG2-CD2 4.09Å; V162-P193 VanDerWaalsContact O-CD 3.27Å; V162-P193 WeakPolarHBondContact O-CD 3.44Å; V162-P193 WeakPolarHBondContact O-CG 3.41Å
163	R	93.3	Very high	90.1	Very high	198 Å²	198	32.3 Å²	32.3	75%	0.747	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-59.4	-29.4	176.5	-70.7	179.5	-178.2	-114	2.5	112.8	S160 L165	S160-R163 WeakPolarHBondContact O-CB 3.46Å; S160-R163 WeakPolarHBondContact O-CG 3.46Å; S160-R163 PolarHBondContact O-N 3.38Å; R163-L165 VanDerWaalsContact C-N 3.33Å
164	S	91.6	Very high	90.6	Very high	17 Å²	17	27.3 Å²	27.3	12%	0.119	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-89.9	9.7	178.6	54.1	0	0	0	0	113.9	R74 Q82 V83 C161 V162 D166	R74-S164 PolarHBondContact NH1-O 3.4Å; R74-S164 PolarHBondContact NH2-O 3.4Å; R74-S164 VanDerWaalsContact NH2-O 3.16Å; Q82-S164 WeakPolarHBondContact CB-OG 3.28Å; V83-S164 CarbonylContact O-C 3.5Å; V83-S164 VanDerWaalsContact O-C 3.31Å; V83-S164 PolarHBondContact O-OG 3.15Å; C161-S164 PolarHBondContact O-OG 3.22Å; V162-S164 PolarHBondContact O-N 2.91Å; S164-D166 PolarHBondContact O-N 2.9Å
165	L	95.6	Very high	90.7	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.139	C	C	.	.			trans	-68.1	120.1	-175.3	-175.5	81.8	0	0	0	111	V83 I86 V162 R163 L192 P193	V83-L165 HydrophobicContact CG1-CD1 3.92Å; V83-L165 WeakPolarHBondContact O-CA 3.31Å; V83-L165 PolarHBondContact O-N 3.23Å; I86-L165 HydrophobicContact CB-CD1 4.23Å; I86-L165 HydrophobicContact CD1-CD1 3.81Å; I86-L165 HydrophobicContact CD1-CD2 4.12Å; I86-L165 HydrophobicContact CG1-CD1 3.63Å; V162-L165 HydrophobicContact CB-CB 4.46Å; V162-L165 WeakPolarHBondContact O-CB 3.39Å; V162-L165 PolarHBondContact O-N 3.49Å; R163-L165 VanDerWaalsContact C-N 3.33Å; L165-L192 HydrophobicContact CD2-CB 4.33Å; L165-L192 HydrophobicContact CD2-CD1 4Å; L165-L192 HydrophobicContact CD2-CD2 4.01Å; L165-L192 HydrophobicContact CD2-CG 4.31Å; L165-P193 HydrophobicContact CB-CG 3.81Å; L165-P193 HydrophobicContact CD2-CG 4.49Å
166	D	94.4	Very high	91.1	Very high	38 Å²	38	22.7 Å²	22.7	20%	0.203	11%	0.114	C	C	.	.			trans	-96.8	-31.1	176.6	-69.1	-26.1	0	0	0	112.3	I70 R74 G84 S164 R197	I70-D166 HydrophobicContact CG2-CB 4.11Å; R74-D166 VanDerWaalsContact CD-OD2 3.26Å; R74-D166 WeakPolarHBondContact CD-OD2 3.48Å; R74-D166 IonicContact CZ-OD1 4Å; R74-D166 IonicContact CZ-OD2 3.47Å; R74-D166 IonicContact NE-OD2 2.65Å; R74-D166 PolarHBondContact NE-OD2 2.96Å; R74-D166 IonicContact NH1-OD1 2.63Å; R74-D166 IonicContact NH1-OD2 3.76Å; R74-D166 PolarHBondContact NH1-OD2 3.24Å; R74-D166 IonicContact NH2-OD1 3.43Å; R74-D166 IonicContact NH2-OD2 3.04Å; G84-D166 PolarHBondContact O-N 2.75Å; S164-D166 PolarHBondContact O-N 2.9Å; D166-R197 PolarHBondContact O-N 3.47Å
167	V	96.3	Very high	91	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.8	-169.9	-170.2	0	0	0	0	111.9	F43 I67 I70 G84 A85 I86 V169 R197	F43-V167 HydrophobicContact CE1-CG1 4.29Å; F43-V167 HydrophobicContact CE2-CG1 4.34Å; F43-V167 HydrophobicContact CZ-CG1 3.64Å; I67-V167 HydrophobicContact CG1-CB 4.32Å; I67-V167 HydrophobicContact CG1-CG1 3.78Å; I70-V167 HydrophobicContact CB-CG2 4.25Å; I70-V167 HydrophobicContact CD1-CG2 3.81Å; I70-V167 HydrophobicContact CG2-CG2 3.77Å; G84-V167 PolarHBondContact O-N 2.78Å; A85-V167 VanDerWaalsContact CA-O 3.26Å; A85-V167 WeakPolarHBondContact CA-O 3.4Å; A85-V167 HydrophobicContact CB-CB 4.13Å; I86-V167 PolarHBondContact N-O 2.77Å; V167-V169 HydrophobicContact CG1-CG2 4.14Å; V167-R197 CarbonylContact C-O 3.48Å; V167-R197 WeakPolarHBondContact CA-O 3.38Å
168	L	96.6	Very high	90.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.8	166.6	175.7	66.2	0	0	0	109.2	I86 I88 L170 L189 L192 R197 T198 G199	I86-L168 HydrophobicContact CB-CD1 4.14Å; I86-L168 HydrophobicContact CG2-CD1 4.11Å; I86-L168 CarbonylContact O-C 3.58Å; I86-L168 WeakPolarHBondContact O-CA 3.46Å; I88-L168 HydrophobicContact CD1-CD1 3.98Å; I88-L168 HydrophobicContact CG1-CD1 4.22Å; L168-L170 HydrophobicContact CD1-CD2 4.4Å; L168-L170 HydrophobicContact CD2-CD2 4.49Å; L168-L170 HydrophobicContact CG-CD2 4.42Å; L168-L189 HydrophobicContact CD2-CD2 3.5Å; L168-L189 VanDerWaalsContact CD2-CD2 3.5Å; L168-L192 HydrophobicContact CD1-CD1 3.9Å; L168-L192 HydrophobicContact CD2-CD1 3.87Å; L168-L192 HydrophobicContact CG-CD1 4.38Å; L168-R197 PolarHBondContact N-O 2.94Å; L168-T198 HydrophobicContact CB-CG2 4.48Å; L168-T198 HydrophobicContact CD2-CG2 4.21Å; L168-T198 HydrophobicContact CG-CG2 4.42Å; L168-T198 CarbonylContact O-C 3.6Å; L168-T198 VanDerWaalsContact O-CA 3.31Å; L168-T198 WeakPolarHBondContact O-CA 3.33Å; L168-G199 PolarHBondContact O-N 2.83Å
169	V	96.8	Very high	89.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.9	172.4	174.8	0	0	0	0	109.9	F43 F63 I67 I86 I87 I88 V167 G199 F201	F43-V169 HydrophobicContact CE1-CG2 4.18Å; F43-V169 HydrophobicContact CZ-CG2 4.13Å; F63-V169 HydrophobicContact CB-CG1 4.25Å; F63-V169 HydrophobicContact CB-CG2 4.06Å; F63-V169 HydrophobicContact CD1-CG1 4.09Å; F63-V169 HydrophobicContact CD2-CG1 4.09Å; F63-V169 HydrophobicContact CE1-CG1 4.39Å; F63-V169 HydrophobicContact CE2-CG1 4.44Å; F63-V169 HydrophobicContact CG-CG1 3.92Å; F63-V169 HydrophobicContact CG-CG2 4.44Å; I67-V169 HydrophobicContact CD1-CG2 3.88Å; I67-V169 HydrophobicContact CG1-CG2 4.47Å; I86-V169 PolarHBondContact O-N 3.48Å; I87-V169 HydrophobicContact CB-CB 4.44Å; I87-V169 HydrophobicContact CG1-CB 4.11Å; I87-V169 HydrophobicContact CG2-CB 4.3Å; I87-V169 HydrophobicContact CG2-CG1 4.18Å; I88-V169 PolarHBondContact N-O 3.49Å; V167-V169 HydrophobicContact CG1-CG2 4.14Å; V169-G199 CarbonylContact C-O 3.57Å; V169-G199 VanDerWaalsContact CA-O 3.28Å; V169-G199 WeakPolarHBondContact CA-O 3.45Å; V169-F201 HydrophobicContact CG1-CD2 3.86Å; V169-F201 HydrophobicContact CG1-CE2 4.14Å
170	L	95.1	Very high	89.2	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	101.8	168.9	-56.9	-178.4	0	0	0	107.8	I88 L168 L176 G199 F201 L212	I88-L170 HydrophobicContact CB-CD2 3.9Å; I88-L170 HydrophobicContact CD1-CD2 3.89Å; I88-L170 HydrophobicContact CG1-CD2 4.21Å; L168-L170 HydrophobicContact CD1-CD2 4.4Å; L168-L170 HydrophobicContact CD2-CD2 4.49Å; L168-L170 HydrophobicContact CG-CD2 4.42Å; L170-L176 HydrophobicContact CB-CD1 4.34Å; L170-G199 PolarHBondContact N-O 2.63Å; L170-F201 PolarHBondContact O-N 2.84Å; L170-L212 HydrophobicContact CD1-CD2 4.04Å; L170-L212 HydrophobicContact CD1-CG 4.41Å
171	D	93.4	Very high	89	Confident	6 Å²	6	28.2 Å²	28.2	3%	0.032	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	141.2	178.1	-172.2	40.2	0	0	0	111	F63 I88 P90 L94 I98 A173	F63-D171 HydrophobicContact CE1-CB 4.31Å; F63-D171 HydrophobicContact CZ-CB 4.38Å; I88-D171 PolarHBondContact O-N 3.42Å; P90-D171 VanDerWaalsContact CD-O 3.29Å; P90-D171 WeakPolarHBondContact CD-O 3.47Å; L94-D171 WeakPolarHBondContact CD2-OD2 3.34Å; I98-D171 WeakPolarHBondContact CD1-OD2 3.45Å; D171-A173 VanDerWaalsContact C-N 3.34Å; D171-A173 PolarHBondContact O-N 2.89Å
172	E	88.4	Confident	88.7	Confident	13 Å²	13	32.7 Å²	32.7	6%	0.061	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	54.8	-168.9	-59.3	-158.9	142.9	0	0	112.4	P90 L94 D174 R175 L176 F201 R330 G331	P90-E172 HydrophobicContact CG-CB 3.81Å; L94-E172 HydrophobicContact CD2-CG 3.78Å; E172-D174 VanDerWaalsContact C-N 3.27Å; E172-D174 PolarHBondContact O-N 2.99Å; E172-R175 HydrophobicContact CB-CB 4.04Å; E172-R175 WeakPolarHBondContact O-CA 3.37Å; E172-R175 WeakPolarHBondContact O-CB 3.45Å; E172-R175 PolarHBondContact O-N 3.33Å; E172-L176 PolarHBondContact O-N 2.66Å; E172-F201 WeakPolarHBondContact CA-O 3.28Å; E172-F201 PolarHBondContact N-O 3.37Å; E172-R330 WeakPolarHBondContact OE2-CB 2.83Å; E172-G331 WeakPolarHBondContact OE1-CA 3.36Å; E172-G331 PolarHBondContact OE1-N 3.37Å; E172-G331 PolarHBondContact OE2-N 3.3Å
173	A	86.4	Confident	88.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-35	-175.4	0	0	0	0	0	113.8	D171 R175 L176 L177 L200 F201 L212	D171-A173 VanDerWaalsContact C-N 3.34Å; D171-A173 PolarHBondContact O-N 2.89Å; A173-R175 VanDerWaalsContact C-N 3.27Å; A173-R175 PolarHBondContact O-N 2.99Å; A173-L176 PolarHBondContact O-N 2.83Å; A173-L177 WeakPolarHBondContact O-CG 3.44Å; A173-L177 PolarHBondContact O-N 2.82Å; A173-L200 HydrophobicContact CB-CD1 3.92Å; A173-L200 HydrophobicContact CB-CD2 3.7Å; A173-L200 HydrophobicContact CB-CG 3.61Å; A173-F201 PolarHBondContact N-O 3.46Å; A173-L212 HydrophobicContact CB-CD2 4.26Å
174	D	83.6	Confident	88.3	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-56.1	-44.2	170.6	52.1	-0.5	0	0	0	111.5	E172 L177 D178 S202 T204 V209 H354	E172-D174 VanDerWaalsContact C-N 3.27Å; E172-D174 PolarHBondContact O-N 2.99Å; D174-L177 PolarHBondContact O-N 3.21Å; D174-D178 PolarHBondContact O-N 3.45Å; D174-S202 WeakPolarHBondContact CB-OG 3.38Å; D174-S202 PolarHBondContact OD1-OG 3.41Å; D174-S202 PolarHBondContact OD2-OG 3.43Å; D174-T204 WeakPolarHBondContact CB-OG1 3.39Å; D174-T204 PolarHBondContact OD2-N 3.25Å; D174-T204 PolarHBondContact OD2-OG1 3.45Å; D174-V209 VanDerWaalsContact CA-CG2 3.45Å; D174-V209 HydrophobicContact CB-CG2 3.83Å; D174-H354 IonicContact OD2-CE1 3.16Å; D174-H354 PolarHBondContact OD2-CE1 2.9Å; D174-H354 IonicContact OD2-NE2 3.49Å
175	R	79.4	Confident	88.3	Confident	42 Å²	42	26.7 Å²	26.7	16%	0.158	16%	0.156	C	C	.	.	H	α-helix	trans	-73.2	-35	-179.2	-175.3	51.5	170.9	175.8	6.1	113.3	P90 E172 A173 L177 D178 M179	P90-R175 HydrophobicContact CB-CB 4.18Å; P90-R175 HydrophobicContact CB-CG 3.67Å; P90-R175 HydrophobicContact CG-CB 3.93Å; P90-R175 HydrophobicContact CG-CG 3.7Å; E172-R175 HydrophobicContact CB-CB 4.04Å; E172-R175 WeakPolarHBondContact O-CA 3.37Å; E172-R175 WeakPolarHBondContact O-CB 3.45Å; E172-R175 PolarHBondContact O-N 3.33Å; A173-R175 VanDerWaalsContact C-N 3.27Å; A173-R175 PolarHBondContact O-N 2.99Å; R175-L177 PolarHBondContact O-N 3.48Å; R175-D178 IonicContact NH1-OD2 3.43Å; R175-D178 PolarHBondContact O-N 3.2Å; R175-M179 HydrophobicContact CG-CG 4.29Å; R175-M179 HydrophobicContact CG-SD 3.97Å; R175-M179 PolarHBondContact NE-SD 2.84Å; R175-M179 WeakPolarHBondContact O-CB 3.43Å; R175-M179 WeakPolarHBondContact O-CG 3.06Å; R175-M179 PolarHBondContact O-N 2.9Å; R175-M179 VanDerWaalsContact O-N 3.08Å
176	L	85.9	Confident	88	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56	-41.5	173.9	-75.9	173.4	0	0	0	110.8	I88 P90 P142 L170 E172 A173 F181 I185	I88-L176 HydrophobicContact CG2-CD1 4.25Å; I88-L176 HydrophobicContact CG2-CD2 4.23Å; P90-L176 HydrophobicContact CB-CD2 3.88Å; P90-L176 HydrophobicContact CB-CG 4.26Å; P142-L176 HydrophobicContact CG-CD2 3.45Å; P142-L176 VanDerWaalsContact CG-CD2 3.45Å; L170-L176 HydrophobicContact CB-CD1 4.34Å; E172-L176 PolarHBondContact O-N 2.66Å; A173-L176 PolarHBondContact O-N 2.83Å; L176-F181 HydrophobicContact CD2-CD2 4.19Å; L176-F181 WeakPolarHBondContact O-CB 2.93Å; L176-F181 PolarHBondContact O-N 3.08Å; L176-F181 VanDerWaalsContact O-N 3.09Å; L176-I185 HydrophobicContact CB-CD1 3.74Å; L176-I185 HydrophobicContact CD1-CD1 4.03Å; L176-I185 HydrophobicContact CD2-CD1 4.26Å; L176-I185 HydrophobicContact CG-CD1 4.23Å
177	L	83.9	Confident	87.9	Confident	20 Å²	20	29.6 Å²	29.6	11%	0.105	17%	0.172	C	C	.	.	H	α-helix	trans	-74	-47.3	177.3	-59.4	174.1	0	0	0	112	A173 D174 R175 M179 G180 E182 E208 V209 L212	A173-L177 WeakPolarHBondContact O-CG 3.44Å; A173-L177 PolarHBondContact O-N 2.82Å; D174-L177 PolarHBondContact O-N 3.21Å; R175-L177 PolarHBondContact O-N 3.48Å; L177-M179 PolarHBondContact O-N 3.47Å; L177-G180 PolarHBondContact O-N 3.26Å; L177-E182 HydrophobicContact CD2-CB 4.02Å; L177-E182 HydrophobicContact CD2-CG 4.14Å; L177-E208 VanDerWaalsContact CD1-C 3.43Å; L177-E208 HydrophobicContact CD1-CB 3.71Å; L177-E208 WeakPolarHBondContact CD1-O 3.14Å; L177-V209 HydrophobicContact CD1-CG2 3.99Å; L177-L212 HydrophobicContact CD1-CB 4.18Å; L177-L212 HydrophobicContact CD1-CD2 4.08Å; L177-L212 HydrophobicContact CD2-CD2 4.27Å; L177-L212 HydrophobicContact CG-CD2 4.31Å
178	D	76.2	Confident	87.7	Confident	56 Å²	56	29.6 Å²	29.6	30%	0.299	17%	0.172	S	C	.	.	H	α-helix	trans	-51.8	-34.1	176.1	-85.1	-3.5	0	0	0	113	D174 R175 G180 R330 N348	D174-D178 PolarHBondContact O-N 3.45Å; R175-D178 IonicContact NH1-OD2 3.43Å; R175-D178 PolarHBondContact O-N 3.2Å; D178-G180 VanDerWaalsContact C-N 3.29Å; D178-R330 IonicContact OD2-CZ 2.85Å; D178-R330 IonicContact OD2-NH1 3.88Å; D178-R330 PolarHBondContact OD2-NH1 3.31Å; D178-R330 IonicContact OD2-NH2 3.06Å; D178-R330 PolarHBondContact OD2-NH2 3.49Å; D178-N348 PolarHBondContact OD2-ND2 3.08Å
179	M	74.8	Confident	87.4	Confident	76 Å²	76	31.1 Å²	31.1	37%	0.374	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.2	-177.9	-70.6	-175.3	66.7	0	0	113.6	P90 R175 L177 F181	P90-M179 HydrophobicContact CB-SD 3.99Å; R175-M179 HydrophobicContact CG-CG 4.29Å; R175-M179 HydrophobicContact CG-SD 3.97Å; R175-M179 PolarHBondContact NE-SD 2.84Å; R175-M179 WeakPolarHBondContact O-CB 3.43Å; R175-M179 WeakPolarHBondContact O-CG 3.06Å; R175-M179 PolarHBondContact O-N 2.9Å; R175-M179 VanDerWaalsContact O-N 3.08Å; L177-M179 PolarHBondContact O-N 3.47Å; M179-F181 VanDerWaalsContact C-N 3.34Å; M179-F181 HydrophobicContact CB-CD2 3.63Å; M179-F181 HydrophobicContact CB-CE2 3.63Å; M179-F181 HydrophobicContact CB-CG 4.46Å; M179-F181 HydrophobicContact CB-CZ 4.44Å; M179-F181 HydrophobicContact CE-CE2 3.63Å; M179-F181 HydrophobicContact CE-CZ 3.97Å; M179-F181 HydrophobicContact CG-CE2 4.36Å; M179-F181 HydrophobicContact SD-CE2 3.92Å
180	G	83.3	Confident	87.1	Confident	54 Å²	54	38.4 Å²	38.4	56%	0.557	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.2	23.7	-177.9	0	0	0	0	0	113.6	L177 D178 E182	L177-G180 PolarHBondContact O-N 3.26Å; D178-G180 VanDerWaalsContact C-N 3.29Å; G180-E182 PolarHBondContact O-N 2.79Å
181	F	86.9	Confident	87	Confident	47 Å²	47	42.2 Å²	42.2	21%	0.206	23%	0.231	C	C	.	.			trans	-81.2	5.1	175.4	-64.7	-55.8	0	0	0	113.6	P142 L176 M179 A183 S184 I185	P142-F181 HydrophobicContact CB-CB 4.08Å; P142-F181 HydrophobicContact CB-CD1 4.11Å; P142-F181 HydrophobicContact CB-CG 4.06Å; P142-F181 HydrophobicContact CG-CB 3.99Å; P142-F181 HydrophobicContact CG-CD1 4.35Å; P142-F181 HydrophobicContact CG-CD2 4.01Å; P142-F181 HydrophobicContact CG-CG 3.89Å; L176-F181 HydrophobicContact CD2-CD2 4.19Å; L176-F181 WeakPolarHBondContact O-CB 2.93Å; L176-F181 PolarHBondContact O-N 3.08Å; L176-F181 VanDerWaalsContact O-N 3.09Å; M179-F181 VanDerWaalsContact C-N 3.34Å; M179-F181 HydrophobicContact CB-CD2 3.63Å; M179-F181 HydrophobicContact CB-CE2 3.63Å; M179-F181 HydrophobicContact CB-CG 4.46Å; M179-F181 HydrophobicContact CB-CZ 4.44Å; M179-F181 HydrophobicContact CE-CE2 3.63Å; M179-F181 HydrophobicContact CE-CZ 3.97Å; M179-F181 HydrophobicContact CG-CE2 4.36Å; M179-F181 HydrophobicContact SD-CE2 3.92Å; F181-A183 VanDerWaalsContact C-N 3.32Å; F181-A183 PolarHBondContact O-N 3.08Å; F181-S184 PolarHBondContact O-N 2.81Å; F181-I185 HydrophobicContact CB-CD1 4.29Å; F181-I185 VanDerWaalsContact O-CG1 3.31Å; F181-I185 WeakPolarHBondContact O-CG1 3.26Å; F181-I185 PolarHBondContact O-N 3.19Å
182	E	86.1	Confident	87	Confident	114 Å²	114	42.3 Å²	42.3	53%	0.533	23%	0.231	S	C	.	.	H	α-helix	trans	-53.5	-47.2	179.4	-174.3	178.4	-175.4	0	0	112.2	L177 G180 I185 N186	L177-E182 HydrophobicContact CD2-CB 4.02Å; L177-E182 HydrophobicContact CD2-CG 4.14Å; G180-E182 PolarHBondContact O-N 2.79Å; E182-I185 PolarHBondContact O-N 2.89Å; E182-N186 PolarHBondContact O-N 2.92Å; E182-N186 PolarHBondContact O-ND2 3.35Å
183	A	88.5	Confident	87.2	Confident	68 Å²	68	43.2 Å²	43.2	56%	0.562	24%	0.238	S	C	*	.	H	α-helix	trans	-60.1	-49.4	177.7	0	0	0	0	0	111.9	F181 I185 N186 T187	F181-A183 VanDerWaalsContact C-N 3.32Å; F181-A183 PolarHBondContact O-N 3.08Å; A183-I185 VanDerWaalsContact C-N 3.31Å; A183-I185 PolarHBondContact O-N 3.05Å; A183-N186 PolarHBondContact O-N 3.41Å; A183-T187 PolarHBondContact O-N 3.26Å; A183-T187 PolarHBondContact O-OG1 3.04Å
184	S	91.8	Very high	87.3	Confident	21 Å²	21	51 Å²	51	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-40.7	176.6	-68.2	0	0	0	0	112.4	E146 F181 T187 I188	E146-S184 WeakPolarHBondContact OE2-CA 3.48Å; E146-S184 WeakPolarHBondContact OE2-CB 3.47Å; E146-S184 PolarHBondContact OE2-OG 3.38Å; F181-S184 PolarHBondContact O-N 2.81Å; S184-T187 PolarHBondContact O-N 2.99Å; S184-I188 WeakPolarHBondContact O-CD1 3.48Å; S184-I188 WeakPolarHBondContact O-CG1 3.37Å; S184-I188 PolarHBondContact O-N 3Å
185	I	91.3	Very high	87.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-47.6	178.3	-70.5	165.7	0	0	0	110.1	L176 F181 E182 A183 T187 I188 L189	L176-I185 HydrophobicContact CB-CD1 3.74Å; L176-I185 HydrophobicContact CD1-CD1 4.03Å; L176-I185 HydrophobicContact CD2-CD1 4.26Å; L176-I185 HydrophobicContact CG-CD1 4.23Å; F181-I185 HydrophobicContact CB-CD1 4.29Å; F181-I185 VanDerWaalsContact O-CG1 3.31Å; F181-I185 WeakPolarHBondContact O-CG1 3.26Å; F181-I185 PolarHBondContact O-N 3.19Å; E182-I185 PolarHBondContact O-N 2.89Å; A183-I185 VanDerWaalsContact C-N 3.31Å; A183-I185 PolarHBondContact O-N 3.05Å; I185-T187 VanDerWaalsContact C-N 3.32Å; I185-T187 PolarHBondContact O-N 2.91Å; I185-I188 WeakPolarHBondContact O-CB 3.36Å; I185-I188 PolarHBondContact O-N 2.78Å; I185-I188 VanDerWaalsContact O-N 3.1Å; I185-L189 HydrophobicContact CG2-CD1 4.02Å; I185-L189 HydrophobicContact CG2-CG 4.12Å; I185-L189 VanDerWaalsContact O-CG 3.26Å; I185-L189 WeakPolarHBondContact O-CG 3.32Å; I185-L189 PolarHBondContact O-N 2.89Å
186	N	89.1	Confident	88.1	Confident	66 Å²	66	58.6 Å²	58.6	35%	0.353	31%	0.308	S	S	.	.	H	α-helix	trans	-57.7	-45.5	177.7	-71.8	-24.3	0	0	0	111.4	E182 A183 I188 L189 E190	E182-N186 PolarHBondContact O-N 2.92Å; E182-N186 PolarHBondContact O-ND2 3.35Å; A183-N186 PolarHBondContact O-N 3.41Å; N186-I188 PolarHBondContact O-N 3.23Å; N186-L189 PolarHBondContact O-N 3Å; N186-E190 WeakPolarHBondContact O-CG 3.09Å; N186-E190 PolarHBondContact O-N 3.46Å; N186-E190 VanDerWaalsContact O-N 3.12Å
187	T	91.3	Very high	88.5	Confident	34 Å²	34	61.2 Å²	61.2	21%	0.209	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-43.2	174.1	-59.3	0	0	0	0	112.3	E146 A183 S184 I185 E190 F191	E146-T187 HydrophobicContact CG-CG2 4.14Å; A183-T187 PolarHBondContact O-N 3.26Å; A183-T187 PolarHBondContact O-OG1 3.04Å; S184-T187 PolarHBondContact O-N 2.99Å; I185-T187 VanDerWaalsContact C-N 3.32Å; I185-T187 PolarHBondContact O-N 2.91Å; T187-E190 WeakPolarHBondContact O-CB 3.22Å; T187-E190 PolarHBondContact O-N 3.1Å; T187-F191 HydrophobicContact CG2-CE2 4.04Å; T187-F191 WeakPolarHBondContact O-CD2 3.32Å
188	I	92.8	Very high	89	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-60.9	-47.2	175.5	-70.4	158.5	0	0	0	110.3	I88 P142 L145 E146 F149 S184 I185 N186 E190 F191 L192	I88-I188 HydrophobicContact CD1-CD1 4.34Å; I88-I188 HydrophobicContact CD1-CG2 4.05Å; P142-I188 HydrophobicContact CB-CD1 4.43Å; L145-I188 HydrophobicContact CB-CD1 4.16Å; L145-I188 HydrophobicContact CD2-CD1 4.03Å; L145-I188 HydrophobicContact CD2-CG1 4.47Å; L145-I188 HydrophobicContact CD2-CG2 4.03Å; L145-I188 HydrophobicContact CG-CD1 4.11Å; L145-I188 HydrophobicContact CG-CG1 4.35Å; E146-I188 HydrophobicContact CB-CD1 4.28Å; E146-I188 HydrophobicContact CB-CG1 4.16Å; F149-I188 HydrophobicContact CD2-CG1 4.48Å; F149-I188 HydrophobicContact CE2-CG1 4.47Å; F149-I188 HydrophobicContact CE2-CG2 4.06Å; S184-I188 WeakPolarHBondContact O-CD1 3.48Å; S184-I188 WeakPolarHBondContact O-CG1 3.37Å; S184-I188 PolarHBondContact O-N 3Å; I185-I188 WeakPolarHBondContact O-CB 3.36Å; I185-I188 PolarHBondContact O-N 2.78Å; I185-I188 VanDerWaalsContact O-N 3.1Å; N186-I188 PolarHBondContact O-N 3.23Å; I188-E190 PolarHBondContact O-N 2.95Å; I188-F191 PolarHBondContact O-N 3.01Å; I188-L192 HydrophobicContact CG2-CD1 4.1Å; I188-L192 HydrophobicContact CG2-CG 4.25Å; I188-L192 WeakPolarHBondContact O-CG 3.22Å; I188-L192 PolarHBondContact O-N 3.06Å
189	L	90.8	Very high	89.9	Confident	31 Å²	31	57.8 Å²	57.8	16%	0.162	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-29.8	-178.2	-68.9	-178.1	0	0	0	113	L168 I185 N186 F191 L192	L168-L189 HydrophobicContact CD2-CD2 3.5Å; L168-L189 VanDerWaalsContact CD2-CD2 3.5Å; I185-L189 HydrophobicContact CG2-CD1 4.02Å; I185-L189 HydrophobicContact CG2-CG 4.12Å; I185-L189 VanDerWaalsContact O-CG 3.26Å; I185-L189 WeakPolarHBondContact O-CG 3.32Å; I185-L189 PolarHBondContact O-N 2.89Å; N186-L189 PolarHBondContact O-N 3Å; L189-F191 VanDerWaalsContact C-N 3.32Å; L189-F191 PolarHBondContact O-N 3.48Å; L189-L192 HydrophobicContact CD2-CD1 4.3Å; L189-L192 PolarHBondContact O-N 2.87Å
190	E	90.9	Very high	90.8	Very high	154 Å²	154	54.3 Å²	54.3	72%	0.72	28%	0.283	S	S	*	.	H	α-helix	trans	-64.6	-32.4	174.8	-71.6	169.5	-173	0	0	113.1	N186 T187 I188	N186-E190 WeakPolarHBondContact O-CG 3.09Å; N186-E190 PolarHBondContact O-N 3.46Å; N186-E190 VanDerWaalsContact O-N 3.12Å; T187-E190 WeakPolarHBondContact O-CB 3.22Å; T187-E190 PolarHBondContact O-N 3.1Å; I188-E190 PolarHBondContact O-N 2.95Å
191	F	92.2	Very high	91.2	Very high	81 Å²	81	51.8 Å²	51.8	36%	0.355	26%	0.256	S	S	.	.	H	α-helix	trans	-81.3	-19.7	176.4	-69.2	-75.7	0	0	0	113.4	F149 A159 T187 I188 L189	F149-F191 HydrophobicContact CB-CD2 4.04Å; F149-F191 HydrophobicContact CB-CE2 4.04Å; F149-F191 HydrophobicContact CB-CG 4.41Å; F149-F191 HydrophobicContact CB-CZ 4.4Å; F149-F191 HydrophobicContact CD1-CB 3.7Å; F149-F191 HydrophobicContact CD1-CD1 4.09Å; F149-F191 HydrophobicContact CD1-CD2 4.05Å; F149-F191 AromaticContact CD1-CG 3.68Å; F149-F191 HydrophobicContact CD1-CG 3.68Å; F149-F191 HydrophobicContact CD2-CD2 4.36Å; F149-F191 HydrophobicContact CE1-CB 3.55Å; F149-F191 HydrophobicContact CE1-CG 4.09Å; F149-F191 HydrophobicContact CG-CB 4.3Å; F149-F191 AromaticContact CG-CD2 3.9Å; F149-F191 HydrophobicContact CG-CD2 3.9Å; F149-F191 HydrophobicContact CG-CE2 4.41Å; F149-F191 HydrophobicContact CG-CG 4.04Å; F149-F191 HydrophobicContact CZ-CB 4.04Å; A159-F191 HydrophobicContact CB-CD1 4.18Å; T187-F191 HydrophobicContact CG2-CE2 4.04Å; T187-F191 WeakPolarHBondContact O-CD2 3.32Å; I188-F191 PolarHBondContact O-N 3.01Å; L189-F191 VanDerWaalsContact C-N 3.32Å; L189-F191 PolarHBondContact O-N 3.48Å
192	L	93.6	Very high	91.2	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.042	25%	0.248	C	C	.	.	S	Bend	trans	-84.6	145.3	-173.8	-58.9	-171.2	0	0	0	112	I86 F149 V162 L165 L168 I188 L189 K194	I86-L192 HydrophobicContact CD1-CD2 3.82Å; F149-L192 HydrophobicContact CZ-CD2 3.79Å; V162-L192 HydrophobicContact CB-CD2 4.19Å; V162-L192 HydrophobicContact CG1-CD2 4.32Å; V162-L192 HydrophobicContact CG2-CD2 4.09Å; L165-L192 HydrophobicContact CD2-CB 4.33Å; L165-L192 HydrophobicContact CD2-CD1 4Å; L165-L192 HydrophobicContact CD2-CD2 4.01Å; L165-L192 HydrophobicContact CD2-CG 4.31Å; L168-L192 HydrophobicContact CD1-CD1 3.9Å; L168-L192 HydrophobicContact CD2-CD1 3.87Å; L168-L192 HydrophobicContact CG-CD1 4.38Å; I188-L192 HydrophobicContact CG2-CD1 4.1Å; I188-L192 HydrophobicContact CG2-CG 4.25Å; I188-L192 WeakPolarHBondContact O-CG 3.22Å; I188-L192 PolarHBondContact O-N 3.06Å; L189-L192 HydrophobicContact CD2-CD1 4.3Å; L189-L192 PolarHBondContact O-N 2.87Å; L192-K194 PolarHBondContact O-N 2.95Å
193	P	92.3	Very high	90.8	Very high	32 Å²	32	45 Å²	45	21%	0.208	23%	0.228	C	C	.	.			trans	-60.7	137	176.6	25.9	-34.5	0	0	0	110.7	V162 L165 Q195 R196	V162-P193 VanDerWaalsContact O-CD 3.27Å; V162-P193 WeakPolarHBondContact O-CD 3.44Å; V162-P193 WeakPolarHBondContact O-CG 3.41Å; L165-P193 HydrophobicContact CB-CG 3.81Å; L165-P193 HydrophobicContact CD2-CG 4.49Å; P193-Q195 VanDerWaalsContact C-N 3.28Å; P193-Q195 PolarHBondContact O-N 3.37Å; P193-R196 WeakPolarHBondContact O-CD 3.44Å; P193-R196 PolarHBondContact O-NH1 2.94Å
194	K	87.8	Confident	90	Very high	163 Å²	163	41.9 Å²	41.9	71%	0.709	20%	0.202	S	C	*	.	S	Bend	trans	-63.9	-33.5	179.6	-74.9	-172.8	178.6	179.6	0	112.6	L192 R196 R218	L192-K194 PolarHBondContact O-N 2.95Å; K194-R196 PolarHBondContact O-N 3.38Å; K194-R218 PolarHBondContact O-NE 3.18Å; K194-R218 PolarHBondContact O-NH1 3.48Å; K194-R218 VanDerWaalsContact O-NH1 3.09Å; K194-R218 PolarHBondContact O-NH2 3.36Å
195	Q	89.3	Confident	89	Confident	168 Å²	168	45.6 Å²	45.6	79%	0.785	22%	0.217	S	C	*	.	S	Bend	trans	-89	96.4	175.5	-176	173.6	-0.5	0	0	109.3	P193	P193-Q195 VanDerWaalsContact C-N 3.28Å; P193-Q195 PolarHBondContact O-N 3.37Å
196	R	92.3	Very high	88.1	Confident	35 Å²	35	47.2 Å²	47.2	13%	0.132	23%	0.227	C	C	.	.	S	Bend	trans	-155.9	162.3	176.3	64.6	-178	-174.5	-90.9	-7.7	108.5	P193 K194	P193-R196 WeakPolarHBondContact O-CD 3.44Å; P193-R196 PolarHBondContact O-NH1 2.94Å; K194-R196 PolarHBondContact O-N 3.38Å
197	R	93.3	Very high	87.4	Confident	56 Å²	56	49.4 Å²	49.4	21%	0.211	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.5	169.8	-62.7	169.2	-156.5	148.9	14.4	108.8	F43 N46 D48 D166 V167 L168	F43-R197 HydrophobicContact CE2-CB 4.09Å; N46-R197 PolarHBondContact OD1-NE 3.11Å; N46-R197 PolarHBondContact OD1-NH2 3.36Å; D48-R197 VanDerWaalsContact OD1-CA 3.27Å; D48-R197 WeakPolarHBondContact OD1-CA 3.37Å; D166-R197 PolarHBondContact O-N 3.47Å; V167-R197 CarbonylContact C-O 3.48Å; V167-R197 WeakPolarHBondContact CA-O 3.38Å; L168-R197 PolarHBondContact N-O 2.94Å
198	T	94.9	Very high	86.7	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.2	180	-54.1	0	0	0	0	110.6	D48 V49 L168 L217	D48-T198 VanDerWaalsContact CA-O 3.31Å; D48-T198 WeakPolarHBondContact CA-O 3.19Å; D48-T198 WeakPolarHBondContact CB-O 3.44Å; D48-T198 PolarHBondContact OD1-N 2.89Å; V49-T198 PolarHBondContact N-O 2.69Å; L168-T198 HydrophobicContact CB-CG2 4.48Å; L168-T198 HydrophobicContact CD2-CG2 4.21Å; L168-T198 HydrophobicContact CG-CG2 4.42Å; L168-T198 CarbonylContact O-C 3.6Å; L168-T198 VanDerWaalsContact O-CA 3.31Å; L168-T198 WeakPolarHBondContact O-CA 3.33Å; T198-L217 HydrophobicContact CG2-CD1 3.6Å; T198-L217 HydrophobicContact CG2-CG 3.98Å
199	G	94.9	Very high	85.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.1	173.6	0	0	0	0	0	110.5	V49 L168 V169 L170	V49-G199 CarbonylContact O-C 3.54Å; V49-G199 WeakPolarHBondContact O-CA 3.21Å; L168-G199 PolarHBondContact O-N 2.83Å; V169-G199 CarbonylContact C-O 3.57Å; V169-G199 VanDerWaalsContact CA-O 3.28Å; V169-G199 WeakPolarHBondContact CA-O 3.45Å; L170-G199 PolarHBondContact N-O 2.63Å
200	L	93.5	Very high	85.4	Confident	4 Å²	4	53 Å²	53	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.3	174.6	-172.8	151.2	0	0	0	109.1	V49 A50 A51 A173 V209 L212 V213 L217	V49-L200 PolarHBondContact O-N 3.28Å; A50-L200 CarbonylContact C-O 3.31Å; A50-L200 WeakPolarHBondContact CA-O 3.43Å; A51-L200 PolarHBondContact N-O 3.35Å; A173-L200 HydrophobicContact CB-CD1 3.92Å; A173-L200 HydrophobicContact CB-CD2 3.7Å; A173-L200 HydrophobicContact CB-CG 3.61Å; L200-V209 HydrophobicContact CD1-CG1 4.43Å; L200-V209 HydrophobicContact CD2-CG1 3.75Å; L200-L212 HydrophobicContact CD1-CD2 3.94Å; L200-L212 HydrophobicContact CD1-CG 4.15Å; L200-V213 HydrophobicContact CD1-CG2 3.74Å; L200-V213 HydrophobicContact CD2-CG2 4.29Å; L200-V213 HydrophobicContact CG-CG2 4.48Å; L200-L217 HydrophobicContact CB-CD1 4.36Å; L200-L217 HydrophobicContact CB-CD2 4.33Å; L200-L217 HydrophobicContact CD1-CD1 4.48Å
201	F	92.2	Very high	84.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124	-177.7	-67	-96	0	0	0	109.6	T39 F43 A51 K59 A62 F63 V169 L170 E172 A173	T39-F201 HydrophobicContact CG2-CE1 3.88Å; T39-F201 HydrophobicContact CG2-CZ 3.87Å; F43-F201 HydrophobicContact CE1-CE2 4.4Å; F43-F201 HydrophobicContact CE1-CZ 4.5Å; A51-F201 HydrophobicContact CB-CD1 3.63Å; A51-F201 HydrophobicContact CB-CE1 3.64Å; A51-F201 HydrophobicContact CB-CG 4.43Å; A51-F201 HydrophobicContact CB-CZ 4.44Å; K59-F201 HydrophobicContact CB-CD1 4.28Å; K59-F201 HydrophobicContact CD-CB 4.39Å; K59-F201 HydrophobicContact CD-CD1 4.45Å; K59-F201 HydrophobicContact CG-CD1 4.48Å; A62-F201 HydrophobicContact CB-CE1 4.14Å; F63-F201 HydrophobicContact CB-CD2 4.29Å; F63-F201 HydrophobicContact CB-CE1 4.3Å; F63-F201 HydrophobicContact CB-CE2 3.56Å; F63-F201 HydrophobicContact CB-CZ 3.58Å; F63-F201 HydrophobicContact CD1-CD1 4.04Å; F63-F201 AromaticContact CD1-CD2 3.79Å; F63-F201 HydrophobicContact CD1-CD2 3.79Å; F63-F201 HydrophobicContact CD1-CE1 4.13Å; F63-F201 AromaticContact CD1-CE2 3.9Å; F63-F201 HydrophobicContact CD1-CE2 3.9Å; F63-F201 AromaticContact CD1-CG 3.88Å; F63-F201 HydrophobicContact CD1-CG 3.88Å; F63-F201 HydrophobicContact CD1-CZ 4.09Å; F63-F201 HydrophobicContact CE1-CG 4.44Å; F63-F201 HydrophobicContact CG-CD2 4.41Å; F63-F201 HydrophobicContact CG-CE2 4.15Å; F63-F201 HydrophobicContact CG-CZ 4.35Å; V169-F201 HydrophobicContact CG1-CD2 3.86Å; V169-F201 HydrophobicContact CG1-CE2 4.14Å; L170-F201 PolarHBondContact O-N 2.84Å; E172-F201 WeakPolarHBondContact CA-O 3.28Å; E172-F201 PolarHBondContact N-O 3.37Å; A173-F201 PolarHBondContact N-O 3.46Å
202	S	87.2	Confident	84.3	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.028	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	155.4	-179.3	-171.8	0	0	0	0	111.1	A51 E52 A53 D174 T204	A51-S202 PolarHBondContact O-N 2.93Å; E52-S202 WeakPolarHBondContact CA-O 3.42Å; A53-S202 PolarHBondContact N-O 3.03Å; D174-S202 WeakPolarHBondContact CB-OG 3.38Å; D174-S202 PolarHBondContact OD1-OG 3.41Å; D174-S202 PolarHBondContact OD2-OG 3.43Å; S202-T204 PolarHBondContact OG-N 2.95Å; S202-T204 PolarHBondContact OG-O 2.99Å
203	A	77.9	Confident	83.7	Confident	15 Å²	15	46.3 Å²	46.3	12%	0.124	22%	0.223	C	C	.	.	S	Bend	trans	-92.4	-20.2	169.1	0	0	0	0	0	112.7	A53 T55	A53-A203 WeakPolarHBondContact O-CA 3.49Å; T55-A203 HydrophobicContact CG2-CB 3.91Å
204	T	71.1	Confident	82.9	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	24%	0.243	C	C	.	.	S	Bend	trans	-128.2	146.1	179.1	68.1	0	0	0	0	111.7	D174 S202	D174-T204 WeakPolarHBondContact CB-OG1 3.39Å; D174-T204 PolarHBondContact OD2-N 3.25Å; D174-T204 PolarHBondContact OD2-OG1 3.45Å; S202-T204 PolarHBondContact OG-N 2.95Å; S202-T204 PolarHBondContact OG-O 2.99Å
205	Q	70	Confident	82.3	Confident	98 Å²	98	49.2 Å²	49.2	46%	0.458	24%	0.244	S	C	.	.			trans	-95	101.3	169.7	-168.8	176.9	12.5	0	0	109.1	E210	Q205-E210 HydrophobicContact CG-CG 4.28Å; Q205-E210 PolarHBondContact NE2-OE1 3.5Å
206	T	72.2	Confident	81.6	Confident	35 Å²	35	41.8 Å²	41.8	22%	0.215	21%	0.212	C	C	.	.			trans	-101.2	158.7	168.4	70.5	0	0	0	0	110	E208 V209 E210	T206-E208 PolarHBondContact O-N 3.34Å; T206-V209 PolarHBondContact O-N 2.87Å; T206-V209 WeakPolarHBondContact OG1-CG2 3.31Å; T206-V209 PolarHBondContact OG1-N 3.4Å; T206-E210 PolarHBondContact O-N 3.19Å
207	Q	75.1	Confident	81	Confident	112 Å²	112	40.8 Å²	40.8	52%	0.523	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-33.6	177.2	-169.8	59.2	54.2	0	0	111.8	E210 N211	Q207-E210 PolarHBondContact NE2-OE2 3.11Å; Q207-E210 WeakPolarHBondContact O-CB 3.29Å; Q207-E210 PolarHBondContact O-N 2.99Å; Q207-N211 PolarHBondContact NE2-OD1 3.02Å; Q207-N211 PolarHBondContact O-N 3.03Å; Q207-N211 PolarHBondContact O-OD1 2.9Å
208	E	75.7	Confident	80.5	Confident	107 Å²	107	44.8 Å²	44.8	50%	0.5	22%	0.224	S	C	.	.	H	α-helix	trans	-67.2	-40.9	177.8	-58.8	147.1	165.4	0	0	110.7	L177 T206 E210 N211 L212	L177-E208 VanDerWaalsContact CD1-C 3.43Å; L177-E208 HydrophobicContact CD1-CB 3.71Å; L177-E208 WeakPolarHBondContact CD1-O 3.14Å; T206-E208 PolarHBondContact O-N 3.34Å; E208-E210 VanDerWaalsContact C-N 3.31Å; E208-E210 PolarHBondContact O-N 3.17Å; E208-N211 WeakPolarHBondContact O-CB 3.12Å; E208-N211 PolarHBondContact O-N 2.89Å; E208-L212 PolarHBondContact O-N 3.22Å
209	V	77.5	Confident	79.7	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-39.4	172	172.9	0	0	0	0	110.7	D174 L177 L200 T206 N211 L212 V213	D174-V209 VanDerWaalsContact CA-CG2 3.45Å; D174-V209 HydrophobicContact CB-CG2 3.83Å; L177-V209 HydrophobicContact CD1-CG2 3.99Å; L200-V209 HydrophobicContact CD1-CG1 4.43Å; L200-V209 HydrophobicContact CD2-CG1 3.75Å; T206-V209 PolarHBondContact O-N 2.87Å; T206-V209 WeakPolarHBondContact OG1-CG2 3.31Å; T206-V209 PolarHBondContact OG1-N 3.4Å; V209-N211 VanDerWaalsContact C-N 3.32Å; V209-N211 PolarHBondContact O-N 3.05Å; V209-L212 WeakPolarHBondContact O-CB 3.19Å; V209-L212 PolarHBondContact O-N 3.46Å; V209-V213 VanDerWaalsContact O-CG2 3.32Å; V209-V213 WeakPolarHBondContact O-CG2 3.29Å; V209-V213 PolarHBondContact O-N 3.31Å
210	E	80.4	Confident	79.4	Confident	29 Å²	29	54 Å²	54	14%	0.136	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-39.4	174.3	-66.4	-146.8	136.4	0	0	112.8	Q205 T206 Q207 E208 L212 V213 R214 R222	Q205-E210 HydrophobicContact CG-CG 4.28Å; Q205-E210 PolarHBondContact NE2-OE1 3.5Å; T206-E210 PolarHBondContact O-N 3.19Å; Q207-E210 PolarHBondContact NE2-OE2 3.11Å; Q207-E210 WeakPolarHBondContact O-CB 3.29Å; Q207-E210 PolarHBondContact O-N 2.99Å; E208-E210 VanDerWaalsContact C-N 3.31Å; E208-E210 PolarHBondContact O-N 3.17Å; E210-L212 VanDerWaalsContact C-N 3.34Å; E210-V213 WeakPolarHBondContact O-CB 3.04Å; E210-V213 PolarHBondContact O-N 3.27Å; E210-R214 WeakPolarHBondContact O-CG 3.48Å; E210-R214 PolarHBondContact O-N 2.9Å; E210-R214 IonicContact OE2-NH2 3.67Å; E210-R222 IonicContact OE1-CZ 3.97Å; E210-R222 IonicContact OE1-NH1 3.22Å; E210-R222 PolarHBondContact OE1-NH1 2.85Å; E210-R222 IonicContact OE1-NH2 3.64Å
211	N	80.3	Confident	79.2	Confident	82 Å²	82	55.6 Å²	55.6	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-41.2	176.5	-65.7	-12.8	0	0	0	110.5	Q207 E208 V209 V213 R214 A215	Q207-N211 PolarHBondContact NE2-OD1 3.02Å; Q207-N211 PolarHBondContact O-N 3.03Å; Q207-N211 PolarHBondContact O-OD1 2.9Å; E208-N211 WeakPolarHBondContact O-CB 3.12Å; E208-N211 PolarHBondContact O-N 2.89Å; V209-N211 VanDerWaalsContact C-N 3.32Å; V209-N211 PolarHBondContact O-N 3.05Å; N211-V213 VanDerWaalsContact C-N 3.32Å; N211-V213 PolarHBondContact O-N 3.48Å; N211-R214 PolarHBondContact O-N 2.67Å; N211-R214 VanDerWaalsContact O-N 3.17Å; N211-A215 WeakPolarHBondContact O-CB 3.2Å; N211-A215 PolarHBondContact O-N 3.13Å
212	L	78.9	Confident	79	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-62.1	-38.7	173.5	-172.7	66.4	0	0	0	111.8	L170 A173 L177 L200 E208 V209 E210 A215 G216	L170-L212 HydrophobicContact CD1-CD2 4.04Å; L170-L212 HydrophobicContact CD1-CG 4.41Å; A173-L212 HydrophobicContact CB-CD2 4.26Å; L177-L212 HydrophobicContact CD1-CB 4.18Å; L177-L212 HydrophobicContact CD1-CD2 4.08Å; L177-L212 HydrophobicContact CD2-CD2 4.27Å; L177-L212 HydrophobicContact CG-CD2 4.31Å; L200-L212 HydrophobicContact CD1-CD2 3.94Å; L200-L212 HydrophobicContact CD1-CG 4.15Å; E208-L212 PolarHBondContact O-N 3.22Å; V209-L212 WeakPolarHBondContact O-CB 3.19Å; V209-L212 PolarHBondContact O-N 3.46Å; E210-L212 VanDerWaalsContact C-N 3.34Å; L212-A215 PolarHBondContact O-N 2.73Å; L212-G216 WeakPolarHBondContact O-CA 3.34Å; L212-G216 PolarHBondContact O-N 3.32Å
213	V	80.1	Confident	79	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.048	31%	0.311	C	S	.	.	H	α-helix	trans	-60.7	-45.7	172.8	169.6	0	0	0	0	110.9	A50 L200 V209 E210 N211 L217 P220	A50-V213 HydrophobicContact CB-CG1 4.49Å; A50-V213 HydrophobicContact CB-CG2 4.01Å; L200-V213 HydrophobicContact CD1-CG2 3.74Å; L200-V213 HydrophobicContact CD2-CG2 4.29Å; L200-V213 HydrophobicContact CG-CG2 4.48Å; V209-V213 VanDerWaalsContact O-CG2 3.32Å; V209-V213 WeakPolarHBondContact O-CG2 3.29Å; V209-V213 PolarHBondContact O-N 3.31Å; E210-V213 WeakPolarHBondContact O-CB 3.04Å; E210-V213 PolarHBondContact O-N 3.27Å; N211-V213 VanDerWaalsContact C-N 3.32Å; N211-V213 PolarHBondContact O-N 3.48Å; V213-L217 HydrophobicContact CG1-CD2 4.39Å; V213-L217 WeakPolarHBondContact O-CB 3.49Å; V213-L217 PolarHBondContact O-N 3.31Å; V213-L217 VanDerWaalsContact O-N 3.11Å; V213-P220 HydrophobicContact CG1-CB 4.2Å; V213-P220 HydrophobicContact CG1-CG 3.8Å
214	R	77.4	Confident	79.3	Confident	170 Å²	170	64.3 Å²	64.3	64%	0.642	33%	0.326	S	S	*	.	H	α-helix	trans	-67.3	-35.4	-179.5	-69.4	176.3	-167.4	179.6	7.3	112.8	E210 N211	E210-R214 WeakPolarHBondContact O-CG 3.48Å; E210-R214 PolarHBondContact O-N 2.9Å; E210-R214 IonicContact OE2-NH2 3.67Å; N211-R214 PolarHBondContact O-N 2.67Å; N211-R214 VanDerWaalsContact O-N 3.17Å
215	A	73.9	Confident	79.6	Confident	87 Å²	87	65.8 Å²	65.8	72%	0.719	34%	0.335	S	S	*	.	H	α-helix	trans	-81.7	-35.8	-179.4	0	0	0	0	0	113	N211 L212	N211-A215 WeakPolarHBondContact O-CB 3.2Å; N211-A215 PolarHBondContact O-N 3.13Å; L212-A215 PolarHBondContact O-N 2.73Å
216	G	74	Confident	79.5	Confident	11 Å²	11	68.1 Å²	68.1	11%	0.113	34%	0.343	C	S	.	.	H	α-helix	trans	-100.7	-22.7	-167.9	0	0	0	0	0	116.1	L212	L212-G216 WeakPolarHBondContact O-CA 3.34Å; L212-G216 PolarHBondContact O-N 3.32Å
217	L	81.4	Confident	78.7	Confident	14 Å²	14	70.7 Å²	70.7	7%	0.073	35%	0.352	C	S	.	.			trans	-112.1	149.9	-174	-74.6	63.3	0	0	0	112	D48 A50 T198 L200 V213 P220	D48-L217 HydrophobicContact CB-CB 3.99Å; D48-L217 HydrophobicContact CB-CD2 4.06Å; D48-L217 HydrophobicContact CB-CG 4Å; D48-L217 VanDerWaalsContact OD2-CA 3.28Å; D48-L217 WeakPolarHBondContact OD2-CA 3.29Å; A50-L217 HydrophobicContact CB-CD2 4.27Å; T198-L217 HydrophobicContact CG2-CD1 3.6Å; T198-L217 HydrophobicContact CG2-CG 3.98Å; L200-L217 HydrophobicContact CB-CD1 4.36Å; L200-L217 HydrophobicContact CB-CD2 4.33Å; L200-L217 HydrophobicContact CD1-CD1 4.48Å; V213-L217 HydrophobicContact CG1-CD2 4.39Å; V213-L217 WeakPolarHBondContact O-CB 3.49Å; V213-L217 PolarHBondContact O-N 3.31Å; V213-L217 VanDerWaalsContact O-N 3.11Å; L217-P220 HydrophobicContact CB-CB 3.83Å; L217-P220 HydrophobicContact CB-CG 4.13Å; L217-P220 HydrophobicContact CD2-CB 3.65Å; L217-P220 HydrophobicContact CG-CB 4.36Å
218	R	81.2	Confident	77.2	Confident	140 Å²	140	75.4 Å²	75.4	53%	0.528	37%	0.371	S	S	.	.	S	Bend	trans	-108.6	116.4	176.5	-68.9	175.5	169.2	-161.7	-12.1	110.1	D48 K194	D48-R218 PolarHBondContact OD2-N 2.99Å; K194-R218 PolarHBondContact O-NE 3.18Å; K194-R218 PolarHBondContact O-NH1 3.48Å; K194-R218 VanDerWaalsContact O-NH1 3.09Å; K194-R218 PolarHBondContact O-NH2 3.36Å
219	N	79.9	Confident	75.5	Confident	153 Å²	153	73.5 Å²	73.5	82%	0.818	38%	0.38	S	S	*	.	S	Bend	trans	46.6	56.8	-177.7	-168.3	25.1	0	0	0	113
220	P	87.4	Confident	73.5	Confident	43 Å²	43	76.8 Å²	76.8	28%	0.279	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-69.2	137.4	-171.7	28	-34.6	0	0	0	112.3	D48 V213 L217	D48-P220 HydrophobicContact CB-CB 4.42Å; D48-P220 WeakPolarHBondContact O-CA 3.41Å; V213-P220 HydrophobicContact CG1-CB 4.2Å; V213-P220 HydrophobicContact CG1-CG 3.8Å; L217-P220 HydrophobicContact CB-CB 3.83Å; L217-P220 HydrophobicContact CB-CG 4.13Å; L217-P220 HydrophobicContact CD2-CB 3.65Å; L217-P220 HydrophobicContact CG-CB 4.36Å
221	V	89.3	Confident	71.2	Confident	39 Å²	39	78.7 Å²	78.7	24%	0.236	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.4	164.1	-177.6	0	0	0	0	109.2	L42 K47 D48 V49 A50 V223	L42-V221 HydrophobicContact CD1-CB 4.47Å; L42-V221 HydrophobicContact CD1-CG1 3.77Å; K47-V221 HydrophobicContact CB-CG2 4.3Å; K47-V221 HydrophobicContact CD-CG2 3.4Å; K47-V221 VanDerWaalsContact CD-CG2 3.4Å; K47-V221 HydrophobicContact CG-CG2 4.47Å; D48-V221 PolarHBondContact O-N 3.28Å; V49-V221 WeakPolarHBondContact CA-O 3.36Å; A50-V221 PolarHBondContact N-O 2.86Å; V221-V223 HydrophobicContact CG1-CG2 4.43Å
222	R	88.1	Confident	69.1	Low	127 Å²	127	80.5 Å²	80.5	48%	0.479	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.1	174.8	-64.3	-177.4	179.3	-157.1	-4.9	109.3	A50 E210	A50-R222 WeakPolarHBondContact O-CA 3.5Å; E210-R222 IonicContact OE1-CZ 3.97Å; E210-R222 IonicContact OE1-NH1 3.22Å; E210-R222 PolarHBondContact OE1-NH1 2.85Å; E210-R222 IonicContact OE1-NH2 3.64Å
223	V	86.9	Confident	67.1	Low	14 Å²	14	85.2 Å²	85.2	9%	0.085	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	107.5	173.8	179.6	0	0	0	0	107	A38 L42 V49 A50 A51 E52 V221 V225	A38-V223 HydrophobicContact CB-CG1 3.65Å; L42-V223 HydrophobicContact CD1-CG2 3.57Å; V49-V223 HydrophobicContact CG1-CG2 3.97Å; A50-V223 PolarHBondContact O-N 3.26Å; A51-V223 CarbonylContact C-O 3.32Å; A51-V223 WeakPolarHBondContact CA-O 3.35Å; E52-V223 PolarHBondContact N-O 3.47Å; V221-V223 HydrophobicContact CG1-CG2 4.43Å; V223-V225 HydrophobicContact CG1-CG2 3.87Å
224	S	84.4	Confident	65.4	Low	61 Å²	61	87.3 Å²	87.3	43%	0.427	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.1	174.5	-174.2	0	0	0	0	108.2	E52	E52-S224 PolarHBondContact OE2-OG 3.37Å
225	V	77.3	Confident	64.1	Low	34 Å²	34	81.1 Å²	81.1	21%	0.206	48%	0.481	C	S	.	.			trans	-99.4	108.9	-179.7	175.3	0	0	0	0	108	P34 V35 A38 E52 A53 V223	P34-V225 HydrophobicContact CB-CG1 3.64Å; V35-V225 HydrophobicContact CB-CB 4.43Å; V35-V225 HydrophobicContact CB-CG2 4.07Å; V35-V225 HydrophobicContact CG2-CG2 4.34Å; A38-V225 HydrophobicContact CB-CG2 4.35Å; E52-V225 PolarHBondContact O-N 2.93Å; A53-V225 HydrophobicContact CB-CB 4.36Å; V223-V225 HydrophobicContact CG1-CG2 3.87Å
226	K	67.7	Low	63.3	Low	147 Å²	147	80.5 Å²	80.5	64%	0.639	46%	0.463	S	S	*	.			trans	-99.6	137	176.6	-61.7	177.2	-177.3	172.8	0	109.1	K228 A235	K226-K228 PolarHBondContact O-N 3.03Å; K226-A235 HydrophobicContact CD-CB 4.32Å
227	E	56.2	Low	62.7	Low	88 Å²	88	82.8 Å²	82.8	41%	0.411	47%	0.47	S	S	.	.			trans	-64.9	126.4	172.7	-72.6	-168.4	-179.8	0	0	110	G229 S240	E227-G229 PolarHBondContact O-N 2.74Å; E227-S240 WeakPolarHBondContact OE2-CA 3.41Å; E227-S240 WeakPolarHBondContact OE2-CB 3.38Å; E227-S240 PolarHBondContact OE2-N 3.27Å; E227-S240 PolarHBondContact OE2-OG 3.02Å
228	K	43.4	Very low	61.7	Low	212 Å²	212	82.3 Å²	82.3	92%	0.922	47%	0.468	S	S	*	.	S	Bend	trans	-78.1	103.3	174.2	-72.7	-178.9	179.1	174	0	108.2	K226	K226-K228 PolarHBondContact O-N 3.03Å
229	G	40.1	Very low	60.7	Low	66 Å²	66	76 Å²	76	68%	0.68	45%	0.445	S	S	*	.			trans	-172.5	-11.9	179.9	0	0	0	0	0	117.7	E227	E227-G229 PolarHBondContact O-N 2.74Å
230	V	34.7	Very low	60.1	Low	77 Å²	77	72.5 Å²	72.5	47%	0.467	43%	0.433	S	S	.	.	S	Bend	trans	-131.8	140	173.3	-165.7	0	0	0	0	108.2	S234	V230-S234 WeakPolarHBondContact CG1-OG 3.39Å
231	A	33.5	Very low	59.6	Low	69 Å²	69	77 Å²	77	57%	0.57	44%	0.444	S	S	*	.			trans	-39.3	146.7	-177.2	0	0	0	0	0	112.6	S233 S234	A231-S233 PolarHBondContact O-N 3.32Å; A231-S234 PolarHBondContact O-N 2.85Å
232	A	34.8	Very low	59.2	Low	120 Å²	120	75.9 Å²	75.9	99%	0.992	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-4	-172.4	0	0	0	0	0	116.3
233	S	36.8	Very low	59.2	Low	110 Å²	110	74.7 Å²	74.7	77%	0.769	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-12.7	175.2	52	0	0	0	0	115.8	A231	A231-S233 PolarHBondContact O-N 3.32Å
234	S	43.9	Very low	59.4	Low	51 Å²	51	74.5 Å²	74.5	36%	0.357	44%	0.435	S	S	.	.			trans	-141.1	77.4	-176.9	63.8	0	0	0	0	114.2	V230 A231 Q236	V230-S234 WeakPolarHBondContact CG1-OG 3.39Å; A231-S234 PolarHBondContact O-N 2.85Å; S234-Q236 PolarHBondContact O-N 3.36Å
235	A	51.4	Low	59.9	Low	40 Å²	40	73.6 Å²	73.6	33%	0.331	42%	0.423	S	S	.	.			trans	-66.5	99.5	173.7	0	0	0	0	0	111.9	K226 K388	K226-A235 HydrophobicContact CD-CB 4.32Å; A235-K388 WeakPolarHBondContact O-CB 3.44Å; A235-K388 WeakPolarHBondContact O-CD 3.4Å
236	Q	57.5	Low	60.8	Low	74 Å²	74	73.3 Å²	73.3	35%	0.346	42%	0.418	S	S	.	.			trans	-70.5	141.6	176.9	-67	179.7	-47.2	0	0	111.3	S234 P390	S234-Q236 PolarHBondContact O-N 3.36Å; Q236-P390 VanDerWaalsContact NE2-CG 3.29Å
237	K	60.7	Low	62.1	Low	59 Å²	59	66.5 Å²	66.5	26%	0.257	39%	0.388	S	S	.	.	S	Bend	trans	-90.4	-0.6	175.4	-69.9	-178.1	173.2	172.4	0	113.6	V353	K237-V353 HydrophobicContact CB-CG1 4.08Å; K237-V353 WeakPolarHBondContact O-CG1 3.22Å
238	T	60.6	Low	64	Low	4 Å²	4	63.7 Å²	63.7	3%	0.025	38%	0.378	C	S	.	.	S	Bend	trans	-103.5	153.1	-179.6	49.3	0	0	0	0	111.4	L242 V353 C389	T238-L242 HydrophobicContact CG2-CD2 4.09Å; T238-V353 HydrophobicContact CG2-CG1 4.35Å; T238-C389 HydrophobicContact CG2-CB 4.27Å
239	P	60.7	Low	66.3	Low	7 Å²	7	53.7 Å²	53.7	5%	0.045	33%	0.334	C	S	.	.			trans	-55.4	140.9	172.1	-22.3	32.2	0	0	0	112	R241 L242 A360	P239-R241 VanDerWaalsContact C-N 3.28Å; P239-R241 PolarHBondContact O-N 3.11Å; P239-L242 HydrophobicContact CB-CB 4.26Å; P239-L242 WeakPolarHBondContact O-CB 3.44Å; P239-L242 PolarHBondContact O-N 3.23Å; P239-A360 HydrophobicContact CB-CB 4.14Å
240	S	66.6	Low	68.8	Low	81 Å²	81	56.4 Å²	56.4	57%	0.566	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-28.2	-176.4	43	0	0	0	0	115	E227 L242	E227-S240 WeakPolarHBondContact OE2-CA 3.41Å; E227-S240 WeakPolarHBondContact OE2-CB 3.38Å; E227-S240 PolarHBondContact OE2-N 3.27Å; E227-S240 PolarHBondContact OE2-OG 3.02Å; S240-L242 VanDerWaalsContact C-N 3.31Å
241	R	76.3	Confident	71.4	Confident	138 Å²	138	53.2 Å²	53.2	52%	0.521	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	11.8	177.5	-62.9	-176.1	172	-156.7	-12.4	113.3	P239 G363 G366	P239-R241 VanDerWaalsContact C-N 3.28Å; P239-R241 PolarHBondContact O-N 3.11Å; R241-G363 VanDerWaalsContact CD-O 3.28Å; R241-G363 WeakPolarHBondContact CD-O 3.32Å; R241-G363 PolarHBondContact NH1-O 3.38Å; R241-G366 PolarHBondContact O-N 2.91Å
242	L	81.9	Confident	74	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.079	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.2	177	-178.3	66.7	0	0	0	110.5	T238 P239 S240 N244 C356 T359 A360 G366 A368	T238-L242 HydrophobicContact CG2-CD2 4.09Å; P239-L242 HydrophobicContact CB-CB 4.26Å; P239-L242 WeakPolarHBondContact O-CB 3.44Å; P239-L242 PolarHBondContact O-N 3.23Å; S240-L242 VanDerWaalsContact C-N 3.31Å; L242-N244 VanDerWaalsContact CD2-OD1 3.28Å; L242-N244 WeakPolarHBondContact CD2-OD1 3.4Å; L242-C356 HydrophobicContact CD2-CB 3.74Å; L242-C356 VanDerWaalsContact CD2-SG 3.53Å; L242-T359 HydrophobicContact CD1-CG2 3.31Å; L242-A360 HydrophobicContact CB-CB 3.81Å; L242-A360 HydrophobicContact CD1-CB 4.05Å; L242-G366 WeakPolarHBondContact CA-O 3.45Å; L242-A368 HydrophobicContact CD1-CB 4.3Å
243	E	88.3	Confident	76.7	Confident	101 Å²	101	50.2 Å²	50.2	47%	0.472	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.7	170.5	-64.5	178.5	153.2	0	0	109.5	Y245 G366 S367 A368	E243-Y245 HydrophobicContact CB-CD2 4.45Å; E243-Y245 HydrophobicContact CB-CE2 3.62Å; E243-Y245 PolarHBondContact OE2-OH 3.29Å; E243-G366 PolarHBondContact N-O 2.93Å; E243-S367 CarbonylContact O-C 3.45Å; E243-S367 VanDerWaalsContact O-CA 3.3Å; E243-S367 WeakPolarHBondContact O-CA 3.33Å; E243-A368 PolarHBondContact O-N 3.42Å
244	N	91	Very high	79.3	Confident	11 Å²	11	45.2 Å²	45.2	6%	0.059	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.1	179.5	-63.2	-65.4	0	0	0	109.9	L242 L391 Q392	L242-N244 VanDerWaalsContact CD2-OD1 3.28Å; L242-N244 WeakPolarHBondContact CD2-OD1 3.4Å; N244-L391 HydrophobicContact CB-CD2 3.57Å; N244-L391 HydrophobicContact CB-CG 4.43Å; N244-L391 CarbonylContact O-C 3.46Å; N244-L391 WeakPolarHBondContact O-CA 3.22Å; N244-Q392 PolarHBondContact O-N 3.35Å
245	Y	95.1	Very high	81.8	Confident	41 Å²	41	42.9 Å²	42.9	16%	0.161	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	153.9	180	-61.1	-76.2	0	0	0	111.7	E243 W339 A368 L369 V370 Q392 M394	E243-Y245 HydrophobicContact CB-CD2 4.45Å; E243-Y245 HydrophobicContact CB-CE2 3.62Å; E243-Y245 PolarHBondContact OE2-OH 3.29Å; Y245-W339 AromaticContact CD2-CH2 3.95Å; Y245-W339 HydrophobicContact CD2-CH2 3.95Å; Y245-W339 AromaticContact CD2-CZ3 3.88Å; Y245-W339 HydrophobicContact CD2-CZ3 3.88Å; Y245-W339 AromaticContact CE2-CH2 3.95Å; Y245-W339 HydrophobicContact CE2-CH2 3.95Å; Y245-W339 HydrophobicContact CE2-CZ3 4.29Å; Y245-A368 PolarHBondContact N-O 2.99Å; Y245-L369 WeakPolarHBondContact O-CA 3.25Å; Y245-V370 PolarHBondContact O-N 3.29Å; Y245-Q392 CarbonylContact C-O 3.53Å; Y245-Q392 WeakPolarHBondContact CA-O 3.28Å; Y245-Q392 HydrophobicContact CD1-CB 3.86Å; Y245-Q392 HydrophobicContact CE1-CB 4.07Å; Y245-M394 HydrophobicContact CD1-CB 4.49Å
246	Y	95.9	Very high	83.8	Confident	28 Å²	28	41.8 Å²	41.8	11%	0.11	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.1	166.3	73.9	-86.4	0	0	0	110.9	V248 V370 I380 L391 Q392 E393 M394	Y246-V248 HydrophobicContact CD2-CG2 3.92Å; Y246-V248 HydrophobicContact CE2-CG2 3.87Å; Y246-V370 CarbonylContact C-O 3.15Å; Y246-V370 WeakPolarHBondContact CA-O 3.4Å; Y246-I380 HydrophobicContact CD1-CD1 4.02Å; Y246-I380 HydrophobicContact CD1-CG1 4.36Å; Y246-I380 HydrophobicContact CD2-CD1 3.39Å; Y246-I380 HydrophobicContact CD2-CG1 4.23Å; Y246-I380 HydrophobicContact CE1-CD1 3.91Å; Y246-I380 HydrophobicContact CE1-CG2 4.43Å; Y246-I380 HydrophobicContact CE2-CD1 3.3Å; Y246-I380 HydrophobicContact CE2-CG1 4.5Å; Y246-I380 HydrophobicContact CG-CD1 3.74Å; Y246-I380 HydrophobicContact CG-CG1 4.14Å; Y246-L391 HydrophobicContact CD1-CB 3.75Å; Y246-Q392 VanDerWaalsContact CD1-C 3.45Å; Y246-Q392 VanDerWaalsContact CD1-O 3.26Å; Y246-Q392 WeakPolarHBondContact CD1-O 3.11Å; Y246-Q392 PolarHBondContact N-O 2.97Å; Y246-E393 HydrophobicContact CD1-CB 4.47Å; Y246-E393 HydrophobicContact CD2-CG 4.47Å; Y246-E393 VanDerWaalsContact CE1-CA 3.41Å; Y246-E393 HydrophobicContact CE1-CB 3.7Å; Y246-E393 HydrophobicContact CE1-CG 4.29Å; Y246-E393 VanDerWaalsContact CE1-N 3.29Å; Y246-E393 HydrophobicContact CE2-CB 4.07Å; Y246-E393 HydrophobicContact CE2-CG 3.72Å; Y246-E393 VanDerWaalsContact CZ-CB 3.47Å; Y246-E393 WeakPolarHBondContact OH-CB 3.44Å; Y246-M394 PolarHBondContact O-N 3.12Å
247	M	95.6	Very high	85.6	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.02	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	123.3	172.1	176.9	179.3	-76.3	0	0	109.3	Q257 L369 V370 F371 L372 M394 L396	M247-Q257 HydrophobicContact SD-CB 3.82Å; M247-Q257 HydrophobicContact SD-CG 3.96Å; M247-L369 HydrophobicContact CB-CD1 4.05Å; M247-V370 PolarHBondContact N-O 3.12Å; M247-F371 HydrophobicContact CB-CD1 4.43Å; M247-F371 HydrophobicContact SD-CD1 4.1Å; M247-F371 HydrophobicContact SD-CE1 3.83Å; M247-L372 PolarHBondContact O-N 2.93Å; M247-M394 HydrophobicContact CE-CE 3.39Å; M247-M394 HydrophobicContact CE-CG 4.36Å; M247-L396 HydrophobicContact CG-CD2 4.08Å; M247-L396 HydrophobicContact SD-CD2 4.05Å
248	V	95.1	Very high	87.3	Confident	30 Å²	30	35.8 Å²	35.8	18%	0.182	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.9	173.5	-176.3	0	0	0	0	108.8	Y246 L372 P374 L396	Y246-V248 HydrophobicContact CD2-CG2 3.92Å; Y246-V248 HydrophobicContact CE2-CG2 3.87Å; V248-L372 CarbonylContact C-O 3.55Å; V248-L372 WeakPolarHBondContact CA-O 3.49Å; V248-P374 HydrophobicContact CG1-CB 4.26Å; V248-P374 HydrophobicContact CG1-CG 4.18Å; V248-L396 WeakPolarHBondContact O-CD1 3.35Å; V248-L396 WeakPolarHBondContact O-CD2 3.19Å; V248-L396 WeakPolarHBondContact O-CG 3.07Å
249	C	92.8	Very high	88.9	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.014	17%	0.173	C	C	.	.			trans	-146.6	148	-176.1	56.9	0	0	0	0	111.3	K254 L372 L373 P374 L396	C249-K254 VanDerWaalsContact SG-CG 3.52Å; C249-L372 PolarHBondContact N-O 3.36Å; C249-L373 WeakPolarHBondContact O-CD2 3.5Å; C249-P374 WeakPolarHBondContact O-CD 3.29Å; C249-L396 HydrophobicContact CB-CD2 3.64Å
250	K	92.1	Very high	90.6	Very high	123 Å²	123	37.2 Å²	37.2	54%	0.535	18%	0.179	S	C	.	.			trans	-68.9	155.9	173.3	-64.3	-179.2	-179.7	176.2	0	110.7	D252 E253 K254	K250-D252 VanDerWaalsContact C-N 3.28Å; K250-D252 WeakPolarHBondContact CB-OD1 3.34Å; K250-D252 PolarHBondContact O-N 3.49Å; K250-E253 PolarHBondContact O-N 3.4Å; K250-E253 VanDerWaalsContact O-N 3.17Å; K250-K254 WeakPolarHBondContact O-CB 3.49Å; K250-K254 PolarHBondContact O-N 3.33Å
251	A	89.8	Confident	91.9	Very high	10 Å²	10	34 Å²	34	8%	0.083	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.1	-171	0	0	0	0	0	113.5	L373 L451	A251-L373 HydrophobicContact CB-CD2 3.81Å; A251-L451 HydrophobicContact CB-CB 4.32Å; A251-L451 HydrophobicContact CB-CD1 4.15Å
252	D	87.5	Confident	92.8	Very high	54 Å²	54	27.4 Å²	27.4	29%	0.289	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-34	175.8	56.9	-39.6	0	0	0	113.3	K250 S450 Q453	K250-D252 VanDerWaalsContact C-N 3.28Å; K250-D252 WeakPolarHBondContact CB-OD1 3.34Å; K250-D252 PolarHBondContact O-N 3.49Å; D252-S450 PolarHBondContact N-OG 2.74Å; D252-S450 PolarHBondContact OD1-OG 3.4Å; D252-Q453 HydrophobicContact CB-CB 4.35Å
253	E	90.4	Very high	93.4	Very high	71 Å²	71	30.7 Å²	30.7	33%	0.332	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-22.6	178.5	-65	178.8	165.5	0	0	113.4	K250 F255 N256 Q257	K250-E253 PolarHBondContact O-N 3.4Å; K250-E253 VanDerWaalsContact O-N 3.17Å; E253-F255 VanDerWaalsContact C-N 3.31Å; E253-F255 PolarHBondContact O-N 2.94Å; E253-N256 WeakPolarHBondContact O-CA 3.25Å; E253-N256 WeakPolarHBondContact O-CB 3.36Å; E253-N256 PolarHBondContact O-N 3.44Å; E253-Q257 PolarHBondContact O-N 3.05Å
254	K	93.3	Very high	93.6	Very high	5 Å²	5	31 Å²	31	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-52.1	-44	-174.1	-175.6	171.1	177.7	174.1	0	113.4	C249 K250 Q257 L258 Y343 D344 F371 L373	C249-K254 VanDerWaalsContact SG-CG 3.52Å; K250-K254 WeakPolarHBondContact O-CB 3.49Å; K250-K254 PolarHBondContact O-N 3.33Å; K254-Q257 PolarHBondContact O-N 2.96Å; K254-L258 PolarHBondContact O-N 3.35Å; K254-L258 VanDerWaalsContact O-N 3.17Å; K254-Y343 HydrophobicContact CB-CE2 4.49Å; K254-Y343 HydrophobicContact CD-CE1 4.43Å; K254-Y343 HydrophobicContact CD-CE2 4.29Å; K254-Y343 WeakPolarHBondContact CE-O 3.49Å; K254-Y343 HydrophobicContact CG-CD2 4.33Å; K254-Y343 HydrophobicContact CG-CE2 3.63Å; K254-Y343 PolarHBondContact NZ-O 3.06Å; K254-D344 IonicContact NZ-OD1 3.83Å; K254-F371 HydrophobicContact CD-CB 4.33Å; K254-F371 VanDerWaalsContact CE-CB 3.45Å; K254-F371 HydrophobicContact CG-CB 4.23Å; K254-F371 HydrophobicContact CG-CD1 4.43Å; K254-F371 PolarHBondContact NZ-O 3.46Å; K254-L373 HydrophobicContact CD-CD2 4.23Å
255	F	94.9	Very high	93.7	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-71.8	-32.8	178.1	-170.4	-115	0	0	0	113	E253 Q257 L258 V259 Y283 A286 L287 L290 Y343 L403 L407	E253-F255 VanDerWaalsContact C-N 3.31Å; E253-F255 PolarHBondContact O-N 2.94Å; F255-Q257 VanDerWaalsContact C-N 3.33Å; F255-L258 HydrophobicContact CD2-CD2 4.16Å; F255-L258 HydrophobicContact CE2-CD2 4.15Å; F255-L258 PolarHBondContact O-N 3.17Å; F255-V259 HydrophobicContact CD1-CG2 4.3Å; F255-V259 HydrophobicContact CE1-CG2 3.83Å; F255-V259 HydrophobicContact CE2-CG2 4.05Å; F255-V259 HydrophobicContact CZ-CG2 3.7Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 3.43Å; F255-Y283 AromaticContact CD2-CD1 3.53Å; F255-Y283 HydrophobicContact CD2-CD1 3.53Å; F255-Y283 AromaticContact CD2-CE1 3.46Å; F255-Y283 HydrophobicContact CD2-CE1 3.46Å; F255-Y283 VanDerWaalsContact CD2-CE1 3.46Å; F255-Y283 AromaticContact CE2-CD1 3.29Å; F255-Y283 HydrophobicContact CE2-CD1 3.29Å; F255-Y283 AromaticContact CE2-CE1 3.74Å; F255-Y283 HydrophobicContact CE2-CE1 3.74Å; F255-Y283 HydrophobicContact CE2-CG 4.3Å; F255-Y283 HydrophobicContact CG-CD1 4.33Å; F255-Y283 AromaticContact CG-CE1 3.92Å; F255-Y283 HydrophobicContact CG-CE1 3.92Å; F255-Y283 AromaticContact CZ-CD1 3.89Å; F255-Y283 HydrophobicContact CZ-CD1 3.89Å; F255-Y283 HydrophobicContact CZ-CE1 4.37Å; F255-A286 HydrophobicContact CE1-CB 4.33Å; F255-A286 HydrophobicContact CZ-CB 3.89Å; F255-L287 HydrophobicContact CE2-CD2 4Å; F255-L287 HydrophobicContact CE2-CG 4.28Å; F255-L287 HydrophobicContact CZ-CD2 4.03Å; F255-L287 HydrophobicContact CZ-CG 4.31Å; F255-L290 HydrophobicContact CE1-CD1 3.58Å; F255-L290 HydrophobicContact CZ-CD1 4.04Å; F255-Y343 HydrophobicContact CB-CE2 4.44Å; F255-Y343 HydrophobicContact CD2-CE2 4.23Å; F255-L403 HydrophobicContact CD1-CD1 3.96Å; F255-L403 HydrophobicContact CE1-CD1 4.09Å; F255-L407 HydrophobicContact CD1-CD1 3.78Å; F255-L407 HydrophobicContact CE1-CD1 3.86Å; F255-L407 HydrophobicContact CE1-CD2 4.19Å
256	N	94.4	Very high	93.5	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-41.2	175.7	-61.6	-17.5	0	0	0	110.6	E253 V259 H260 L403	E253-N256 WeakPolarHBondContact O-CA 3.25Å; E253-N256 WeakPolarHBondContact O-CB 3.36Å; E253-N256 PolarHBondContact O-N 3.44Å; N256-V259 PolarHBondContact O-N 3.23Å; N256-H260 WeakPolarHBondContact O-CB 3.3Å; N256-H260 PolarHBondContact O-N 2.82Å; N256-L403 HydrophobicContact CB-CD1 4.49Å; N256-L403 VanDerWaalsContact OD1-CB 3.29Å; N256-L403 WeakPolarHBondContact OD1-CB 3.39Å; N256-L403 WeakPolarHBondContact OD1-CD1 3.39Å; N256-L403 WeakPolarHBondContact OD1-CG 3.45Å; N256-L403 PolarHBondContact OD1-N 3.47Å
257	Q	95.2	Very high	93.2	Very high	7 Å²	7	40.7 Å²	40.7	3%	0.033	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-45.1	174.9	-63.3	-63.7	-24.6	0	0	111.9	M247 E253 K254 F255 V259 H260 F261 F371 L396 Q397	M247-Q257 HydrophobicContact SD-CB 3.82Å; M247-Q257 HydrophobicContact SD-CG 3.96Å; E253-Q257 PolarHBondContact O-N 3.05Å; K254-Q257 PolarHBondContact O-N 2.96Å; F255-Q257 VanDerWaalsContact C-N 3.33Å; Q257-V259 PolarHBondContact O-N 3.05Å; Q257-H260 PolarHBondContact O-N 2.84Å; Q257-F261 WeakPolarHBondContact O-CB 3.29Å; Q257-F261 PolarHBondContact O-N 3.4Å; Q257-F371 HydrophobicContact CB-CE1 4.01Å; Q257-L396 HydrophobicContact CG-CD2 3.85Å; Q257-Q397 PolarHBondContact NE2-O 3.16Å
258	L	95.6	Very high	93	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-47.9	176.6	175.9	66.1	0	0	0	111.8	K254 F255 F261 L262 V272 F274 L341 Y343 F371	K254-L258 PolarHBondContact O-N 3.35Å; K254-L258 VanDerWaalsContact O-N 3.17Å; F255-L258 HydrophobicContact CD2-CD2 4.16Å; F255-L258 HydrophobicContact CE2-CD2 4.15Å; F255-L258 PolarHBondContact O-N 3.17Å; L258-F261 WeakPolarHBondContact O-CB 3.5Å; L258-F261 PolarHBondContact O-N 3.01Å; L258-L262 HydrophobicContact CD1-CD1 3.91Å; L258-L262 HydrophobicContact CD1-CG 4.19Å; L258-L262 HydrophobicContact CD2-CD1 4.49Å; L258-L262 HydrophobicContact CG-CD1 3.9Å; L258-L262 VanDerWaalsContact O-CG 3.3Å; L258-L262 WeakPolarHBondContact O-CG 3.32Å; L258-L262 PolarHBondContact O-N 2.78Å; L258-V272 HydrophobicContact CD1-CG1 4.16Å; L258-V272 HydrophobicContact CD2-CG1 4.21Å; L258-F274 HydrophobicContact CD2-CZ 4.1Å; L258-L341 HydrophobicContact CD1-CB 4.42Å; L258-L341 HydrophobicContact CD1-CD1 3.72Å; L258-Y343 HydrophobicContact CB-CD2 4.09Å; L258-Y343 HydrophobicContact CB-CE2 4.16Å; L258-Y343 HydrophobicContact CD2-CD2 3.58Å; L258-Y343 HydrophobicContact CD2-CE2 4Å; L258-Y343 HydrophobicContact CD2-CG 4.32Å; L258-Y343 HydrophobicContact CG-CD2 4.29Å; L258-F371 HydrophobicContact CB-CZ 4.21Å; L258-F371 HydrophobicContact CD1-CE2 4.1Å; L258-F371 HydrophobicContact CD1-CZ 4.14Å
259	V	95.4	Very high	93	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-37.2	-178.8	170.5	0	0	0	0	111.6	F255 N256 Q257 L262 R263 L287 L290 V291 L403	F255-V259 HydrophobicContact CD1-CG2 4.3Å; F255-V259 HydrophobicContact CE1-CG2 3.83Å; F255-V259 HydrophobicContact CE2-CG2 4.05Å; F255-V259 HydrophobicContact CZ-CG2 3.7Å; F255-V259 WeakPolarHBondContact O-CG2 3.38Å; F255-V259 PolarHBondContact O-N 3.43Å; N256-V259 PolarHBondContact O-N 3.23Å; Q257-V259 PolarHBondContact O-N 3.05Å; V259-L262 PolarHBondContact O-N 2.84Å; V259-R263 HydrophobicContact CG1-CG 4.36Å; V259-R263 WeakPolarHBondContact O-CB 3.37Å; V259-R263 VanDerWaalsContact O-CG 3.22Å; V259-R263 WeakPolarHBondContact O-CG 3.43Å; V259-R263 PolarHBondContact O-N 3.13Å; V259-L287 HydrophobicContact CG2-CD2 3.78Å; V259-L290 HydrophobicContact CG1-CB 4.32Å; V259-L290 HydrophobicContact CG2-CD1 4.41Å; V259-V291 HydrophobicContact CG1-CG2 4.29Å; V259-L403 HydrophobicContact CB-CD1 3.56Å; V259-L403 HydrophobicContact CG1-CD1 3.79Å; V259-L403 HydrophobicContact CG1-CD2 4.48Å; V259-L403 HydrophobicContact CG2-CD1 3.59Å
260	H	94.9	Very high	93.1	Very high	40 Å²	40	41.6 Å²	41.6	19%	0.185	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-48.2	173.6	179.7	86	0	0	0	110.9	N256 Q257 L262 R263 N264 T400	N256-H260 WeakPolarHBondContact O-CB 3.3Å; N256-H260 PolarHBondContact O-N 2.82Å; Q257-H260 PolarHBondContact O-N 2.84Å; H260-L262 PolarHBondContact O-N 2.86Å; H260-R263 PolarHBondContact O-N 2.98Å; H260-N264 PolarHBondContact NE2-ND2 3.26Å; H260-N264 PolarHBondContact O-N 3.49Å; H260-T400 HydrophobicContact CB-CG2 3.84Å
261	F	95.1	Very high	93.2	Very high	14 Å²	14	35.7 Å²	35.7	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-55.1	-55	175.1	-174.5	-83.3	0	0	0	111.4	Q257 L258 R263 N264 H265 H270 W339 L341 L369 M394	Q257-F261 WeakPolarHBondContact O-CB 3.29Å; Q257-F261 PolarHBondContact O-N 3.4Å; L258-F261 WeakPolarHBondContact O-CB 3.5Å; L258-F261 PolarHBondContact O-N 3.01Å; F261-R263 PolarHBondContact O-N 3Å; F261-R263 VanDerWaalsContact O-N 3.17Å; F261-N264 PolarHBondContact O-N 3.43Å; F261-H265 HydrophobicContact CE1-CB 4.33Å; F261-H265 AromaticContact CE1-CD2 3.83Å; F261-H265 AromaticContact CE2-CD2 3.84Å; F261-H265 AromaticContact CE2-NE2 3.81Å; F261-H265 AromaticContact CZ-CD2 3.69Å; F261-H265 AromaticContact CZ-NE2 3.91Å; F261-H265 PolarHBondContact O-CD2 3.06Å; F261-H265 VanDerWaalsContact O-CD2 3.27Å; F261-H265 PolarHBondContact O-N 3.38Å; F261-H265 VanDerWaalsContact O-N 3.12Å; F261-H270 AromaticContact CE1-CE1 3.99Å; F261-W339 HydrophobicContact CE1-CD2 4.14Å; F261-W339 HydrophobicContact CE1-CE3 4.42Å; F261-W339 HydrophobicContact CE1-CG 4.16Å; F261-W339 HydrophobicContact CE2-CD2 4.5Å; F261-W339 HydrophobicContact CE2-CE3 4.38Å; F261-W339 HydrophobicContact CE2-CH2 4.23Å; F261-W339 HydrophobicContact CE2-CZ2 4.33Å; F261-W339 HydrophobicContact CE2-CZ3 4.24Å; F261-W339 AromaticContact CZ-CD2 3.48Å; F261-W339 HydrophobicContact CZ-CD2 3.48Å; F261-W339 VanDerWaalsContact CZ-CD2 3.48Å; F261-W339 AromaticContact CZ-CE2 3.63Å; F261-W339 AromaticContact CZ-CE3 3.64Å; F261-W339 HydrophobicContact CZ-CE3 3.64Å; F261-W339 AromaticContact CZ-CG 3.96Å; F261-W339 HydrophobicContact CZ-CG 3.96Å; F261-W339 HydrophobicContact CZ-CH2 4.09Å; F261-W339 AromaticContact CZ-CZ2 3.94Å; F261-W339 HydrophobicContact CZ-CZ2 3.94Å; F261-W339 AromaticContact CZ-CZ3 3.94Å; F261-W339 HydrophobicContact CZ-CZ3 3.94Å; F261-L341 HydrophobicContact CD1-CD1 3.55Å; F261-L341 HydrophobicContact CD1-CD2 4Å; F261-L341 HydrophobicContact CD1-CG 4.43Å; F261-L341 HydrophobicContact CE1-CD1 3.75Å; F261-L341 HydrophobicContact CE1-CD2 3.57Å; F261-L341 HydrophobicContact CE1-CG 4.22Å; F261-L341 HydrophobicContact CZ-CD2 3.96Å; F261-L369 HydrophobicContact CD2-CD2 4.3Å; F261-L369 HydrophobicContact CE2-CD2 4.38Å; F261-M394 HydrophobicContact CD2-CE 3.98Å; F261-M394 HydrophobicContact CE2-CE 4.1Å
262	L	95.3	Very high	93.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-27.8	-178.5	-68.9	171.6	0	0	0	113.5	L258 V259 H260 K266 H270 V272 L287 V291 I321 L341	L258-L262 HydrophobicContact CD1-CD1 3.91Å; L258-L262 HydrophobicContact CD1-CG 4.19Å; L258-L262 HydrophobicContact CD2-CD1 4.49Å; L258-L262 HydrophobicContact CG-CD1 3.9Å; L258-L262 VanDerWaalsContact O-CG 3.3Å; L258-L262 WeakPolarHBondContact O-CG 3.32Å; L258-L262 PolarHBondContact O-N 2.78Å; V259-L262 PolarHBondContact O-N 2.84Å; H260-L262 PolarHBondContact O-N 2.86Å; L262-K266 WeakPolarHBondContact O-CG 3.43Å; L262-H270 HydrophobicContact CD2-CB 4.16Å; L262-V272 HydrophobicContact CD2-CG2 4.39Å; L262-L287 HydrophobicContact CD1-CD1 4.34Å; L262-L287 HydrophobicContact CD1-CD2 3.74Å; L262-V291 HydrophobicContact CB-CG2 4.25Å; L262-I321 HydrophobicContact CB-CD1 4.21Å; L262-I321 HydrophobicContact CD1-CD1 4.18Å; L262-I321 HydrophobicContact CD2-CD1 3.86Å; L262-I321 HydrophobicContact CD2-CG1 4.04Å; L262-I321 HydrophobicContact CG-CD1 4.31Å; L262-L341 HydrophobicContact CD2-CD1 3.62Å; L262-L341 HydrophobicContact CG-CD1 4.17Å
263	R	93.8	Very high	94	Very high	84 Å²	84	32.7 Å²	32.7	32%	0.317	15%	0.151	S	C	.	.	H	α-helix	trans	-74.8	-27.6	176.4	-79.1	174	176.2	170.7	1.8	113.4	V259 H260 F261 K266 L290	V259-R263 HydrophobicContact CG1-CG 4.36Å; V259-R263 WeakPolarHBondContact O-CB 3.37Å; V259-R263 VanDerWaalsContact O-CG 3.22Å; V259-R263 WeakPolarHBondContact O-CG 3.43Å; V259-R263 PolarHBondContact O-N 3.13Å; H260-R263 PolarHBondContact O-N 2.98Å; F261-R263 PolarHBondContact O-N 3Å; F261-R263 VanDerWaalsContact O-N 3.17Å; R263-K266 VanDerWaalsContact O-CE 3.32Å; R263-K266 WeakPolarHBondContact O-CE 3.08Å; R263-K266 WeakPolarHBondContact O-CG 3.29Å; R263-L290 PolarHBondContact NE-O 2.82Å; R263-L290 VanDerWaalsContact NE-O 3.13Å; R263-L290 PolarHBondContact NH2-O 3.09Å
264	N	92.8	Very high	94.2	Very high	106 Å²	106	29.3 Å²	29.3	57%	0.567	14%	0.136	S	C	*	.	H	α-helix	trans	-84.8	-26.2	177	-63.6	-15.5	0	0	0	111.5	H260 F261	H260-N264 PolarHBondContact NE2-ND2 3.26Å; H260-N264 PolarHBondContact O-N 3.49Å; F261-N264 PolarHBondContact O-N 3.43Å
265	H	92.3	Very high	94.2	Very high	49 Å²	49	30.3 Å²	30.3	23%	0.227	14%	0.143	C	C	.	.			trans	-106.2	33.6	-176.3	-68.5	-86.1	0	0	0	113.7	F261 Q267 E268 H270 W339	F261-H265 HydrophobicContact CE1-CB 4.33Å; F261-H265 AromaticContact CE1-CD2 3.83Å; F261-H265 AromaticContact CE2-CD2 3.84Å; F261-H265 AromaticContact CE2-NE2 3.81Å; F261-H265 AromaticContact CZ-CD2 3.69Å; F261-H265 AromaticContact CZ-NE2 3.91Å; F261-H265 PolarHBondContact O-CD2 3.06Å; F261-H265 VanDerWaalsContact O-CD2 3.27Å; F261-H265 PolarHBondContact O-N 3.38Å; F261-H265 VanDerWaalsContact O-N 3.12Å; H265-Q267 VanDerWaalsContact C-N 3.27Å; H265-Q267 PolarHBondContact O-N 2.61Å; H265-E268 WeakPolarHBondContact CB-OE2 3.46Å; H265-E268 IonicContact CE1-OE2 3.67Å; H265-E268 IonicContact CG-OE2 2.87Å; H265-E268 VanDerWaalsContact ND1-CD 3.32Å; H265-E268 IonicContact ND1-OE1 3.72Å; H265-E268 PolarHBondContact ND1-OE1 3.44Å; H265-E268 IonicContact ND1-OE2 2.67Å; H265-E268 PolarHBondContact ND1-OE2 3.28Å; H265-E268 PolarHBondContact O-N 2.86Å; H265-E268 VanDerWaalsContact O-N 3.16Å; H265-H270 VanDerWaalsContact CB-CE1 3.45Å; H265-H270 WeakPolarHBondContact CB-CE1 3.27Å; H265-H270 PolarHBondContact O-NE2 2.91Å; H265-W339 AromaticContact ND1-NE1 3.84Å
266	K	90.8	Very high	94.2	Very high	74 Å²	74	31 Å²	31	32%	0.322	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.2	-171.4	-68.7	-177	-175.5	-171	0	115.7	L262 R263 E268 K292 V294	L262-K266 WeakPolarHBondContact O-CG 3.43Å; R263-K266 VanDerWaalsContact O-CE 3.32Å; R263-K266 WeakPolarHBondContact O-CE 3.08Å; R263-K266 WeakPolarHBondContact O-CG 3.29Å; K266-E268 VanDerWaalsContact C-N 3.26Å; K266-K292 PolarHBondContact NZ-O 2.69Å; K266-V294 HydrophobicContact CB-CG2 3.59Å; K266-V294 HydrophobicContact CD-CG2 4Å; K266-V294 HydrophobicContact CG-CG2 3.6Å
267	Q	89.5	Confident	94.2	Very high	162 Å²	162	31.6 Å²	31.6	76%	0.757	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-2.7	-177.5	-58.2	-57.2	-20.7	0	0	113	H265 S319	H265-Q267 VanDerWaalsContact C-N 3.27Å; H265-Q267 PolarHBondContact O-N 2.61Å; Q267-S319 WeakPolarHBondContact O-CB 3.4Å
268	E	92.6	Very high	94.2	Very high	53 Å²	53	31.9 Å²	31.9	25%	0.248	16%	0.156	C	C	.	.	S	Bend	trans	-100.8	163.8	-177.7	-68	169.6	-174.3	0	0	111.2	H265 K266 H270 G320 N338 W339	H265-E268 WeakPolarHBondContact CB-OE2 3.46Å; H265-E268 IonicContact CE1-OE2 3.67Å; H265-E268 IonicContact CG-OE2 2.87Å; H265-E268 VanDerWaalsContact ND1-CD 3.32Å; H265-E268 IonicContact ND1-OE1 3.72Å; H265-E268 PolarHBondContact ND1-OE1 3.44Å; H265-E268 IonicContact ND1-OE2 2.67Å; H265-E268 PolarHBondContact ND1-OE2 3.28Å; H265-E268 PolarHBondContact O-N 2.86Å; H265-E268 VanDerWaalsContact O-N 3.16Å; K266-E268 VanDerWaalsContact C-N 3.26Å; E268-H270 WeakPolarHBondContact CB-NE2 3.41Å; E268-H270 PolarHBondContact O-CD2 3.28Å; E268-H270 VanDerWaalsContact O-CD2 3.25Å; E268-H270 IonicContact OE2-CE1 3.32Å; E268-G320 PolarHBondContact O-N 3.04Å; E268-N338 HydrophobicContact CB-CB 3.9Å; E268-N338 HydrophobicContact CG-CB 4.16Å; E268-W339 PolarHBondContact OE2-NE1 2.96Å
269	K	94.1	Very high	94.2	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.3	177	-164.1	173.7	-174	173.3	0	110.3	F314 R315 L317 G320 I334 P335 E336 N338 W339	K269-F314 HydrophobicContact CD-CZ 4.44Å; K269-F314 WeakPolarHBondContact CE-O 3.45Å; K269-F314 HydrophobicContact CG-CE1 4.29Å; K269-F314 HydrophobicContact CG-CE2 4.27Å; K269-F314 HydrophobicContact CG-CZ 3.71Å; K269-F314 PolarHBondContact NZ-O 3.33Å; K269-R315 PolarHBondContact NZ-O 3.34Å; K269-L317 VanDerWaalsContact CE-O 3.26Å; K269-L317 WeakPolarHBondContact CE-O 3.48Å; K269-L317 PolarHBondContact NZ-O 2.91Å; K269-G320 WeakPolarHBondContact CA-O 3.45Å; K269-I334 HydrophobicContact CD-CG2 4.44Å; K269-P335 PolarHBondContact NZ-O 2.89Å; K269-E336 WeakPolarHBondContact CB-O 3.41Å; K269-N338 PolarHBondContact N-OD1 3.07Å; K269-N338 PolarHBondContact O-N 3.23Å; K269-W339 PolarHBondContact O-N 3.18Å
270	H	94.8	Very high	94.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.3	-171.8	-61.1	-80.5	0	0	0	112.4	F261 L262 H265 E268 G320 I321 L322 W339	F261-H270 AromaticContact CE1-CE1 3.99Å; L262-H270 HydrophobicContact CD2-CB 4.16Å; H265-H270 VanDerWaalsContact CB-CE1 3.45Å; H265-H270 WeakPolarHBondContact CB-CE1 3.27Å; H265-H270 PolarHBondContact O-NE2 2.91Å; E268-H270 WeakPolarHBondContact CB-NE2 3.41Å; E268-H270 PolarHBondContact O-CD2 3.28Å; E268-H270 VanDerWaalsContact O-CD2 3.25Å; E268-H270 IonicContact OE2-CE1 3.32Å; H270-G320 PolarHBondContact N-O 3.06Å; H270-I321 HydrophobicContact CB-CG1 4.12Å; H270-I321 HydrophobicContact CB-CG2 4.46Å; H270-L322 PolarHBondContact O-N 3.4Å; H270-W339 WeakPolarHBondContact CA-O 3.21Å; H270-W339 AromaticContact CE1-CD1 3.77Å; H270-W339 WeakPolarHBondContact ND1-CB 3.4Å
271	L	95.1	Very high	94.3	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.2	163.8	-75.7	171.7	0	0	0	109.6	F273 F314 L322 I334 V337 W339 V340 L341 R358	L271-F273 HydrophobicContact CB-CE2 4.1Å; L271-F314 HydrophobicContact CD2-CE1 4.01Å; L271-L322 HydrophobicContact CD2-CB 3.94Å; L271-L322 HydrophobicContact CD2-CD2 3.65Å; L271-L322 HydrophobicContact CD2-CG 3.99Å; L271-I334 HydrophobicContact CD1-CD1 4.14Å; L271-I334 HydrophobicContact CD2-CD1 3.85Å; L271-V337 HydrophobicContact CB-CG1 4.46Å; L271-V337 HydrophobicContact CD1-CG1 3.95Å; L271-V337 HydrophobicContact CD1-CG2 3.88Å; L271-V337 HydrophobicContact CG-CG1 4.08Å; L271-V337 HydrophobicContact CG-CG2 4.29Å; L271-W339 PolarHBondContact N-O 3.46Å; L271-V340 HydrophobicContact CB-CG2 4.47Å; L271-V340 HydrophobicContact CD1-CG2 4.48Å; L271-V340 CarbonylContact O-C 3.59Å; L271-L341 PolarHBondContact O-N 3.4Å; L271-R358 HydrophobicContact CD1-CB 3.46Å; L271-R358 VanDerWaalsContact CD1-CB 3.46Å; L271-R358 HydrophobicContact CD1-CG 3.9Å
272	V	96.7	Very high	94.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112	-179.5	-167	0	0	0	0	110	L258 L262 F274 I321 L322 V323 C324 L341	L258-V272 HydrophobicContact CD1-CG1 4.16Å; L258-V272 HydrophobicContact CD2-CG1 4.21Å; L262-V272 HydrophobicContact CD2-CG2 4.39Å; V272-F274 HydrophobicContact CB-CE2 4.26Å; V272-F274 HydrophobicContact CG1-CD2 4.24Å; V272-F274 HydrophobicContact CG1-CE2 3.49Å; V272-F274 VanDerWaalsContact CG1-CE2 3.49Å; V272-F274 HydrophobicContact CG1-CZ 4.08Å; V272-I321 HydrophobicContact CG2-CG2 3.73Å; V272-L322 PolarHBondContact N-O 3.33Å; V272-V323 WeakPolarHBondContact O-CA 3.43Å; V272-C324 PolarHBondContact O-N 3.02Å; V272-L341 CarbonylContact C-O 3.56Å; V272-L341 VanDerWaalsContact CA-O 3.29Å; V272-L341 WeakPolarHBondContact CA-O 3.29Å; V272-L341 HydrophobicContact CG1-CB 4.25Å; V272-L341 HydrophobicContact CG2-CB 4.24Å; V272-L341 HydrophobicContact CG2-CD1 4.15Å
273	F	96.5	Very high	94.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.4	-177.6	-74.1	-80.8	0	0	0	112.4	L271 C324 M328 A329 V340 L341 Y343 D344 R355 R358	L271-F273 HydrophobicContact CB-CE2 4.1Å; F273-C324 WeakPolarHBondContact CA-O 3.47Å; F273-M328 HydrophobicContact CE1-CB 4.16Å; F273-M328 HydrophobicContact CZ-CB 4.42Å; F273-A329 HydrophobicContact CE1-CB 3.8Å; F273-A329 HydrophobicContact CZ-CB 4.15Å; F273-V340 HydrophobicContact CD2-CG1 3.76Å; F273-V340 HydrophobicContact CE2-CG1 3.68Å; F273-L341 PolarHBondContact N-O 2.78Å; F273-Y343 WeakPolarHBondContact O-CB 3.34Å; F273-Y343 PolarHBondContact O-N 3.22Å; F273-D344 PolarHBondContact O-N 3.27Å; F273-R355 HydrophobicContact CD1-CG 4.07Å; F273-R355 HydrophobicContact CD2-CB 4.18Å; F273-R355 HydrophobicContact CD2-CG 3.96Å; F273-R355 HydrophobicContact CE1-CG 4.08Å; F273-R355 HydrophobicContact CE2-CB 4.04Å; F273-R355 HydrophobicContact CE2-CG 3.96Å; F273-R355 HydrophobicContact CG-CG 4.02Å; F273-R355 HydrophobicContact CZ-CB 4.45Å; F273-R355 HydrophobicContact CZ-CG 4.03Å; F273-R358 HydrophobicContact CE2-CG 4.48Å; F273-R358 HydrophobicContact CZ-CG 4.25Å
274	F	96.1	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.			trans	-123.3	150.1	171.7	-69.6	-92	0	0	0	110.5	L258 V272 T276 C279 V280 Y283 V323 C324 Y343	L258-F274 HydrophobicContact CD2-CZ 4.1Å; V272-F274 HydrophobicContact CB-CE2 4.26Å; V272-F274 HydrophobicContact CG1-CD2 4.24Å; V272-F274 HydrophobicContact CG1-CE2 3.49Å; V272-F274 VanDerWaalsContact CG1-CE2 3.49Å; V272-F274 HydrophobicContact CG1-CZ 4.08Å; F274-T276 VanDerWaalsContact C-N 3.34Å; F274-T276 PolarHBondContact O-N 2.91Å; F274-C279 HydrophobicContact CB-CB 3.95Å; F274-C279 HydrophobicContact CD1-CB 4.03Å; F274-C279 HydrophobicContact CG-CB 4.28Å; F274-V280 HydrophobicContact CB-CG2 3.95Å; F274-V280 HydrophobicContact CD2-CG2 4.47Å; F274-Y283 AromaticContact CD1-CD2 3.57Å; F274-Y283 HydrophobicContact CD1-CD2 3.57Å; F274-Y283 HydrophobicContact CD1-CE2 4.08Å; F274-Y283 HydrophobicContact CD1-CG 4.29Å; F274-Y283 HydrophobicContact CE1-CD1 4.3Å; F274-Y283 AromaticContact CE1-CD2 3.14Å; F274-Y283 HydrophobicContact CE1-CD2 3.14Å; F274-Y283 AromaticContact CE1-CE2 3.71Å; F274-Y283 HydrophobicContact CE1-CE2 3.71Å; F274-Y283 AromaticContact CE1-CG 3.48Å; F274-Y283 HydrophobicContact CE1-CG 3.48Å; F274-Y283 VanDerWaalsContact CE1-CG 3.48Å; F274-Y283 AromaticContact CZ-CD2 3.89Å; F274-Y283 HydrophobicContact CZ-CD2 3.89Å; F274-Y283 AromaticContact CZ-CG 3.76Å; F274-Y283 HydrophobicContact CZ-CG 3.76Å; F274-V323 HydrophobicContact CD2-CG1 3.53Å; F274-V323 HydrophobicContact CE2-CG1 3.51Å; F274-C324 PolarHBondContact N-O 3.47Å; F274-Y343 AromaticContact CD1-CD1 3.55Å; F274-Y343 HydrophobicContact CD1-CD1 3.55Å; F274-Y343 HydrophobicContact CD1-CE1 4.3Å; F274-Y343 HydrophobicContact CD1-CG 4.08Å; F274-Y343 AromaticContact CE1-CD1 3.18Å; F274-Y343 HydrophobicContact CE1-CD1 3.18Å; F274-Y343 HydrophobicContact CE1-CD2 4.31Å; F274-Y343 AromaticContact CE1-CE1 3.76Å; F274-Y343 HydrophobicContact CE1-CE1 3.76Å; F274-Y343 AromaticContact CE1-CG 3.49Å; F274-Y343 HydrophobicContact CE1-CG 3.49Å; F274-Y343 VanDerWaalsContact CE1-CG 3.49Å; F274-Y343 HydrophobicContact CZ-CD1 4.1Å; F274-Y343 AromaticContact CZ-CG 3.95Å; F274-Y343 HydrophobicContact CZ-CG 3.95Å
275	S	92.4	Very high	94.5	Very high	26 Å²	26	27.2 Å²	27.2	18%	0.182	13%	0.133	C	C	.	.	S	Bend	trans	-70.9	-25.5	-174.3	-74.8	0	0	0	0	114.1	D344 P345	S275-D344 PolarHBondContact N-OD2 2.88Å; S275-D344 WeakPolarHBondContact OG-CB 3.46Å; S275-P345 PolarHBondContact OG-O 3.44Å
276	T	94.8	Very high	94.6	Very high	17 Å²	17	25 Å²	25	10%	0.104	12%	0.124	C	C	.	.	S	Bend	trans	-133.2	153.7	-176	81.8	0	0	0	0	113.9	F274 A278 C279 V280 S427 A431	F274-T276 VanDerWaalsContact C-N 3.34Å; F274-T276 PolarHBondContact O-N 2.91Å; T276-A278 PolarHBondContact O-N 3.37Å; T276-A278 PolarHBondContact OG1-N 3.27Å; T276-C279 PolarHBondContact O-N 2.8Å; T276-C279 PolarHBondContact OG1-N 3.34Å; T276-C279 VanDerWaalsContact OG1-N 3.15Å; T276-C279 PolarHBondContact OG1-SG 3.35Å; T276-V280 PolarHBondContact O-N 3.48Å; T276-V280 VanDerWaalsContact O-N 3.09Å; T276-S427 WeakPolarHBondContact CB-OG 3.3Å; T276-S427 WeakPolarHBondContact CG2-O 3.39Å; T276-S427 PolarHBondContact OG1-OG 3.3Å; T276-A431 HydrophobicContact CG2-CB 3.71Å
277	C	94.6	Very high	94.8	Very high	29 Å²	29	21.5 Å²	21.5	20%	0.196	11%	0.108	C	C	.	.	H	α-helix	trans	-58.6	-34.6	174.9	-61.3	0	0	0	0	112.3	V280 E281 H300	C277-V280 PolarHBondContact O-N 3.02Å; C277-E281 PolarHBondContact O-N 2.88Å; C277-E281 VanDerWaalsContact O-N 3.12Å; C277-H300 HydrophobicContact CB-CB 4.1Å
278	A	94.9	Very high	95	Very high	13 Å²	13	19 Å²	19	11%	0.107	10%	0.097	C	C	.	.	H	α-helix	trans	-72.1	-35.1	180	0	0	0	0	0	111.6	T276 E281 Y282 K423 A424	T276-A278 PolarHBondContact O-N 3.37Å; T276-A278 PolarHBondContact OG1-N 3.27Å; A278-E281 PolarHBondContact O-N 3.18Å; A278-Y282 WeakPolarHBondContact O-CB 3.49Å; A278-Y282 PolarHBondContact O-N 3.05Å; A278-K423 HydrophobicContact CB-CB 4.49Å; A278-K423 HydrophobicContact CB-CD 4.34Å; A278-K423 HydrophobicContact CB-CG 3.96Å; A278-A424 HydrophobicContact CB-CB 4.36Å
279	C	96.1	Very high	95	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.8	-46	172	-64.8	0	0	0	0	111.4	F274 T276 E281 Y282 Y283	F274-C279 HydrophobicContact CB-CB 3.95Å; F274-C279 HydrophobicContact CD1-CB 4.03Å; F274-C279 HydrophobicContact CG-CB 4.28Å; T276-C279 PolarHBondContact O-N 2.8Å; T276-C279 PolarHBondContact OG1-N 3.34Å; T276-C279 VanDerWaalsContact OG1-N 3.15Å; T276-C279 PolarHBondContact OG1-SG 3.35Å; C279-E281 VanDerWaalsContact C-N 3.3Å; C279-E281 PolarHBondContact O-N 3.23Å; C279-Y282 PolarHBondContact O-N 3.13Å; C279-Y283 HydrophobicContact CB-CD2 4.1Å; C279-Y283 HydrophobicContact CB-CE2 4.4Å; C279-Y283 WeakPolarHBondContact O-CB 3.44Å; C279-Y283 WeakPolarHBondContact O-CD2 3.19Å; C279-Y283 PolarHBondContact O-N 3.42Å
280	V	96.4	Very high	95	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-54.2	-46.7	174.3	168.3	0	0	0	0	111.5	F274 T276 C277 Y282 G284 C298 H300 V323 T325	F274-V280 HydrophobicContact CB-CG2 3.95Å; F274-V280 HydrophobicContact CD2-CG2 4.47Å; T276-V280 PolarHBondContact O-N 3.48Å; T276-V280 VanDerWaalsContact O-N 3.09Å; C277-V280 PolarHBondContact O-N 3.02Å; V280-Y282 PolarHBondContact O-N 3.04Å; V280-G284 WeakPolarHBondContact O-CA 3.43Å; V280-G284 PolarHBondContact O-N 3.33Å; V280-C298 HydrophobicContact CG1-CB 3.9Å; V280-H300 HydrophobicContact CG1-CB 4.38Å; V280-V323 HydrophobicContact CB-CG1 4.29Å; V280-V323 HydrophobicContact CG1-CG1 4Å; V280-V323 HydrophobicContact CG2-CG1 4.26Å; V280-T325 HydrophobicContact CG2-CG2 3.56Å
281	E	94.8	Very high	94.9	Very high	65 Å²	65	19.2 Å²	19.2	30%	0.304	11%	0.106	S	C	.	.	H	α-helix	trans	-69	-32	-179.9	-79.9	-169.8	-142.7	0	0	114.7	C277 A278 C279 H300 K420	C277-E281 PolarHBondContact O-N 2.88Å; C277-E281 VanDerWaalsContact O-N 3.12Å; A278-E281 PolarHBondContact O-N 3.18Å; C279-E281 VanDerWaalsContact C-N 3.3Å; C279-E281 PolarHBondContact O-N 3.23Å; E281-H300 IonicContact OE1-CE1 3.96Å; E281-H300 IonicContact OE1-NE2 3.94Å; E281-K420 IonicContact OE2-NZ 3.54Å; E281-K420 PolarHBondContact OE2-NZ 3.4Å
282	Y	96	Very high	94.6	Very high	10 Å²	10	27 Å²	27	4%	0.039	14%	0.14	C	C	.	.	H	α-helix	trans	-78.8	-56.2	179.3	170.8	-109	0	0	0	110.6	A278 C279 V280 G284 K285 A286 V417 K420 G421 A424 F455	A278-Y282 WeakPolarHBondContact O-CB 3.49Å; A278-Y282 PolarHBondContact O-N 3.05Å; C279-Y282 PolarHBondContact O-N 3.13Å; V280-Y282 PolarHBondContact O-N 3.04Å; Y282-G284 VanDerWaalsContact C-N 3.33Å; Y282-G284 PolarHBondContact O-N 2.94Å; Y282-K285 PolarHBondContact O-N 3.45Å; Y282-A286 PolarHBondContact O-N 3.19Å; Y282-V417 HydrophobicContact CE2-CG1 4.37Å; Y282-K420 HydrophobicContact CD2-CB 4.24Å; Y282-G421 VanDerWaalsContact CD2-CA 3.41Å; Y282-A424 HydrophobicContact CD1-CB 4.24Å; Y282-A424 HydrophobicContact CG-CB 4.14Å; Y282-F455 HydrophobicContact CD1-CD1 4.2Å; Y282-F455 HydrophobicContact CE1-CD1 4.11Å; Y282-F455 PolarHBondContact OH-O 3.21Å
283	Y	96.3	Very high	94.2	Very high	2 Å²	2	31 Å²	31	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-68.7	-31.1	-179.1	-72.8	-66.4	0	0	0	112.4	F255 F274 C279 K285 A286 L287 Y343 F455	F255-Y283 AromaticContact CD2-CD1 3.53Å; F255-Y283 HydrophobicContact CD2-CD1 3.53Å; F255-Y283 AromaticContact CD2-CE1 3.46Å; F255-Y283 HydrophobicContact CD2-CE1 3.46Å; F255-Y283 VanDerWaalsContact CD2-CE1 3.46Å; F255-Y283 AromaticContact CE2-CD1 3.29Å; F255-Y283 HydrophobicContact CE2-CD1 3.29Å; F255-Y283 AromaticContact CE2-CE1 3.74Å; F255-Y283 HydrophobicContact CE2-CE1 3.74Å; F255-Y283 HydrophobicContact CE2-CG 4.3Å; F255-Y283 HydrophobicContact CG-CD1 4.33Å; F255-Y283 AromaticContact CG-CE1 3.92Å; F255-Y283 HydrophobicContact CG-CE1 3.92Å; F255-Y283 AromaticContact CZ-CD1 3.89Å; F255-Y283 HydrophobicContact CZ-CD1 3.89Å; F255-Y283 HydrophobicContact CZ-CE1 4.37Å; F274-Y283 AromaticContact CD1-CD2 3.57Å; F274-Y283 HydrophobicContact CD1-CD2 3.57Å; F274-Y283 HydrophobicContact CD1-CE2 4.08Å; F274-Y283 HydrophobicContact CD1-CG 4.29Å; F274-Y283 HydrophobicContact CE1-CD1 4.3Å; F274-Y283 AromaticContact CE1-CD2 3.14Å; F274-Y283 HydrophobicContact CE1-CD2 3.14Å; F274-Y283 AromaticContact CE1-CE2 3.71Å; F274-Y283 HydrophobicContact CE1-CE2 3.71Å; F274-Y283 AromaticContact CE1-CG 3.48Å; F274-Y283 HydrophobicContact CE1-CG 3.48Å; F274-Y283 VanDerWaalsContact CE1-CG 3.48Å; F274-Y283 AromaticContact CZ-CD2 3.89Å; F274-Y283 HydrophobicContact CZ-CD2 3.89Å; F274-Y283 AromaticContact CZ-CG 3.76Å; F274-Y283 HydrophobicContact CZ-CG 3.76Å; C279-Y283 HydrophobicContact CB-CD2 4.1Å; C279-Y283 HydrophobicContact CB-CE2 4.4Å; C279-Y283 WeakPolarHBondContact O-CB 3.44Å; C279-Y283 WeakPolarHBondContact O-CD2 3.19Å; C279-Y283 PolarHBondContact O-N 3.42Å; Y283-K285 PolarHBondContact O-N 2.92Å; Y283-A286 PolarHBondContact O-N 3.46Å; Y283-L287 VanDerWaalsContact O-CB 3.29Å; Y283-L287 WeakPolarHBondContact O-CB 3.49Å; Y283-L287 WeakPolarHBondContact O-CG 3.31Å; Y283-L287 PolarHBondContact O-N 2.87Å; Y283-Y343 HydrophobicContact CE2-CE1 4.11Å; Y283-Y343 PolarHBondContact OH-OH 3.47Å; Y283-F455 HydrophobicContact CE2-CD1 4.34Å; Y283-F455 AromaticContact CE2-CE1 3.72Å; Y283-F455 HydrophobicContact CE2-CE1 3.72Å; Y283-F455 HydrophobicContact CE2-CZ 4.04Å
284	G	95.4	Very high	94	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.1	-49.4	171	0	0	0	0	0	112.5	V280 Y282 A286 L287 E288 C298	V280-G284 WeakPolarHBondContact O-CA 3.43Å; V280-G284 PolarHBondContact O-N 3.33Å; Y282-G284 VanDerWaalsContact C-N 3.33Å; Y282-G284 PolarHBondContact O-N 2.94Å; G284-A286 PolarHBondContact O-N 3.44Å; G284-L287 PolarHBondContact O-N 3.37Å; G284-E288 WeakPolarHBondContact O-CG 3.4Å; G284-E288 PolarHBondContact O-N 3.38Å; G284-C298 VanDerWaalsContact CA-SG 3.58Å
285	K	93.8	Very high	94	Very high	70 Å²	70	36.2 Å²	36.2	30%	0.304	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-38.1	175.1	-76.4	-171.5	168.7	-161.2	0	113	Y282 Y283 A289 V417 K420	Y282-K285 PolarHBondContact O-N 3.45Å; Y283-K285 PolarHBondContact O-N 2.92Å; K285-A289 PolarHBondContact O-N 3.4Å; K285-V417 HydrophobicContact CD-CG2 4.49Å; K285-K420 HydrophobicContact CD-CD 3.86Å
286	A	94.3	Very high	94.1	Very high	3 Å²	3	35.8 Å²	35.8	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-47.5	177.2	0	0	0	0	0	111	F255 Y282 Y283 G284 E288 A289 L290 L407	F255-A286 HydrophobicContact CE1-CB 4.33Å; F255-A286 HydrophobicContact CZ-CB 3.89Å; Y282-A286 PolarHBondContact O-N 3.19Å; Y283-A286 PolarHBondContact O-N 3.46Å; G284-A286 PolarHBondContact O-N 3.44Å; A286-E288 PolarHBondContact O-N 2.89Å; A286-A289 PolarHBondContact O-N 2.87Å; A286-L290 HydrophobicContact CB-CD1 4.49Å; A286-L290 WeakPolarHBondContact O-CB 3.36Å; A286-L290 WeakPolarHBondContact O-CD1 3.36Å; A286-L290 WeakPolarHBondContact O-CG 3.47Å; A286-L290 PolarHBondContact O-N 3.22Å; A286-L407 HydrophobicContact CB-CD2 3.75Å
287	L	95.8	Very high	94.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-40.8	178.3	-71.1	172.5	0	0	0	111.6	F255 V259 L262 Y283 G284 A289 L290 V291 I296 V323	F255-L287 HydrophobicContact CE2-CD2 4Å; F255-L287 HydrophobicContact CE2-CG 4.28Å; F255-L287 HydrophobicContact CZ-CD2 4.03Å; F255-L287 HydrophobicContact CZ-CG 4.31Å; V259-L287 HydrophobicContact CG2-CD2 3.78Å; L262-L287 HydrophobicContact CD1-CD1 4.34Å; L262-L287 HydrophobicContact CD1-CD2 3.74Å; Y283-L287 VanDerWaalsContact O-CB 3.29Å; Y283-L287 WeakPolarHBondContact O-CB 3.49Å; Y283-L287 WeakPolarHBondContact O-CG 3.31Å; Y283-L287 PolarHBondContact O-N 2.87Å; G284-L287 PolarHBondContact O-N 3.37Å; L287-A289 PolarHBondContact O-N 3.02Å; L287-L290 PolarHBondContact O-N 2.91Å; L287-L290 VanDerWaalsContact O-N 3.09Å; L287-V291 HydrophobicContact CD2-CG2 4.08Å; L287-V291 PolarHBondContact O-N 3.4Å; L287-I296 HydrophobicContact CB-CD1 3.79Å; L287-I296 VanDerWaalsContact O-CD1 3.31Å; L287-I296 WeakPolarHBondContact O-CD1 3.26Å; L287-V323 HydrophobicContact CD1-CG2 3.77Å
288	E	94.3	Very high	94.1	Very high	111 Å²	111	35.7 Å²	35.7	52%	0.519	20%	0.2	S	C	.	.	H	α-helix	trans	-56.3	-37.7	175.3	-80.6	173.4	-171.4	0	0	112.2	G284 A286 I296	G284-E288 WeakPolarHBondContact O-CG 3.4Å; G284-E288 PolarHBondContact O-N 3.38Å; A286-E288 PolarHBondContact O-N 2.89Å; E288-I296 HydrophobicContact CG-CB 4Å; E288-I296 HydrophobicContact CG-CG2 4.3Å
289	A	92.4	Very high	94	Very high	43 Å²	43	35.1 Å²	35.1	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-79.2	-28.6	178.3	0	0	0	0	0	113.4	K285 A286 L287 M410	K285-A289 PolarHBondContact O-N 3.4Å; A286-A289 PolarHBondContact O-N 2.87Å; L287-A289 PolarHBondContact O-N 3.02Å; A289-M410 HydrophobicContact CB-CE 3.51Å; A289-M410 HydrophobicContact CB-SD 3.71Å
290	L	93.1	Very high	93.7	Very high	12 Å²	12	35.8 Å²	35.8	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-101.7	-27.8	-167.9	-66.4	171.9	0	0	0	114.2	F255 V259 R263 A286 L287 L403 K406 L407	F255-L290 HydrophobicContact CE1-CD1 3.58Å; F255-L290 HydrophobicContact CZ-CD1 4.04Å; V259-L290 HydrophobicContact CG1-CB 4.32Å; V259-L290 HydrophobicContact CG2-CD1 4.41Å; R263-L290 PolarHBondContact NE-O 2.82Å; R263-L290 VanDerWaalsContact NE-O 3.13Å; R263-L290 PolarHBondContact NH2-O 3.09Å; A286-L290 HydrophobicContact CB-CD1 4.49Å; A286-L290 WeakPolarHBondContact O-CB 3.36Å; A286-L290 WeakPolarHBondContact O-CD1 3.36Å; A286-L290 WeakPolarHBondContact O-CG 3.47Å; A286-L290 PolarHBondContact O-N 3.22Å; L287-L290 PolarHBondContact O-N 2.91Å; L287-L290 VanDerWaalsContact O-N 3.09Å; L290-L403 HydrophobicContact CD1-CD1 4.22Å; L290-L403 HydrophobicContact CD2-CD2 4.24Å; L290-K406 HydrophobicContact CD2-CG 3.97Å; L290-L407 HydrophobicContact CD1-CD2 3.94Å; L290-L407 HydrophobicContact CD1-CG 4.49Å
291	V	92.6	Very high	93	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.012	21%	0.214	C	C	.	.	S	Bend	trans	-109.2	80.6	-179.9	-172	0	0	0	0	108.7	V259 L262 L287 V294 I296 I321	V259-V291 HydrophobicContact CG1-CG2 4.29Å; L262-V291 HydrophobicContact CB-CG2 4.25Å; L287-V291 HydrophobicContact CD2-CG2 4.08Å; L287-V291 PolarHBondContact O-N 3.4Å; V291-V294 HydrophobicContact CG1-CB 4.24Å; V291-V294 HydrophobicContact CG1-CG2 4.06Å; V291-I296 HydrophobicContact CB-CD1 4.12Å; V291-I321 HydrophobicContact CG1-CD1 4.05Å
292	K	90.1	Very high	92.5	Very high	164 Å²	164	41.9 Å²	41.9	71%	0.713	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	145	178.6	-61.6	-175	-179	-178.6	0	111.7	K266	K266-K292 PolarHBondContact NZ-O 2.69Å
293	G	87.9	Confident	91.9	Very high	85 Å²	85	43 Å²	43	88%	0.876	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	11.3	176	0	0	0	0	0	114.6
294	V	92.8	Very high	90.8	Very high	24 Å²	24	50 Å²	50	15%	0.145	27%	0.269	C	S	.	.	S	Bend	trans	-128.3	141.7	177	-175.8	0	0	0	0	109.1	K266 V291 I296 I321	K266-V294 HydrophobicContact CB-CG2 3.59Å; K266-V294 HydrophobicContact CD-CG2 4Å; K266-V294 HydrophobicContact CG-CG2 3.6Å; V291-V294 HydrophobicContact CG1-CB 4.24Å; V291-V294 HydrophobicContact CG1-CG2 4.06Å; V294-I296 PolarHBondContact O-N 3.44Å; V294-I321 HydrophobicContact CB-CD1 4.35Å; V294-I321 HydrophobicContact CG1-CD1 3.77Å; V294-I321 HydrophobicContact CG1-CG1 3.84Å
295	K	94.7	Very high	89.4	Confident	85 Å²	85	59 Å²	59	37%	0.37	31%	0.305	S	S	.	.			trans	-78.8	120.5	174.6	-174.1	162.5	175.1	-179.9	0	109.8	E313 L317 G320 I321	K295-E313 WeakPolarHBondContact CE-OE1 3.5Å; K295-E313 IonicContact NZ-OE1 3.83Å; K295-E313 PolarHBondContact NZ-OE1 3.37Å; K295-L317 HydrophobicContact CB-CD1 4.34Å; K295-L317 HydrophobicContact CD-CD1 3.66Å; K295-L317 HydrophobicContact CD-CD2 3.99Å; K295-L317 HydrophobicContact CD-CG 4.47Å; K295-L317 HydrophobicContact CG-CD1 4.06Å; K295-G320 WeakPolarHBondContact O-CA 3.49Å; K295-I321 PolarHBondContact O-N 3.35Å
296	I	95.5	Very high	88.8	Confident	17 Å²	17	63 Å²	63	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132	-179.8	-50.1	-172.7	0	0	0	108.6	L287 E288 V291 V294 I321 V323	L287-I296 HydrophobicContact CB-CD1 3.79Å; L287-I296 VanDerWaalsContact O-CD1 3.31Å; L287-I296 WeakPolarHBondContact O-CD1 3.26Å; E288-I296 HydrophobicContact CG-CB 4Å; E288-I296 HydrophobicContact CG-CG2 4.3Å; V291-I296 HydrophobicContact CB-CD1 4.12Å; V294-I296 PolarHBondContact O-N 3.44Å; I296-I321 WeakPolarHBondContact CA-O 2.85Å; I296-I321 HydrophobicContact CD1-CD1 4.31Å; I296-I321 HydrophobicContact CG1-CB 4.31Å; I296-I321 HydrophobicContact CG1-CD1 4.29Å; I296-I321 HydrophobicContact CG2-CB 4.48Å; I296-I321 HydrophobicContact CG2-CG2 4.49Å; I296-V323 HydrophobicContact CG2-CG2 4.03Å
297	M	95.1	Very high	88.3	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.084	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.7	178.2	-71.9	-172.8	-70.2	0	0	110.3	I310 E313 F314 L317 I321 L322 V323	M297-I310 HydrophobicContact CB-CG2 3.76Å; M297-I310 HydrophobicContact CG-CG2 4.24Å; M297-I310 HydrophobicContact SD-CG2 3.93Å; M297-E313 HydrophobicContact CE-CG 4.41Å; M297-E313 HydrophobicContact SD-CB 4.25Å; M297-E313 HydrophobicContact SD-CG 3.95Å; M297-F314 VanDerWaalsContact CE-CA 3.47Å; M297-F314 HydrophobicContact CE-CB 3.48Å; M297-F314 VanDerWaalsContact CE-CB 3.48Å; M297-F314 HydrophobicContact CE-CD2 3.48Å; M297-F314 VanDerWaalsContact CE-CD2 3.48Å; M297-F314 HydrophobicContact CE-CG 3.94Å; M297-L317 HydrophobicContact CE-CD1 3.3Å; M297-L317 HydrophobicContact CE-CG 4.47Å; M297-I321 PolarHBondContact N-O 3.34Å; M297-L322 HydrophobicContact CB-CD1 4.21Å; M297-L322 WeakPolarHBondContact O-CA 3.33Å; M297-V323 PolarHBondContact O-N 2.84Å
298	C	94.8	Very high	87.6	Confident	27 Å²	27	65.8 Å²	65.8	18%	0.182	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132	-177.1	-64.9	0	0	0	0	110.9	V280 G284 V323	V280-C298 HydrophobicContact CG1-CB 3.9Å; G284-C298 VanDerWaalsContact CA-SG 3.58Å; C298-V323 CarbonylContact C-O 3.56Å; C298-V323 VanDerWaalsContact CA-O 3.27Å; C298-V323 WeakPolarHBondContact CA-O 3.16Å
299	I	91.8	Very high	87.1	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.9	174.2	-69.3	177.3	0	0	0	110.9	R307 I310 F311 L322 V323 C324 T325 M328	I299-R307 HydrophobicContact CG2-CG 3.83Å; I299-I310 HydrophobicContact CD1-CB 4.22Å; I299-I310 HydrophobicContact CD1-CG2 3.82Å; I299-I310 HydrophobicContact CG1-CB 4.12Å; I299-I310 HydrophobicContact CG1-CG2 3.62Å; I299-F311 HydrophobicContact CD1-CB 4.02Å; I299-L322 HydrophobicContact CB-CD1 4.1Å; I299-L322 HydrophobicContact CD1-CD1 3.84Å; I299-L322 HydrophobicContact CD1-CD2 4.14Å; I299-L322 HydrophobicContact CG1-CD1 3.78Å; I299-V323 PolarHBondContact N-O 3.41Å; I299-C324 HydrophobicContact CB-CB 4.48Å; I299-C324 WeakPolarHBondContact O-CA 3.14Å; I299-C324 WeakPolarHBondContact O-CB 3.48Å; I299-T325 PolarHBondContact O-N 3.02Å; I299-M328 HydrophobicContact CB-CG 4.21Å; I299-M328 HydrophobicContact CB-SD 4.36Å; I299-M328 HydrophobicContact CD1-CE 4.32Å; I299-M328 HydrophobicContact CD1-SD 4.09Å; I299-M328 HydrophobicContact CG2-CG 3.82Å; I299-M328 HydrophobicContact CG2-SD 3.64Å
300	H	89.8	Confident	87	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.065	33%	0.333	C	S	.	.			trans	-148.5	164.5	172.7	62.4	91.1	0	0	0	112.3	C277 V280 E281 K302 M303 T325	C277-H300 HydrophobicContact CB-CB 4.1Å; V280-H300 HydrophobicContact CG1-CB 4.38Å; E281-H300 IonicContact OE1-CE1 3.96Å; E281-H300 IonicContact OE1-NE2 3.94Å; H300-K302 VanDerWaalsContact C-N 3.26Å; H300-K302 PolarHBondContact O-N 3.18Å; H300-K302 VanDerWaalsContact O-N 3.15Å; H300-M303 VanDerWaalsContact CD2-SD 3.58Å; H300-M303 PolarHBondContact N-SD 2.89Å; H300-M303 VanDerWaalsContact N-SD 3.44Å; H300-M303 WeakPolarHBondContact NE2-CG 3.36Å; H300-M303 WeakPolarHBondContact O-CB 3.48Å; H300-M303 WeakPolarHBondContact O-CG 3.25Å; H300-M303 PolarHBondContact O-N 3.43Å; H300-M303 VanDerWaalsContact O-N 3.08Å; H300-T325 HydrophobicContact CB-CG2 4.04Å
301	G	81.9	Confident	86.7	Confident	34 Å²	34	66.9 Å²	66.9	35%	0.351	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.7	-170.2	0	0	0	0	0	116.1	M303	G301-M303 PolarHBondContact O-N 3.24Å
302	K	84.3	Confident	86.4	Confident	160 Å²	160	69.3 Å²	69.3	70%	0.696	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-6	177.4	-63.3	-172.6	175.8	-172.9	0	113.9	H300	H300-K302 VanDerWaalsContact C-N 3.26Å; H300-K302 PolarHBondContact O-N 3.18Å; H300-K302 VanDerWaalsContact O-N 3.15Å
303	M	83.2	Confident	86.5	Confident	33 Å²	33	65 Å²	65	16%	0.163	33%	0.325	C	S	.	.			trans	-81	119.5	176	-57.5	177.6	79.7	0	0	110	H300 G301 K306 R307 I310	H300-M303 VanDerWaalsContact CD2-SD 3.58Å; H300-M303 PolarHBondContact N-SD 2.89Å; H300-M303 VanDerWaalsContact N-SD 3.44Å; H300-M303 WeakPolarHBondContact NE2-CG 3.36Å; H300-M303 WeakPolarHBondContact O-CB 3.48Å; H300-M303 WeakPolarHBondContact O-CG 3.25Å; H300-M303 PolarHBondContact O-N 3.43Å; H300-M303 VanDerWaalsContact O-N 3.08Å; G301-M303 PolarHBondContact O-N 3.24Å; M303-K306 HydrophobicContact CE-CB 4.22Å; M303-R307 HydrophobicContact CB-CB 4.06Å; M303-R307 HydrophobicContact CB-CG 4.46Å; M303-I310 HydrophobicContact CE-CD1 3.41Å; M303-I310 VanDerWaalsContact CE-CD1 3.41Å
304	K	72.5	Confident	86.6	Confident	148 Å²	148	61 Å²	61	64%	0.643	28%	0.284	S	S	*	.	S	Bend	trans	-88.6	-64.6	179.8	-65.3	-176.1	179.3	-178.1	0	112.4
305	Y	67.5	Low	86.4	Confident	190 Å²	190	63.5 Å²	63.5	75%	0.745	29%	0.291	S	S	*	.	S	Bend	trans	-95.2	-32.8	-168.3	-55.3	-76.9	0	0	0	114.8	R307	Y305-R307 VanDerWaalsContact C-N 3.35Å
306	K	81	Confident	86.1	Confident	155 Å²	155	67.8 Å²	67.8	67%	0.674	31%	0.309	S	S	*	.	S	Bend	trans	-81.6	-13.6	-175.3	-65	-175.6	179.9	-178.3	0	114.1	M303 K309 I310	M303-K306 HydrophobicContact CE-CB 4.22Å; K306-K309 PolarHBondContact O-N 2.92Å; K306-I310 HydrophobicContact CB-CD1 4.16Å; K306-I310 WeakPolarHBondContact O-CG1 3.46Å; K306-I310 PolarHBondContact O-N 3.42Å
307	R	82.9	Confident	85.9	Confident	16 Å²	16	68.7 Å²	68.7	6%	0.06	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-51.3	-168.6	-164.6	168.2	68.9	-179.8	24.5	112.4	E93 I299 M303 Y305 K309 I310 F311	E93-R307 VanDerWaalsContact CD-NH2 3.29Å; E93-R307 IonicContact OE1-CZ 3.78Å; E93-R307 IonicContact OE1-NE 3.08Å; E93-R307 PolarHBondContact OE1-NE 2.64Å; E93-R307 IonicContact OE1-NH2 3.61Å; E93-R307 PolarHBondContact OE1-NH2 3.24Å; E93-R307 IonicContact OE2-CZ 2.92Å; E93-R307 IonicContact OE2-NE 3.7Å; E93-R307 IonicContact OE2-NH2 2.77Å; E93-R307 PolarHBondContact OE2-NH2 2.77Å; I299-R307 HydrophobicContact CG2-CG 3.83Å; M303-R307 HydrophobicContact CB-CB 4.06Å; M303-R307 HydrophobicContact CB-CG 4.46Å; Y305-R307 VanDerWaalsContact C-N 3.35Å; R307-K309 VanDerWaalsContact C-N 3.32Å; R307-K309 PolarHBondContact O-N 3.35Å; R307-I310 PolarHBondContact O-N 2.71Å; R307-F311 WeakPolarHBondContact O-CB 3.3Å; R307-F311 PolarHBondContact O-N 2.93Å
308	N	80.5	Confident	85.6	Confident	45 Å²	45	74.6 Å²	74.6	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-38.5	178.8	-68.7	10.7	0	0	0	111.9	F311 M312	N308-F311 PolarHBondContact O-N 2.8Å; N308-M312 VanDerWaalsContact O-CG 3.29Å; N308-M312 WeakPolarHBondContact O-CG 3.26Å; N308-M312 PolarHBondContact O-N 3.32Å
309	K	85.7	Confident	85.5	Confident	156 Å²	156	75.3 Å²	75.3	68%	0.678	35%	0.346	S	S	*	.	H	α-helix	trans	-61.2	-49.4	177.7	-175.5	176.6	178.5	176.1	0	111.3	K306 R307 F311 M312 E313	K306-K309 PolarHBondContact O-N 2.92Å; R307-K309 VanDerWaalsContact C-N 3.32Å; R307-K309 PolarHBondContact O-N 3.35Å; K309-F311 VanDerWaalsContact C-N 3.32Å; K309-F311 PolarHBondContact O-N 2.8Å; K309-M312 PolarHBondContact O-N 3.42Å; K309-E313 VanDerWaalsContact O-CB 3.31Å; K309-E313 WeakPolarHBondContact O-CB 3.06Å; K309-E313 PolarHBondContact O-N 2.96Å
310	I	89.9	Confident	85.6	Confident	29 Å²	29	75.3 Å²	75.3	15%	0.149	35%	0.346	C	S	.	.	H	α-helix	trans	-64.3	-39.9	179	-64.7	164.7	0	0	0	110.7	M297 I299 M303 K306 R307 E313 F314	M297-I310 HydrophobicContact CB-CG2 3.76Å; M297-I310 HydrophobicContact CG-CG2 4.24Å; M297-I310 HydrophobicContact SD-CG2 3.93Å; I299-I310 HydrophobicContact CD1-CB 4.22Å; I299-I310 HydrophobicContact CD1-CG2 3.82Å; I299-I310 HydrophobicContact CG1-CB 4.12Å; I299-I310 HydrophobicContact CG1-CG2 3.62Å; M303-I310 HydrophobicContact CE-CD1 3.41Å; M303-I310 VanDerWaalsContact CE-CD1 3.41Å; K306-I310 HydrophobicContact CB-CD1 4.16Å; K306-I310 WeakPolarHBondContact O-CG1 3.46Å; K306-I310 PolarHBondContact O-N 3.42Å; R307-I310 PolarHBondContact O-N 2.71Å; I310-E313 PolarHBondContact O-N 3.08Å; I310-F314 WeakPolarHBondContact O-CB 3.36Å; I310-F314 PolarHBondContact O-N 3.09Å
311	F	86.9	Confident	85.9	Confident	4 Å²	4	74.7 Å²	74.7	2%	0.018	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-50.4	176.4	172.1	-115.3	0	0	0	111.9	I299 R307 N308 K309 E313 F314 R315 M328 I332 I334	I299-F311 HydrophobicContact CD1-CB 4.02Å; R307-F311 WeakPolarHBondContact O-CB 3.3Å; R307-F311 PolarHBondContact O-N 2.93Å; N308-F311 PolarHBondContact O-N 2.8Å; K309-F311 VanDerWaalsContact C-N 3.32Å; K309-F311 PolarHBondContact O-N 2.8Å; F311-E313 VanDerWaalsContact C-N 3.3Å; F311-E313 PolarHBondContact O-N 2.67Å; F311-F314 PolarHBondContact O-N 2.87Å; F311-R315 WeakPolarHBondContact O-CB 3.5Å; F311-R315 PolarHBondContact O-N 2.96Å; F311-M328 HydrophobicContact CD2-CE 3.63Å; F311-M328 HydrophobicContact CE2-CE 4.02Å; F311-I332 HydrophobicContact CD2-CG2 3.98Å; F311-I332 HydrophobicContact CE1-CG2 4.39Å; F311-I332 HydrophobicContact CE2-CG2 3.06Å; F311-I332 HydrophobicContact CZ-CG2 3.32Å; F311-I334 HydrophobicContact CE2-CD1 4.4Å; F311-I334 HydrophobicContact CE2-CG1 3.92Å
312	M	85.9	Confident	86.6	Confident	52 Å²	52	73 Å²	73	26%	0.256	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-37	178.5	-68.3	-57.8	173.7	0	0	112.3	V96 E100 N308 K309 K316	V96-M312 HydrophobicContact CG1-CE 3.84Å; E100-M312 WeakPolarHBondContact OE1-CE 3.19Å; N308-M312 VanDerWaalsContact O-CG 3.29Å; N308-M312 WeakPolarHBondContact O-CG 3.26Å; N308-M312 PolarHBondContact O-N 3.32Å; K309-M312 PolarHBondContact O-N 3.42Å; M312-K316 WeakPolarHBondContact O-CG 3.4Å; M312-K316 PolarHBondContact O-N 3.07Å
313	E	90.9	Very high	87.2	Confident	75 Å²	75	65.4 Å²	65.4	35%	0.35	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-44.4	174.9	-172.9	171.8	-178.8	0	0	111.5	K295 M297 K309 I310 F311 K316 L317	K295-E313 WeakPolarHBondContact CE-OE1 3.5Å; K295-E313 IonicContact NZ-OE1 3.83Å; K295-E313 PolarHBondContact NZ-OE1 3.37Å; M297-E313 HydrophobicContact CE-CG 4.41Å; M297-E313 HydrophobicContact SD-CB 4.25Å; M297-E313 HydrophobicContact SD-CG 3.95Å; K309-E313 VanDerWaalsContact O-CB 3.31Å; K309-E313 WeakPolarHBondContact O-CB 3.06Å; K309-E313 PolarHBondContact O-N 2.96Å; I310-E313 PolarHBondContact O-N 3.08Å; F311-E313 VanDerWaalsContact C-N 3.3Å; F311-E313 PolarHBondContact O-N 2.67Å; E313-K316 PolarHBondContact O-N 3.37Å; E313-L317 WeakPolarHBondContact O-CG 3.35Å; E313-L317 PolarHBondContact O-N 3.37Å
314	F	91.6	Very high	87.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-38.1	177.1	-170.4	-111.8	0	0	0	113.1	K269 L271 M297 I310 F311 K316 L317 L322 I334	K269-F314 HydrophobicContact CD-CZ 4.44Å; K269-F314 WeakPolarHBondContact CE-O 3.45Å; K269-F314 HydrophobicContact CG-CE1 4.29Å; K269-F314 HydrophobicContact CG-CE2 4.27Å; K269-F314 HydrophobicContact CG-CZ 3.71Å; K269-F314 PolarHBondContact NZ-O 3.33Å; L271-F314 HydrophobicContact CD2-CE1 4.01Å; M297-F314 VanDerWaalsContact CE-CA 3.47Å; M297-F314 HydrophobicContact CE-CB 3.48Å; M297-F314 VanDerWaalsContact CE-CB 3.48Å; M297-F314 HydrophobicContact CE-CD2 3.48Å; M297-F314 VanDerWaalsContact CE-CD2 3.48Å; M297-F314 HydrophobicContact CE-CG 3.94Å; I310-F314 WeakPolarHBondContact O-CB 3.36Å; I310-F314 PolarHBondContact O-N 3.09Å; F311-F314 PolarHBondContact O-N 2.87Å; F314-K316 PolarHBondContact O-N 3.47Å; F314-L317 HydrophobicContact CD2-CD1 4.12Å; F314-L317 PolarHBondContact O-N 3.04Å; F314-L317 VanDerWaalsContact O-N 3.11Å; F314-L322 HydrophobicContact CD1-CB 3.8Å; F314-L322 HydrophobicContact CD1-CD2 3.49Å; F314-L322 VanDerWaalsContact CD1-CD2 3.49Å; F314-L322 HydrophobicContact CD1-CG 4.23Å; F314-L322 HydrophobicContact CD2-CB 3.78Å; F314-L322 HydrophobicContact CE1-CB 3.51Å; F314-L322 HydrophobicContact CE1-CD2 3.78Å; F314-L322 HydrophobicContact CE1-CG 4.27Å; F314-L322 HydrophobicContact CE2-CB 3.51Å; F314-L322 HydrophobicContact CG-CB 3.92Å; F314-L322 HydrophobicContact CG-CD2 4Å; F314-L322 HydrophobicContact CG-CG 4.44Å; F314-L322 HydrophobicContact CZ-CB 3.36Å; F314-I334 HydrophobicContact CD1-CD1 4.07Å; F314-I334 HydrophobicContact CD1-CG2 4.01Å; F314-I334 HydrophobicContact CE1-CD1 4.1Å; F314-I334 HydrophobicContact CE1-CG2 3.81Å
315	R	88.1	Confident	88.7	Confident	77 Å²	77	57.4 Å²	57.4	29%	0.291	26%	0.259	S	S	.	.	H	α-helix	trans	-56.2	-40	177.8	-169.3	178.3	174.8	-168.2	-0.3	111.3	E100 K269 F311 P335	E100-R315 IonicContact OE2-CZ 3.52Å; E100-R315 IonicContact OE2-NH1 3.31Å; E100-R315 PolarHBondContact OE2-NH1 3.22Å; K269-R315 PolarHBondContact NZ-O 3.34Å; F311-R315 WeakPolarHBondContact O-CB 3.5Å; F311-R315 PolarHBondContact O-N 2.96Å; R315-P335 HydrophobicContact CG-CG 4.27Å
316	K	89.3	Confident	89.6	Confident	174 Å²	174	49.8 Å²	49.8	76%	0.757	23%	0.231	S	C	*	.	H	α-helix	trans	-76.9	-15.9	180	-66.9	178	-177.7	-173.5	0	114.8	M312 E313 F314	M312-K316 WeakPolarHBondContact O-CG 3.4Å; M312-K316 PolarHBondContact O-N 3.07Å; E313-K316 PolarHBondContact O-N 3.37Å; F314-K316 PolarHBondContact O-N 3.47Å
317	L	90.6	Very high	89.6	Confident	36 Å²	36	43.9 Å²	43.9	19%	0.188	21%	0.208	C	C	.	.			trans	-75	139	179.5	-69.4	173.8	0	0	0	111.1	K269 K295 M297 E313 F314	K269-L317 VanDerWaalsContact CE-O 3.26Å; K269-L317 WeakPolarHBondContact CE-O 3.48Å; K269-L317 PolarHBondContact NZ-O 2.91Å; K295-L317 HydrophobicContact CB-CD1 4.34Å; K295-L317 HydrophobicContact CD-CD1 3.66Å; K295-L317 HydrophobicContact CD-CD2 3.99Å; K295-L317 HydrophobicContact CD-CG 4.47Å; K295-L317 HydrophobicContact CG-CD1 4.06Å; M297-L317 HydrophobicContact CE-CD1 3.3Å; M297-L317 HydrophobicContact CE-CG 4.47Å; E313-L317 WeakPolarHBondContact O-CG 3.35Å; E313-L317 PolarHBondContact O-N 3.37Å; F314-L317 HydrophobicContact CD2-CD1 4.12Å; F314-L317 PolarHBondContact O-N 3.04Å; F314-L317 VanDerWaalsContact O-N 3.11Å
318	Q	88.8	Confident	89.5	Confident	142 Å²	142	43.1 Å²	43.1	66%	0.664	21%	0.205	S	C	*	.	S	Bend	trans	-78.8	-39.6	171.7	-66.9	-65.3	-47.3	0	0	111
319	S	92.3	Very high	89	Confident	41 Å²	41	41 Å²	41	29%	0.287	19%	0.194	S	C	.	.	S	Bend	trans	-136.1	151.4	176	65.8	0	0	0	0	111.2	Q267	Q267-S319 WeakPolarHBondContact O-CB 3.4Å
320	G	94.5	Very high	88.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.6	171.1	-177.4	0	0	0	0	0	113.6	E268 K269 H270 K295	E268-G320 PolarHBondContact O-N 3.04Å; K269-G320 WeakPolarHBondContact CA-O 3.45Å; H270-G320 PolarHBondContact N-O 3.06Å; K295-G320 WeakPolarHBondContact O-CA 3.49Å
321	I	96.1	Very high	87.1	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.3	-177.4	-59.4	162.6	0	0	0	108.9	L262 H270 V272 V291 V294 K295 I296 M297 V323	L262-I321 HydrophobicContact CB-CD1 4.21Å; L262-I321 HydrophobicContact CD1-CD1 4.18Å; L262-I321 HydrophobicContact CD2-CD1 3.86Å; L262-I321 HydrophobicContact CD2-CG1 4.04Å; L262-I321 HydrophobicContact CG-CD1 4.31Å; H270-I321 HydrophobicContact CB-CG1 4.12Å; H270-I321 HydrophobicContact CB-CG2 4.46Å; V272-I321 HydrophobicContact CG2-CG2 3.73Å; V291-I321 HydrophobicContact CG1-CD1 4.05Å; V294-I321 HydrophobicContact CB-CD1 4.35Å; V294-I321 HydrophobicContact CG1-CD1 3.77Å; V294-I321 HydrophobicContact CG1-CG1 3.84Å; K295-I321 PolarHBondContact O-N 3.35Å; I296-I321 WeakPolarHBondContact CA-O 2.85Å; I296-I321 HydrophobicContact CD1-CD1 4.31Å; I296-I321 HydrophobicContact CG1-CB 4.31Å; I296-I321 HydrophobicContact CG1-CD1 4.29Å; I296-I321 HydrophobicContact CG2-CB 4.48Å; I296-I321 HydrophobicContact CG2-CG2 4.49Å; M297-I321 PolarHBondContact N-O 3.34Å; I321-V323 HydrophobicContact CG2-CG2 4.16Å
322	L	95.8	Very high	86.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	111.5	170.6	173.7	62.9	0	0	0	110.2	H270 L271 V272 M297 I299 F314 C324 M328 I334	H270-L322 PolarHBondContact O-N 3.4Å; L271-L322 HydrophobicContact CD2-CB 3.94Å; L271-L322 HydrophobicContact CD2-CD2 3.65Å; L271-L322 HydrophobicContact CD2-CG 3.99Å; V272-L322 PolarHBondContact N-O 3.33Å; M297-L322 HydrophobicContact CB-CD1 4.21Å; M297-L322 WeakPolarHBondContact O-CA 3.33Å; I299-L322 HydrophobicContact CB-CD1 4.1Å; I299-L322 HydrophobicContact CD1-CD1 3.84Å; I299-L322 HydrophobicContact CD1-CD2 4.14Å; I299-L322 HydrophobicContact CG1-CD1 3.78Å; F314-L322 HydrophobicContact CD1-CB 3.8Å; F314-L322 HydrophobicContact CD1-CD2 3.49Å; F314-L322 VanDerWaalsContact CD1-CD2 3.49Å; F314-L322 HydrophobicContact CD1-CG 4.23Å; F314-L322 HydrophobicContact CD2-CB 3.78Å; F314-L322 HydrophobicContact CE1-CB 3.51Å; F314-L322 HydrophobicContact CE1-CD2 3.78Å; F314-L322 HydrophobicContact CE1-CG 4.27Å; F314-L322 HydrophobicContact CE2-CB 3.51Å; F314-L322 HydrophobicContact CG-CB 3.92Å; F314-L322 HydrophobicContact CG-CD2 4Å; F314-L322 HydrophobicContact CG-CG 4.44Å; F314-L322 HydrophobicContact CZ-CB 3.36Å; L322-C324 HydrophobicContact CG-CB 4.42Å; L322-M328 HydrophobicContact CD2-CE 4.04Å; L322-I334 HydrophobicContact CD2-CD1 4.27Å
323	V	96.7	Very high	85.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.2	175.4	-175	0	0	0	0	108.9	V272 F274 V280 L287 I296 M297 C298 I299 I321	V272-V323 WeakPolarHBondContact O-CA 3.43Å; F274-V323 HydrophobicContact CD2-CG1 3.53Å; F274-V323 HydrophobicContact CE2-CG1 3.51Å; V280-V323 HydrophobicContact CB-CG1 4.29Å; V280-V323 HydrophobicContact CG1-CG1 4Å; V280-V323 HydrophobicContact CG2-CG1 4.26Å; L287-V323 HydrophobicContact CD1-CG2 3.77Å; I296-V323 HydrophobicContact CG2-CG2 4.03Å; M297-V323 PolarHBondContact O-N 2.84Å; C298-V323 CarbonylContact C-O 3.56Å; C298-V323 VanDerWaalsContact CA-O 3.27Å; C298-V323 WeakPolarHBondContact CA-O 3.16Å; I299-V323 PolarHBondContact N-O 3.41Å; I321-V323 HydrophobicContact CG2-CG2 4.16Å
324	C	94.6	Very high	85.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	163.3	-171.3	58.1	0	0	0	0	115.4	V272 F273 F274 I299 L322 M328	V272-C324 PolarHBondContact O-N 3.02Å; F273-C324 WeakPolarHBondContact CA-O 3.47Å; F274-C324 PolarHBondContact N-O 3.47Å; I299-C324 HydrophobicContact CB-CB 4.48Å; I299-C324 WeakPolarHBondContact O-CA 3.14Å; I299-C324 WeakPolarHBondContact O-CB 3.48Å; L322-C324 HydrophobicContact CG-CB 4.42Å; C324-M328 HydrophobicContact CB-CB 3.85Å; C324-M328 HydrophobicContact CB-CG 3.52Å
325	T	92.3	Very high	84.4	Confident	12 Å²	12	31.2 Å²	31.2	7%	0.074	16%	0.158	C	C	.	.			trans	-96.1	-178.2	165.8	63.8	0	0	0	0	110.4	V280 I299 H300 V327 M328	V280-T325 HydrophobicContact CG2-CG2 3.56Å; I299-T325 PolarHBondContact O-N 3.02Å; H300-T325 HydrophobicContact CB-CG2 4.04Å; T325-V327 PolarHBondContact O-N 3.1Å; T325-M328 PolarHBondContact O-N 2.94Å
326	D	86.6	Confident	83.9	Confident	30 Å²	30	32.3 Å²	32.3	16%	0.16	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-58.7	-2.5	178.2	-69.3	-47	0	0	0	116.6	M328 A329 R355	D326-M328 PolarHBondContact O-N 3.22Å; D326-A329 HydrophobicContact CB-CB 4.26Å; D326-A329 WeakPolarHBondContact O-CB 3.36Å; D326-A329 PolarHBondContact O-N 3.39Å; D326-R355 IonicContact OD1-CZ 3.61Å; D326-R355 IonicContact OD1-NE 2.82Å; D326-R355 PolarHBondContact OD1-NE 3.44Å; D326-R355 IonicContact OD1-NH2 3.86Å; D326-R355 PolarHBondContact OD1-NH2 3.32Å; D326-R355 IonicContact OD2-CZ 3.38Å; D326-R355 IonicContact OD2-NH2 3.18Å; D326-R355 PolarHBondContact OD2-NH2 3Å
327	V	80.8	Confident	84	Confident	31 Å²	31	24.4 Å²	24.4	19%	0.188	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-61.6	-30.1	167.4	177.4	0	0	0	0	110.6	T325	T325-V327 PolarHBondContact O-N 3.1Å
328	M	81.7	Confident	84.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-95.6	0.5	178	-59.2	-55.6	-62.9	0	0	114.1	F273 I299 F311 L322 C324 T325 D326 I332 I334 R358	F273-M328 HydrophobicContact CE1-CB 4.16Å; F273-M328 HydrophobicContact CZ-CB 4.42Å; I299-M328 HydrophobicContact CB-CG 4.21Å; I299-M328 HydrophobicContact CB-SD 4.36Å; I299-M328 HydrophobicContact CD1-CE 4.32Å; I299-M328 HydrophobicContact CD1-SD 4.09Å; I299-M328 HydrophobicContact CG2-CG 3.82Å; I299-M328 HydrophobicContact CG2-SD 3.64Å; F311-M328 HydrophobicContact CD2-CE 3.63Å; F311-M328 HydrophobicContact CE2-CE 4.02Å; L322-M328 HydrophobicContact CD2-CE 4.04Å; C324-M328 HydrophobicContact CB-CB 3.85Å; C324-M328 HydrophobicContact CB-CG 3.52Å; T325-M328 PolarHBondContact O-N 2.94Å; D326-M328 PolarHBondContact O-N 3.22Å; M328-I332 HydrophobicContact CE-CB 4.42Å; M328-I332 HydrophobicContact CE-CD1 3.43Å; M328-I332 VanDerWaalsContact CE-CD1 3.43Å; M328-I332 HydrophobicContact CE-CG2 3.85Å; M328-I332 HydrophobicContact SD-CD1 3.41Å; M328-I332 WeakPolarHBondContact SD-CD1 3.42Å; M328-I334 HydrophobicContact CE-CD1 3.97Å; M328-R358 WeakPolarHBondContact O-CD 3.43Å
329	A	69.9	Low	84.3	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	-78.9	-20.9	-173.5	0	0	0	0	0	113.7	F273 D326 H354 R355 R358	F273-A329 HydrophobicContact CE1-CB 3.8Å; F273-A329 HydrophobicContact CZ-CB 4.15Å; D326-A329 HydrophobicContact CB-CB 4.26Å; D326-A329 WeakPolarHBondContact O-CB 3.36Å; D326-A329 PolarHBondContact O-N 3.39Å; A329-H354 CarbonylContact O-C 3.5Å; A329-H354 WeakPolarHBondContact O-CB 3.49Å; A329-R355 HydrophobicContact CB-CG 3.61Å; A329-R358 PolarHBondContact O-NE 2.66Å; A329-R358 PolarHBondContact O-NH2 3.17Å
330	R	73	Confident	84.5	Confident	3 Å²	3	18.4 Å²	18.4	1%	0.011	10%	0.1	C	C	.	.	S	Bend	trans	-132.7	147.6	-169.3	-74.7	-175.3	170	122.2	-20.8	111.9	E172 D178 I332 S350 H354	E172-R330 WeakPolarHBondContact OE2-CB 2.83Å; D178-R330 IonicContact OD2-CZ 2.85Å; D178-R330 IonicContact OD2-NH1 3.88Å; D178-R330 PolarHBondContact OD2-NH1 3.31Å; D178-R330 IonicContact OD2-NH2 3.06Å; D178-R330 PolarHBondContact OD2-NH2 3.49Å; R330-I332 WeakPolarHBondContact O-CG1 3.45Å; R330-I332 PolarHBondContact O-N 3.27Å; R330-S350 PolarHBondContact NH2-OG 3.26Å; R330-H354 HydrophobicContact CG-CB 3.52Å; R330-H354 PolarHBondContact NE-CD2 3.38Å; R330-H354 PolarHBondContact NE-NE2 3.14Å; R330-H354 PolarHBondContact NH2-CD2 2.76Å; R330-H354 PolarHBondContact NH2-NE2 3.2Å; R330-H354 VanDerWaalsContact NH2-NE2 3.11Å
331	G	63	Low	84.6	Confident	11 Å²	11	18.4 Å²	18.4	11%	0.113	10%	0.1	C	C	.	.	S	Bend	trans	73.8	-42.2	172.7	0	0	0	0	0	117.5	L94 Q97 E172 D333 R358	L94-G331 WeakPolarHBondContact CD1-O 3.33Å; Q97-G331 PolarHBondContact OE1-O 3.4Å; E172-G331 WeakPolarHBondContact OE1-CA 3.36Å; E172-G331 PolarHBondContact OE1-N 3.37Å; E172-G331 PolarHBondContact OE2-N 3.3Å; G331-D333 PolarHBondContact O-N 2.81Å; G331-R358 VanDerWaalsContact C-NH1 3.32Å
332	I	73.3	Confident	84.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.			trans	-70.3	131.3	-168.4	-58.6	178.1	0	0	0	112.1	E93 F311 M328 R330 I334 R358 R361	E93-I332 HydrophobicContact CB-CD1 3.42Å; E93-I332 VanDerWaalsContact CB-CD1 3.42Å; E93-I332 HydrophobicContact CB-CG1 3.65Å; E93-I332 HydrophobicContact CG-CD1 3.7Å; E93-I332 HydrophobicContact CG-CG1 4.47Å; F311-I332 HydrophobicContact CD2-CG2 3.98Å; F311-I332 HydrophobicContact CE1-CG2 4.39Å; F311-I332 HydrophobicContact CE2-CG2 3.06Å; F311-I332 HydrophobicContact CZ-CG2 3.32Å; M328-I332 HydrophobicContact CE-CB 4.42Å; M328-I332 HydrophobicContact CE-CD1 3.43Å; M328-I332 VanDerWaalsContact CE-CD1 3.43Å; M328-I332 HydrophobicContact CE-CG2 3.85Å; M328-I332 HydrophobicContact SD-CD1 3.41Å; M328-I332 WeakPolarHBondContact SD-CD1 3.42Å; R330-I332 WeakPolarHBondContact O-CG1 3.45Å; R330-I332 PolarHBondContact O-N 3.27Å; I332-I334 HydrophobicContact CG2-CD1 4.38Å; I332-I334 HydrophobicContact CG2-CG1 4.03Å; I332-R358 PolarHBondContact O-NH1 3.06Å; I332-R361 PolarHBondContact O-NH1 3.28Å; I332-R361 PolarHBondContact O-NH2 2.89Å
333	D	71	Confident	84.5	Confident	44 Å²	44	18.6 Å²	18.6	24%	0.235	10%	0.101	C	C	.	.			trans	-97.6	106.2	176.1	-163.9	40.9	0	0	0	112.6	Q97 G331 R361	Q97-D333 VanDerWaalsContact NE2-CB 3.26Å; G331-D333 PolarHBondContact O-N 2.81Å; D333-R361 VanDerWaalsContact CA-NH1 3.25Å; D333-R361 IonicContact OD1-CZ 3.1Å; D333-R361 IonicContact OD1-NH1 2.8Å; D333-R361 PolarHBondContact OD1-NH1 3.41Å
334	I	78.4	Confident	84.4	Confident	4 Å²	4	18.8 Å²	18.8	2%	0.021	10%	0.101	C	C	.	.			trans	-112.8	110.8	173.7	-59.4	171.8	0	0	0	105.2	K269 L271 F311 F314 L322 M328 I332 V337	K269-I334 HydrophobicContact CD-CG2 4.44Å; L271-I334 HydrophobicContact CD1-CD1 4.14Å; L271-I334 HydrophobicContact CD2-CD1 3.85Å; F311-I334 HydrophobicContact CE2-CD1 4.4Å; F311-I334 HydrophobicContact CE2-CG1 3.92Å; F314-I334 HydrophobicContact CD1-CD1 4.07Å; F314-I334 HydrophobicContact CD1-CG2 4.01Å; F314-I334 HydrophobicContact CE1-CD1 4.1Å; F314-I334 HydrophobicContact CE1-CG2 3.81Å; L322-I334 HydrophobicContact CD2-CD1 4.27Å; M328-I334 HydrophobicContact CE-CD1 3.97Å; I332-I334 HydrophobicContact CG2-CD1 4.38Å; I332-I334 HydrophobicContact CG2-CG1 4.03Å; I334-V337 HydrophobicContact CB-CG2 3.79Å; I334-V337 HydrophobicContact CG2-CG2 3.5Å; I334-V337 VanDerWaalsContact CG2-CG2 3.5Å
335	P	76.1	Confident	84.3	Confident	50 Å²	50	19 Å²	19	33%	0.325	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	145.6	178.2	27.4	-32.3	0	0	0	109.7	K269 R315 V337	K269-P335 PolarHBondContact NZ-O 2.89Å; R315-P335 HydrophobicContact CG-CG 4.27Å; P335-V337 PolarHBondContact O-N 3.14Å
336	E	78.4	Confident	84.2	Confident	100 Å²	100	18.5 Å²	18.5	47%	0.467	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	38.3	165.5	-57.6	169.8	165.1	0	0	114.4	K269 N338	K269-E336 WeakPolarHBondContact CB-O 3.41Å; E336-N338 PolarHBondContact O-N 3.08Å
337	V	89.8	Confident	84.2	Confident	7 Å²	7	19.2 Å²	19.2	4%	0.042	11%	0.107	C	C	.	.			trans	-71.1	120.6	168.1	179.9	0	0	0	0	108.3	L271 I334 P335 W339 V340 T359	L271-V337 HydrophobicContact CB-CG1 4.46Å; L271-V337 HydrophobicContact CD1-CG1 3.95Å; L271-V337 HydrophobicContact CD1-CG2 3.88Å; L271-V337 HydrophobicContact CG-CG1 4.08Å; L271-V337 HydrophobicContact CG-CG2 4.29Å; I334-V337 HydrophobicContact CB-CG2 3.79Å; I334-V337 HydrophobicContact CG2-CG2 3.5Å; I334-V337 VanDerWaalsContact CG2-CG2 3.5Å; P335-V337 PolarHBondContact O-N 3.14Å; V337-W339 WeakPolarHBondContact CG1-O 3.26Å; V337-V340 HydrophobicContact CG1-CG2 4.17Å; V337-T359 WeakPolarHBondContact O-CB 3.17Å; V337-T359 PolarHBondContact O-OG1 2.99Å
338	N	92.4	Very high	84.3	Confident	64 Å²	64	19.2 Å²	19.2	34%	0.342	11%	0.106	S	C	.	.			trans	-81	-44.2	175.7	-56.4	95.7	0	0	0	111	E268 K269 E336 T359 S367	E268-N338 HydrophobicContact CB-CB 3.9Å; E268-N338 HydrophobicContact CG-CB 4.16Å; K269-N338 PolarHBondContact N-OD1 3.07Å; K269-N338 PolarHBondContact O-N 3.23Å; E336-N338 PolarHBondContact O-N 3.08Å; N338-T359 PolarHBondContact O-OG1 3.11Å; N338-S367 PolarHBondContact O-N 3.26Å
339	W	94.6	Very high	84.4	Confident	29 Å²	29	19.3 Å²	19.3	11%	0.11	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.7	-173.2	-76.2	92.7	0	0	0	113.8	Y245 F261 H265 E268 K269 H270 L271 V337 L341 S367 L369	Y245-W339 AromaticContact CD2-CH2 3.95Å; Y245-W339 HydrophobicContact CD2-CH2 3.95Å; Y245-W339 AromaticContact CD2-CZ3 3.88Å; Y245-W339 HydrophobicContact CD2-CZ3 3.88Å; Y245-W339 AromaticContact CE2-CH2 3.95Å; Y245-W339 HydrophobicContact CE2-CH2 3.95Å; Y245-W339 HydrophobicContact CE2-CZ3 4.29Å; F261-W339 HydrophobicContact CE1-CD2 4.14Å; F261-W339 HydrophobicContact CE1-CE3 4.42Å; F261-W339 HydrophobicContact CE1-CG 4.16Å; F261-W339 HydrophobicContact CE2-CD2 4.5Å; F261-W339 HydrophobicContact CE2-CE3 4.38Å; F261-W339 HydrophobicContact CE2-CH2 4.23Å; F261-W339 HydrophobicContact CE2-CZ2 4.33Å; F261-W339 HydrophobicContact CE2-CZ3 4.24Å; F261-W339 AromaticContact CZ-CD2 3.48Å; F261-W339 HydrophobicContact CZ-CD2 3.48Å; F261-W339 VanDerWaalsContact CZ-CD2 3.48Å; F261-W339 AromaticContact CZ-CE2 3.63Å; F261-W339 AromaticContact CZ-CE3 3.64Å; F261-W339 HydrophobicContact CZ-CE3 3.64Å; F261-W339 AromaticContact CZ-CG 3.96Å; F261-W339 HydrophobicContact CZ-CG 3.96Å; F261-W339 HydrophobicContact CZ-CH2 4.09Å; F261-W339 AromaticContact CZ-CZ2 3.94Å; F261-W339 HydrophobicContact CZ-CZ2 3.94Å; F261-W339 AromaticContact CZ-CZ3 3.94Å; F261-W339 HydrophobicContact CZ-CZ3 3.94Å; H265-W339 AromaticContact ND1-NE1 3.84Å; E268-W339 PolarHBondContact OE2-NE1 2.96Å; K269-W339 PolarHBondContact O-N 3.18Å; H270-W339 WeakPolarHBondContact CA-O 3.21Å; H270-W339 AromaticContact CE1-CD1 3.77Å; H270-W339 WeakPolarHBondContact ND1-CB 3.4Å; L271-W339 PolarHBondContact N-O 3.46Å; V337-W339 WeakPolarHBondContact CG1-O 3.26Å; W339-L341 HydrophobicContact CB-CD2 4.21Å; W339-L341 HydrophobicContact CE3-CD2 4.05Å; W339-S367 CarbonylContact C-O 3.58Å; W339-S367 VanDerWaalsContact CA-O 3.26Å; W339-S367 WeakPolarHBondContact CA-O 3.27Å; W339-S367 VanDerWaalsContact CE3-CB 3.47Å; W339-S367 VanDerWaalsContact CH2-CB 3.45Å; W339-L369 HydrophobicContact CE3-CB 4.45Å; W339-L369 HydrophobicContact CZ3-CB 4.23Å
340	V	95	Very high	84.9	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	106	166.3	179.1	0	0	0	0	109.4	L271 F273 V337 Q342 R355 R358 T359 S367 A368 L369	L271-V340 HydrophobicContact CB-CG2 4.47Å; L271-V340 HydrophobicContact CD1-CG2 4.48Å; L271-V340 CarbonylContact O-C 3.59Å; F273-V340 HydrophobicContact CD2-CG1 3.76Å; F273-V340 HydrophobicContact CE2-CG1 3.68Å; V337-V340 HydrophobicContact CG1-CG2 4.17Å; V340-Q342 HydrophobicContact CG1-CG 4.27Å; V340-R355 HydrophobicContact CG1-CB 4.4Å; V340-R355 WeakPolarHBondContact CG1-O 3.2Å; V340-R358 HydrophobicContact CG2-CB 3.87Å; V340-T359 HydrophobicContact CG2-CG2 3.81Å; V340-S367 PolarHBondContact N-O 2.91Å; V340-A368 HydrophobicContact CB-CB 4.13Å; V340-A368 CarbonylContact O-C 3.56Å; V340-A368 VanDerWaalsContact O-CA 3.22Å; V340-A368 WeakPolarHBondContact O-CA 3.41Å; V340-L369 PolarHBondContact O-N 3.2Å
341	L	96.6	Very high	85.4	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	113.9	178.6	-51.5	-176.5	0	0	0	109.7	L258 F261 L262 L271 V272 F273 W339 Y343 L369 F371	L258-L341 HydrophobicContact CD1-CB 4.42Å; L258-L341 HydrophobicContact CD1-CD1 3.72Å; F261-L341 HydrophobicContact CD1-CD1 3.55Å; F261-L341 HydrophobicContact CD1-CD2 4Å; F261-L341 HydrophobicContact CD1-CG 4.43Å; F261-L341 HydrophobicContact CE1-CD1 3.75Å; F261-L341 HydrophobicContact CE1-CD2 3.57Å; F261-L341 HydrophobicContact CE1-CG 4.22Å; F261-L341 HydrophobicContact CZ-CD2 3.96Å; L262-L341 HydrophobicContact CD2-CD1 3.62Å; L262-L341 HydrophobicContact CG-CD1 4.17Å; L271-L341 PolarHBondContact O-N 3.4Å; V272-L341 CarbonylContact C-O 3.56Å; V272-L341 VanDerWaalsContact CA-O 3.29Å; V272-L341 WeakPolarHBondContact CA-O 3.29Å; V272-L341 HydrophobicContact CG1-CB 4.25Å; V272-L341 HydrophobicContact CG2-CB 4.24Å; V272-L341 HydrophobicContact CG2-CD1 4.15Å; F273-L341 PolarHBondContact N-O 2.78Å; W339-L341 HydrophobicContact CB-CD2 4.21Å; W339-L341 HydrophobicContact CE3-CD2 4.05Å; L341-Y343 PolarHBondContact O-N 3.47Å; L341-L369 CarbonylContact C-O 3.56Å; L341-L369 HydrophobicContact CD2-CB 3.83Å; L341-L369 HydrophobicContact CD2-CD2 4.14Å; L341-F371 HydrophobicContact CB-CE2 4.5Å
342	Q	95.6	Very high	86.6	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	86.4	175.1	-55	-170.8	58.4	0	0	108.3	V340 D344 R355 L369 V370 F371	V340-Q342 HydrophobicContact CG1-CG 4.27Å; Q342-D344 VanDerWaalsContact C-N 3.3Å; Q342-R355 HydrophobicContact CG-CB 4.41Å; Q342-L369 PolarHBondContact N-O 3.43Å; Q342-V370 HydrophobicContact CB-CB 4.15Å; Q342-V370 HydrophobicContact CB-CG2 4.08Å; Q342-F371 PolarHBondContact O-N 3.28Å
343	Y	95.9	Very high	87	Confident	6 Å²	6	19.7 Å²	19.7	2%	0.024	11%	0.108	C	C	.	.	S	Bend	trans	-61.3	-44.7	178.8	-175	-96.7	0	0	0	110.3	K254 F255 L258 F273 F274 Y283 L341	K254-Y343 HydrophobicContact CB-CE2 4.49Å; K254-Y343 HydrophobicContact CD-CE1 4.43Å; K254-Y343 HydrophobicContact CD-CE2 4.29Å; K254-Y343 WeakPolarHBondContact CE-O 3.49Å; K254-Y343 HydrophobicContact CG-CD2 4.33Å; K254-Y343 HydrophobicContact CG-CE2 3.63Å; K254-Y343 PolarHBondContact NZ-O 3.06Å; F255-Y343 HydrophobicContact CB-CE2 4.44Å; F255-Y343 HydrophobicContact CD2-CE2 4.23Å; L258-Y343 HydrophobicContact CB-CD2 4.09Å; L258-Y343 HydrophobicContact CB-CE2 4.16Å; L258-Y343 HydrophobicContact CD2-CD2 3.58Å; L258-Y343 HydrophobicContact CD2-CE2 4Å; L258-Y343 HydrophobicContact CD2-CG 4.32Å; L258-Y343 HydrophobicContact CG-CD2 4.29Å; F273-Y343 WeakPolarHBondContact O-CB 3.34Å; F273-Y343 PolarHBondContact O-N 3.22Å; F274-Y343 AromaticContact CD1-CD1 3.55Å; F274-Y343 HydrophobicContact CD1-CD1 3.55Å; F274-Y343 HydrophobicContact CD1-CE1 4.3Å; F274-Y343 HydrophobicContact CD1-CG 4.08Å; F274-Y343 AromaticContact CE1-CD1 3.18Å; F274-Y343 HydrophobicContact CE1-CD1 3.18Å; F274-Y343 HydrophobicContact CE1-CD2 4.31Å; F274-Y343 AromaticContact CE1-CE1 3.76Å; F274-Y343 HydrophobicContact CE1-CE1 3.76Å; F274-Y343 AromaticContact CE1-CG 3.49Å; F274-Y343 HydrophobicContact CE1-CG 3.49Å; F274-Y343 VanDerWaalsContact CE1-CG 3.49Å; F274-Y343 HydrophobicContact CZ-CD1 4.1Å; F274-Y343 AromaticContact CZ-CG 3.95Å; F274-Y343 HydrophobicContact CZ-CG 3.95Å; Y283-Y343 HydrophobicContact CE2-CE1 4.11Å; Y283-Y343 PolarHBondContact OH-OH 3.47Å; L341-Y343 PolarHBondContact O-N 3.47Å
344	D	93.1	Very high	87.5	Confident	3 Å²	3	17.6 Å²	17.6	2%	0.016	10%	0.097	C	C	.	.	S	Bend	trans	-107.6	134.4	171.2	-57.7	-40.6	0	0	0	110.1	K254 F273 S275 Q342 R355 Y428	K254-D344 IonicContact NZ-OD1 3.83Å; F273-D344 PolarHBondContact O-N 3.27Å; S275-D344 PolarHBondContact N-OD2 2.88Å; S275-D344 WeakPolarHBondContact OG-CB 3.46Å; Q342-D344 VanDerWaalsContact C-N 3.3Å; D344-R355 PolarHBondContact O-NH1 3.28Å; D344-Y428 HydrophobicContact CB-CE2 4.48Å; D344-Y428 VanDerWaalsContact OD1-CE2 3.28Å; D344-Y428 WeakPolarHBondContact OD1-CE2 3.29Å
345	P	92.4	Very high	88	Confident	6 Å²	6	17.4 Å²	17.4	4%	0.039	10%	0.096	C	C	.	.			trans	-53.4	139.2	169.3	-28.7	38.8	0	0	0	111.2	S275 V370 L372 Y379 F441	S275-P345 PolarHBondContact OG-O 3.44Å; P345-V370 HydrophobicContact CG-CG2 4.32Å; P345-L372 HydrophobicContact CG-CD2 3.62Å; P345-Y379 HydrophobicContact CB-CE1 4.11Å; P345-F441 HydrophobicContact CB-CE1 3.88Å; P345-F441 HydrophobicContact CB-CZ 3.69Å; P345-F441 HydrophobicContact CG-CE1 3.85Å; P345-F441 HydrophobicContact CG-CZ 4.05Å
346	P	90.6	Very high	88.5	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.			trans	-66.7	143	180	24	-28.7	0	0	0	111.4	N348 A351 F352 R355 H435	P346-N348 PolarHBondContact O-N 3.5Å; P346-A351 HydrophobicContact CB-CB 3.8Å; P346-F352 HydrophobicContact CG-CB 3.67Å; P346-F352 HydrophobicContact CG-CD2 3.99Å; P346-F352 HydrophobicContact CG-CG 4.35Å; P346-R355 VanDerWaalsContact CB-CZ 3.46Å; P346-H435 PolarHBondContact O-CE1 2.9Å; P346-H435 PolarHBondContact O-NE2 3.44Å
347	S	85.8	Confident	88.5	Confident	45 Å²	45	10.3 Å²	10.3	32%	0.315	6%	0.058	S	C	.	.	S	Bend	trans	-57.9	-23.6	-179.5	-56.3	0	0	0	0	114.7	E436	S347-E436 VanDerWaalsContact O-CB 3.22Å; S347-E436 WeakPolarHBondContact O-CB 3.31Å; S347-E436 PolarHBondContact O-N 3.2Å
348	N	83.4	Confident	88.3	Confident	32 Å²	32	10.2 Å²	10.2	17%	0.171	6%	0.057	C	C	.	.	S	Bend	trans	-129.2	151.8	174	68.8	11.7	0	0	0	112	D178 P346 S350 A351 E436	D178-N348 PolarHBondContact OD2-ND2 3.08Å; P346-N348 PolarHBondContact O-N 3.5Å; N348-S350 VanDerWaalsContact C-N 3.3Å; N348-S350 PolarHBondContact ND2-OG 3.32Å; N348-S350 PolarHBondContact O-N 3Å; N348-S350 PolarHBondContact OD1-OG 3.15Å; N348-A351 PolarHBondContact O-N 3.37Å; N348-A351 WeakPolarHBondContact OD1-CA 3.34Å; N348-A351 WeakPolarHBondContact OD1-CB 3.35Å; N348-A351 PolarHBondContact OD1-N 3.42Å; N348-E436 WeakPolarHBondContact CA-OE2 3.47Å; N348-E436 WeakPolarHBondContact CB-OE2 3.47Å
349	A	84.1	Confident	88	Confident	2 Å²	2	7.2 Å²	7.2	2%	0.017	4%	0.041	C	C	.	.	H	α-helix	trans	-66.1	-33.4	-175.8	0	0	0	0	0	112.6	F352 F382 Q387 E436	A349-F352 VanDerWaalsContact O-CB 3.25Å; A349-F352 WeakPolarHBondContact O-CB 3.31Å; A349-F352 PolarHBondContact O-N 3.21Å; A349-F382 HydrophobicContact CB-CE1 3.62Å; A349-F382 HydrophobicContact CB-CZ 4.16Å; A349-Q387 HydrophobicContact CB-CG 3.93Å; A349-E436 PolarHBondContact N-OE2 3.1Å
350	S	79.6	Confident	87.3	Confident	15 Å²	15	6.3 Å²	6.3	11%	0.105	4%	0.04	C	C	.	.	H	α-helix	trans	-64.9	-43.1	178.3	57	0	0	0	0	111.4	R330 N348 F352 V353 H354	R330-S350 PolarHBondContact NH2-OG 3.26Å; N348-S350 VanDerWaalsContact C-N 3.3Å; N348-S350 PolarHBondContact ND2-OG 3.32Å; N348-S350 PolarHBondContact O-N 3Å; N348-S350 PolarHBondContact OD1-OG 3.15Å; S350-F352 PolarHBondContact O-N 3.18Å; S350-F352 VanDerWaalsContact O-N 3.13Å; S350-V353 PolarHBondContact O-N 3.07Å; S350-H354 VanDerWaalsContact C-CD2 3.44Å; S350-H354 PolarHBondContact O-CD2 3.05Å; S350-H354 PolarHBondContact O-N 3.33Å
351	A	83.6	Confident	86.3	Confident	1 Å²	1	7.5 Å²	7.5	1%	0.008	4%	0.044	C	C	.	.	H	α-helix	trans	-58.7	-27.4	177.6	0	0	0	0	0	113	P346 N348 V353 H354 R355	P346-A351 HydrophobicContact CB-CB 3.8Å; N348-A351 PolarHBondContact O-N 3.37Å; N348-A351 WeakPolarHBondContact OD1-CA 3.34Å; N348-A351 WeakPolarHBondContact OD1-CB 3.35Å; N348-A351 PolarHBondContact OD1-N 3.42Å; A351-V353 PolarHBondContact O-N 2.6Å; A351-H354 PolarHBondContact O-N 3.01Å; A351-R355 WeakPolarHBondContact O-CB 3.49Å; A351-R355 VanDerWaalsContact O-CG 3.25Å; A351-R355 WeakPolarHBondContact O-CG 3.44Å; A351-R355 PolarHBondContact O-N 2.65Å
352	F	88.1	Confident	84.8	Confident	1 Å²	1	13 Å²	13	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-55.3	-52	172.8	-170.7	-86.7	0	0	0	111.7	P346 A349 S350 H354 R355 C356 V370 Y379 L383 L391	P346-F352 HydrophobicContact CG-CB 3.67Å; P346-F352 HydrophobicContact CG-CD2 3.99Å; P346-F352 HydrophobicContact CG-CG 4.35Å; A349-F352 VanDerWaalsContact O-CB 3.25Å; A349-F352 WeakPolarHBondContact O-CB 3.31Å; A349-F352 PolarHBondContact O-N 3.21Å; S350-F352 PolarHBondContact O-N 3.18Å; S350-F352 VanDerWaalsContact O-N 3.13Å; F352-H354 VanDerWaalsContact C-N 3.28Å; F352-H354 PolarHBondContact O-N 3.47Å; F352-R355 PolarHBondContact O-N 3.46Å; F352-C356 PolarHBondContact O-N 3.1Å; F352-C356 PolarHBondContact O-SG 2.84Å; F352-C356 VanDerWaalsContact O-SG 3.4Å; F352-V370 HydrophobicContact CE2-CB 3.85Å; F352-V370 HydrophobicContact CE2-CG1 3.95Å; F352-V370 HydrophobicContact CE2-CG2 4.12Å; F352-V370 HydrophobicContact CZ-CB 4.41Å; F352-V370 HydrophobicContact CZ-CG1 4.22Å; F352-Y379 HydrophobicContact CD2-CE1 4.42Å; F352-L383 HydrophobicContact CB-CD2 4.03Å; F352-L383 HydrophobicContact CD1-CD1 4.06Å; F352-L383 HydrophobicContact CD1-CD2 4.18Å; F352-L383 HydrophobicContact CD2-CD1 3.74Å; F352-L383 HydrophobicContact CD2-CD2 4.41Å; F352-L383 HydrophobicContact CE1-CD1 4.03Å; F352-L383 HydrophobicContact CE2-CD1 3.68Å; F352-L383 HydrophobicContact CG-CD1 3.93Å; F352-L383 HydrophobicContact CG-CD2 3.94Å; F352-L383 HydrophobicContact CZ-CD1 3.85Å; F352-L391 HydrophobicContact CE1-CD2 4.26Å; F352-L391 HydrophobicContact CZ-CD1 4.39Å; F352-L391 HydrophobicContact CZ-CD2 3.76Å
353	V	82.6	Confident	83.4	Confident	5 Å²	5	14.2 Å²	14.2	3%	0.03	9%	0.085	C	C	.	.	H	α-helix	trans	-62.1	-38.1	-179.7	-178.7	0	0	0	0	110.9	K237 T238 S350 A351 C356 G357 Q387	K237-V353 HydrophobicContact CB-CG1 4.08Å; K237-V353 WeakPolarHBondContact O-CG1 3.22Å; T238-V353 HydrophobicContact CG2-CG1 4.35Å; S350-V353 PolarHBondContact O-N 3.07Å; A351-V353 PolarHBondContact O-N 2.6Å; V353-C356 VanDerWaalsContact CA-SG 3.55Å; V353-C356 PolarHBondContact O-SG 3.37Å; V353-G357 PolarHBondContact O-N 2.86Å; V353-Q387 HydrophobicContact CG2-CB 3.9Å; V353-Q387 HydrophobicContact CG2-CG 4.25Å
354	H	81.6	Confident	82.3	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-73.8	-38.6	-179.7	-58	-79.8	0	0	0	113.2	D174 A329 R330 S350 A351 F352 G357 R358	D174-H354 IonicContact OD2-CE1 3.16Å; D174-H354 PolarHBondContact OD2-CE1 2.9Å; D174-H354 IonicContact OD2-NE2 3.49Å; A329-H354 CarbonylContact O-C 3.5Å; A329-H354 WeakPolarHBondContact O-CB 3.49Å; R330-H354 HydrophobicContact CG-CB 3.52Å; R330-H354 PolarHBondContact NE-CD2 3.38Å; R330-H354 PolarHBondContact NE-NE2 3.14Å; R330-H354 PolarHBondContact NH2-CD2 2.76Å; R330-H354 PolarHBondContact NH2-NE2 3.2Å; R330-H354 VanDerWaalsContact NH2-NE2 3.11Å; S350-H354 VanDerWaalsContact C-CD2 3.44Å; S350-H354 PolarHBondContact O-CD2 3.05Å; S350-H354 PolarHBondContact O-N 3.33Å; A351-H354 PolarHBondContact O-N 3.01Å; F352-H354 VanDerWaalsContact C-N 3.28Å; F352-H354 PolarHBondContact O-N 3.47Å; H354-G357 CarbonylContact O-C 3.58Å; H354-G357 PolarHBondContact O-N 3.16Å; H354-R358 PolarHBondContact O-N 2.83Å; H354-R358 PolarHBondContact O-NE 3.04Å
355	R	88.2	Confident	81.8	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-54.4	173.3	-75.7	175.1	179.4	-169.3	3.4	109.5	F273 D326 A329 V340 Q342 D344 P346 A351 F352 G357 R358	F273-R355 HydrophobicContact CD1-CG 4.07Å; F273-R355 HydrophobicContact CD2-CB 4.18Å; F273-R355 HydrophobicContact CD2-CG 3.96Å; F273-R355 HydrophobicContact CE1-CG 4.08Å; F273-R355 HydrophobicContact CE2-CB 4.04Å; F273-R355 HydrophobicContact CE2-CG 3.96Å; F273-R355 HydrophobicContact CG-CG 4.02Å; F273-R355 HydrophobicContact CZ-CB 4.45Å; F273-R355 HydrophobicContact CZ-CG 4.03Å; D326-R355 IonicContact OD1-CZ 3.61Å; D326-R355 IonicContact OD1-NE 2.82Å; D326-R355 PolarHBondContact OD1-NE 3.44Å; D326-R355 IonicContact OD1-NH2 3.86Å; D326-R355 PolarHBondContact OD1-NH2 3.32Å; D326-R355 IonicContact OD2-CZ 3.38Å; D326-R355 IonicContact OD2-NH2 3.18Å; D326-R355 PolarHBondContact OD2-NH2 3Å; A329-R355 HydrophobicContact CB-CG 3.61Å; V340-R355 HydrophobicContact CG1-CB 4.4Å; V340-R355 WeakPolarHBondContact CG1-O 3.2Å; Q342-R355 HydrophobicContact CG-CB 4.41Å; D344-R355 PolarHBondContact O-NH1 3.28Å; P346-R355 VanDerWaalsContact CB-CZ 3.46Å; A351-R355 WeakPolarHBondContact O-CB 3.49Å; A351-R355 VanDerWaalsContact O-CG 3.25Å; A351-R355 WeakPolarHBondContact O-CG 3.44Å; A351-R355 PolarHBondContact O-N 2.65Å; F352-R355 PolarHBondContact O-N 3.46Å; R355-G357 VanDerWaalsContact C-N 3.27Å; R355-G357 PolarHBondContact O-N 3.16Å; R355-R358 VanDerWaalsContact O-CB 3.26Å; R355-R358 WeakPolarHBondContact O-CB 3.41Å; R355-R358 VanDerWaalsContact O-CG 3.26Å; R355-R358 WeakPolarHBondContact O-CG 3.19Å; R355-R358 PolarHBondContact O-N 3.49Å
356	C	86.4	Confident	81.6	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.8	-33.1	-178.1	76.1	0	0	0	0	111.7	L242 F352 V353 R358 T359 A368	L242-C356 HydrophobicContact CD2-CB 3.74Å; L242-C356 VanDerWaalsContact CD2-SG 3.53Å; F352-C356 PolarHBondContact O-N 3.1Å; F352-C356 PolarHBondContact O-SG 2.84Å; F352-C356 VanDerWaalsContact O-SG 3.4Å; V353-C356 VanDerWaalsContact CA-SG 3.55Å; V353-C356 PolarHBondContact O-SG 3.37Å; C356-R358 PolarHBondContact O-N 3.04Å; C356-T359 WeakPolarHBondContact O-CG2 3.37Å; C356-T359 PolarHBondContact O-N 3.37Å; C356-A368 HydrophobicContact CB-CB 3.69Å
357	G	80.3	Confident	81.7	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	14.2	169.9	0	0	0	0	0	116.2	T55 V353 H354 R355 R361	T55-G357 WeakPolarHBondContact OG1-CA 3.26Å; V353-G357 PolarHBondContact O-N 2.86Å; H354-G357 CarbonylContact O-C 3.58Å; H354-G357 PolarHBondContact O-N 3.16Å; R355-G357 VanDerWaalsContact C-N 3.27Å; R355-G357 PolarHBondContact O-N 3.16Å; G357-R361 PolarHBondContact O-NE 3.44Å; G357-R361 VanDerWaalsContact O-NE 3.09Å; G357-R361 PolarHBondContact O-NH2 3.11Å
358	R	85.2	Confident	82.1	Confident	5 Å²	5	20.7 Å²	20.7	2%	0.019	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-18.1	164.8	-64.8	-53.9	102.1	174.2	6.8	112.9	L271 F273 M328 A329 G331 I332 V340 H354 R355 C356 R361	L271-R358 HydrophobicContact CD1-CB 3.46Å; L271-R358 VanDerWaalsContact CD1-CB 3.46Å; L271-R358 HydrophobicContact CD1-CG 3.9Å; F273-R358 HydrophobicContact CE2-CG 4.48Å; F273-R358 HydrophobicContact CZ-CG 4.25Å; M328-R358 WeakPolarHBondContact O-CD 3.43Å; A329-R358 PolarHBondContact O-NE 2.66Å; A329-R358 PolarHBondContact O-NH2 3.17Å; G331-R358 VanDerWaalsContact C-NH1 3.32Å; I332-R358 PolarHBondContact O-NH1 3.06Å; V340-R358 HydrophobicContact CG2-CB 3.87Å; H354-R358 PolarHBondContact O-N 2.83Å; H354-R358 PolarHBondContact O-NE 3.04Å; R355-R358 VanDerWaalsContact O-CB 3.26Å; R355-R358 WeakPolarHBondContact O-CB 3.41Å; R355-R358 VanDerWaalsContact O-CG 3.26Å; R355-R358 WeakPolarHBondContact O-CG 3.19Å; R355-R358 PolarHBondContact O-N 3.49Å; C356-R358 PolarHBondContact O-N 3.04Å; R358-R361 VanDerWaalsContact NE-NH2 3.15Å
359	T	85.4	Confident	82.7	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.012	12%	0.12	C	C	.	.	S	Bend	trans	-109.7	-176.4	170.1	-175	0	0	0	0	110.1	L242 V337 N338 V340 C356 R361 G366	L242-T359 HydrophobicContact CD1-CG2 3.31Å; V337-T359 WeakPolarHBondContact O-CB 3.17Å; V337-T359 PolarHBondContact O-OG1 2.99Å; N338-T359 PolarHBondContact O-OG1 3.11Å; V340-T359 HydrophobicContact CG2-CG2 3.81Å; C356-T359 WeakPolarHBondContact O-CG2 3.37Å; C356-T359 PolarHBondContact O-N 3.37Å; T359-R361 PolarHBondContact O-N 3.28Å; T359-G366 WeakPolarHBondContact OG1-CA 3.38Å
360	A	80.4	Confident	83.3	Confident	9 Å²	9	19 Å²	19	7%	0.074	12%	0.119	C	C	.	.	S	Bend	trans	53.4	45.5	179.9	0	0	0	0	0	114.1	P239 L242 H364	P239-A360 HydrophobicContact CB-CB 4.14Å; L242-A360 HydrophobicContact CB-CB 3.81Å; L242-A360 HydrophobicContact CD1-CB 4.05Å; A360-H364 CarbonylContact C-O 3.46Å; A360-H364 VanDerWaalsContact CA-O 3.23Å; A360-H364 WeakPolarHBondContact CA-O 3.36Å
361	R	74.3	Confident	84	Confident	26 Å²	26	18.4 Å²	18.4	10%	0.098	11%	0.114	C	C	.	.			trans	-97.8	147.7	-177	-67.5	-171.5	170	-165.9	1.4	112.8	I332 D333 G357 R358 T359 G363 H364	I332-R361 PolarHBondContact O-NH1 3.28Å; I332-R361 PolarHBondContact O-NH2 2.89Å; D333-R361 VanDerWaalsContact CA-NH1 3.25Å; D333-R361 IonicContact OD1-CZ 3.1Å; D333-R361 IonicContact OD1-NH1 2.8Å; D333-R361 PolarHBondContact OD1-NH1 3.41Å; G357-R361 PolarHBondContact O-NE 3.44Å; G357-R361 VanDerWaalsContact O-NE 3.09Å; G357-R361 PolarHBondContact O-NH2 3.11Å; R358-R361 VanDerWaalsContact NE-NH2 3.15Å; T359-R361 PolarHBondContact O-N 3.28Å; R361-G363 PolarHBondContact O-N 3.06Å; R361-G363 VanDerWaalsContact O-N 3.15Å; R361-H364 WeakPolarHBondContact O-CB 3.29Å; R361-H364 PolarHBondContact O-N 3.39Å
362	I	65.4	Low	84.6	Confident	116 Å²	116	18.3 Å²	18.3	60%	0.595	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	43.9	172	-48.4	176.4	0	0	0	110.9	H364	I362-H364 VanDerWaalsContact C-N 3.31Å; I362-H364 PolarHBondContact O-N 3.34Å
363	G	64.8	Low	84.9	Confident	25 Å²	25	18.5 Å²	18.5	26%	0.258	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	-0.7	178.4	0	0	0	0	0	116.1	R241 R361	R241-G363 VanDerWaalsContact CD-O 3.28Å; R241-G363 WeakPolarHBondContact CD-O 3.32Å; R241-G363 PolarHBondContact NH1-O 3.38Å; R361-G363 PolarHBondContact O-N 3.06Å; R361-G363 VanDerWaalsContact O-N 3.15Å
364	H	73.1	Confident	85.3	Confident	116 Å²	116	21.5 Å²	21.5	54%	0.537	13%	0.134	S	C	.	.			trans	-73.1	152.7	168.2	-70.5	-86	0	0	0	111.4	A360 R361 I362	A360-H364 CarbonylContact C-O 3.46Å; A360-H364 VanDerWaalsContact CA-O 3.23Å; A360-H364 WeakPolarHBondContact CA-O 3.36Å; R361-H364 WeakPolarHBondContact O-CB 3.29Å; R361-H364 PolarHBondContact O-N 3.39Å; I362-H364 VanDerWaalsContact C-N 3.31Å; I362-H364 PolarHBondContact O-N 3.34Å
365	G	81.7	Confident	85.8	Confident	53 Å²	53	24.4 Å²	24.4	55%	0.546	15%	0.149	S	C	.	.			trans	-76.3	161.3	169.4	0	0	0	0	0	111.4
366	G	89.3	Confident	86	Confident	8 Å²	8	24.4 Å²	24.4	8%	0.082	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	154.6	-177.9	0	0	0	0	0	112.4	R241 L242 E243 T359	R241-G366 PolarHBondContact O-N 2.91Å; L242-G366 WeakPolarHBondContact CA-O 3.45Å; E243-G366 PolarHBondContact N-O 2.93Å; T359-G366 WeakPolarHBondContact OG1-CA 3.38Å
367	S	92.4	Very high	86.2	Confident	16 Å²	16	29.5 Å²	29.5	11%	0.112	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.5	-176.6	-51.9	0	0	0	0	110.9	E243 N338 W339 V340	E243-S367 CarbonylContact O-C 3.45Å; E243-S367 VanDerWaalsContact O-CA 3.3Å; E243-S367 WeakPolarHBondContact O-CA 3.33Å; N338-S367 PolarHBondContact O-N 3.26Å; W339-S367 CarbonylContact C-O 3.58Å; W339-S367 VanDerWaalsContact CA-O 3.26Å; W339-S367 WeakPolarHBondContact CA-O 3.27Å; W339-S367 VanDerWaalsContact CE3-CB 3.47Å; W339-S367 VanDerWaalsContact CH2-CB 3.45Å; V340-S367 PolarHBondContact N-O 2.91Å
368	A	94.4	Very high	86.7	Confident	2 Å²	2	33.1 Å²	33.1	2%	0.017	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.5	175.8	0	0	0	0	0	109.7	L242 E243 Y245 V340 C356	L242-A368 HydrophobicContact CD1-CB 4.3Å; E243-A368 PolarHBondContact O-N 3.42Å; Y245-A368 PolarHBondContact N-O 2.99Å; V340-A368 HydrophobicContact CB-CB 4.13Å; V340-A368 CarbonylContact O-C 3.56Å; V340-A368 VanDerWaalsContact O-CA 3.22Å; V340-A368 WeakPolarHBondContact O-CA 3.41Å; C356-A368 HydrophobicContact CB-CB 3.69Å
369	L	95.8	Very high	87.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.4	178.6	175	66.6	0	0	0	109.7	Y245 M247 F261 W339 V340 L341 Q342 F371 M394	Y245-L369 WeakPolarHBondContact O-CA 3.25Å; M247-L369 HydrophobicContact CB-CD1 4.05Å; F261-L369 HydrophobicContact CD2-CD2 4.3Å; F261-L369 HydrophobicContact CE2-CD2 4.38Å; W339-L369 HydrophobicContact CE3-CB 4.45Å; W339-L369 HydrophobicContact CZ3-CB 4.23Å; V340-L369 PolarHBondContact O-N 3.2Å; L341-L369 CarbonylContact C-O 3.56Å; L341-L369 HydrophobicContact CD2-CB 3.83Å; L341-L369 HydrophobicContact CD2-CD2 4.14Å; Q342-L369 PolarHBondContact N-O 3.43Å; L369-F371 HydrophobicContact CD2-CD2 4.48Å; L369-F371 HydrophobicContact CD2-CE1 4.22Å; L369-F371 HydrophobicContact CD2-CE2 3.7Å; L369-F371 HydrophobicContact CD2-CZ 3.55Å; L369-F371 HydrophobicContact CG-CD2 4.46Å; L369-F371 HydrophobicContact CG-CE2 4.09Å; L369-F371 HydrophobicContact CG-CZ 4.35Å; L369-M394 HydrophobicContact CD1-CB 4.28Å; L369-M394 HydrophobicContact CD1-CE 3.74Å; L369-M394 HydrophobicContact CD1-SD 4.38Å; L369-M394 HydrophobicContact CD2-CE 3.33Å; L369-M394 HydrophobicContact CG-CE 4.16Å
370	V	95.9	Very high	87.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.4	169.8	63.2	0	0	0	0	111.4	Y245 Y246 M247 Q342 P345 F352 L372 L391	Y245-V370 PolarHBondContact O-N 3.29Å; Y246-V370 CarbonylContact C-O 3.15Å; Y246-V370 WeakPolarHBondContact CA-O 3.4Å; M247-V370 PolarHBondContact N-O 3.12Å; Q342-V370 HydrophobicContact CB-CB 4.15Å; Q342-V370 HydrophobicContact CB-CG2 4.08Å; P345-V370 HydrophobicContact CG-CG2 4.32Å; F352-V370 HydrophobicContact CE2-CB 3.85Å; F352-V370 HydrophobicContact CE2-CG1 3.95Å; F352-V370 HydrophobicContact CE2-CG2 4.12Å; F352-V370 HydrophobicContact CZ-CB 4.41Å; F352-V370 HydrophobicContact CZ-CG1 4.22Å; V370-L372 HydrophobicContact CG1-CG 4.41Å; V370-L372 HydrophobicContact CG2-CD2 4.02Å; V370-L372 HydrophobicContact CG2-CG 4.37Å; V370-L391 HydrophobicContact CG1-CD2 4.32Å
371	F	95.8	Very high	87.8	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.3	174.7	-63.9	-99.6	0	0	0	109.9	M247 K254 Q257 L258 L341 Q342 L369	M247-F371 HydrophobicContact CB-CD1 4.43Å; M247-F371 HydrophobicContact SD-CD1 4.1Å; M247-F371 HydrophobicContact SD-CE1 3.83Å; K254-F371 HydrophobicContact CD-CB 4.33Å; K254-F371 VanDerWaalsContact CE-CB 3.45Å; K254-F371 HydrophobicContact CG-CB 4.23Å; K254-F371 HydrophobicContact CG-CD1 4.43Å; K254-F371 PolarHBondContact NZ-O 3.46Å; Q257-F371 HydrophobicContact CB-CE1 4.01Å; L258-F371 HydrophobicContact CB-CZ 4.21Å; L258-F371 HydrophobicContact CD1-CE2 4.1Å; L258-F371 HydrophobicContact CD1-CZ 4.14Å; L341-F371 HydrophobicContact CB-CE2 4.5Å; Q342-F371 PolarHBondContact O-N 3.28Å; L369-F371 HydrophobicContact CD2-CD2 4.48Å; L369-F371 HydrophobicContact CD2-CE1 4.22Å; L369-F371 HydrophobicContact CD2-CE2 3.7Å; L369-F371 HydrophobicContact CD2-CZ 3.55Å; L369-F371 HydrophobicContact CG-CD2 4.46Å; L369-F371 HydrophobicContact CG-CE2 4.09Å; L369-F371 HydrophobicContact CG-CZ 4.35Å
372	L	95.3	Very high	88.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.4	-179.2	-62.1	176.5	0	0	0	110.5	M247 V248 C249 P345 V370 E376 Y379 I380	M247-L372 PolarHBondContact O-N 2.93Å; V248-L372 CarbonylContact C-O 3.55Å; V248-L372 WeakPolarHBondContact CA-O 3.49Å; C249-L372 PolarHBondContact N-O 3.36Å; P345-L372 HydrophobicContact CG-CD2 3.62Å; V370-L372 HydrophobicContact CG1-CG 4.41Å; V370-L372 HydrophobicContact CG2-CD2 4.02Å; V370-L372 HydrophobicContact CG2-CG 4.37Å; L372-E376 WeakPolarHBondContact CA-OE2 3.19Å; L372-E376 HydrophobicContact CB-CB 4.15Å; L372-E376 HydrophobicContact CD2-CB 4.16Å; L372-Y379 HydrophobicContact CD2-CD1 3.95Å; L372-I380 HydrophobicContact CD1-CD1 4.01Å; L372-I380 HydrophobicContact CD1-CG1 3.64Å
373	L	94.4	Very high	89.7	Confident	4 Å²	4	34 Å²	34	2%	0.021	20%	0.202	C	C	.	.			trans	-76.8	158.9	166.1	-58.3	179.2	0	0	0	109.9	C249 A251 K254 M375 E376 L446	C249-L373 WeakPolarHBondContact O-CD2 3.5Å; A251-L373 HydrophobicContact CB-CD2 3.81Å; K254-L373 HydrophobicContact CD-CD2 4.23Å; L373-M375 HydrophobicContact CB-CE 3.92Å; L373-M375 HydrophobicContact CB-SD 3.91Å; L373-M375 HydrophobicContact CD1-CE 3.41Å; L373-M375 VanDerWaalsContact CD1-CE 3.41Å; L373-M375 HydrophobicContact CD1-SD 4.41Å; L373-M375 HydrophobicContact CG-CE 4.3Å; L373-M375 PolarHBondContact O-N 2.87Å; L373-M375 VanDerWaalsContact O-N 3.16Å; L373-E376 HydrophobicContact CB-CG 4.02Å; L373-E376 WeakPolarHBondContact CD1-OE1 3.47Å; L373-E376 PolarHBondContact N-OE2 3.37Å; L373-E376 WeakPolarHBondContact O-CA 3.4Å; L373-E376 WeakPolarHBondContact O-CB 3.34Å; L373-E376 PolarHBondContact O-N 2.61Å; L373-L446 HydrophobicContact CD1-CD1 3.78Å
374	P	92.3	Very high	90.8	Very high	69 Å²	69	34.7 Å²	34.7	45%	0.448	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-55.1	-35.8	-179	-27.8	36.7	0	0	0	114	V248 C249 E376	V248-P374 HydrophobicContact CG1-CB 4.26Å; V248-P374 HydrophobicContact CG1-CG 4.18Å; C249-P374 WeakPolarHBondContact O-CD 3.29Å; P374-E376 PolarHBondContact O-N 3.49Å
375	M	90.9	Very high	91.3	Very high	61 Å²	61	35.2 Å²	35.2	30%	0.3	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-75.3	-10.8	176.8	65.5	-96.7	-171.8	0	0	114.3	L373 D445 L446	L373-M375 HydrophobicContact CB-CE 3.92Å; L373-M375 HydrophobicContact CB-SD 3.91Å; L373-M375 HydrophobicContact CD1-CE 3.41Å; L373-M375 VanDerWaalsContact CD1-CE 3.41Å; L373-M375 HydrophobicContact CD1-SD 4.41Å; L373-M375 HydrophobicContact CG-CE 4.3Å; L373-M375 PolarHBondContact O-N 2.87Å; L373-M375 VanDerWaalsContact O-N 3.16Å; M375-D445 HydrophobicContact CG-CB 4.46Å; M375-L446 HydrophobicContact CE-CB 4.34Å; M375-L446 HydrophobicContact CE-CD1 3.55Å
376	E	92.8	Very high	91.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-95.1	1.5	-175.7	-61.9	168.5	177.9	0	0	112.6	L372 L373 P374 S378 Y379 Y432 F441	L372-E376 WeakPolarHBondContact CA-OE2 3.19Å; L372-E376 HydrophobicContact CB-CB 4.15Å; L372-E376 HydrophobicContact CD2-CB 4.16Å; L373-E376 HydrophobicContact CB-CG 4.02Å; L373-E376 WeakPolarHBondContact CD1-OE1 3.47Å; L373-E376 PolarHBondContact N-OE2 3.37Å; L373-E376 WeakPolarHBondContact O-CA 3.4Å; L373-E376 WeakPolarHBondContact O-CB 3.34Å; L373-E376 PolarHBondContact O-N 2.61Å; P374-E376 PolarHBondContact O-N 3.49Å; E376-S378 PolarHBondContact O-N 3.17Å; E376-S378 VanDerWaalsContact O-N 3.13Å; E376-Y379 WeakPolarHBondContact O-CB 3.41Å; E376-Y379 PolarHBondContact O-N 3.35Å; E376-Y432 WeakPolarHBondContact OE1-CE2 3.29Å; E376-Y432 VanDerWaalsContact OE1-CZ 3.3Å; E376-Y432 PolarHBondContact OE1-OH 3.2Å; E376-F441 HydrophobicContact CB-CE1 4.15Å; E376-F441 HydrophobicContact CG-CD1 3.89Å; E376-F441 HydrophobicContact CG-CE1 3.68Å
377	E	90.3	Very high	90.9	Very high	107 Å²	107	37.3 Å²	37.3	50%	0.5	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-32.7	-176.4	-168.2	177.1	-178.1	0	0	112.8	Y379 I380	E377-Y379 PolarHBondContact O-N 3.35Å; E377-I380 HydrophobicContact CG-CD1 3.86Å; E377-I380 WeakPolarHBondContact O-CB 3.37Å; E377-I380 WeakPolarHBondContact O-CD1 3.38Å; E377-I380 WeakPolarHBondContact O-CG1 3.5Å; E377-I380 PolarHBondContact O-N 2.96Å
378	S	91.8	Very high	90.3	Very high	75 Å²	75	41.4 Å²	41.4	52%	0.524	22%	0.223	S	C	.	.	H	α-helix	trans	-59.5	-19.5	175	-64.9	0	0	0	0	113.6	E376 I380 N381 F382	E376-S378 PolarHBondContact O-N 3.17Å; E376-S378 VanDerWaalsContact O-N 3.13Å; S378-I380 PolarHBondContact O-N 3Å; S378-N381 PolarHBondContact O-N 3.09Å; S378-F382 PolarHBondContact O-N 2.93Å
379	Y	92.8	Very high	89.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-28.6	174.8	-167.5	-123.6	0	0	0	112.6	P345 F352 L372 E376 E377 F382 L383 I440 F441	P345-Y379 HydrophobicContact CB-CE1 4.11Å; F352-Y379 HydrophobicContact CD2-CE1 4.42Å; L372-Y379 HydrophobicContact CD2-CD1 3.95Å; E376-Y379 WeakPolarHBondContact O-CB 3.41Å; E376-Y379 PolarHBondContact O-N 3.35Å; E377-Y379 PolarHBondContact O-N 3.35Å; Y379-F382 AromaticContact CD2-CD1 3.98Å; Y379-F382 HydrophobicContact CD2-CD1 3.98Å; Y379-F382 AromaticContact CE2-CD1 3.91Å; Y379-F382 HydrophobicContact CE2-CD1 3.91Å; Y379-F382 HydrophobicContact CE2-CE1 4.25Å; Y379-F382 PolarHBondContact O-N 3.16Å; Y379-L383 HydrophobicContact CD1-CD1 3.73Å; Y379-L383 HydrophobicContact CD1-CG 4.18Å; Y379-L383 HydrophobicContact CE1-CD1 3.47Å; Y379-L383 VanDerWaalsContact CE1-CD1 3.47Å; Y379-L383 HydrophobicContact CE1-CD2 4.24Å; Y379-L383 HydrophobicContact CE1-CG 3.93Å; Y379-L383 HydrophobicContact CE2-CD2 4.38Å; Y379-L383 HydrophobicContact CE2-CG 4.35Å; Y379-L383 HydrophobicContact CG-CD1 4.49Å; Y379-L383 WeakPolarHBondContact O-CG 3.08Å; Y379-L383 PolarHBondContact O-N 3.18Å; Y379-I440 HydrophobicContact CD2-CD1 4.24Å; Y379-F441 HydrophobicContact CD1-CZ 4.09Å; Y379-F441 AromaticContact CD2-CE2 3.55Å; Y379-F441 HydrophobicContact CD2-CE2 3.55Å; Y379-F441 AromaticContact CD2-CZ 3.82Å; Y379-F441 HydrophobicContact CD2-CZ 3.82Å; Y379-F441 HydrophobicContact CE1-CZ 4.36Å; Y379-F441 AromaticContact CE2-CE2 3.76Å; Y379-F441 HydrophobicContact CE2-CE2 3.76Å; Y379-F441 HydrophobicContact CE2-CZ 4.13Å; Y379-F441 HydrophobicContact CG-CE2 4.01Å; Y379-F441 AromaticContact CG-CZ 3.8Å; Y379-F441 HydrophobicContact CG-CZ 3.8Å
380	I	91.8	Very high	89.2	Confident	18 Å²	18	44.5 Å²	44.5	9%	0.092	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-50.1	178.9	-60.7	160.1	0	0	0	110.2	Y246 L372 E377 S378 F382 L383 A384 L391	Y246-I380 HydrophobicContact CD1-CD1 4.02Å; Y246-I380 HydrophobicContact CD1-CG1 4.36Å; Y246-I380 HydrophobicContact CD2-CD1 3.39Å; Y246-I380 HydrophobicContact CD2-CG1 4.23Å; Y246-I380 HydrophobicContact CE1-CD1 3.91Å; Y246-I380 HydrophobicContact CE1-CG2 4.43Å; Y246-I380 HydrophobicContact CE2-CD1 3.3Å; Y246-I380 HydrophobicContact CE2-CG1 4.5Å; Y246-I380 HydrophobicContact CG-CD1 3.74Å; Y246-I380 HydrophobicContact CG-CG1 4.14Å; L372-I380 HydrophobicContact CD1-CD1 4.01Å; L372-I380 HydrophobicContact CD1-CG1 3.64Å; E377-I380 HydrophobicContact CG-CD1 3.86Å; E377-I380 WeakPolarHBondContact O-CB 3.37Å; E377-I380 WeakPolarHBondContact O-CD1 3.38Å; E377-I380 WeakPolarHBondContact O-CG1 3.5Å; E377-I380 PolarHBondContact O-N 2.96Å; S378-I380 PolarHBondContact O-N 3Å; I380-F382 VanDerWaalsContact C-N 3.3Å; I380-F382 PolarHBondContact O-N 2.95Å; I380-L383 PolarHBondContact O-N 3.1Å; I380-A384 WeakPolarHBondContact O-CB 3.22Å; I380-A384 PolarHBondContact O-N 3.5Å; I380-L391 HydrophobicContact CG1-CD1 4.43Å; I380-L391 HydrophobicContact CG2-CB 4.25Å; I380-L391 HydrophobicContact CG2-CD1 4.19Å
381	N	89.9	Confident	88.9	Confident	109 Å²	109	45.6 Å²	45.6	58%	0.583	25%	0.249	S	C	*	.	H	α-helix	trans	-62.8	-40.3	177.8	-69.3	-29.2	0	0	0	111.1	S378 A384 I385	S378-N381 PolarHBondContact O-N 3.09Å; N381-A384 PolarHBondContact O-N 3.15Å; N381-I385 VanDerWaalsContact O-CG1 3.29Å; N381-I385 WeakPolarHBondContact O-CG1 3.3Å; N381-I385 PolarHBondContact O-N 3.17Å
382	F	90.1	Very high	88.7	Confident	50 Å²	50	51.2 Å²	51.2	22%	0.219	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-44.5	175.6	174.7	-94.6	0	0	0	112.4	A349 S378 Y379 I380 I385 N386 C437 I440	A349-F382 HydrophobicContact CB-CE1 3.62Å; A349-F382 HydrophobicContact CB-CZ 4.16Å; S378-F382 PolarHBondContact O-N 2.93Å; Y379-F382 AromaticContact CD2-CD1 3.98Å; Y379-F382 HydrophobicContact CD2-CD1 3.98Å; Y379-F382 AromaticContact CE2-CD1 3.91Å; Y379-F382 HydrophobicContact CE2-CD1 3.91Å; Y379-F382 HydrophobicContact CE2-CE1 4.25Å; Y379-F382 PolarHBondContact O-N 3.16Å; I380-F382 VanDerWaalsContact C-N 3.3Å; I380-F382 PolarHBondContact O-N 2.95Å; F382-I385 PolarHBondContact O-N 3.01Å; F382-N386 HydrophobicContact CE2-CB 4.27Å; F382-N386 VanDerWaalsContact CE2-ND2 3.26Å; F382-N386 WeakPolarHBondContact CE2-ND2 3.27Å; F382-N386 HydrophobicContact CZ-CB 4.26Å; F382-N386 VanDerWaalsContact O-CB 3.3Å; F382-N386 WeakPolarHBondContact O-CB 3.48Å; F382-N386 PolarHBondContact O-N 3.27Å; F382-N386 PolarHBondContact O-OD1 2.83Å; F382-C437 WeakPolarHBondContact CE1-SG 3.18Å; F382-C437 VanDerWaalsContact CZ-SG 3.55Å; F382-I440 HydrophobicContact CB-CD1 3.9Å; F382-I440 HydrophobicContact CG-CD1 4.17Å
383	L	88.5	Confident	88.7	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-39.3	176.3	-73.1	176.3	0	0	0	112.3	F352 Y379 I380 I385 Q387 K388 C389 L391	F352-L383 HydrophobicContact CB-CD2 4.03Å; F352-L383 HydrophobicContact CD1-CD1 4.06Å; F352-L383 HydrophobicContact CD1-CD2 4.18Å; F352-L383 HydrophobicContact CD2-CD1 3.74Å; F352-L383 HydrophobicContact CD2-CD2 4.41Å; F352-L383 HydrophobicContact CE1-CD1 4.03Å; F352-L383 HydrophobicContact CE2-CD1 3.68Å; F352-L383 HydrophobicContact CG-CD1 3.93Å; F352-L383 HydrophobicContact CG-CD2 3.94Å; F352-L383 HydrophobicContact CZ-CD1 3.85Å; Y379-L383 HydrophobicContact CD1-CD1 3.73Å; Y379-L383 HydrophobicContact CD1-CG 4.18Å; Y379-L383 HydrophobicContact CE1-CD1 3.47Å; Y379-L383 VanDerWaalsContact CE1-CD1 3.47Å; Y379-L383 HydrophobicContact CE1-CD2 4.24Å; Y379-L383 HydrophobicContact CE1-CG 3.93Å; Y379-L383 HydrophobicContact CE2-CD2 4.38Å; Y379-L383 HydrophobicContact CE2-CG 4.35Å; Y379-L383 HydrophobicContact CG-CD1 4.49Å; Y379-L383 WeakPolarHBondContact O-CG 3.08Å; Y379-L383 PolarHBondContact O-N 3.18Å; I380-L383 PolarHBondContact O-N 3.1Å; L383-I385 PolarHBondContact O-N 3.41Å; L383-Q387 HydrophobicContact CD2-CG 4.16Å; L383-Q387 CarbonylContact O-C 3.59Å; L383-Q387 WeakPolarHBondContact O-CA 3.43Å; L383-Q387 WeakPolarHBondContact O-CB 3.45Å; L383-Q387 PolarHBondContact O-N 3.33Å; L383-K388 PolarHBondContact O-N 3.47Å; L383-C389 PolarHBondContact O-N 3.2Å; L383-L391 HydrophobicContact CB-CD1 4.31Å; L383-L391 HydrophobicContact CD1-CD1 3.7Å
384	A	87.1	Confident	88.7	Confident	40 Å²	40	58.7 Å²	58.7	33%	0.331	31%	0.31	S	S	.	.	H	α-helix	trans	-62.1	-42.7	176.9	0	0	0	0	0	111.8	I380 N381 K388	I380-A384 WeakPolarHBondContact O-CB 3.22Å; I380-A384 PolarHBondContact O-N 3.5Å; N381-A384 PolarHBondContact O-N 3.15Å; A384-K388 VanDerWaalsContact O-CA 3.25Å; A384-K388 WeakPolarHBondContact O-CA 3.39Å; A384-K388 PolarHBondContact O-N 2.63Å
385	I	84.6	Confident	88.6	Confident	127 Å²	127	62.9 Å²	62.9	65%	0.651	32%	0.321	S	S	*	.	H	α-helix	trans	-78.9	-53.5	-178.1	-63.8	166.5	0	0	0	111.3	N381 F382 L383	N381-I385 VanDerWaalsContact O-CG1 3.29Å; N381-I385 WeakPolarHBondContact O-CG1 3.3Å; N381-I385 PolarHBondContact O-N 3.17Å; F382-I385 PolarHBondContact O-N 3.01Å; L383-I385 PolarHBondContact O-N 3.41Å
386	N	81.8	Confident	88.6	Confident	82 Å²	82	63.5 Å²	63.5	44%	0.439	33%	0.325	S	S	.	.	H	α-helix	trans	-83.6	-32.7	-168.3	-67.4	45.7	0	0	0	112.9	F382	F382-N386 HydrophobicContact CE2-CB 4.27Å; F382-N386 VanDerWaalsContact CE2-ND2 3.26Å; F382-N386 WeakPolarHBondContact CE2-ND2 3.27Å; F382-N386 HydrophobicContact CZ-CB 4.26Å; F382-N386 VanDerWaalsContact O-CB 3.3Å; F382-N386 WeakPolarHBondContact O-CB 3.48Å; F382-N386 PolarHBondContact O-N 3.27Å; F382-N386 PolarHBondContact O-OD1 2.83Å
387	Q	80	Confident	88.4	Confident	22 Å²	22	67.7 Å²	67.7	10%	0.103	35%	0.345	C	S	.	.	S	Bend	trans	-109.1	-2.2	-179.1	-59.7	-55.8	-26.8	0	0	113.5	A349 V353 L383 C389	A349-Q387 HydrophobicContact CB-CG 3.93Å; V353-Q387 HydrophobicContact CG2-CB 3.9Å; V353-Q387 HydrophobicContact CG2-CG 4.25Å; L383-Q387 HydrophobicContact CD2-CG 4.16Å; L383-Q387 CarbonylContact O-C 3.59Å; L383-Q387 WeakPolarHBondContact O-CA 3.43Å; L383-Q387 WeakPolarHBondContact O-CB 3.45Å; L383-Q387 PolarHBondContact O-N 3.33Å; Q387-C389 HydrophobicContact CB-CB 4.35Å; Q387-C389 PolarHBondContact O-N 3.4Å
388	K	80.6	Confident	87.9	Confident	103 Å²	103	74 Å²	74	45%	0.448	36%	0.364	S	S	.	.			trans	53.5	38.8	-178.3	-56.7	-176.9	179.7	-178.2	0	111.6	A235 L383 A384 P390	A235-K388 WeakPolarHBondContact O-CB 3.44Å; A235-K388 WeakPolarHBondContact O-CD 3.4Å; L383-K388 PolarHBondContact O-N 3.47Å; A384-K388 VanDerWaalsContact O-CA 3.25Å; A384-K388 WeakPolarHBondContact O-CA 3.39Å; A384-K388 PolarHBondContact O-N 2.63Å; K388-P390 WeakPolarHBondContact O-CD 3.34Å
389	C	81.3	Confident	87.3	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.376	C	S	.	.			trans	-118.7	89	-177.1	-176.6	0	0	0	0	109.1	T238 L383 Q387	T238-C389 HydrophobicContact CG2-CB 4.27Å; L383-C389 PolarHBondContact O-N 3.2Å; Q387-C389 HydrophobicContact CB-CB 4.35Å; Q387-C389 PolarHBondContact O-N 3.4Å
390	P	85	Confident	86.9	Confident	67 Å²	67	79.1 Å²	79.1	44%	0.435	39%	0.387	S	S	.	.			trans	-68.7	145.6	175.1	29.7	-33.4	0	0	0	110.4	Q236 K388	Q236-P390 VanDerWaalsContact NE2-CG 3.29Å; K388-P390 WeakPolarHBondContact O-CD 3.34Å
391	L	89.8	Confident	86.7	Confident	23 Å²	23	82.6 Å²	82.6	12%	0.12	41%	0.409	C	S	.	.			trans	-122.6	143.1	-178.5	-68.1	152.8	0	0	0	109.7	N244 Y246 F352 V370 I380 L383	N244-L391 HydrophobicContact CB-CD2 3.57Å; N244-L391 HydrophobicContact CB-CG 4.43Å; N244-L391 CarbonylContact O-C 3.46Å; N244-L391 WeakPolarHBondContact O-CA 3.22Å; Y246-L391 HydrophobicContact CD1-CB 3.75Å; F352-L391 HydrophobicContact CE1-CD2 4.26Å; F352-L391 HydrophobicContact CZ-CD1 4.39Å; F352-L391 HydrophobicContact CZ-CD2 3.76Å; V370-L391 HydrophobicContact CG1-CD2 4.32Å; I380-L391 HydrophobicContact CG1-CD1 4.43Å; I380-L391 HydrophobicContact CG2-CB 4.25Å; I380-L391 HydrophobicContact CG2-CD1 4.19Å; L383-L391 HydrophobicContact CB-CD1 4.31Å; L383-L391 HydrophobicContact CD1-CD1 3.7Å
392	Q	92.6	Very high	86.7	Confident	119 Å²	119	81.9 Å²	81.9	56%	0.556	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	141.2	175.3	-65.2	-178	-4.8	0	0	111	N244 Y245 Y246 M394	N244-Q392 PolarHBondContact O-N 3.35Å; Y245-Q392 CarbonylContact C-O 3.53Å; Y245-Q392 WeakPolarHBondContact CA-O 3.28Å; Y245-Q392 HydrophobicContact CD1-CB 3.86Å; Y245-Q392 HydrophobicContact CE1-CB 4.07Å; Y246-Q392 VanDerWaalsContact CD1-C 3.45Å; Y246-Q392 VanDerWaalsContact CD1-O 3.26Å; Y246-Q392 WeakPolarHBondContact CD1-O 3.11Å; Y246-Q392 PolarHBondContact N-O 2.97Å; Q392-M394 PolarHBondContact O-N 2.96Å
393	E	94.6	Very high	86.8	Confident	120 Å²	120	79.7 Å²	79.7	56%	0.561	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.2	179.4	-165.8	-176.9	172.2	0	0	111.2	Y246	Y246-E393 HydrophobicContact CD1-CB 4.47Å; Y246-E393 HydrophobicContact CD2-CG 4.47Å; Y246-E393 VanDerWaalsContact CE1-CA 3.41Å; Y246-E393 HydrophobicContact CE1-CB 3.7Å; Y246-E393 HydrophobicContact CE1-CG 4.29Å; Y246-E393 VanDerWaalsContact CE1-N 3.29Å; Y246-E393 HydrophobicContact CE2-CB 4.07Å; Y246-E393 HydrophobicContact CE2-CG 3.72Å; Y246-E393 VanDerWaalsContact CZ-CB 3.47Å; Y246-E393 WeakPolarHBondContact OH-CB 3.44Å
394	M	94.1	Very high	86.9	Confident	40 Å²	40	81.7 Å²	81.7	20%	0.197	41%	0.406	C	S	.	.			trans	-107.8	114.4	167.8	-166.5	172.8	82.7	0	0	109.8	Y245 Y246 M247 F261 L369 Q392	Y245-M394 HydrophobicContact CD1-CB 4.49Å; Y246-M394 PolarHBondContact O-N 3.12Å; M247-M394 HydrophobicContact CE-CE 3.39Å; M247-M394 HydrophobicContact CE-CG 4.36Å; F261-M394 HydrophobicContact CD2-CE 3.98Å; F261-M394 HydrophobicContact CE2-CE 4.1Å; L369-M394 HydrophobicContact CD1-CB 4.28Å; L369-M394 HydrophobicContact CD1-CE 3.74Å; L369-M394 HydrophobicContact CD1-SD 4.38Å; L369-M394 HydrophobicContact CD2-CE 3.33Å; L369-M394 HydrophobicContact CG-CE 4.16Å; Q392-M394 PolarHBondContact O-N 2.96Å
395	K	91	Very high	87.1	Confident	157 Å²	157	83.6 Å²	83.6	68%	0.683	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-65.4	144.1	-174.8	-66.1	-176.2	179.6	178.5	0	112.4	Q397	K395-Q397 PolarHBondContact O-NE2 3.38Å; K395-Q397 VanDerWaalsContact O-NE2 3.13Å
396	L	89.5	Confident	87.4	Confident	74 Å²	74	83.1 Å²	83.1	39%	0.387	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-54.8	136.4	172.2	-74.9	166	0	0	0	111.7	M247 V248 C249 Q257	M247-L396 HydrophobicContact CG-CD2 4.08Å; M247-L396 HydrophobicContact SD-CD2 4.05Å; V248-L396 WeakPolarHBondContact O-CD1 3.35Å; V248-L396 WeakPolarHBondContact O-CD2 3.19Å; V248-L396 WeakPolarHBondContact O-CG 3.07Å; C249-L396 HydrophobicContact CB-CD2 3.64Å; Q257-L396 HydrophobicContact CG-CD2 3.85Å
397	Q	88.9	Confident	87.9	Confident	88 Å²	88	79.6 Å²	79.6	41%	0.411	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-83.6	125.4	172.6	-58.8	-55.9	-51.2	0	0	109.3	Q257 K395 N399 T400	Q257-Q397 PolarHBondContact NE2-O 3.16Å; K395-Q397 PolarHBondContact O-NE2 3.38Å; K395-Q397 VanDerWaalsContact O-NE2 3.13Å; Q397-N399 VanDerWaalsContact C-N 3.35Å; Q397-T400 HydrophobicContact CB-CG2 4.25Å
398	R	80.4	Confident	88.5	Confident	241 Å²	241	80.6 Å²	80.6	91%	0.909	39%	0.393	S	S	*	.	S	Bend	trans	-77.7	-20.7	-178.7	-64.2	-177	-179.6	179.9	-0.9	113.2	T400	R398-T400 VanDerWaalsContact C-N 3.34Å; R398-T400 PolarHBondContact O-N 2.92Å
399	N	78.6	Confident	89	Confident	144 Å²	144	78.5 Å²	78.5	77%	0.77	39%	0.392	S	S	*	.			trans	-97	37.2	-174.3	-63.3	-8.5	0	0	0	112.5	Q397	Q397-N399 VanDerWaalsContact C-N 3.35Å
400	T	84.7	Confident	89.5	Confident	37 Å²	37	80.2 Å²	80.2	23%	0.227	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-81.8	133.9	177.4	53.8	0	0	0	0	111.5	H260 Q397 R398	H260-T400 HydrophobicContact CB-CG2 3.84Å; Q397-T400 HydrophobicContact CB-CG2 4.25Å; R398-T400 VanDerWaalsContact C-N 3.34Å; R398-T400 PolarHBondContact O-N 2.92Å
401	V	88.5	Confident	89.8	Confident	91 Å²	91	77.2 Å²	77.2	55%	0.552	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-72.4	134.1	172.9	-179.6	0	0	0	0	109.2	L403	V401-L403 HydrophobicContact CG1-CD2 4.42Å; V401-L403 WeakPolarHBondContact O-CG 3.37Å; V401-L403 PolarHBondContact O-N 3.23Å
402	D	89.8	Confident	89.9	Confident	94 Å²	94	79.1 Å²	79.1	50%	0.503	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-69.3	117.5	171.7	-179.2	17.9	0	0	0	110.8	L404 P405	D402-L404 VanDerWaalsContact OD1-CB 3.25Å; D402-L404 WeakPolarHBondContact OD1-CB 3.44Å; D402-L404 PolarHBondContact OD1-N 3.22Å; D402-P405 WeakPolarHBondContact OD2-CD 3.41Å
403	L	91	Very high	89.8	Confident	5 Å²	5	76.7 Å²	76.7	3%	0.026	39%	0.392	C	S	.	.			trans	-94.7	-12.4	-177.6	-53.4	174.4	0	0	0	112.4	F255 N256 V259 L290 V401 K406 L407	F255-L403 HydrophobicContact CD1-CD1 3.96Å; F255-L403 HydrophobicContact CE1-CD1 4.09Å; N256-L403 HydrophobicContact CB-CD1 4.49Å; N256-L403 VanDerWaalsContact OD1-CB 3.29Å; N256-L403 WeakPolarHBondContact OD1-CB 3.39Å; N256-L403 WeakPolarHBondContact OD1-CD1 3.39Å; N256-L403 WeakPolarHBondContact OD1-CG 3.45Å; N256-L403 PolarHBondContact OD1-N 3.47Å; V259-L403 HydrophobicContact CB-CD1 3.56Å; V259-L403 HydrophobicContact CG1-CD1 3.79Å; V259-L403 HydrophobicContact CG1-CD2 4.48Å; V259-L403 HydrophobicContact CG2-CD1 3.59Å; L290-L403 HydrophobicContact CD1-CD1 4.22Å; L290-L403 HydrophobicContact CD2-CD2 4.24Å; V401-L403 HydrophobicContact CG1-CD2 4.42Å; V401-L403 WeakPolarHBondContact O-CG 3.37Å; V401-L403 PolarHBondContact O-N 3.23Å; L403-K406 PolarHBondContact O-N 3.03Å; L403-K406 VanDerWaalsContact O-N 3.1Å; L403-L407 HydrophobicContact CB-CD1 4.32Å; L403-L407 WeakPolarHBondContact O-CG 3.49Å; L403-L407 PolarHBondContact O-N 3.45Å
404	L	90	Very high	89.6	Confident	41 Å²	41	72.1 Å²	72.1	22%	0.215	37%	0.371	C	S	.	.	H	α-helix	trans	-56	-45.9	-174.6	-177.9	63.7	0	0	0	112.8	D402 K406 L407 K408 Q453 A456	D402-L404 VanDerWaalsContact OD1-CB 3.25Å; D402-L404 WeakPolarHBondContact OD1-CB 3.44Å; D402-L404 PolarHBondContact OD1-N 3.22Å; L404-K406 VanDerWaalsContact C-N 3.29Å; L404-K406 PolarHBondContact O-N 2.77Å; L404-L407 PolarHBondContact O-N 3.08Å; L404-K408 HydrophobicContact CD1-CD 4.34Å; L404-K408 HydrophobicContact CD1-CG 4.25Å; L404-K408 HydrophobicContact CG-CD 4.31Å; L404-K408 WeakPolarHBondContact O-CB 3.47Å; L404-K408 WeakPolarHBondContact O-CG 3.25Å; L404-K408 PolarHBondContact O-N 3.43Å; L404-Q453 WeakPolarHBondContact CD1-O 3.34Å; L404-A456 HydrophobicContact CD1-CB 3.79Å
405	P	91.7	Very high	89.3	Confident	80 Å²	80	71.3 Å²	71.3	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-38.5	178.7	-22.7	34.4	0	0	0	112.1	D402 S409	D402-P405 WeakPolarHBondContact OD2-CD 3.41Å; P405-S409 WeakPolarHBondContact O-CB 3.42Å; P405-S409 PolarHBondContact O-N 2.9Å
406	K	92.3	Very high	89.2	Confident	118 Å²	118	64.2 Å²	64.2	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-42.1	-179.6	-171.5	61.1	177.1	179.8	0	111.6	L290 L403 L404 S409 M410	L290-K406 HydrophobicContact CD2-CG 3.97Å; L403-K406 PolarHBondContact O-N 3.03Å; L403-K406 VanDerWaalsContact O-N 3.1Å; L404-K406 VanDerWaalsContact C-N 3.29Å; L404-K406 PolarHBondContact O-N 2.77Å; K406-S409 WeakPolarHBondContact O-CB 3.4Å; K406-S409 PolarHBondContact O-N 2.77Å; K406-M410 WeakPolarHBondContact O-CG 3.47Å; K406-M410 PolarHBondContact O-N 3.22Å
407	L	92.3	Very high	89.3	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-43.3	176.6	-69.2	172.3	0	0	0	111.8	F255 A286 L290 L403 L404 S409 M410 A411 A456	F255-L407 HydrophobicContact CD1-CD1 3.78Å; F255-L407 HydrophobicContact CE1-CD1 3.86Å; F255-L407 HydrophobicContact CE1-CD2 4.19Å; A286-L407 HydrophobicContact CB-CD2 3.75Å; L290-L407 HydrophobicContact CD1-CD2 3.94Å; L290-L407 HydrophobicContact CD1-CG 4.49Å; L403-L407 HydrophobicContact CB-CD1 4.32Å; L403-L407 WeakPolarHBondContact O-CG 3.49Å; L403-L407 PolarHBondContact O-N 3.45Å; L404-L407 PolarHBondContact O-N 3.08Å; L407-S409 VanDerWaalsContact C-N 3.34Å; L407-S409 PolarHBondContact O-N 2.68Å; L407-M410 WeakPolarHBondContact O-CB 3.36Å; L407-M410 PolarHBondContact O-N 2.98Å; L407-A411 PolarHBondContact O-N 3.05Å; L407-A456 HydrophobicContact CB-CB 3.36Å; L407-A456 HydrophobicContact CD1-CB 4.04Å; L407-A456 HydrophobicContact CG-CB 4.34Å
408	K	91.6	Very high	89.4	Confident	42 Å²	42	57.7 Å²	57.7	18%	0.183	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-43.1	173.7	-74.9	-175.3	174.6	-177.4	0	111.4	L404 M410 A411 L412 A456 L458 V477	L404-K408 HydrophobicContact CD1-CD 4.34Å; L404-K408 HydrophobicContact CD1-CG 4.25Å; L404-K408 HydrophobicContact CG-CD 4.31Å; L404-K408 WeakPolarHBondContact O-CB 3.47Å; L404-K408 WeakPolarHBondContact O-CG 3.25Å; L404-K408 PolarHBondContact O-N 3.43Å; K408-M410 VanDerWaalsContact C-N 3.33Å; K408-M410 PolarHBondContact O-N 3.27Å; K408-A411 PolarHBondContact O-N 3.49Å; K408-L412 WeakPolarHBondContact O-CG 3.35Å; K408-L412 PolarHBondContact O-N 2.66Å; K408-A456 HydrophobicContact CG-CB 4.29Å; K408-L458 HydrophobicContact CB-CD2 4.15Å; K408-L458 HydrophobicContact CG-CD2 4.1Å; K408-V477 HydrophobicContact CD-CG2 3.96Å
409	S	92.3	Very high	89.9	Confident	60 Å²	60	49.6 Å²	49.6	42%	0.42	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-41.3	174.4	175.3	0	0	0	0	112.3	P405 K406 L407 L412 A413	P405-S409 WeakPolarHBondContact O-CB 3.42Å; P405-S409 PolarHBondContact O-N 2.9Å; K406-S409 WeakPolarHBondContact O-CB 3.4Å; K406-S409 PolarHBondContact O-N 2.77Å; L407-S409 VanDerWaalsContact C-N 3.34Å; L407-S409 PolarHBondContact O-N 2.68Å; S409-L412 PolarHBondContact O-N 3.06Å; S409-A413 VanDerWaalsContact O-CB 3.31Å; S409-A413 WeakPolarHBondContact O-CB 3.41Å; S409-A413 PolarHBondContact O-N 2.97Å
410	M	91.8	Very high	90.6	Very high	36 Å²	36	44.7 Å²	44.7	18%	0.177	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-40.3	175	-70.3	173.8	62.7	0	0	112.6	A289 K406 L407 K408 A413 D414 V417	A289-M410 HydrophobicContact CB-CE 3.51Å; A289-M410 HydrophobicContact CB-SD 3.71Å; K406-M410 WeakPolarHBondContact O-CG 3.47Å; K406-M410 PolarHBondContact O-N 3.22Å; L407-M410 WeakPolarHBondContact O-CB 3.36Å; L407-M410 PolarHBondContact O-N 2.98Å; K408-M410 VanDerWaalsContact C-N 3.33Å; K408-M410 PolarHBondContact O-N 3.27Å; M410-A413 PolarHBondContact O-N 3.1Å; M410-D414 PolarHBondContact O-N 2.97Å; M410-D414 VanDerWaalsContact O-N 3.13Å; M410-V417 HydrophobicContact CB-CG1 4.31Å
411	A	90.9	Very high	91	Very high	4 Å²	4	43 Å²	43	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-68.2	-35.8	177	0	0	0	0	0	112.6	L407 K408 F418 L458	L407-A411 PolarHBondContact O-N 3.05Å; K408-A411 PolarHBondContact O-N 3.49Å; A411-F418 HydrophobicContact CB-CB 4.27Å; A411-L458 HydrophobicContact CB-CD1 4.17Å; A411-L458 HydrophobicContact CB-CD2 4.48Å; A411-L458 HydrophobicContact CB-CG 4.27Å
412	L	91.2	Very high	91.2	Very high	62 Å²	62	40 Å²	40	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-70.4	-32.6	174.1	-72.8	168.4	0	0	0	112.5	K408 S409 L458 V479 I484	K408-L412 WeakPolarHBondContact O-CG 3.35Å; K408-L412 PolarHBondContact O-N 2.66Å; S409-L412 PolarHBondContact O-N 3.06Å; L412-L458 HydrophobicContact CD2-CD1 3.68Å; L412-L458 HydrophobicContact CD2-CD2 4.36Å; L412-L458 HydrophobicContact CG-CD1 4Å; L412-L458 HydrophobicContact CG-CD2 4.15Å; L412-V479 HydrophobicContact CD2-CB 4.17Å; L412-V479 HydrophobicContact CD2-CG1 3.92Å; L412-V479 HydrophobicContact CD2-CG2 4.19Å; L412-I484 HydrophobicContact CD2-CD1 4.29Å
413	A	90.5	Very high	91.4	Very high	69 Å²	69	41.7 Å²	41.7	57%	0.57	22%	0.222	S	C	*	.	H	α-helix	trans	-79.1	-27.4	-179.4	0	0	0	0	0	113.9	S409 M410	S409-A413 VanDerWaalsContact O-CB 3.31Å; S409-A413 WeakPolarHBondContact O-CB 3.41Å; S409-A413 PolarHBondContact O-N 2.97Å; M410-A413 PolarHBondContact O-N 3.1Å
414	D	90.1	Very high	91.6	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.123	22%	0.221	C	C	.	.			trans	-141.7	116.7	-179.3	-178.4	16.7	0	0	0	112.2	M410 A416 V417 F418 K487	M410-D414 PolarHBondContact O-N 2.97Å; M410-D414 VanDerWaalsContact O-N 3.13Å; D414-A416 PolarHBondContact O-N 3.36Å; D414-A416 VanDerWaalsContact O-N 3.13Å; D414-A416 PolarHBondContact OD1-N 2.88Å; D414-V417 HydrophobicContact CB-CG2 4.1Å; D414-V417 WeakPolarHBondContact O-CB 3.47Å; D414-V417 PolarHBondContact O-N 3.3Å; D414-F418 PolarHBondContact O-N 3.24Å; D414-K487 HydrophobicContact CB-CB 4.03Å; D414-K487 PolarHBondContact OD1-N 3.45Å; D414-K487 VanDerWaalsContact OD1-N 3.07Å
415	R	88.1	Confident	91.9	Very high	23 Å²	23	39.5 Å²	39.5	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-53.7	-33.2	175	-175.9	67.3	-174.5	-161	-4.9	112.9	V417 F418 E419 T481 I484 P485 F486	R415-V417 VanDerWaalsContact C-N 3.3Å; R415-V417 PolarHBondContact O-N 3.18Å; R415-F418 PolarHBondContact O-N 3.32Å; R415-E419 HydrophobicContact CG-CG 4.29Å; R415-E419 IonicContact CZ-OE1 3.41Å; R415-E419 IonicContact NE-OE1 3.62Å; R415-E419 PolarHBondContact NE-OE1 3.4Å; R415-E419 IonicContact NH2-OE1 3.76Å; R415-E419 PolarHBondContact NH2-OE1 2.87Å; R415-E419 WeakPolarHBondContact O-CG 3.45Å; R415-E419 PolarHBondContact O-N 3Å; R415-T481 PolarHBondContact NH1-O 3.3Å; R415-I484 HydrophobicContact CB-CG2 3.98Å; R415-P485 WeakPolarHBondContact CB-O 3.02Å; R415-P485 PolarHBondContact N-O 2.95Å; R415-F486 HydrophobicContact CB-CD1 3.79Å; R415-F486 HydrophobicContact CB-CD2 4.21Å; R415-F486 HydrophobicContact CB-CE1 3.92Å; R415-F486 HydrophobicContact CB-CE2 4.33Å; R415-F486 HydrophobicContact CB-CG 3.94Å; R415-F486 HydrophobicContact CB-CZ 4.18Å; R415-F486 HydrophobicContact CG-CD1 4.19Å; R415-F486 HydrophobicContact CG-CD2 4.19Å; R415-F486 HydrophobicContact CG-CE1 3.83Å; R415-F486 HydrophobicContact CG-CE2 3.83Å; R415-F486 HydrophobicContact CG-CG 4.35Å; R415-F486 HydrophobicContact CG-CZ 3.63Å
416	A	88.9	Confident	92	Very high	8 Å²	8	37.3 Å²	37.3	7%	0.066	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-32.7	178.6	0	0	0	0	0	112.7	D414 K420 F486	D414-A416 PolarHBondContact O-N 3.36Å; D414-A416 VanDerWaalsContact O-N 3.13Å; D414-A416 PolarHBondContact OD1-N 2.88Å; A416-K420 WeakPolarHBondContact O-CB 3.4Å; A416-K420 WeakPolarHBondContact O-CD 3.46Å; A416-K420 WeakPolarHBondContact O-CG 3.33Å; A416-K420 PolarHBondContact O-N 3.24Å; A416-K420 VanDerWaalsContact O-N 3.16Å; A416-F486 HydrophobicContact CB-CD1 3.84Å; A416-F486 HydrophobicContact CB-CE1 3.87Å
417	V	91	Very high	92.1	Very high	16 Å²	16	32.7 Å²	32.7	10%	0.097	18%	0.178	C	C	.	.	H	α-helix	trans	-72	-44.4	175.2	177.4	0	0	0	0	109.8	Y282 K285 M410 D414 R415 E419 K420 G421	Y282-V417 HydrophobicContact CE2-CG1 4.37Å; K285-V417 HydrophobicContact CD-CG2 4.49Å; M410-V417 HydrophobicContact CB-CG1 4.31Å; D414-V417 HydrophobicContact CB-CG2 4.1Å; D414-V417 WeakPolarHBondContact O-CB 3.47Å; D414-V417 PolarHBondContact O-N 3.3Å; R415-V417 VanDerWaalsContact C-N 3.3Å; R415-V417 PolarHBondContact O-N 3.18Å; V417-E419 PolarHBondContact O-N 3.49Å; V417-K420 PolarHBondContact O-N 3.11Å; V417-G421 PolarHBondContact O-N 3.3Å
418	F	91.3	Very high	92.3	Very high	9 Å²	9	32.7 Å²	32.7	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-56	-51	174.8	170.2	-105.4	0	0	0	112.5	A411 D414 R415 K420 G421 M422 L458 R459 T481 I484	A411-F418 HydrophobicContact CB-CB 4.27Å; D414-F418 PolarHBondContact O-N 3.24Å; R415-F418 PolarHBondContact O-N 3.32Å; F418-K420 VanDerWaalsContact C-N 3.33Å; F418-K420 PolarHBondContact O-N 3.47Å; F418-G421 PolarHBondContact O-N 2.81Å; F418-M422 HydrophobicContact CD2-CG 4.42Å; F418-M422 HydrophobicContact CE1-CG 4.34Å; F418-M422 HydrophobicContact CE2-CG 4.01Å; F418-M422 HydrophobicContact CE2-SD 4.23Å; F418-M422 HydrophobicContact CZ-CG 3.98Å; F418-M422 HydrophobicContact CZ-SD 4.37Å; F418-M422 WeakPolarHBondContact O-CG 3.44Å; F418-M422 PolarHBondContact O-N 3.45Å; F418-M422 VanDerWaalsContact O-N 3.07Å; F418-L458 HydrophobicContact CD2-CB 4.29Å; F418-L458 HydrophobicContact CD2-CD1 3.74Å; F418-L458 HydrophobicContact CD2-CG 4.03Å; F418-L458 HydrophobicContact CE2-CB 3.98Å; F418-L458 HydrophobicContact CE2-CD1 4.13Å; F418-L458 HydrophobicContact CE2-CG 4.24Å; F418-R459 HydrophobicContact CE2-CG 4.48Å; F418-R459 HydrophobicContact CZ-CG 4.26Å; F418-T481 HydrophobicContact CE2-CG2 4.14Å; F418-T481 HydrophobicContact CZ-CG2 4.06Å; F418-I484 HydrophobicContact CG-CD1 4.44Å
419	E	90.8	Very high	92.4	Very high	71 Å²	71	30.7 Å²	30.7	33%	0.332	17%	0.169	S	C	.	.	H	α-helix	trans	-66	-35.4	-179.4	-72	-178.1	176.9	0	0	112.6	R415 V417 K423	R415-E419 HydrophobicContact CG-CG 4.29Å; R415-E419 IonicContact CZ-OE1 3.41Å; R415-E419 IonicContact NE-OE1 3.62Å; R415-E419 PolarHBondContact NE-OE1 3.4Å; R415-E419 IonicContact NH2-OE1 3.76Å; R415-E419 PolarHBondContact NH2-OE1 2.87Å; R415-E419 WeakPolarHBondContact O-CG 3.45Å; R415-E419 PolarHBondContact O-N 3Å; V417-E419 PolarHBondContact O-N 3.49Å; E419-K423 WeakPolarHBondContact O-CB 3.14Å; E419-K423 PolarHBondContact O-N 2.92Å
420	K	93	Very high	92.4	Very high	42 Å²	42	31.8 Å²	31.8	18%	0.183	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-44.1	173.4	-79.5	173.7	-180	-111.3	0	111.7	E281 Y282 K285 A416 V417 F418 K423 A424	E281-K420 IonicContact OE2-NZ 3.54Å; E281-K420 PolarHBondContact OE2-NZ 3.4Å; Y282-K420 HydrophobicContact CD2-CB 4.24Å; K285-K420 HydrophobicContact CD-CD 3.86Å; A416-K420 WeakPolarHBondContact O-CB 3.4Å; A416-K420 WeakPolarHBondContact O-CD 3.46Å; A416-K420 WeakPolarHBondContact O-CG 3.33Å; A416-K420 PolarHBondContact O-N 3.24Å; A416-K420 VanDerWaalsContact O-N 3.16Å; V417-K420 PolarHBondContact O-N 3.11Å; F418-K420 VanDerWaalsContact C-N 3.33Å; F418-K420 PolarHBondContact O-N 3.47Å; K420-K423 PolarHBondContact O-N 3.28Å; K420-A424 WeakPolarHBondContact O-CB 3.33Å; K420-A424 PolarHBondContact O-N 3.46Å
421	G	93.9	Very high	92.4	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-47.1	176.5	0	0	0	0	0	112.1	Y282 V417 F418 K423 A424 F425	Y282-G421 VanDerWaalsContact CD2-CA 3.41Å; V417-G421 PolarHBondContact O-N 3.3Å; F418-G421 PolarHBondContact O-N 2.81Å; G421-K423 PolarHBondContact O-N 3.06Å; G421-A424 PolarHBondContact O-N 3.45Å; G421-F425 PolarHBondContact O-N 2.98Å
422	M	92.8	Very high	92.5	Very high	27 Å²	27	31.4 Å²	31.4	13%	0.133	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-45.8	176.5	-66.1	-65.9	-75.9	0	0	112.2	F418 V426 L457 R459 P461	F418-M422 HydrophobicContact CD2-CG 4.42Å; F418-M422 HydrophobicContact CE1-CG 4.34Å; F418-M422 HydrophobicContact CE2-CG 4.01Å; F418-M422 HydrophobicContact CE2-SD 4.23Å; F418-M422 HydrophobicContact CZ-CG 3.98Å; F418-M422 HydrophobicContact CZ-SD 4.37Å; F418-M422 WeakPolarHBondContact O-CG 3.44Å; F418-M422 PolarHBondContact O-N 3.45Å; F418-M422 VanDerWaalsContact O-N 3.07Å; M422-V426 WeakPolarHBondContact O-CG2 3.44Å; M422-V426 PolarHBondContact O-N 3.11Å; M422-V426 VanDerWaalsContact O-N 3.12Å; M422-L457 HydrophobicContact CG-CD2 4.5Å; M422-L457 HydrophobicContact SD-CD1 4.17Å; M422-L457 HydrophobicContact SD-CD2 3.86Å; M422-L457 HydrophobicContact SD-CG 4.44Å; M422-R459 HydrophobicContact CE-CG 4.2Å; M422-R459 VanDerWaalsContact SD-O 3.36Å; M422-P461 VanDerWaalsContact CE-CA 3.44Å; M422-P461 HydrophobicContact CE-CB 3.61Å; M422-P461 HydrophobicContact CE-CG 4.37Å
423	K	94.3	Very high	92.5	Very high	130 Å²	130	31 Å²	31	57%	0.565	17%	0.173	S	C	*	.	H	α-helix	trans	-66.8	-39.3	178.6	-171.9	179.4	-178	178.3	0	111.9	A278 E419 K420 G421 S427	A278-K423 HydrophobicContact CB-CB 4.49Å; A278-K423 HydrophobicContact CB-CD 4.34Å; A278-K423 HydrophobicContact CB-CG 3.96Å; E419-K423 WeakPolarHBondContact O-CB 3.14Å; E419-K423 PolarHBondContact O-N 2.92Å; K420-K423 PolarHBondContact O-N 3.28Å; G421-K423 PolarHBondContact O-N 3.06Å; K423-S427 VanDerWaalsContact O-CB 3.31Å; K423-S427 WeakPolarHBondContact O-CB 3.17Å; K423-S427 PolarHBondContact O-N 3.38Å; K423-S427 PolarHBondContact O-OG 3.19Å
424	A	95.5	Very high	92.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-51.1	177.2	0	0	0	0	0	110.3	A278 Y282 K420 G421 V426 S427 Y428 F455	A278-A424 HydrophobicContact CB-CB 4.36Å; Y282-A424 HydrophobicContact CD1-CB 4.24Å; Y282-A424 HydrophobicContact CG-CB 4.14Å; K420-A424 WeakPolarHBondContact O-CB 3.33Å; K420-A424 PolarHBondContact O-N 3.46Å; G421-A424 PolarHBondContact O-N 3.45Å; A424-V426 PolarHBondContact O-N 2.8Å; A424-S427 PolarHBondContact O-N 2.96Å; A424-S427 PolarHBondContact O-OG 3.02Å; A424-Y428 WeakPolarHBondContact O-CB 3.36Å; A424-Y428 PolarHBondContact O-N 3Å; A424-F455 HydrophobicContact CB-CD1 4.07Å; A424-F455 HydrophobicContact CB-CE1 3.74Å
425	F	95.4	Very high	92.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.5	-52.4	176.5	179.6	-84.5	0	0	0	112.4	G421 S427 Y428 V429 F448 L451 A452 F455 L457 P461 M463 L466	G421-F425 PolarHBondContact O-N 2.98Å; F425-S427 VanDerWaalsContact C-N 3.28Å; F425-S427 PolarHBondContact O-N 3Å; F425-Y428 PolarHBondContact O-N 3.17Å; F425-V429 HydrophobicContact CD1-CG2 4.2Å; F425-V429 HydrophobicContact CE1-CG2 3.84Å; F425-V429 HydrophobicContact CZ-CG2 4.03Å; F425-V429 WeakPolarHBondContact O-CG2 3.13Å; F425-V429 PolarHBondContact O-N 3.43Å; F425-F448 HydrophobicContact CZ-CD1 4.26Å; F425-L451 HydrophobicContact CD2-CD2 4.35Å; F425-L451 HydrophobicContact CD2-CG 4.22Å; F425-L451 HydrophobicContact CE2-CB 4.18Å; F425-L451 HydrophobicContact CE2-CD2 3.75Å; F425-L451 HydrophobicContact CE2-CG 3.77Å; F425-L451 HydrophobicContact CZ-CD2 4.3Å; F425-A452 HydrophobicContact CE2-CB 3.9Å; F425-A452 HydrophobicContact CZ-CB 4.42Å; F425-F455 HydrophobicContact CB-CB 4.48Å; F425-F455 HydrophobicContact CB-CD1 4.16Å; F425-F455 HydrophobicContact CB-CG 4.13Å; F425-F455 HydrophobicContact CD2-CB 4.29Å; F425-F455 AromaticContact CD2-CD2 3.85Å; F425-F455 HydrophobicContact CD2-CD2 3.85Å; F425-F455 HydrophobicContact CD2-CE2 4.41Å; F425-F455 HydrophobicContact CD2-CG 4.1Å; F425-L457 HydrophobicContact CB-CD1 3.94Å; F425-L457 HydrophobicContact CB-CD2 4.42Å; F425-L457 HydrophobicContact CD1-CD1 4.22Å; F425-L457 HydrophobicContact CD2-CD1 3.76Å; F425-L457 HydrophobicContact CE2-CD1 4.29Å; F425-L457 HydrophobicContact CG-CD1 3.7Å; F425-P461 HydrophobicContact CD1-CG 3.47Å; F425-P461 VanDerWaalsContact CD1-CG 3.47Å; F425-P461 HydrophobicContact CE1-CG 3.63Å; F425-P461 HydrophobicContact CG-CG 4.47Å; F425-M463 HydrophobicContact CD1-SD 4.4Å; F425-M463 HydrophobicContact CE1-SD 4.09Å; F425-L466 HydrophobicContact CE1-CD1 4.16Å
426	V	94.6	Very high	92.5	Very high	34 Å²	34	40 Å²	40	21%	0.206	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-43.7	-179.5	172.7	0	0	0	0	110.6	M422 A424 Q430 P461 M463	M422-V426 WeakPolarHBondContact O-CG2 3.44Å; M422-V426 PolarHBondContact O-N 3.11Å; M422-V426 VanDerWaalsContact O-N 3.12Å; A424-V426 PolarHBondContact O-N 2.8Å; V426-Q430 VanDerWaalsContact O-CG 3.31Å; V426-Q430 WeakPolarHBondContact O-CG 3.41Å; V426-Q430 PolarHBondContact O-N 2.95Å; V426-Q430 VanDerWaalsContact O-N 3.13Å; V426-P461 HydrophobicContact CG2-CB 3.71Å; V426-P461 HydrophobicContact CG2-CG 3.97Å; V426-M463 HydrophobicContact CB-CE 4.47Å; V426-M463 HydrophobicContact CB-SD 4.47Å; V426-M463 HydrophobicContact CG1-CE 4.05Å; V426-M463 HydrophobicContact CG1-SD 4.46Å; V426-M463 HydrophobicContact CG2-SD 3.99Å
427	S	94.6	Very high	92.5	Very high	21 Å²	21	40.1 Å²	40.1	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-37	179.3	73.8	0	0	0	0	112.9	T276 K423 A424 F425 Q430 A431	T276-S427 WeakPolarHBondContact CB-OG 3.3Å; T276-S427 WeakPolarHBondContact CG2-O 3.39Å; T276-S427 PolarHBondContact OG1-OG 3.3Å; K423-S427 VanDerWaalsContact O-CB 3.31Å; K423-S427 WeakPolarHBondContact O-CB 3.17Å; K423-S427 PolarHBondContact O-N 3.38Å; K423-S427 PolarHBondContact O-OG 3.19Å; A424-S427 PolarHBondContact O-N 2.96Å; A424-S427 PolarHBondContact O-OG 3.02Å; F425-S427 VanDerWaalsContact C-N 3.28Å; F425-S427 PolarHBondContact O-N 3Å; S427-Q430 PolarHBondContact O-N 3.27Å; S427-A431 WeakPolarHBondContact O-CB 3.41Å; S427-A431 PolarHBondContact O-N 2.74Å
428	Y	95.1	Very high	92.4	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.027	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-49.9	177.7	171.9	-92.1	0	0	0	110.3	D344 A424 F425 Q430 A431 Y432 L451 F455	D344-Y428 HydrophobicContact CB-CE2 4.48Å; D344-Y428 VanDerWaalsContact OD1-CE2 3.28Å; D344-Y428 WeakPolarHBondContact OD1-CE2 3.29Å; A424-Y428 WeakPolarHBondContact O-CB 3.36Å; A424-Y428 PolarHBondContact O-N 3Å; F425-Y428 PolarHBondContact O-N 3.17Å; Y428-Q430 VanDerWaalsContact C-N 3.27Å; Y428-Q430 PolarHBondContact O-N 2.83Å; Y428-A431 PolarHBondContact O-N 3.15Å; Y428-Y432 HydrophobicContact CE1-CD2 4.17Å; Y428-Y432 AromaticContact CZ-CD2 3.89Å; Y428-Y432 WeakPolarHBondContact O-CB 3.45Å; Y428-Y432 PolarHBondContact O-N 2.84Å; Y428-L451 HydrophobicContact CD1-CD1 4.19Å; Y428-L451 HydrophobicContact CD1-CD2 3.86Å; Y428-L451 HydrophobicContact CE1-CD1 3.71Å; Y428-L451 HydrophobicContact CE1-CD2 3.73Å; Y428-L451 HydrophobicContact CE1-CG 4.34Å; Y428-F455 HydrophobicContact CD1-CE2 4.24Å; Y428-F455 HydrophobicContact CD1-CZ 4.4Å; Y428-F455 HydrophobicContact CD2-CZ 4.38Å; Y428-F455 HydrophobicContact CG-CE2 4.23Å; Y428-F455 AromaticContact CG-CZ 3.94Å; Y428-F455 HydrophobicContact CG-CZ 3.94Å
429	V	93.9	Very high	92.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-40.6	177.9	173.2	0	0	0	0	111.2	F425 Y432 A433 L443 F448 L451 M463 E465	F425-V429 HydrophobicContact CD1-CG2 4.2Å; F425-V429 HydrophobicContact CE1-CG2 3.84Å; F425-V429 HydrophobicContact CZ-CG2 4.03Å; F425-V429 WeakPolarHBondContact O-CG2 3.13Å; F425-V429 PolarHBondContact O-N 3.43Å; V429-Y432 PolarHBondContact O-N 2.8Å; V429-A433 WeakPolarHBondContact O-CB 3.49Å; V429-A433 PolarHBondContact O-N 3.2Å; V429-L443 HydrophobicContact CG1-CD1 3.92Å; V429-F448 HydrophobicContact CG1-CE1 3.99Å; V429-F448 HydrophobicContact CG2-CE1 4.22Å; V429-L451 HydrophobicContact CG2-CD2 4.05Å; V429-M463 HydrophobicContact CB-CE 3.83Å; V429-M463 HydrophobicContact CG1-CE 3.66Å; V429-E465 HydrophobicContact CG1-CB 4.3Å; V429-E465 HydrophobicContact CG1-CG 4.33Å
430	Q	92.2	Very high	92.3	Very high	84 Å²	84	48.8 Å²	48.8	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-66.7	-36.9	175.6	-73.6	177.5	-12	0	0	113.4	V426 S427 Y428 K434	V426-Q430 VanDerWaalsContact O-CG 3.31Å; V426-Q430 WeakPolarHBondContact O-CG 3.41Å; V426-Q430 PolarHBondContact O-N 2.95Å; V426-Q430 VanDerWaalsContact O-N 3.13Å; S427-Q430 PolarHBondContact O-N 3.27Å; Y428-Q430 VanDerWaalsContact C-N 3.27Å; Y428-Q430 PolarHBondContact O-N 2.83Å; Q430-K434 WeakPolarHBondContact O-CG 3.35Å; Q430-K434 PolarHBondContact O-N 3.43Å
431	A	92.4	Very high	92.2	Very high	21 Å²	21	47 Å²	47	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-42.4	175.8	0	0	0	0	0	111	T276 S427 Y428 A433 K434 H435	T276-A431 HydrophobicContact CG2-CB 3.71Å; S427-A431 WeakPolarHBondContact O-CB 3.41Å; S427-A431 PolarHBondContact O-N 2.74Å; Y428-A431 PolarHBondContact O-N 3.15Å; A431-A433 VanDerWaalsContact C-N 3.34Å; A431-A433 PolarHBondContact O-N 3.47Å; A431-K434 CarbonylContact O-C 3.59Å; A431-K434 PolarHBondContact O-N 2.91Å; A431-K434 VanDerWaalsContact O-N 3.11Å; A431-H435 PolarHBondContact O-N 2.99Å
432	Y	92.4	Very high	92	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.039	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-44.3	175.6	-160.9	-88.2	0	0	0	111.8	E376 Y428 V429 K434 H435 F441 L446	E376-Y432 WeakPolarHBondContact OE1-CE2 3.29Å; E376-Y432 VanDerWaalsContact OE1-CZ 3.3Å; E376-Y432 PolarHBondContact OE1-OH 3.2Å; Y428-Y432 HydrophobicContact CE1-CD2 4.17Å; Y428-Y432 AromaticContact CZ-CD2 3.89Å; Y428-Y432 WeakPolarHBondContact O-CB 3.45Å; Y428-Y432 PolarHBondContact O-N 2.84Å; V429-Y432 PolarHBondContact O-N 2.8Å; Y432-K434 PolarHBondContact O-N 3.2Å; Y432-H435 WeakPolarHBondContact O-CB 3.2Å; Y432-H435 PolarHBondContact O-N 2.72Å; Y432-F441 HydrophobicContact CD1-CB 4.34Å; Y432-F441 HydrophobicContact CD2-CD1 4.42Å; Y432-F441 HydrophobicContact CE1-CB 3.84Å; Y432-F441 HydrophobicContact CE2-CB 4.32Å; Y432-F441 AromaticContact CE2-CD1 3.6Å; Y432-F441 HydrophobicContact CE2-CD1 3.6Å; Y432-F441 HydrophobicContact CE2-CE1 4.47Å; Y432-F441 HydrophobicContact CE2-CG 4.42Å; Y432-F441 AromaticContact CZ-CD1 3.66Å; Y432-L446 HydrophobicContact CD1-CD2 4.14Å; Y432-L446 HydrophobicContact CE1-CD2 4.36Å; Y432-L446 HydrophobicContact CG-CD2 4.4Å
433	A	91.2	Very high	91.8	Very high	53 Å²	53	53.9 Å²	53.9	44%	0.438	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-23.9	177.4	0	0	0	0	0	114	V429 A431 L443	V429-A433 WeakPolarHBondContact O-CB 3.49Å; V429-A433 PolarHBondContact O-N 3.2Å; A431-A433 VanDerWaalsContact C-N 3.34Å; A431-A433 PolarHBondContact O-N 3.47Å; A433-L443 HydrophobicContact CB-CD1 3.59Å
434	K	90.4	Very high	91.5	Very high	171 Å²	171	57 Å²	57	74%	0.743	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	10.9	-176.2	-67.8	177.5	-180	-177.5	0	112.8	Q430 A431 Y432	Q430-K434 WeakPolarHBondContact O-CG 3.35Å; Q430-K434 PolarHBondContact O-N 3.43Å; A431-K434 CarbonylContact O-C 3.59Å; A431-K434 PolarHBondContact O-N 2.91Å; A431-K434 VanDerWaalsContact O-N 3.11Å; Y432-K434 PolarHBondContact O-N 3.2Å
435	H	91.4	Very high	91.1	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.056	30%	0.299	C	S	.	.			trans	-63.1	139	-180	-163.6	-61.4	0	0	0	110.6	P346 A431 Y432 C437 N438 F441	P346-H435 PolarHBondContact O-CE1 2.9Å; P346-H435 PolarHBondContact O-NE2 3.44Å; A431-H435 PolarHBondContact O-N 2.99Å; Y432-H435 WeakPolarHBondContact O-CB 3.2Å; Y432-H435 PolarHBondContact O-N 2.72Å; H435-C437 PolarHBondContact ND1-N 3.25Å; H435-C437 VanDerWaalsContact ND1-N 3.11Å; H435-C437 PolarHBondContact O-N 2.95Å; H435-N438 PolarHBondContact O-N 3.49Å; H435-F441 HydrophobicContact CB-CB 3.94Å; H435-F441 HydrophobicContact CB-CD2 4.28Å; H435-F441 HydrophobicContact CB-CG 4.25Å; H435-F441 AromaticContact CD2-CD2 3.57Å; H435-F441 AromaticContact CD2-CE2 3.83Å; H435-F441 AromaticContact CD2-CG 3.77Å; H435-F441 AromaticContact CE1-CD2 3.39Å; H435-F441 WeakPolarHBondContact CE1-CD2 3.31Å; H435-F441 AromaticContact CE1-CE2 3.27Å; H435-F441 WeakPolarHBondContact CE1-CE2 3.5Å; H435-F441 AromaticContact CG-CD2 3.47Å; H435-F441 VanDerWaalsContact CG-CD2 3.47Å; H435-F441 AromaticContact CG-CG 3.79Å; H435-F441 AromaticContact ND1-CD2 3.34Å; H435-F441 VanDerWaalsContact ND1-CD2 3.34Å; H435-F441 WeakPolarHBondContact ND1-CD2 3.35Å; H435-F441 AromaticContact ND1-CE2 3.75Å; H435-F441 AromaticContact NE2-CD2 3.53Å; H435-F441 AromaticContact NE2-CE2 3.3Å; H435-F441 VanDerWaalsContact NE2-CE2 3.3Å; H435-F441 WeakPolarHBondContact NE2-CE2 3.45Å; H435-F441 AromaticContact NE2-CZ 3.73Å
436	E	88.2	Confident	90.8	Very high	121 Å²	121	60.6 Å²	60.6	57%	0.565	30%	0.301	S	S	*	.	S	Bend	trans	-56.6	-49.6	180	-176.6	-172.8	-173.5	0	0	111.3	S347 N348 A349 N438	S347-E436 VanDerWaalsContact O-CB 3.22Å; S347-E436 WeakPolarHBondContact O-CB 3.31Å; S347-E436 PolarHBondContact O-N 3.2Å; N348-E436 WeakPolarHBondContact CA-OE2 3.47Å; N348-E436 WeakPolarHBondContact CB-OE2 3.47Å; A349-E436 PolarHBondContact N-OE2 3.1Å; E436-N438 PolarHBondContact O-N 3.31Å
437	C	87.8	Confident	90.6	Very high	12 Å²	12	62.8 Å²	62.8	8%	0.081	31%	0.311	C	S	.	.			trans	-74.2	55.8	172.9	-47.9	0	0	0	0	113.5	F382 H435 L439 I440 F441	F382-C437 WeakPolarHBondContact CE1-SG 3.18Å; F382-C437 VanDerWaalsContact CZ-SG 3.55Å; H435-C437 PolarHBondContact ND1-N 3.25Å; H435-C437 VanDerWaalsContact ND1-N 3.11Å; H435-C437 PolarHBondContact O-N 2.95Å; C437-L439 PolarHBondContact O-N 3.42Å; C437-L439 VanDerWaalsContact O-N 3.1Å; C437-I440 HydrophobicContact CB-CB 4.38Å; C437-I440 HydrophobicContact CB-CD1 4.23Å; C437-I440 HydrophobicContact CB-CG1 4.48Å; C437-I440 PolarHBondContact O-N 3.16Å; C437-F441 HydrophobicContact CB-CD2 3.87Å; C437-F441 HydrophobicContact CB-CE2 4.06Å; C437-F441 WeakPolarHBondContact O-CD2 3.36Å; C437-F441 PolarHBondContact O-N 2.95Å
438	N	88.8	Confident	90.4	Very high	104 Å²	104	62.4 Å²	62.4	56%	0.556	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.1	-177.5	65.3	0.1	0	0	0	114.8	H435 E436 I440 R442	H435-N438 PolarHBondContact O-N 3.49Å; E436-N438 PolarHBondContact O-N 3.31Å; N438-I440 VanDerWaalsContact C-N 3.35Å; N438-R442 WeakPolarHBondContact O-CG 3.48Å
439	L	89.3	Confident	90.2	Very high	145 Å²	145	62.2 Å²	62.2	76%	0.759	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-27.4	175.2	-66.4	178.3	0	0	0	112.9	C437 R442	C437-L439 PolarHBondContact O-N 3.42Å; C437-L439 VanDerWaalsContact O-N 3.1Å; L439-R442 WeakPolarHBondContact O-CD 3.18Å; L439-R442 WeakPolarHBondContact O-CG 3.48Å
440	I	90.8	Very high	90.1	Very high	28 Å²	28	62.8 Å²	62.8	14%	0.144	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-49.7	178	-57.5	174.9	0	0	0	109	Y379 F382 C437 N438 R442	Y379-I440 HydrophobicContact CD2-CD1 4.24Å; F382-I440 HydrophobicContact CB-CD1 3.9Å; F382-I440 HydrophobicContact CG-CD1 4.17Å; C437-I440 HydrophobicContact CB-CB 4.38Å; C437-I440 HydrophobicContact CB-CD1 4.23Å; C437-I440 HydrophobicContact CB-CG1 4.48Å; C437-I440 PolarHBondContact O-N 3.16Å; N438-I440 VanDerWaalsContact C-N 3.35Å; I440-R442 VanDerWaalsContact C-N 3.32Å; I440-R442 PolarHBondContact O-N 3.38Å
441	F	91.6	Very high	90.1	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.026	29%	0.294	C	S	.	.	S	Bend	trans	-88.8	67.7	-179	-61.2	-82.7	0	0	0	111.1	P345 E376 Y379 Y432 H435 C437	P345-F441 HydrophobicContact CB-CE1 3.88Å; P345-F441 HydrophobicContact CB-CZ 3.69Å; P345-F441 HydrophobicContact CG-CE1 3.85Å; P345-F441 HydrophobicContact CG-CZ 4.05Å; E376-F441 HydrophobicContact CB-CE1 4.15Å; E376-F441 HydrophobicContact CG-CD1 3.89Å; E376-F441 HydrophobicContact CG-CE1 3.68Å; Y379-F441 HydrophobicContact CD1-CZ 4.09Å; Y379-F441 AromaticContact CD2-CE2 3.55Å; Y379-F441 HydrophobicContact CD2-CE2 3.55Å; Y379-F441 AromaticContact CD2-CZ 3.82Å; Y379-F441 HydrophobicContact CD2-CZ 3.82Å; Y379-F441 HydrophobicContact CE1-CZ 4.36Å; Y379-F441 AromaticContact CE2-CE2 3.76Å; Y379-F441 HydrophobicContact CE2-CE2 3.76Å; Y379-F441 HydrophobicContact CE2-CZ 4.13Å; Y379-F441 HydrophobicContact CG-CE2 4.01Å; Y379-F441 AromaticContact CG-CZ 3.8Å; Y379-F441 HydrophobicContact CG-CZ 3.8Å; Y432-F441 HydrophobicContact CD1-CB 4.34Å; Y432-F441 HydrophobicContact CD2-CD1 4.42Å; Y432-F441 HydrophobicContact CE1-CB 3.84Å; Y432-F441 HydrophobicContact CE2-CB 4.32Å; Y432-F441 AromaticContact CE2-CD1 3.6Å; Y432-F441 HydrophobicContact CE2-CD1 3.6Å; Y432-F441 HydrophobicContact CE2-CE1 4.47Å; Y432-F441 HydrophobicContact CE2-CG 4.42Å; Y432-F441 AromaticContact CZ-CD1 3.66Å; H435-F441 HydrophobicContact CB-CB 3.94Å; H435-F441 HydrophobicContact CB-CD2 4.28Å; H435-F441 HydrophobicContact CB-CG 4.25Å; H435-F441 AromaticContact CD2-CD2 3.57Å; H435-F441 AromaticContact CD2-CE2 3.83Å; H435-F441 AromaticContact CD2-CG 3.77Å; H435-F441 AromaticContact CE1-CD2 3.39Å; H435-F441 WeakPolarHBondContact CE1-CD2 3.31Å; H435-F441 AromaticContact CE1-CE2 3.27Å; H435-F441 WeakPolarHBondContact CE1-CE2 3.5Å; H435-F441 AromaticContact CG-CD2 3.47Å; H435-F441 VanDerWaalsContact CG-CD2 3.47Å; H435-F441 AromaticContact CG-CG 3.79Å; H435-F441 AromaticContact ND1-CD2 3.34Å; H435-F441 VanDerWaalsContact ND1-CD2 3.34Å; H435-F441 WeakPolarHBondContact ND1-CD2 3.35Å; H435-F441 AromaticContact ND1-CE2 3.75Å; H435-F441 AromaticContact NE2-CD2 3.53Å; H435-F441 AromaticContact NE2-CE2 3.3Å; H435-F441 VanDerWaalsContact NE2-CE2 3.3Å; H435-F441 WeakPolarHBondContact NE2-CE2 3.45Å; H435-F441 AromaticContact NE2-CZ 3.73Å; C437-F441 HydrophobicContact CB-CD2 3.87Å; C437-F441 HydrophobicContact CB-CE2 4.06Å; C437-F441 WeakPolarHBondContact O-CD2 3.36Å; C437-F441 PolarHBondContact O-N 2.95Å
442	R	90.1	Very high	90	Very high	132 Å²	132	58.1 Å²	58.1	50%	0.498	29%	0.286	S	S	.	.			trans	-84.7	118.8	-177.7	-62.7	-172.4	-55.9	-170	1.6	111	N438 L439 I440 K444 D445	N438-R442 WeakPolarHBondContact O-CG 3.48Å; L439-R442 WeakPolarHBondContact O-CD 3.18Å; L439-R442 WeakPolarHBondContact O-CG 3.48Å; I440-R442 VanDerWaalsContact C-N 3.32Å; I440-R442 PolarHBondContact O-N 3.38Å; R442-K444 PolarHBondContact O-N 3.24Å; R442-K444 VanDerWaalsContact O-N 3.08Å; R442-D445 IonicContact CZ-OD2 3.67Å; R442-D445 IonicContact NE-OD1 3.36Å; R442-D445 IonicContact NE-OD2 3.4Å; R442-D445 PolarHBondContact NE-OD2 3.38Å; R442-D445 IonicContact NH2-OD1 3.52Å; R442-D445 IonicContact NH2-OD2 3.58Å; R442-D445 PolarHBondContact NH2-OD2 3.13Å; R442-D445 PolarHBondContact O-N 3.33Å
443	L	88.3	Confident	90	Very high	40 Å²	40	59.9 Å²	59.9	21%	0.209	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21	177.5	-168.8	142.1	0	0	0	113.6	V429 A433 D445 F448 E465	V429-L443 HydrophobicContact CG1-CD1 3.92Å; A433-L443 HydrophobicContact CB-CD1 3.59Å; L443-D445 VanDerWaalsContact C-N 3.35Å; L443-F448 HydrophobicContact CD2-CE2 4.44Å; L443-F448 HydrophobicContact CD2-CZ 3.69Å; L443-F448 HydrophobicContact CG-CZ 3.94Å; L443-E465 HydrophobicContact CD1-CG 4.47Å
444	K	87.6	Confident	89.9	Confident	196 Å²	196	57.6 Å²	57.6	85%	0.852	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.7	176.4	-68.1	-178.4	179.6	179.1	0	112.9	R442	R442-K444 PolarHBondContact O-N 3.24Å; R442-K444 VanDerWaalsContact O-N 3.08Å
445	D	87.9	Confident	90	Very high	67 Å²	67	49.7 Å²	49.7	36%	0.358	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-8.5	-176.2	-53.2	-19.7	0	0	0	112	M375 R442 L443 D447	M375-D445 HydrophobicContact CG-CB 4.46Å; R442-D445 IonicContact CZ-OD2 3.67Å; R442-D445 IonicContact NE-OD1 3.36Å; R442-D445 IonicContact NE-OD2 3.4Å; R442-D445 PolarHBondContact NE-OD2 3.38Å; R442-D445 IonicContact NH2-OD1 3.52Å; R442-D445 IonicContact NH2-OD2 3.58Å; R442-D445 PolarHBondContact NH2-OD2 3.13Å; R442-D445 PolarHBondContact O-N 3.33Å; L443-D445 VanDerWaalsContact C-N 3.35Å; D445-D447 PolarHBondContact O-N 2.97Å
446	L	88.8	Confident	90	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.042	24%	0.24	C	C	.	.			trans	-71.6	117.2	-179.7	-171.8	63.6	0	0	0	110.3	L373 M375 Y432 F448 L451	L373-L446 HydrophobicContact CD1-CD1 3.78Å; M375-L446 HydrophobicContact CE-CB 4.34Å; M375-L446 HydrophobicContact CE-CD1 3.55Å; Y432-L446 HydrophobicContact CD1-CD2 4.14Å; Y432-L446 HydrophobicContact CE1-CD2 4.36Å; Y432-L446 HydrophobicContact CG-CD2 4.4Å; L446-F448 HydrophobicContact CD2-CE1 4.13Å; L446-F448 HydrophobicContact CD2-CZ 4.43Å; L446-F448 VanDerWaalsContact O-CD2 3.23Å; L446-F448 WeakPolarHBondContact O-CD2 3.42Å; L446-F448 WeakPolarHBondContact O-CE2 3.17Å; L446-F448 PolarHBondContact O-N 3.42Å; L446-L451 HydrophobicContact CD1-CD2 4.34Å; L446-L451 HydrophobicContact CD2-CD2 3.86Å; L446-L451 HydrophobicContact CG-CD2 4.19Å
447	D	90.4	Very high	90.2	Very high	81 Å²	81	43.7 Å²	43.7	43%	0.433	21%	0.214	S	C	.	.			trans	-71.4	98.6	170.7	-178.9	-5.9	0	0	0	110.2	D445 A449 S450 L451	D445-D447 PolarHBondContact O-N 2.97Å; D447-A449 VanDerWaalsContact C-N 3.27Å; D447-A449 PolarHBondContact O-N 3.13Å; D447-A449 WeakPolarHBondContact OD1-CA 3.45Å; D447-A449 WeakPolarHBondContact OD1-CB 3.42Å; D447-A449 PolarHBondContact OD1-N 3.07Å; D447-S450 PolarHBondContact OD1-N 3.46Å; D447-S450 WeakPolarHBondContact OD2-CB 3.43Å; D447-L451 WeakPolarHBondContact O-CB 3.23Å; D447-L451 PolarHBondContact O-N 3.08Å
448	F	90.8	Very high	90.3	Very high	12 Å²	12	43.2 Å²	43.2	5%	0.053	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-27.4	178.5	-67.3	-77.8	0	0	0	113.5	F425 V429 L443 L446 A452 M460 L466 F471	F425-F448 HydrophobicContact CZ-CD1 4.26Å; V429-F448 HydrophobicContact CG1-CE1 3.99Å; V429-F448 HydrophobicContact CG2-CE1 4.22Å; L443-F448 HydrophobicContact CD2-CE2 4.44Å; L443-F448 HydrophobicContact CD2-CZ 3.69Å; L443-F448 HydrophobicContact CG-CZ 3.94Å; L446-F448 HydrophobicContact CD2-CE1 4.13Å; L446-F448 HydrophobicContact CD2-CZ 4.43Å; L446-F448 VanDerWaalsContact O-CD2 3.23Å; L446-F448 WeakPolarHBondContact O-CD2 3.42Å; L446-F448 WeakPolarHBondContact O-CE2 3.17Å; L446-F448 PolarHBondContact O-N 3.42Å; F448-A452 WeakPolarHBondContact O-CB 3.48Å; F448-A452 PolarHBondContact O-N 3.03Å; F448-M460 HydrophobicContact CB-CE 4.23Å; F448-L466 HydrophobicContact CB-CD2 4.27Å; F448-L466 HydrophobicContact CD1-CD2 3.39Å; F448-L466 HydrophobicContact CD2-CD2 4.29Å; F448-L466 HydrophobicContact CE1-CD2 3.71Å; F448-L466 HydrophobicContact CG-CD2 3.71Å; F448-L466 HydrophobicContact CZ-CD2 4.3Å; F448-F471 HydrophobicContact CB-CD1 4.01Å; F448-F471 HydrophobicContact CB-CE1 3.61Å; F448-F471 HydrophobicContact CB-CZ 4.42Å; F448-F471 HydrophobicContact CD2-CE1 4.12Å; F448-F471 HydrophobicContact CG-CE1 4.09Å
449	A	90.4	Very high	90.3	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-74.3	-53.1	-179.2	0	0	0	0	0	110.1	D447 L451 A452 Q453 D473 F474	D447-A449 VanDerWaalsContact C-N 3.27Å; D447-A449 PolarHBondContact O-N 3.13Å; D447-A449 WeakPolarHBondContact OD1-CA 3.45Å; D447-A449 WeakPolarHBondContact OD1-CB 3.42Å; D447-A449 PolarHBondContact OD1-N 3.07Å; A449-L451 VanDerWaalsContact C-N 3.29Å; A449-L451 PolarHBondContact O-N 3.04Å; A449-A452 PolarHBondContact O-N 3.41Å; A449-Q453 WeakPolarHBondContact O-CG 3.33Å; A449-Q453 PolarHBondContact O-N 3.06Å; A449-D473 HydrophobicContact CB-CB 4.02Å; A449-F474 HydrophobicContact CB-CB 4.06Å
450	S	90.9	Very high	90.2	Very high	12 Å²	12	37.5 Å²	37.5	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-41.4	174	173.8	0	0	0	0	111.2	D252 D447 A452 Q453 G454	D252-S450 PolarHBondContact N-OG 2.74Å; D252-S450 PolarHBondContact OD1-OG 3.4Å; D447-S450 PolarHBondContact OD1-N 3.46Å; D447-S450 WeakPolarHBondContact OD2-CB 3.43Å; S450-A452 PolarHBondContact O-N 3.33Å; S450-Q453 WeakPolarHBondContact O-CB 3.37Å; S450-Q453 PolarHBondContact O-N 2.92Å; S450-G454 PolarHBondContact O-N 3.05Å
451	L	91.7	Very high	90.1	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-45.7	175.3	-173.7	68.8	0	0	0	112.3	A251 F425 Y428 V429 L446 D447 A449 Q453 G454 F455	A251-L451 HydrophobicContact CB-CB 4.32Å; A251-L451 HydrophobicContact CB-CD1 4.15Å; F425-L451 HydrophobicContact CD2-CD2 4.35Å; F425-L451 HydrophobicContact CD2-CG 4.22Å; F425-L451 HydrophobicContact CE2-CB 4.18Å; F425-L451 HydrophobicContact CE2-CD2 3.75Å; F425-L451 HydrophobicContact CE2-CG 3.77Å; F425-L451 HydrophobicContact CZ-CD2 4.3Å; Y428-L451 HydrophobicContact CD1-CD1 4.19Å; Y428-L451 HydrophobicContact CD1-CD2 3.86Å; Y428-L451 HydrophobicContact CE1-CD1 3.71Å; Y428-L451 HydrophobicContact CE1-CD2 3.73Å; Y428-L451 HydrophobicContact CE1-CG 4.34Å; V429-L451 HydrophobicContact CG2-CD2 4.05Å; L446-L451 HydrophobicContact CD1-CD2 4.34Å; L446-L451 HydrophobicContact CD2-CD2 3.86Å; L446-L451 HydrophobicContact CG-CD2 4.19Å; D447-L451 WeakPolarHBondContact O-CB 3.23Å; D447-L451 PolarHBondContact O-N 3.08Å; A449-L451 VanDerWaalsContact C-N 3.29Å; A449-L451 PolarHBondContact O-N 3.04Å; L451-Q453 VanDerWaalsContact C-N 3.26Å; L451-Q453 PolarHBondContact O-N 2.87Å; L451-G454 PolarHBondContact O-N 3.13Å; L451-G454 VanDerWaalsContact O-N 3.11Å; L451-F455 HydrophobicContact CD1-CD2 4.11Å; L451-F455 HydrophobicContact CD1-CE2 3.78Å; L451-F455 HydrophobicContact CG-CD2 4.16Å; L451-F455 HydrophobicContact CG-CE2 4.15Å; L451-F455 WeakPolarHBondContact O-CD2 3.48Å; L451-F455 PolarHBondContact O-N 3.41Å
452	A	92.3	Very high	89.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-33.9	178.2	0	0	0	0	0	112.1	F425 F448 A449 S450 F455 A456 L457 M460 F474	F425-A452 HydrophobicContact CE2-CB 3.9Å; F425-A452 HydrophobicContact CZ-CB 4.42Å; F448-A452 WeakPolarHBondContact O-CB 3.48Å; F448-A452 PolarHBondContact O-N 3.03Å; A449-A452 PolarHBondContact O-N 3.41Å; S450-A452 PolarHBondContact O-N 3.33Å; A452-F455 PolarHBondContact O-N 3.33Å; A452-A456 PolarHBondContact O-N 3.33Å; A452-L457 HydrophobicContact CB-CB 4.49Å; A452-L457 HydrophobicContact CB-CD1 4.02Å; A452-L457 HydrophobicContact CB-CG 4.43Å; A452-L457 PolarHBondContact O-N 3.07Å; A452-M460 HydrophobicContact CB-CE 4.33Å; A452-M460 HydrophobicContact CB-SD 3.48Å; A452-M460 WeakPolarHBondContact CB-SD 3.31Å; A452-F474 HydrophobicContact CB-CD2 3.72Å; A452-F474 HydrophobicContact CB-CE2 3.6Å
453	Q	90.6	Very high	89.6	Confident	48 Å²	48	41.1 Å²	41.1	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-44.2	170.3	-67.4	178.3	10.8	0	0	111.3	D252 L404 A449 S450 L451 F455 A456 D473 F474	D252-Q453 HydrophobicContact CB-CB 4.35Å; L404-Q453 WeakPolarHBondContact CD1-O 3.34Å; A449-Q453 WeakPolarHBondContact O-CG 3.33Å; A449-Q453 PolarHBondContact O-N 3.06Å; S450-Q453 WeakPolarHBondContact O-CB 3.37Å; S450-Q453 PolarHBondContact O-N 2.92Å; L451-Q453 VanDerWaalsContact C-N 3.26Å; L451-Q453 PolarHBondContact O-N 2.87Å; Q453-F455 VanDerWaalsContact C-N 3.26Å; Q453-F455 PolarHBondContact O-N 3Å; Q453-A456 VanDerWaalsContact O-CA 3.29Å; Q453-A456 WeakPolarHBondContact O-CA 3.37Å; Q453-A456 PolarHBondContact O-N 2.94Å; Q453-D473 PolarHBondContact NE2-O 3.29Å; Q453-F474 HydrophobicContact CG-CD2 4.39Å
454	G	89.6	Confident	89.4	Confident	5 Å²	5	43.4 Å²	43.4	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-28.7	175.4	0	0	0	0	0	114.6	S450 L451 A456	S450-G454 PolarHBondContact O-N 3.05Å; L451-G454 PolarHBondContact O-N 3.13Å; L451-G454 VanDerWaalsContact O-N 3.11Å; G454-A456 VanDerWaalsContact C-N 3.28Å
455	F	92.6	Very high	89.3	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.022	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	5	169.7	-81.7	-94.2	0	0	0	113.6	Y282 Y283 A424 F425 Y428 L451 A452 Q453 L457	Y282-F455 HydrophobicContact CD1-CD1 4.2Å; Y282-F455 HydrophobicContact CE1-CD1 4.11Å; Y282-F455 PolarHBondContact OH-O 3.21Å; Y283-F455 HydrophobicContact CE2-CD1 4.34Å; Y283-F455 AromaticContact CE2-CE1 3.72Å; Y283-F455 HydrophobicContact CE2-CE1 3.72Å; Y283-F455 HydrophobicContact CE2-CZ 4.04Å; A424-F455 HydrophobicContact CB-CD1 4.07Å; A424-F455 HydrophobicContact CB-CE1 3.74Å; F425-F455 HydrophobicContact CB-CB 4.48Å; F425-F455 HydrophobicContact CB-CD1 4.16Å; F425-F455 HydrophobicContact CB-CG 4.13Å; F425-F455 HydrophobicContact CD2-CB 4.29Å; F425-F455 AromaticContact CD2-CD2 3.85Å; F425-F455 HydrophobicContact CD2-CD2 3.85Å; F425-F455 HydrophobicContact CD2-CE2 4.41Å; F425-F455 HydrophobicContact CD2-CG 4.1Å; Y428-F455 HydrophobicContact CD1-CE2 4.24Å; Y428-F455 HydrophobicContact CD1-CZ 4.4Å; Y428-F455 HydrophobicContact CD2-CZ 4.38Å; Y428-F455 HydrophobicContact CG-CE2 4.23Å; Y428-F455 AromaticContact CG-CZ 3.94Å; Y428-F455 HydrophobicContact CG-CZ 3.94Å; L451-F455 HydrophobicContact CD1-CD2 4.11Å; L451-F455 HydrophobicContact CD1-CE2 3.78Å; L451-F455 HydrophobicContact CG-CD2 4.16Å; L451-F455 HydrophobicContact CG-CE2 4.15Å; L451-F455 WeakPolarHBondContact O-CD2 3.48Å; L451-F455 PolarHBondContact O-N 3.41Å; A452-F455 PolarHBondContact O-N 3.33Å; Q453-F455 VanDerWaalsContact C-N 3.26Å; Q453-F455 PolarHBondContact O-N 3Å; F455-L457 HydrophobicContact CB-CD2 3.97Å; F455-L457 HydrophobicContact CB-CG 3.91Å; F455-L457 PolarHBondContact O-N 3.12Å; F455-L457 VanDerWaalsContact O-N 3.15Å
456	A	92.2	Very high	89.2	Confident	3 Å²	3	33.8 Å²	33.8	3%	0.025	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	39.7	-176.4	0	0	0	0	0	113.6	L404 L407 K408 A452 Q453 G454	L404-A456 HydrophobicContact CD1-CB 3.79Å; L407-A456 HydrophobicContact CB-CB 3.36Å; L407-A456 HydrophobicContact CD1-CB 4.04Å; L407-A456 HydrophobicContact CG-CB 4.34Å; K408-A456 HydrophobicContact CG-CB 4.29Å; A452-A456 PolarHBondContact O-N 3.33Å; Q453-A456 VanDerWaalsContact O-CA 3.29Å; Q453-A456 WeakPolarHBondContact O-CA 3.37Å; Q453-A456 PolarHBondContact O-N 2.94Å; G454-A456 VanDerWaalsContact C-N 3.28Å
457	L	91.6	Very high	88.9	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	20%	0.202	C	C	.	.			trans	-67.7	137.3	-178.8	-60.9	-170	0	0	0	110.6	M422 F425 A452 F455 F474	M422-L457 HydrophobicContact CG-CD2 4.5Å; M422-L457 HydrophobicContact SD-CD1 4.17Å; M422-L457 HydrophobicContact SD-CD2 3.86Å; M422-L457 HydrophobicContact SD-CG 4.44Å; F425-L457 HydrophobicContact CB-CD1 3.94Å; F425-L457 HydrophobicContact CB-CD2 4.42Å; F425-L457 HydrophobicContact CD1-CD1 4.22Å; F425-L457 HydrophobicContact CD2-CD1 3.76Å; F425-L457 HydrophobicContact CE2-CD1 4.29Å; F425-L457 HydrophobicContact CG-CD1 3.7Å; A452-L457 HydrophobicContact CB-CB 4.49Å; A452-L457 HydrophobicContact CB-CD1 4.02Å; A452-L457 HydrophobicContact CB-CG 4.43Å; A452-L457 PolarHBondContact O-N 3.07Å; F455-L457 HydrophobicContact CB-CD2 3.97Å; F455-L457 HydrophobicContact CB-CG 3.91Å; F455-L457 PolarHBondContact O-N 3.12Å; F455-L457 VanDerWaalsContact O-N 3.15Å; L457-F474 HydrophobicContact CB-CE2 4.48Å; L457-F474 HydrophobicContact CB-CZ 4.38Å
458	L	89.8	Confident	88.1	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.222	C	C	.	.	S	Bend	trans	-79.5	-27.9	173.3	-54.4	178.5	0	0	0	111.7	K408 A411 L412 F418 V477 T481 I484	K408-L458 HydrophobicContact CB-CD2 4.15Å; K408-L458 HydrophobicContact CG-CD2 4.1Å; A411-L458 HydrophobicContact CB-CD1 4.17Å; A411-L458 HydrophobicContact CB-CD2 4.48Å; A411-L458 HydrophobicContact CB-CG 4.27Å; L412-L458 HydrophobicContact CD2-CD1 3.68Å; L412-L458 HydrophobicContact CD2-CD2 4.36Å; L412-L458 HydrophobicContact CG-CD1 4Å; L412-L458 HydrophobicContact CG-CD2 4.15Å; F418-L458 HydrophobicContact CD2-CB 4.29Å; F418-L458 HydrophobicContact CD2-CD1 3.74Å; F418-L458 HydrophobicContact CD2-CG 4.03Å; F418-L458 HydrophobicContact CE2-CB 3.98Å; F418-L458 HydrophobicContact CE2-CD1 4.13Å; F418-L458 HydrophobicContact CE2-CG 4.24Å; L458-V477 HydrophobicContact CD2-CB 4.31Å; L458-V477 HydrophobicContact CD2-CG2 3.82Å; L458-V477 PolarHBondContact O-N 3.46Å; L458-T481 HydrophobicContact CB-CG2 4.04Å; L458-I484 HydrophobicContact CD1-CD1 3.59Å
459	R	88.7	Confident	87.7	Confident	91 Å²	91	47.1 Å²	47.1	34%	0.343	24%	0.239	S	C	.	.	S	Bend	trans	-149.8	157.2	177.1	70.7	175.8	-177.9	-170.3	-6.3	111.1	F418 M422 T481 D482	F418-R459 HydrophobicContact CE2-CG 4.48Å; F418-R459 HydrophobicContact CZ-CG 4.26Å; M422-R459 HydrophobicContact CE-CG 4.2Å; M422-R459 VanDerWaalsContact SD-O 3.36Å; R459-T481 HydrophobicContact CB-CG2 4.47Å; R459-T481 WeakPolarHBondContact CD-OG1 3.35Å; R459-T481 HydrophobicContact CG-CG2 4.19Å; R459-T481 PolarHBondContact NE-OG1 3.39Å; R459-T481 PolarHBondContact NH1-OG1 3.3Å; R459-D482 IonicContact NH1-OD1 3.01Å; R459-D482 IonicContact NH2-OD1 3.77Å
460	M	88.4	Confident	86.9	Confident	38 Å²	38	55.6 Å²	55.6	19%	0.187	28%	0.278	C	S	.	.			trans	-70.6	139.1	175.1	-68.9	-62.4	-89.7	0	0	112.4	F448 A452 L466 F471 F474	F448-M460 HydrophobicContact CB-CE 4.23Å; A452-M460 HydrophobicContact CB-CE 4.33Å; A452-M460 HydrophobicContact CB-SD 3.48Å; A452-M460 WeakPolarHBondContact CB-SD 3.31Å; M460-L466 HydrophobicContact CE-CD1 3.91Å; M460-F471 HydrophobicContact CE-CD1 4.11Å; M460-F471 HydrophobicContact CE-CD2 3.69Å; M460-F471 HydrophobicContact CE-CE1 4.2Å; M460-F471 HydrophobicContact CE-CE2 3.79Å; M460-F471 HydrophobicContact CE-CG 3.87Å; M460-F471 HydrophobicContact CE-CZ 4.06Å; M460-F471 HydrophobicContact CG-CD2 4.3Å; M460-F474 HydrophobicContact CG-CD1 3.78Å; M460-F474 HydrophobicContact CG-CE1 3.93Å; M460-F474 HydrophobicContact CG-CG 4.15Å; M460-F474 HydrophobicContact CG-CZ 4.42Å; M460-F474 HydrophobicContact SD-CD1 4.3Å; M460-F474 HydrophobicContact SD-CD2 4.1Å; M460-F474 HydrophobicContact SD-CE1 4.42Å; M460-F474 HydrophobicContact SD-CE2 4.22Å; M460-F474 HydrophobicContact SD-CG 4.14Å; M460-F474 HydrophobicContact SD-CZ 4.37Å
461	P	88.1	Confident	86.5	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.078	29%	0.285	C	S	.	.			trans	-72.2	152.1	175.2	24.5	-27	0	0	0	111.9	M422 F425 V426 M463 L466	M422-P461 VanDerWaalsContact CE-CA 3.44Å; M422-P461 HydrophobicContact CE-CB 3.61Å; M422-P461 HydrophobicContact CE-CG 4.37Å; F425-P461 HydrophobicContact CD1-CG 3.47Å; F425-P461 VanDerWaalsContact CD1-CG 3.47Å; F425-P461 HydrophobicContact CE1-CG 3.63Å; F425-P461 HydrophobicContact CG-CG 4.47Å; V426-P461 HydrophobicContact CG2-CB 3.71Å; V426-P461 HydrophobicContact CG2-CG 3.97Å; P461-M463 HydrophobicContact CG-SD 4.24Å; P461-M463 PolarHBondContact O-N 3.44Å; P461-L466 HydrophobicContact CG-CD1 4Å; P461-L466 WeakPolarHBondContact O-CD1 3.36Å
462	K	84.9	Confident	85.5	Confident	217 Å²	217	62.4 Å²	62.4	94%	0.943	32%	0.317	S	S	*	.			trans	-87.2	104.3	169.4	-63.2	-174.5	-178.8	-177.7	0	108.7
463	M	86.6	Confident	84.9	Confident	13 Å²	13	67.8 Å²	67.8	6%	0.064	35%	0.346	C	S	.	.			trans	-140.8	155.1	176.7	68.2	-167.6	-70.8	0	0	111.6	F425 V426 V429 P461 E465 L466 R467	F425-M463 HydrophobicContact CD1-SD 4.4Å; F425-M463 HydrophobicContact CE1-SD 4.09Å; V426-M463 HydrophobicContact CB-CE 4.47Å; V426-M463 HydrophobicContact CB-SD 4.47Å; V426-M463 HydrophobicContact CG1-CE 4.05Å; V426-M463 HydrophobicContact CG1-SD 4.46Å; V426-M463 HydrophobicContact CG2-SD 3.99Å; V429-M463 HydrophobicContact CB-CE 3.83Å; V429-M463 HydrophobicContact CG1-CE 3.66Å; P461-M463 HydrophobicContact CG-SD 4.24Å; P461-M463 PolarHBondContact O-N 3.44Å; M463-E465 WeakPolarHBondContact CB-OE2 3.41Å; M463-E465 HydrophobicContact CE-CB 4.06Å; M463-E465 VanDerWaalsContact CE-CD 3.41Å; M463-E465 HydrophobicContact CE-CG 4.07Å; M463-E465 WeakPolarHBondContact CE-OE2 3.36Å; M463-E465 HydrophobicContact CG-CB 4.41Å; M463-E465 WeakPolarHBondContact CG-OE2 3.43Å; M463-E465 PolarHBondContact O-N 2.98Å; M463-L466 HydrophobicContact CG-CB 4.03Å; M463-L466 HydrophobicContact CG-CD1 3.81Å; M463-L466 HydrophobicContact CG-CG 3.53Å; M463-L466 PolarHBondContact O-N 3.32Å; M463-L466 HydrophobicContact SD-CD1 3.91Å; M463-L466 HydrophobicContact SD-CG 3.9Å; M463-R467 PolarHBondContact O-N 2.9Å
464	P	84.4	Confident	84.5	Confident	89 Å²	89	66.3 Å²	66.3	58%	0.578	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-52.2	-39.4	-179.5	-27.6	35.2	0	0	0	114.3	L466 R467	P464-L466 PolarHBondContact O-N 3.07Å; P464-R467 VanDerWaalsContact O-CB 3.3Å; P464-R467 WeakPolarHBondContact O-CB 3.35Å; P464-R467 PolarHBondContact O-N 3.37Å; P464-R467 VanDerWaalsContact O-N 3.15Å
465	E	85	Confident	84	Confident	49 Å²	49	71 Å²	71	23%	0.229	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-69	-21.2	-174.9	-58.9	84.2	166.6	0	0	113.2	V429 L443 M463 K469	V429-E465 HydrophobicContact CG1-CB 4.3Å; V429-E465 HydrophobicContact CG1-CG 4.33Å; L443-E465 HydrophobicContact CD1-CG 4.47Å; M463-E465 WeakPolarHBondContact CB-OE2 3.41Å; M463-E465 HydrophobicContact CE-CB 4.06Å; M463-E465 VanDerWaalsContact CE-CD 3.41Å; M463-E465 HydrophobicContact CE-CG 4.07Å; M463-E465 WeakPolarHBondContact CE-OE2 3.36Å; M463-E465 HydrophobicContact CG-CB 4.41Å; M463-E465 WeakPolarHBondContact CG-OE2 3.43Å; M463-E465 PolarHBondContact O-N 2.98Å; E465-K469 PolarHBondContact O-NZ 3.17Å
466	L	84.9	Confident	83.2	Confident	12 Å²	12	74.6 Å²	74.6	6%	0.063	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-102.9	-2.6	177.4	-56.6	-176.1	0	0	0	112.6	F425 F448 M460 P461 M463 P464 G468 K469 F471	F425-L466 HydrophobicContact CE1-CD1 4.16Å; F448-L466 HydrophobicContact CB-CD2 4.27Å; F448-L466 HydrophobicContact CD1-CD2 3.39Å; F448-L466 HydrophobicContact CD2-CD2 4.29Å; F448-L466 HydrophobicContact CE1-CD2 3.71Å; F448-L466 HydrophobicContact CG-CD2 3.71Å; F448-L466 HydrophobicContact CZ-CD2 4.3Å; M460-L466 HydrophobicContact CE-CD1 3.91Å; P461-L466 HydrophobicContact CG-CD1 4Å; P461-L466 WeakPolarHBondContact O-CD1 3.36Å; M463-L466 HydrophobicContact CG-CB 4.03Å; M463-L466 HydrophobicContact CG-CD1 3.81Å; M463-L466 HydrophobicContact CG-CG 3.53Å; M463-L466 PolarHBondContact O-N 3.32Å; M463-L466 HydrophobicContact SD-CD1 3.91Å; M463-L466 HydrophobicContact SD-CG 3.9Å; P464-L466 PolarHBondContact O-N 3.07Å; L466-G468 PolarHBondContact O-N 2.86Å; L466-K469 PolarHBondContact O-N 2.95Å; L466-F471 HydrophobicContact CB-CE2 4.28Å; L466-F471 HydrophobicContact CB-CZ 4.13Å; L466-F471 HydrophobicContact CD2-CE1 4.33Å; L466-F471 HydrophobicContact CD2-CE2 4.45Å; L466-F471 HydrophobicContact CD2-CZ 3.7Å; L466-F471 HydrophobicContact CG-CZ 4.35Å
467	R	83.1	Confident	82.5	Confident	205 Å²	205	76.5 Å²	76.5	77%	0.774	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	125.9	-174.7	-173.3	-177.7	-72.6	170.1	-2.4	110.2	M463 P464 K469	M463-R467 PolarHBondContact O-N 2.9Å; P464-R467 VanDerWaalsContact O-CB 3.3Å; P464-R467 WeakPolarHBondContact O-CB 3.35Å; P464-R467 PolarHBondContact O-N 3.37Å; P464-R467 VanDerWaalsContact O-N 3.15Å; R467-K469 VanDerWaalsContact C-N 3.29Å; R467-K469 PolarHBondContact O-N 2.81Å
468	G	73.8	Confident	81.6	Confident	84 Å²	84	84.5 Å²	84.5	87%	0.866	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	2.3	177.7	0	0	0	0	0	114.9	L466	L466-G468 PolarHBondContact O-N 2.86Å
469	K	81.1	Confident	80.9	Confident	91 Å²	91	87.3 Å²	87.3	40%	0.396	46%	0.461	S	S	.	.			trans	-94.1	143.2	174.5	-64.8	-176.4	-179.6	177.2	0	110.7	E465 L466 R467 F471	E465-K469 PolarHBondContact O-NZ 3.17Å; L466-K469 PolarHBondContact O-N 2.95Å; R467-K469 VanDerWaalsContact C-N 3.29Å; R467-K469 PolarHBondContact O-N 2.81Å; K469-F471 HydrophobicContact CB-CE1 4Å; K469-F471 HydrophobicContact CB-CE2 4.04Å; K469-F471 HydrophobicContact CB-CZ 3.45Å; K469-F471 VanDerWaalsContact CB-CZ 3.45Å; K469-F471 HydrophobicContact CD-CE1 4.43Å; K469-F471 HydrophobicContact CD-CZ 4.22Å; K469-F471 HydrophobicContact CG-CZ 4.48Å
470	Q	75.1	Confident	80.3	Confident	182 Å²	182	87.7 Å²	87.7	85%	0.85	47%	0.47	S	S	*	.			trans	-105.1	145.2	170.8	-62.7	-174.7	9.4	0	0	109.2
471	F	81.4	Confident	79.8	Confident	51 Å²	51	86.3 Å²	86.3	22%	0.224	46%	0.464	C	S	.	.			trans	-126.4	79.2	-176.6	-53.3	-74.9	0	0	0	109.1	F448 M460 L466 K469 D473 F474	F448-F471 HydrophobicContact CB-CD1 4.01Å; F448-F471 HydrophobicContact CB-CE1 3.61Å; F448-F471 HydrophobicContact CB-CZ 4.42Å; F448-F471 HydrophobicContact CD2-CE1 4.12Å; F448-F471 HydrophobicContact CG-CE1 4.09Å; M460-F471 HydrophobicContact CE-CD1 4.11Å; M460-F471 HydrophobicContact CE-CD2 3.69Å; M460-F471 HydrophobicContact CE-CE1 4.2Å; M460-F471 HydrophobicContact CE-CE2 3.79Å; M460-F471 HydrophobicContact CE-CG 3.87Å; M460-F471 HydrophobicContact CE-CZ 4.06Å; M460-F471 HydrophobicContact CG-CD2 4.3Å; L466-F471 HydrophobicContact CB-CE2 4.28Å; L466-F471 HydrophobicContact CB-CZ 4.13Å; L466-F471 HydrophobicContact CD2-CE1 4.33Å; L466-F471 HydrophobicContact CD2-CE2 4.45Å; L466-F471 HydrophobicContact CD2-CZ 3.7Å; L466-F471 HydrophobicContact CG-CZ 4.35Å; K469-F471 HydrophobicContact CB-CE1 4Å; K469-F471 HydrophobicContact CB-CE2 4.04Å; K469-F471 HydrophobicContact CB-CZ 3.45Å; K469-F471 VanDerWaalsContact CB-CZ 3.45Å; K469-F471 HydrophobicContact CD-CE1 4.43Å; K469-F471 HydrophobicContact CD-CZ 4.22Å; K469-F471 HydrophobicContact CG-CZ 4.48Å; F471-D473 VanDerWaalsContact C-N 3.26Å; F471-D473 PolarHBondContact O-N 3.3Å; F471-F474 HydrophobicContact CB-CB 4Å; F471-F474 PolarHBondContact O-N 2.98Å
472	P	72	Confident	79.2	Confident	111 Å²	111	89.8 Å²	89.8	72%	0.721	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-31.9	-177.5	25.6	-33.1	0	0	0	112.5	F474	P472-F474 VanDerWaalsContact C-N 3.29Å; P472-F474 PolarHBondContact O-N 3.27Å
473	D	79.3	Confident	78.9	Confident	112 Å²	112	84 Å²	84	60%	0.599	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.4	-177.7	-52	-49.6	0	0	0	113.6	A449 Q453 F471	A449-D473 HydrophobicContact CB-CB 4.02Å; Q453-D473 PolarHBondContact NE2-O 3.29Å; F471-D473 VanDerWaalsContact C-N 3.26Å; F471-D473 PolarHBondContact O-N 3.3Å
474	F	82	Confident	78.8	Confident	18 Å²	18	83.7 Å²	83.7	8%	0.079	46%	0.463	C	S	.	.			trans	-89	113.4	174.4	-178.4	-98	0	0	0	109.9	A449 A452 Q453 L457 M460 F471 P472 P476	A449-F474 HydrophobicContact CB-CB 4.06Å; A452-F474 HydrophobicContact CB-CD2 3.72Å; A452-F474 HydrophobicContact CB-CE2 3.6Å; Q453-F474 HydrophobicContact CG-CD2 4.39Å; L457-F474 HydrophobicContact CB-CE2 4.48Å; L457-F474 HydrophobicContact CB-CZ 4.38Å; M460-F474 HydrophobicContact CG-CD1 3.78Å; M460-F474 HydrophobicContact CG-CE1 3.93Å; M460-F474 HydrophobicContact CG-CG 4.15Å; M460-F474 HydrophobicContact CG-CZ 4.42Å; M460-F474 HydrophobicContact SD-CD1 4.3Å; M460-F474 HydrophobicContact SD-CD2 4.1Å; M460-F474 HydrophobicContact SD-CE1 4.42Å; M460-F474 HydrophobicContact SD-CE2 4.22Å; M460-F474 HydrophobicContact SD-CG 4.14Å; M460-F474 HydrophobicContact SD-CZ 4.37Å; F471-F474 HydrophobicContact CB-CB 4Å; F471-F474 PolarHBondContact O-N 2.98Å; P472-F474 VanDerWaalsContact C-N 3.29Å; P472-F474 PolarHBondContact O-N 3.27Å; F474-P476 HydrophobicContact CD1-CB 4.43Å; F474-P476 HydrophobicContact CE1-CB 3.99Å; F474-P476 WeakPolarHBondContact O-CD 3.5Å
475	V	78.5	Confident	78.8	Confident	102 Å²	102	82.5 Å²	82.5	62%	0.618	46%	0.456	S	S	*	.			trans	-90.5	100.9	175.6	-174	0	0	0	0	109.7
476	P	76	Confident	78.8	Confident	82 Å²	82	81.1 Å²	81.1	53%	0.532	45%	0.449	S	S	.	.			trans	-66.9	151.9	175.6	29.9	-35.4	0	0	0	110.6	F474	F474-P476 HydrophobicContact CD1-CB 4.43Å; F474-P476 HydrophobicContact CE1-CB 3.99Å; F474-P476 WeakPolarHBondContact O-CD 3.5Å
477	V	77	Confident	78.8	Confident	42 Å²	42	88.7 Å²	88.7	26%	0.255	48%	0.481	S	S	.	.			trans	-81	130.8	171.7	-177.3	0	0	0	0	108.2	K408 L458 V479	K408-V477 HydrophobicContact CD-CG2 3.96Å; L458-V477 HydrophobicContact CD2-CB 4.31Å; L458-V477 HydrophobicContact CD2-CG2 3.82Å; L458-V477 PolarHBondContact O-N 3.46Å; V477-V479 HydrophobicContact CG1-CB 4.2Å; V477-V479 HydrophobicContact CG1-CG2 3.78Å; V477-V479 PolarHBondContact O-N 3.03Å
478	D	72.8	Confident	78.8	Confident	171 Å²	171	83.1 Å²	83.1	91%	0.914	47%	0.467	S	S	*	.	S	Bend	trans	-75.6	57.9	179.7	-163.7	17	0	0	0	112
479	V	75.3	Confident	79.3	Confident	62 Å²	62	87.4 Å²	87.4	38%	0.376	46%	0.462	S	S	.	.	S	Bend	trans	-130.1	133.1	177.8	173.7	0	0	0	0	107.9	L412 V477 T481	L412-V479 HydrophobicContact CD2-CB 4.17Å; L412-V479 HydrophobicContact CD2-CG1 3.92Å; L412-V479 HydrophobicContact CD2-CG2 4.19Å; V477-V479 HydrophobicContact CG1-CB 4.2Å; V477-V479 HydrophobicContact CG1-CG2 3.78Å; V477-V479 PolarHBondContact O-N 3.03Å; V479-T481 VanDerWaalsContact C-N 3.34Å; V479-T481 PolarHBondContact O-N 3.44Å
480	N	76.8	Confident	79.4	Confident	98 Å²	98	89 Å²	89	52%	0.524	47%	0.473	S	S	.	.			trans	-64.9	96.3	171.5	-173.4	-13.7	0	0	0	109.7	D482 T483	N480-D482 PolarHBondContact O-N 3.2Å; N480-D482 WeakPolarHBondContact OD1-CB 3.08Å; N480-D482 PolarHBondContact OD1-N 3.25Å; N480-D482 VanDerWaalsContact OD1-N 3.08Å; N480-T483 HydrophobicContact CB-CG2 4.23Å; N480-T483 PolarHBondContact O-N 3.28Å; N480-T483 PolarHBondContact O-OG1 3.3Å
481	T	77.3	Confident	79.6	Confident	9 Å²	9	85.9 Å²	85.9	6%	0.055	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-55.2	-24.9	-177.9	55.3	0	0	0	0	113.4	R415 F418 L458 R459 V479 T483 I484	R415-T481 PolarHBondContact NH1-O 3.3Å; F418-T481 HydrophobicContact CE2-CG2 4.14Å; F418-T481 HydrophobicContact CZ-CG2 4.06Å; L458-T481 HydrophobicContact CB-CG2 4.04Å; R459-T481 HydrophobicContact CB-CG2 4.47Å; R459-T481 WeakPolarHBondContact CD-OG1 3.35Å; R459-T481 HydrophobicContact CG-CG2 4.19Å; R459-T481 PolarHBondContact NE-OG1 3.39Å; R459-T481 PolarHBondContact NH1-OG1 3.3Å; V479-T481 VanDerWaalsContact C-N 3.34Å; V479-T481 PolarHBondContact O-N 3.44Å; T481-T483 PolarHBondContact O-N 2.82Å; T481-I484 WeakPolarHBondContact O-CG1 3.48Å; T481-I484 PolarHBondContact O-N 3.41Å
482	D	75.9	Confident	79.7	Confident	85 Å²	85	84.5 Å²	84.5	46%	0.455	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-73	-14	-178.4	-61.9	-35.2	0	0	0	113.1	R459 N480 R495	R459-D482 IonicContact NH1-OD1 3.01Å; R459-D482 IonicContact NH2-OD1 3.77Å; N480-D482 PolarHBondContact O-N 3.2Å; N480-D482 WeakPolarHBondContact OD1-CB 3.08Å; N480-D482 PolarHBondContact OD1-N 3.25Å; N480-D482 VanDerWaalsContact OD1-N 3.08Å; D482-R495 PolarHBondContact O-NH2 3.44Å
483	T	79.4	Confident	80	Confident	97 Å²	97	86 Å²	86	60%	0.595	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-89.7	-9.1	176.5	62.1	0	0	0	0	114	N480 T481 P485	N480-T483 HydrophobicContact CB-CG2 4.23Å; N480-T483 PolarHBondContact O-N 3.28Å; N480-T483 PolarHBondContact O-OG1 3.3Å; T481-T483 PolarHBondContact O-N 2.82Å; T483-P485 WeakPolarHBondContact O-CD 3.5Å
484	I	83.1	Confident	80.1	Confident	6 Å²	6	86.7 Å²	86.7	3%	0.031	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-62.2	121.8	-179.7	-58.9	171.3	0	0	0	109.6	L412 R415 F418 L458 T481 R495	L412-I484 HydrophobicContact CD2-CD1 4.29Å; R415-I484 HydrophobicContact CB-CG2 3.98Å; F418-I484 HydrophobicContact CG-CD1 4.44Å; L458-I484 HydrophobicContact CD1-CD1 3.59Å; T481-I484 WeakPolarHBondContact O-CG1 3.48Å; T481-I484 PolarHBondContact O-N 3.41Å; I484-R495 PolarHBondContact O-NH1 2.8Å; I484-R495 VanDerWaalsContact O-NH1 3.08Å
485	P	84.7	Confident	80.1	Confident	64 Å²	64	87.8 Å²	87.8	42%	0.416	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-84.4	155	179.5	33.4	-33.9	0	0	0	112.1	R415 T483 E492	R415-P485 WeakPolarHBondContact CB-O 3.02Å; R415-P485 PolarHBondContact N-O 2.95Å; T483-P485 WeakPolarHBondContact O-CD 3.5Å; P485-E492 HydrophobicContact CB-CG 4.42Å
486	F	85.4	Confident	80.3	Confident	19 Å²	19	88.1 Å²	88.1	8%	0.083	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-70.1	136.3	163.7	-74.1	-76.9	0	0	0	110	R415 A416 D488 R491 E492 R495	R415-F486 HydrophobicContact CB-CD1 3.79Å; R415-F486 HydrophobicContact CB-CD2 4.21Å; R415-F486 HydrophobicContact CB-CE1 3.92Å; R415-F486 HydrophobicContact CB-CE2 4.33Å; R415-F486 HydrophobicContact CB-CG 3.94Å; R415-F486 HydrophobicContact CB-CZ 4.18Å; R415-F486 HydrophobicContact CG-CD1 4.19Å; R415-F486 HydrophobicContact CG-CD2 4.19Å; R415-F486 HydrophobicContact CG-CE1 3.83Å; R415-F486 HydrophobicContact CG-CE2 3.83Å; R415-F486 HydrophobicContact CG-CG 4.35Å; R415-F486 HydrophobicContact CG-CZ 3.63Å; A416-F486 HydrophobicContact CB-CD1 3.84Å; A416-F486 HydrophobicContact CB-CE1 3.87Å; F486-D488 PolarHBondContact O-N 3.03Å; F486-R491 HydrophobicContact CB-CB 4.41Å; F486-R491 HydrophobicContact CD1-CG 4.41Å; F486-R491 HydrophobicContact CD2-CG 4.33Å; F486-R491 HydrophobicContact CG-CB 4.43Å; F486-R491 HydrophobicContact CG-CG 4.26Å; F486-E492 HydrophobicContact CB-CB 4.13Å; F486-E492 WeakPolarHBondContact CD2-OE2 3.49Å; F486-E492 PolarHBondContact N-OE2 3.44Å; F486-R495 HydrophobicContact CD2-CB 4.34Å; F486-R495 HydrophobicContact CE2-CB 4.28Å; F486-R495 HydrophobicContact CE2-CG 4.21Å
487	K	85.1	Confident	80.6	Confident	171 Å²	171	91.5 Å²	91.5	74%	0.743	45%	0.447	S	S	*	.	S	Bend	trans	-63.3	-29.6	173.1	-172.1	177.2	-179	-179.1	0	112.2	D414 K489	D414-K487 HydrophobicContact CB-CB 4.03Å; D414-K487 PolarHBondContact OD1-N 3.45Å; D414-K487 VanDerWaalsContact OD1-N 3.07Å; K487-K489 PolarHBondContact O-N 3.38Å
488	D	83.6	Confident	80.9	Confident	88 Å²	88	94.1 Å²	94.1	47%	0.471	46%	0.46	S	S	.	.	S	Bend	trans	-78.1	113.4	173.9	-175.3	-20.6	0	0	0	110.8	F486 I490 R491 E492	F486-D488 PolarHBondContact O-N 3.03Å; D488-I490 VanDerWaalsContact C-N 3.27Å; D488-I490 PolarHBondContact O-N 3.33Å; D488-I490 WeakPolarHBondContact OD1-CB 3.48Å; D488-I490 PolarHBondContact OD1-N 3.08Å; D488-R491 HydrophobicContact CB-CB 4.03Å; D488-R491 PolarHBondContact O-N 3.03Å; D488-E492 PolarHBondContact O-N 2.97Å
489	K	82.8	Confident	81.3	Confident	175 Å²	175	89.1 Å²	89.1	76%	0.761	43%	0.432	S	S	*	.	H	α-helix	trans	-60.6	-32.2	-178	-65.9	-175.5	179.3	-179.4	0	113.2	K487 K493	K487-K489 PolarHBondContact O-N 3.38Å; K489-K493 WeakPolarHBondContact O-CG 3.41Å; K489-K493 PolarHBondContact O-N 3.41Å; K489-K493 VanDerWaalsContact O-N 3.17Å
490	I	83.4	Confident	81.6	Confident	123 Å²	123	90.8 Å²	90.8	63%	0.631	44%	0.436	S	S	*	.	H	α-helix	trans	-70.7	-47.3	-179.4	-61	174.4	0	0	0	109.1	D488 E492 K493 Q494	D488-I490 VanDerWaalsContact C-N 3.27Å; D488-I490 PolarHBondContact O-N 3.33Å; D488-I490 WeakPolarHBondContact OD1-CB 3.48Å; D488-I490 PolarHBondContact OD1-N 3.08Å; I490-E492 VanDerWaalsContact C-N 3.33Å; I490-E492 PolarHBondContact O-N 3.33Å; I490-K493 PolarHBondContact O-N 3.29Å; I490-Q494 PolarHBondContact O-N 3.32Å; I490-Q494 VanDerWaalsContact O-N 3.11Å
491	R	80.6	Confident	81.7	Confident	118 Å²	118	91.2 Å²	91.2	45%	0.445	44%	0.435	S	S	.	.	H	α-helix	trans	-66	-36.2	-179.7	-159.2	173.8	-178.8	177.9	-2.1	112.2	F486 D488 Q494 R495	F486-R491 HydrophobicContact CB-CB 4.41Å; F486-R491 HydrophobicContact CD1-CG 4.41Å; F486-R491 HydrophobicContact CD2-CG 4.33Å; F486-R491 HydrophobicContact CG-CB 4.43Å; F486-R491 HydrophobicContact CG-CG 4.26Å; D488-R491 HydrophobicContact CB-CB 4.03Å; D488-R491 PolarHBondContact O-N 3.03Å; R491-Q494 PolarHBondContact O-N 2.66Å; R491-R495 WeakPolarHBondContact O-CB 3.46Å; R491-R495 PolarHBondContact O-N 2.83Å
492	E	81.9	Confident	81.8	Confident	22 Å²	22	95 Å²	95	10%	0.103	45%	0.452	C	S	.	.	H	α-helix	trans	-66.5	-42.6	174.7	-172	56.2	-154	0	0	112	P485 F486 D488 I490 Q494 R495 Q496	P485-E492 HydrophobicContact CB-CG 4.42Å; F486-E492 HydrophobicContact CB-CB 4.13Å; F486-E492 WeakPolarHBondContact CD2-OE2 3.49Å; F486-E492 PolarHBondContact N-OE2 3.44Å; D488-E492 PolarHBondContact O-N 2.97Å; I490-E492 VanDerWaalsContact C-N 3.33Å; I490-E492 PolarHBondContact O-N 3.33Å; E492-Q494 VanDerWaalsContact C-N 3.32Å; E492-Q494 PolarHBondContact O-N 3.15Å; E492-R495 WeakPolarHBondContact O-CB 3.37Å; E492-R495 PolarHBondContact O-N 3.08Å; E492-R495 IonicContact OE1-NH1 3.06Å; E492-R495 PolarHBondContact OE1-NH1 2.89Å; E492-R495 IonicContact OE2-NH1 3.99Å; E492-Q496 WeakPolarHBondContact O-CG 3.42Å; E492-Q496 PolarHBondContact O-N 2.74Å; E492-Q496 PolarHBondContact OE1-NE2 3.39Å
493	K	80	Confident	81.9	Confident	142 Å²	142	99.8 Å²	99.8	62%	0.617	46%	0.464	S	S	*	.	H	α-helix	trans	-58.3	-43.9	174.5	-76.8	178	-179.8	-175.2	0	111.9	K489 I490 Q496 K497	K489-K493 WeakPolarHBondContact O-CG 3.41Å; K489-K493 PolarHBondContact O-N 3.41Å; K489-K493 VanDerWaalsContact O-N 3.17Å; I490-K493 PolarHBondContact O-N 3.29Å; K493-Q496 PolarHBondContact O-N 3.19Å; K493-K497 WeakPolarHBondContact O-CG 3.47Å; K493-K497 PolarHBondContact O-N 3.41Å; K493-K497 VanDerWaalsContact O-N 3.09Å
494	Q	80.7	Confident	81.7	Confident	126 Å²	126	102.6 Å²	102.6	59%	0.589	46%	0.463	S	S	*	.	H	α-helix	trans	-61.7	-44	176.4	-72.7	176.5	-19.6	0	0	111.8	I490 R491 E492 K497 L498	I490-Q494 PolarHBondContact O-N 3.32Å; I490-Q494 VanDerWaalsContact O-N 3.11Å; R491-Q494 PolarHBondContact O-N 2.66Å; E492-Q494 VanDerWaalsContact C-N 3.32Å; E492-Q494 PolarHBondContact O-N 3.15Å; Q494-K497 PolarHBondContact O-N 3.29Å; Q494-L498 PolarHBondContact O-N 3.48Å
495	R	81.1	Confident	81.4	Confident	42 Å²	42	106.7 Å²	106.7	16%	0.158	48%	0.482	C	S	.	.	H	α-helix	trans	-62	-44.5	177	-174.3	-155.4	177.7	-150.5	-2.5	112	D482 I484 F486 R491 E492 K497 L498 L499	D482-R495 PolarHBondContact O-NH2 3.44Å; I484-R495 PolarHBondContact O-NH1 2.8Å; I484-R495 VanDerWaalsContact O-NH1 3.08Å; F486-R495 HydrophobicContact CD2-CB 4.34Å; F486-R495 HydrophobicContact CE2-CB 4.28Å; F486-R495 HydrophobicContact CE2-CG 4.21Å; R491-R495 WeakPolarHBondContact O-CB 3.46Å; R491-R495 PolarHBondContact O-N 2.83Å; E492-R495 WeakPolarHBondContact O-CB 3.37Å; E492-R495 PolarHBondContact O-N 3.08Å; E492-R495 IonicContact OE1-NH1 3.06Å; E492-R495 PolarHBondContact OE1-NH1 2.89Å; E492-R495 IonicContact OE2-NH1 3.99Å; R495-K497 VanDerWaalsContact C-N 3.34Å; R495-K497 PolarHBondContact O-N 3.02Å; R495-L498 PolarHBondContact O-N 3.11Å; R495-L498 VanDerWaalsContact O-N 3.16Å; R495-L499 HydrophobicContact CG-CD1 4.03Å; R495-L499 WeakPolarHBondContact O-CB 3.37Å; R495-L499 WeakPolarHBondContact O-CG 3.34Å; R495-L499 PolarHBondContact O-N 3.3Å
496	Q	82.5	Confident	80.8	Confident	108 Å²	108	110.1 Å²	110.1	51%	0.505	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-43.6	178.3	-73.2	176.3	-2.3	0	0	111.4	E492 K493 L498 L499 E500	E492-Q496 WeakPolarHBondContact O-CG 3.42Å; E492-Q496 PolarHBondContact O-N 2.74Å; E492-Q496 PolarHBondContact OE1-NE2 3.39Å; K493-Q496 PolarHBondContact O-N 3.19Å; Q496-L498 VanDerWaalsContact C-N 3.33Å; Q496-L498 PolarHBondContact O-N 3.22Å; Q496-L499 PolarHBondContact O-N 3.15Å; Q496-E500 WeakPolarHBondContact O-CB 3.3Å; Q496-E500 PolarHBondContact O-N 3.35Å
497	K	83.5	Confident	80	Confident	153 Å²	153	113.8 Å²	113.8	67%	0.665	52%	0.515	S	S	*	.	H	α-helix	trans	-57.4	-45.7	172.2	-71.6	-179.8	178.1	-170.9	0	111.9	K493 Q494 R495 E500 Q501	K493-K497 WeakPolarHBondContact O-CG 3.47Å; K493-K497 PolarHBondContact O-N 3.41Å; K493-K497 VanDerWaalsContact O-N 3.09Å; Q494-K497 PolarHBondContact O-N 3.29Å; R495-K497 VanDerWaalsContact C-N 3.34Å; R495-K497 PolarHBondContact O-N 3.02Å; K497-E500 PolarHBondContact O-N 3.26Å; K497-Q501 WeakPolarHBondContact O-CB 3.33Å; K497-Q501 PolarHBondContact O-N 3.37Å
498	L	82.8	Confident	78.9	Confident	98 Å²	98	111.4 Å²	111.4	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-66.6	-39.6	-179.5	-151.4	111.5	0	0	0	112.3	Q494 R495 Q496 Q501 Q502	Q494-L498 PolarHBondContact O-N 3.48Å; R495-L498 PolarHBondContact O-N 3.11Å; R495-L498 VanDerWaalsContact O-N 3.16Å; Q496-L498 VanDerWaalsContact C-N 3.33Å; Q496-L498 PolarHBondContact O-N 3.22Å; L498-Q501 PolarHBondContact O-N 3.47Å; L498-Q502 WeakPolarHBondContact O-CB 3.38Å; L498-Q502 WeakPolarHBondContact O-CG 3.47Å; L498-Q502 PolarHBondContact O-N 3.28Å
499	L	81.4	Confident	77.7	Confident	66 Å²	66	111.7 Å²	111.7	35%	0.346	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-39.3	174.9	-79.4	167.6	0	0	0	111.7	R495 Q496 Q502 R503	R495-L499 HydrophobicContact CG-CD1 4.03Å; R495-L499 WeakPolarHBondContact O-CB 3.37Å; R495-L499 WeakPolarHBondContact O-CG 3.34Å; R495-L499 PolarHBondContact O-N 3.3Å; Q496-L499 PolarHBondContact O-N 3.15Å; L499-Q502 PolarHBondContact O-N 3.08Å; L499-R503 WeakPolarHBondContact O-CB 3.44Å; L499-R503 VanDerWaalsContact O-CG 3.32Å; L499-R503 WeakPolarHBondContact O-CG 3.47Å; L499-R503 PolarHBondContact O-N 3.33Å
500	E	81.3	Confident	76.5	Confident	96 Å²	96	109 Å²	109	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-43	175.6	-166.2	-179.3	173.7	0	0	111.1	Q496 K497 R503 R504	Q496-E500 WeakPolarHBondContact O-CB 3.3Å; Q496-E500 PolarHBondContact O-N 3.35Å; K497-E500 PolarHBondContact O-N 3.26Å; E500-R503 PolarHBondContact O-N 3.49Å; E500-R504 WeakPolarHBondContact O-CB 3.21Å; E500-R504 VanDerWaalsContact O-CG 3.3Å; E500-R504 WeakPolarHBondContact O-CG 3.38Å; E500-R504 PolarHBondContact O-N 3.06Å; E500-R504 IonicContact OE1-CZ 3.43Å; E500-R504 IonicContact OE1-NE 3.45Å; E500-R504 PolarHBondContact OE1-NE 2.91Å; E500-R504 IonicContact OE1-NH2 2.7Å; E500-R504 PolarHBondContact OE1-NH2 3.26Å
501	Q	80.1	Confident	75.2	Confident	107 Å²	107	105 Å²	105	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-59.1	-48.3	172.7	-176.4	178.6	-4.5	0	0	111.4	K497 L498 R503 R504 E505	K497-Q501 WeakPolarHBondContact O-CB 3.33Å; K497-Q501 PolarHBondContact O-N 3.37Å; L498-Q501 PolarHBondContact O-N 3.47Å; Q501-R503 VanDerWaalsContact C-N 3.31Å; Q501-R503 PolarHBondContact O-N 3.1Å; Q501-R504 PolarHBondContact O-N 3.28Å; Q501-E505 PolarHBondContact NE2-OE1 3.09Å; Q501-E505 WeakPolarHBondContact O-CB 3.35Å; Q501-E505 WeakPolarHBondContact O-CG 3.44Å; Q501-E505 PolarHBondContact O-N 3.07Å
502	Q	78.3	Confident	74	Confident	88 Å²	88	105.2 Å²	105.2	41%	0.411	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-35.7	176.7	-75.7	-178.9	10.4	0	0	113	L498 L499 K506	L498-Q502 WeakPolarHBondContact O-CB 3.38Å; L498-Q502 WeakPolarHBondContact O-CG 3.47Å; L498-Q502 PolarHBondContact O-N 3.28Å; L499-Q502 PolarHBondContact O-N 3.08Å; Q502-K506 WeakPolarHBondContact O-CB 3.18Å; Q502-K506 WeakPolarHBondContact O-CG 3.38Å; Q502-K506 PolarHBondContact O-N 3.25Å
503	R	79.1	Confident	72.4	Confident	187 Å²	187	113.5 Å²	113.5	71%	0.706	52%	0.518	S	S	*	.	H	α-helix	trans	-65.6	-47.3	173.8	-79.7	177.3	176.4	-171.7	-0.5	110.5	L499 E500 Q501 E505 K506 T507	L499-R503 WeakPolarHBondContact O-CB 3.44Å; L499-R503 VanDerWaalsContact O-CG 3.32Å; L499-R503 WeakPolarHBondContact O-CG 3.47Å; L499-R503 PolarHBondContact O-N 3.33Å; E500-R503 PolarHBondContact O-N 3.49Å; Q501-R503 VanDerWaalsContact C-N 3.31Å; Q501-R503 PolarHBondContact O-N 3.1Å; R503-E505 PolarHBondContact O-N 3.09Å; R503-K506 PolarHBondContact O-N 3.47Å; R503-T507 PolarHBondContact O-N 2.93Å; R503-T507 PolarHBondContact O-OG1 3.12Å
504	R	75.4	Confident	71	Confident	155 Å²	155	115 Å²	115	59%	0.585	53%	0.525	S	S	*	.	H	α-helix	trans	-57.5	-46.9	175.2	-70.9	174.5	-175	-162.2	3	111.1	E500 Q501 K506 T507 E508	E500-R504 WeakPolarHBondContact O-CB 3.21Å; E500-R504 VanDerWaalsContact O-CG 3.3Å; E500-R504 WeakPolarHBondContact O-CG 3.38Å; E500-R504 PolarHBondContact O-N 3.06Å; E500-R504 IonicContact OE1-CZ 3.43Å; E500-R504 IonicContact OE1-NE 3.45Å; E500-R504 PolarHBondContact OE1-NE 2.91Å; E500-R504 IonicContact OE1-NH2 2.7Å; E500-R504 PolarHBondContact OE1-NH2 3.26Å; Q501-R504 PolarHBondContact O-N 3.28Å; R504-K506 PolarHBondContact O-N 2.91Å; R504-T507 PolarHBondContact O-N 3.3Å; R504-E508 WeakPolarHBondContact O-CB 3.46Å; R504-E508 WeakPolarHBondContact O-CG 3.44Å; R504-E508 PolarHBondContact O-N 3.23Å
505	E	75.3	Confident	69.4	Low	92 Å²	92	115.9 Å²	115.9	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-63.6	-39	177.3	-73.7	175.3	-171.4	0	0	113.3	Q501 R503 N509	Q501-E505 PolarHBondContact NE2-OE1 3.09Å; Q501-E505 WeakPolarHBondContact O-CB 3.35Å; Q501-E505 WeakPolarHBondContact O-CG 3.44Å; Q501-E505 PolarHBondContact O-N 3.07Å; R503-E505 PolarHBondContact O-N 3.09Å; E505-N509 VanDerWaalsContact O-CB 3.3Å; E505-N509 WeakPolarHBondContact O-CB 3.4Å; E505-N509 PolarHBondContact O-N 2.78Å; E505-N509 PolarHBondContact O-ND2 3.06Å
506	K	73	Confident	67.9	Low	136 Å²	136	118.6 Å²	118.6	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-66.7	-45.2	174.5	-81.6	-178.8	179.5	178.7	0	111.6	Q502 R503 R504 E508 N509 E510	Q502-K506 WeakPolarHBondContact O-CB 3.18Å; Q502-K506 WeakPolarHBondContact O-CG 3.38Å; Q502-K506 PolarHBondContact O-N 3.25Å; R503-K506 PolarHBondContact O-N 3.47Å; R504-K506 PolarHBondContact O-N 2.91Å; K506-E508 VanDerWaalsContact C-N 3.33Å; K506-E508 PolarHBondContact O-N 3.05Å; K506-N509 PolarHBondContact O-N 2.93Å; K506-E510 WeakPolarHBondContact O-CB 3.47Å; K506-E510 WeakPolarHBondContact O-CG 3.28Å; K506-E510 PolarHBondContact O-N 2.94Å
507	T	68.3	Low	66.3	Low	97 Å²	97	122.2 Å²	122.2	60%	0.595	56%	0.558	S	S	*	*	H	α-helix	trans	-63.6	-39.6	177.6	-50.9	0	0	0	0	111.3	R503 R504 G511	R503-T507 PolarHBondContact O-N 2.93Å; R503-T507 PolarHBondContact O-OG1 3.12Å; R504-T507 PolarHBondContact O-N 3.3Å; T507-G511 PolarHBondContact O-N 3.28Å
508	E	62.2	Low	64.8	Low	121 Å²	121	122.1 Å²	122.1	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-39.8	172.9	-77.9	-169.5	179.1	0	0	112.8	R504 K506 R512	R504-E508 WeakPolarHBondContact O-CB 3.46Å; R504-E508 WeakPolarHBondContact O-CG 3.44Å; R504-E508 PolarHBondContact O-N 3.23Å; K506-E508 VanDerWaalsContact C-N 3.33Å; K506-E508 PolarHBondContact O-N 3.05Å; E508-R512 WeakPolarHBondContact O-CB 3.44Å; E508-R512 VanDerWaalsContact O-CG 3.31Å; E508-R512 WeakPolarHBondContact O-CG 3.26Å; E508-R512 PolarHBondContact O-N 2.97Å
509	N	58.4	Low	63.1	Low	93 Å²	93	122.1 Å²	122.1	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-73.1	-34.2	177.8	-83.6	-31.3	0	0	0	113	E505 K506 R512 R513	E505-N509 VanDerWaalsContact O-CB 3.3Å; E505-N509 WeakPolarHBondContact O-CB 3.4Å; E505-N509 PolarHBondContact O-N 2.78Å; E505-N509 PolarHBondContact O-ND2 3.06Å; K506-N509 PolarHBondContact O-N 2.93Å; N509-R512 PolarHBondContact O-N 3.27Å; N509-R513 WeakPolarHBondContact O-CB 3.48Å; N509-R513 WeakPolarHBondContact O-CG 3.48Å; N509-R513 PolarHBondContact O-N 3.3Å
510	E	56.9	Low	61.8	Low	119 Å²	119	122.4 Å²	122.4	56%	0.556	57%	0.572	S	S	*	*	H	α-helix	trans	-71.9	-40.4	172.4	-77.2	-176.5	175.5	0	0	111.9	K506 R512 R513 K514	K506-E510 WeakPolarHBondContact O-CB 3.47Å; K506-E510 WeakPolarHBondContact O-CG 3.28Å; K506-E510 PolarHBondContact O-N 2.94Å; E510-R512 VanDerWaalsContact C-N 3.32Å; E510-R512 PolarHBondContact O-N 3.03Å; E510-R513 PolarHBondContact O-N 3.33Å; E510-K514 PolarHBondContact O-N 2.92Å
511	G	57.7	Low	60.1	Low	39 Å²	39	128 Å²	128	40%	0.402	59%	0.589	S	S	.	*	H	α-helix	trans	-58	-44.2	169.4	0	0	0	0	0	111.4	T507 K514 F515	T507-G511 PolarHBondContact O-N 3.28Å; G511-K514 PolarHBondContact O-N 3.47Å; G511-F515 WeakPolarHBondContact O-CB 3.29Å; G511-F515 PolarHBondContact O-N 3.28Å
512	R	53.5	Low	58.8	Low	122 Å²	122	127.2 Å²	127.2	46%	0.46	60%	0.595	S	S	.	*	H	α-helix	trans	-63.2	-41.9	172	-80.5	175.8	178	172.1	7.2	112.6	E508 N509 E510 F515 I516 K531	E508-R512 WeakPolarHBondContact O-CB 3.44Å; E508-R512 VanDerWaalsContact O-CG 3.31Å; E508-R512 WeakPolarHBondContact O-CG 3.26Å; E508-R512 PolarHBondContact O-N 2.97Å; N509-R512 PolarHBondContact O-N 3.27Å; E510-R512 VanDerWaalsContact C-N 3.32Å; E510-R512 PolarHBondContact O-N 3.03Å; R512-F515 PolarHBondContact O-N 3.32Å; R512-I516 WeakPolarHBondContact O-CB 3.4Å; R512-I516 WeakPolarHBondContact O-CD1 3.49Å; R512-I516 WeakPolarHBondContact O-CG1 3.46Å; R512-I516 PolarHBondContact O-N 2.87Å; R512-K531 VanDerWaalsContact NH2-NZ 3.12Å
513	R	49	Very low	57.7	Low	196 Å²	196	130 Å²	130	74%	0.74	61%	0.606	S	S	*	*	H	α-helix	trans	-65	-38.9	177.3	-83.5	177.1	165	-176.6	-4.4	112.6	N509 E510 I516	N509-R513 WeakPolarHBondContact O-CB 3.48Å; N509-R513 WeakPolarHBondContact O-CG 3.48Å; N509-R513 PolarHBondContact O-N 3.3Å; E510-R513 PolarHBondContact O-N 3.33Å; R513-I516 PolarHBondContact O-N 2.84Å
514	K	50.9	Low	56.4	Low	174 Å²	174	124.1 Å²	124.1	76%	0.757	59%	0.587	S	S	*	*	H	α-helix	trans	-67.3	-39.6	172.6	-77.1	-178.8	177.2	177.2	0	111.8	E510 G511 I516 K517	E510-K514 PolarHBondContact O-N 2.92Å; G511-K514 PolarHBondContact O-N 3.47Å; K514-I516 VanDerWaalsContact C-N 3.32Å; K514-I516 PolarHBondContact O-N 3.44Å; K514-K517 PolarHBondContact O-N 2.88Å
515	F	47.6	Very low	55.4	Low	145 Å²	145	123.9 Å²	123.9	64%	0.636	59%	0.59	S	S	*	*	H	α-helix	trans	-71.4	-21.8	177	-129.9	-89.1	0	0	0	114.2	G511 R512	G511-F515 WeakPolarHBondContact O-CB 3.29Å; G511-F515 PolarHBondContact O-N 3.28Å; R512-F515 PolarHBondContact O-N 3.32Å
516	I	49.8	Very low	54.6	Low	99 Å²	99	122.4 Å²	122.4	51%	0.508	59%	0.593	S	S	.	*	H	α-helix	trans	-81.5	-22.6	179.6	-76	166.1	0	0	0	112.2	R512 R513 K514 N518 Q524	R512-I516 WeakPolarHBondContact O-CB 3.4Å; R512-I516 WeakPolarHBondContact O-CD1 3.49Å; R512-I516 WeakPolarHBondContact O-CG1 3.46Å; R512-I516 PolarHBondContact O-N 2.87Å; R513-I516 PolarHBondContact O-N 2.84Å; K514-I516 VanDerWaalsContact C-N 3.32Å; K514-I516 PolarHBondContact O-N 3.44Å; I516-N518 VanDerWaalsContact C-N 3.31Å; I516-N518 PolarHBondContact O-N 3.16Å; I516-Q524 PolarHBondContact O-NE2 2.9Å
517	K	47	Very low	53.9	Low	184 Å²	184	122.5 Å²	122.5	80%	0.8	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-22.5	179.6	-92.6	-174.6	171.3	-174.5	0	114.4	K514	K514-K517 PolarHBondContact O-N 2.88Å
518	N	53.6	Low	53.4	Low	151 Å²	151	125.8 Å²	125.8	81%	0.807	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	47.1	-176.7	-78.5	2	0	0	0	114.4	I516	I516-N518 VanDerWaalsContact C-N 3.31Å; I516-N518 PolarHBondContact O-N 3.16Å
519	K	45.9	Very low	53.4	Low	98 Å²	98	126 Å²	126	43%	0.426	60%	0.601	S	S	.	*	S	Bend	trans	-137.9	128	165.2	-82.8	-170.8	175.6	177.8	0	112.6
520	A	53.8	Low	53.6	Low	71 Å²	71	129.7 Å²	129.7	59%	0.587	61%	0.613	S	S	*	*			trans	-51.5	136.6	171.7	0	0	0	0	0	111.7	S522 K523	A520-S522 PolarHBondContact O-N 3.15Å; A520-K523 PolarHBondContact O-N 3.04Å
521	W	46.3	Very low	53.8	Low	215 Å²	215	128.6 Å²	128.6	81%	0.814	61%	0.606	S	S	*	*	H	α-helix	trans	-47.5	-34.6	-172.3	-175.4	-97.2	0	0	0	114.6	K523 Q524 K525	W521-K523 PolarHBondContact O-N 3.48Å; W521-Q524 PolarHBondContact O-N 3.09Å; W521-K525 PolarHBondContact O-N 3.47Å
522	S	52.2	Low	54	Low	90 Å²	90	133.5 Å²	133.5	63%	0.629	62%	0.616	S	S	*	*	H	α-helix	trans	-67.1	-33.5	-179.7	77	0	0	0	0	113.4	A520 Q524	A520-S522 PolarHBondContact O-N 3.15Å; S522-Q524 VanDerWaalsContact C-N 3.3Å; S522-Q524 PolarHBondContact O-N 3.04Å
523	K	55.4	Low	54.6	Low	145 Å²	145	135.2 Å²	135.2	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-75.1	-18.9	177.6	-70.1	-175.5	179.1	177.7	0	112.6	A520 W521	A520-K523 PolarHBondContact O-N 3.04Å; W521-K523 PolarHBondContact O-N 3.48Å
524	Q	52.6	Low	54.9	Low	65 Å²	65	131.1 Å²	131.1	30%	0.304	62%	0.618	S	S	.	*	H	α-helix	trans	-78.1	-35.6	175.5	-73.6	-176.8	-2.8	0	0	112.5	I516 W521 S522 K528	I516-Q524 PolarHBondContact O-NE2 2.9Å; W521-Q524 PolarHBondContact O-N 3.09Å; S522-Q524 VanDerWaalsContact C-N 3.3Å; S522-Q524 PolarHBondContact O-N 3.04Å; Q524-K528 WeakPolarHBondContact O-CB 3.24Å; Q524-K528 PolarHBondContact O-N 3.03Å; Q524-K528 VanDerWaalsContact O-N 3.08Å
525	K	54.4	Low	55.1	Low	150 Å²	150	127 Å²	127	65%	0.652	60%	0.604	S	S	*	*	H	α-helix	trans	-66.8	-47.6	179.7	-159.8	177.5	-179.7	-174.8	0	111.7	W521 K527 K528 E529	W521-K525 PolarHBondContact O-N 3.47Å; K525-K527 PolarHBondContact O-N 3.31Å; K525-K528 PolarHBondContact O-N 3.12Å; K525-E529 PolarHBondContact O-N 2.94Å; K525-E529 VanDerWaalsContact O-N 3.11Å
526	A	59.3	Low	55.6	Low	61 Å²	61	125.6 Å²	125.6	50%	0.504	60%	0.599	S	S	.	*	H	α-helix	trans	-63	-38.4	178	0	0	0	0	0	113.1	K530	A526-K530 PolarHBondContact O-N 3.43Å; A526-K530 VanDerWaalsContact O-N 3.1Å
527	K	57.8	Low	55.9	Low	138 Å²	138	127 Å²	127	60%	0.6	60%	0.602	S	S	*	*	H	α-helix	trans	-70.8	-33.2	177.2	-162.7	173.9	-176.5	177.5	0	112.1	K525 K531	K525-K527 PolarHBondContact O-N 3.31Å; K527-K531 WeakPolarHBondContact O-CB 3.49Å; K527-K531 PolarHBondContact O-N 2.96Å
528	K	57.2	Low	56	Low	166 Å²	166	125 Å²	125	72%	0.722	59%	0.589	S	S	*	*	H	α-helix	trans	-68.2	-39.6	177.4	-161.1	175.9	-176	-178.8	0	111.5	Q524 K525 K532	Q524-K528 WeakPolarHBondContact O-CB 3.24Å; Q524-K528 PolarHBondContact O-N 3.03Å; Q524-K528 VanDerWaalsContact O-N 3.08Å; K525-K528 PolarHBondContact O-N 3.12Å; K528-K532 WeakPolarHBondContact O-CB 3.37Å; K528-K532 PolarHBondContact O-N 3.06Å
529	E	61.3	Low	56.1	Low	126 Å²	126	125.6 Å²	125.6	59%	0.589	58%	0.584	S	S	*	*	H	α-helix	trans	-68	-43.5	173.9	-75.2	-175.3	169.5	0	0	112.7	K525 K531 K532 K533	K525-E529 PolarHBondContact O-N 2.94Å; K525-E529 VanDerWaalsContact O-N 3.11Å; E529-K531 VanDerWaalsContact C-N 3.31Å; E529-K531 PolarHBondContact O-N 3.31Å; E529-K532 WeakPolarHBondContact O-CB 3.32Å; E529-K532 PolarHBondContact O-N 3.29Å; E529-K533 PolarHBondContact O-N 3.35Å; E529-K533 VanDerWaalsContact O-N 3.08Å
530	K	64.5	Low	56.3	Low	170 Å²	170	131.9 Å²	131.9	74%	0.739	61%	0.606	S	S	*	*	H	α-helix	trans	-60.1	-40.9	175.2	-118	179.4	179.2	179.9	0	112.2	A526 K532 K533 M534	A526-K530 PolarHBondContact O-N 3.43Å; A526-K530 VanDerWaalsContact O-N 3.1Å; K530-K532 VanDerWaalsContact C-N 3.34Å; K530-K533 PolarHBondContact O-N 3.08Å; K530-M534 WeakPolarHBondContact O-CB 3.49Å; K530-M534 PolarHBondContact O-N 3.06Å; K530-M534 VanDerWaalsContact O-N 3.08Å
531	K	60.7	Low	55.9	Low	96 Å²	96	134.8 Å²	134.8	42%	0.417	61%	0.607	S	S	.	*	H	α-helix	trans	-70.3	-31	178.8	-150	177.2	-171.6	-174.8	0	112.4	R512 K527 E529 N535	R512-K531 VanDerWaalsContact NH2-NZ 3.12Å; K527-K531 WeakPolarHBondContact O-CB 3.49Å; K527-K531 PolarHBondContact O-N 2.96Å; E529-K531 VanDerWaalsContact C-N 3.31Å; E529-K531 PolarHBondContact O-N 3.31Å; K531-N535 WeakPolarHBondContact O-CB 3.35Å; K531-N535 PolarHBondContact O-N 3.24Å
532	K	61.2	Low	55.5	Low	141 Å²	141	131.6 Å²	131.6	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-67.2	-47.4	175	-151.7	-176.6	-179.2	-163.4	0	111	K528 E529 K530 M534 N535 E536	K528-K532 WeakPolarHBondContact O-CB 3.37Å; K528-K532 PolarHBondContact O-N 3.06Å; E529-K532 WeakPolarHBondContact O-CB 3.32Å; E529-K532 PolarHBondContact O-N 3.29Å; K530-K532 VanDerWaalsContact C-N 3.34Å; K532-M534 VanDerWaalsContact C-N 3.33Å; K532-M534 PolarHBondContact O-N 3.3Å; K532-N535 PolarHBondContact O-N 2.87Å; K532-E536 WeakPolarHBondContact O-CG 3.37Å; K532-E536 PolarHBondContact O-N 3.44Å
533	K	65.5	Low	55	Low	158 Å²	158	130.5 Å²	130.5	69%	0.687	60%	0.604	S	S	*	*	H	α-helix	trans	-61.2	-37.7	174.9	-73.6	-174.6	173.8	-176	0	113	E529 K530 K537	E529-K533 PolarHBondContact O-N 3.35Å; E529-K533 VanDerWaalsContact O-N 3.08Å; K530-K533 PolarHBondContact O-N 3.08Å; K533-K537 PolarHBondContact O-N 2.92Å; K533-K537 VanDerWaalsContact O-N 3.07Å
534	M	56.6	Low	54.1	Low	111 Å²	111	128.6 Å²	128.6	55%	0.547	61%	0.609	S	S	.	*	H	α-helix	trans	-74.8	-34.8	179.5	-158.7	179.6	73.9	0	0	112.8	K530 K532 K537 R538	K530-M534 WeakPolarHBondContact O-CB 3.49Å; K530-M534 PolarHBondContact O-N 3.06Å; K530-M534 VanDerWaalsContact O-N 3.08Å; K532-M534 VanDerWaalsContact C-N 3.33Å; K532-M534 PolarHBondContact O-N 3.3Å; M534-K537 PolarHBondContact O-N 3.37Å; M534-R538 PolarHBondContact O-N 2.85Å
535	N	54.1	Low	53.3	Low	88 Å²	88	132.4 Å²	132.4	47%	0.471	63%	0.631	S	S	.	*	H	α-helix	trans	-69.5	-35.9	172	-105.5	25.6	0	0	0	112.1	K531 K532 K537 K539	K531-N535 WeakPolarHBondContact O-CB 3.35Å; K531-N535 PolarHBondContact O-N 3.24Å; K532-N535 PolarHBondContact O-N 2.87Å; N535-K537 VanDerWaalsContact C-N 3.29Å; N535-K539 WeakPolarHBondContact O-CB 3.37Å; N535-K539 WeakPolarHBondContact O-CG 3.49Å; N535-K539 PolarHBondContact O-N 2.92Å
536	E	58.1	Low	52.7	Low	114 Å²	114	133 Å²	133	53%	0.533	64%	0.64	S	S	.	*	H	α-helix	trans	-65.5	-34.2	172.7	-79.6	166	178.9	0	0	111.6	K532	K532-E536 WeakPolarHBondContact O-CG 3.37Å; K532-E536 PolarHBondContact O-N 3.44Å
537	K	56.1	Low	52.2	Low	129 Å²	129	139 Å²	139	56%	0.561	66%	0.657	S	S	*	*	H	α-helix	trans	-70.5	-45.9	173.8	-167	177.2	177.3	-175.8	0	112.7	K533 M534 N535 K539 R540 E541	K533-K537 PolarHBondContact O-N 2.92Å; K533-K537 VanDerWaalsContact O-N 3.07Å; M534-K537 PolarHBondContact O-N 3.37Å; N535-K537 VanDerWaalsContact C-N 3.29Å; K537-K539 PolarHBondContact O-N 3.22Å; K537-R540 VanDerWaalsContact O-CB 3.29Å; K537-R540 WeakPolarHBondContact O-CB 3.4Å; K537-R540 PolarHBondContact O-N 2.7Å; K537-E541 WeakPolarHBondContact CE-OE1 3.35Å; K537-E541 PolarHBondContact O-N 3.45Å
538	R	49.9	Very low	51.9	Low	142 Å²	142	138.4 Å²	138.4	54%	0.536	66%	0.661	S	S	.	*	H	α-helix	trans	-61.9	-40.3	176.6	-103.1	-177.4	169.6	179.5	-5.3	113.4	M534 R540 E541 E542	M534-R538 PolarHBondContact O-N 2.85Å; R538-R540 PolarHBondContact O-N 3.21Å; R538-R540 VanDerWaalsContact O-N 3.14Å; R538-E541 PolarHBondContact O-N 2.85Å; R538-E542 PolarHBondContact O-N 3.4Å; R538-E542 VanDerWaalsContact O-N 3.1Å
539	K	54.7	Low	51.3	Low	164 Å²	164	136.8 Å²	136.8	71%	0.713	66%	0.656	S	S	*	*	H	α-helix	trans	-63.7	-14.3	173.7	-79	-172.2	168.8	-145.2	0	114.1	N535 K537	N535-K539 WeakPolarHBondContact O-CB 3.37Å; N535-K539 WeakPolarHBondContact O-CG 3.49Å; N535-K539 PolarHBondContact O-N 2.92Å; K537-K539 PolarHBondContact O-N 3.22Å
540	R	51.6	Low	50.6	Low	230 Å²	230	136.6 Å²	136.6	87%	0.868	66%	0.659	S	S	*	*	H	α-helix	trans	-93.1	-18.6	175.4	-121.3	178.5	-177.8	-178.6	-0.5	112.9	K537 R538	K537-R540 VanDerWaalsContact O-CB 3.29Å; K537-R540 WeakPolarHBondContact O-CB 3.4Å; K537-R540 PolarHBondContact O-N 2.7Å; R538-R540 PolarHBondContact O-N 3.21Å; R538-R540 VanDerWaalsContact O-N 3.14Å
541	E	43.8	Very low	49.8	Very low	131 Å²	131	133.3 Å²	133.3	61%	0.612	65%	0.648	S	S	*	*	H	α-helix	trans	-105.8	-26.4	-172.9	-72.9	171.4	178.1	0	0	112.9	K537 R538 G543	K537-E541 WeakPolarHBondContact CE-OE1 3.35Å; K537-E541 PolarHBondContact O-N 3.45Å; R538-E541 PolarHBondContact O-N 2.85Å; E541-G543 PolarHBondContact O-N 3.25Å
542	E	39.1	Very low	49.3	Very low	149 Å²	149	134.9 Å²	134.9	70%	0.696	66%	0.656	S	S	*	*			trans	-96.2	85	178.5	-74.3	168.5	179.7	0	0	110.6	R538	R538-E542 PolarHBondContact O-N 3.4Å; R538-E542 VanDerWaalsContact O-N 3.1Å
543	G	41.2	Very low	49.1	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	64%	0.641	S	S	*	*			trans	-108.2	112.4	163.5	0	0	0	0	0	110.4	E541	E541-G543 PolarHBondContact O-N 3.25Å
544	S	37.5	Very low	48.4	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	63%	0.633	S	S	*	*			trans	149.7	113.4	151	47.2	0	0	0	0	110.8
545	D	34.4	Very low	48.5	Very low	145 Å²	145	127.5 Å²	127.5	78%	0.775	63%	0.63	S	S	*	*				167.8	138.7	123.5	-82.2	-18.7	0	0	0	111.6	E547	D545-E547 PolarHBondContact O-N 3.27Å
546	I	42.9	Very low	49	Very low	163 Å²	163	126.6 Å²	126.6	84%	0.836	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	36.1	-148.2	-76	163.8	0	0	0	114.7
547	E	48.7	Very low	49.6	Very low	185 Å²	185	123 Å²	123	86%	0.864	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	-1.1	176.6	-70.1	-171.9	169.4	0	0	115.7	D545	D545-E547 PolarHBondContact O-N 3.27Å
548	D	49.9	Very low	50	Low	126 Å²	126	120.1 Å²	120.1	67%	0.674	60%	0.603	S	S	*	*	S	Bend	trans	-101	-12.3	-177	-81.1	-33.7	0	0	0	115.4	M551 E552	D548-M551 PolarHBondContact O-N 3.33Å; D548-E552 PolarHBondContact O-N 3.47Å
549	E	45.3	Very low	51.1	Low	133 Å²	133	120.9 Å²	120.9	62%	0.621	61%	0.606	S	S	*	*	H	α-helix	trans	-64.6	-44	-175.6	-93.9	-174.5	153.9	0	0	113.1	M551 E552 E553	E549-M551 PolarHBondContact O-N 2.91Å; E549-E552 PolarHBondContact O-N 3.26Å; E549-E553 WeakPolarHBondContact O-CB 3.3Å; E549-E553 PolarHBondContact O-N 3.34Å
550	D	46.3	Very low	51.9	Low	122 Å²	122	114.6 Å²	114.6	65%	0.652	58%	0.58	S	S	*	*	H	α-helix	trans	-64.4	-31.1	179.7	-76.3	-5.4	0	0	0	112.2	L554	D550-L554 PolarHBondContact O-N 2.95Å
551	M	47.7	Very low	52.4	Low	101 Å²	101	107.2 Å²	107.2	50%	0.498	56%	0.557	S	S	.	*	H	α-helix	trans	-83.4	-32.4	-179.6	-160.6	73.5	-74.7	0	0	112	D548 E549 L554 L555	D548-M551 PolarHBondContact O-N 3.33Å; E549-M551 PolarHBondContact O-N 2.91Å; M551-L554 HydrophobicContact CE-CB 3.46Å; M551-L554 VanDerWaalsContact CE-CB 3.46Å; M551-L554 HydrophobicContact CE-CD1 3.5Å; M551-L554 HydrophobicContact CE-CG 4.11Å; M551-L555 WeakPolarHBondContact O-CB 3.3Å; M551-L555 WeakPolarHBondContact O-CD1 3.43Å; M551-L555 WeakPolarHBondContact O-CG 3.47Å; M551-L555 PolarHBondContact O-N 2.95Å
552	E	51.4	Low	53.7	Low	128 Å²	128	107.7 Å²	107.7	60%	0.598	56%	0.557	S	S	*	*	H	α-helix	trans	-71.2	-36.1	173.8	-158.8	168	-156.1	0	0	111.8	D548 E549 L555 N556	D548-E552 PolarHBondContact O-N 3.47Å; E549-E552 PolarHBondContact O-N 3.26Å; E552-L555 PolarHBondContact O-N 2.89Å; E552-N556 WeakPolarHBondContact O-CB 3.49Å; E552-N556 PolarHBondContact O-N 2.89Å
553	E	55.4	Low	55.2	Low	65 Å²	65	105.6 Å²	105.6	30%	0.304	55%	0.546	S	S	.	.	H	α-helix	trans	-61	-51.6	173.1	-171.1	174.2	-159.2	0	0	111.4	E549 L555 N556 D557 T581	E549-E553 WeakPolarHBondContact O-CB 3.3Å; E549-E553 PolarHBondContact O-N 3.34Å; E553-L555 VanDerWaalsContact C-N 3.27Å; E553-L555 PolarHBondContact O-N 3.46Å; E553-N556 WeakPolarHBondContact O-CA 3.48Å; E553-N556 WeakPolarHBondContact O-CB 3.39Å; E553-N556 PolarHBondContact O-N 3.1Å; E553-D557 PolarHBondContact O-N 3.46Å; E553-T581 HydrophobicContact CG-CG2 4.21Å
554	L	51.5	Low	56.4	Low	98 Å²	98	104.8 Å²	104.8	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-35.1	175.4	-87.1	161.9	0	0	0	112.9	D550 M551 N556 T558	D550-L554 PolarHBondContact O-N 2.95Å; M551-L554 HydrophobicContact CE-CB 3.46Å; M551-L554 VanDerWaalsContact CE-CB 3.46Å; M551-L554 HydrophobicContact CE-CD1 3.5Å; M551-L554 HydrophobicContact CE-CG 4.11Å; L554-N556 VanDerWaalsContact C-N 3.33Å; L554-T558 WeakPolarHBondContact O-CB 3.33Å; L554-T558 WeakPolarHBondContact O-CG2 3.37Å; L554-T558 PolarHBondContact O-N 3.03Å; L554-T558 VanDerWaalsContact O-N 3.09Å; L554-T558 PolarHBondContact O-OG1 2.87Å
555	L	58.2	Low	57.7	Low	92 Å²	92	108 Å²	108	48%	0.482	53%	0.526	S	S	.	.	H	α-helix	trans	-71.6	-28.4	174.9	-75.9	168.1	0	0	0	112.5	M551 E552 E553 T558 R559	M551-L555 WeakPolarHBondContact O-CB 3.3Å; M551-L555 WeakPolarHBondContact O-CD1 3.43Å; M551-L555 WeakPolarHBondContact O-CG 3.47Å; M551-L555 PolarHBondContact O-N 2.95Å; E552-L555 PolarHBondContact O-N 2.89Å; E553-L555 VanDerWaalsContact C-N 3.27Å; E553-L555 PolarHBondContact O-N 3.46Å; L555-T558 WeakPolarHBondContact CA-OG1 3.29Å; L555-T558 PolarHBondContact O-OG1 3.5Å; L555-T558 VanDerWaalsContact O-OG1 3.09Å; L555-R559 WeakPolarHBondContact O-CD 3.44Å; L555-R559 VanDerWaalsContact O-CG 3.24Å; L555-R559 WeakPolarHBondContact O-CG 3.36Å; L555-R559 PolarHBondContact O-N 3.2Å
556	N	66.1	Low	59.5	Low	69 Å²	69	108.5 Å²	108.5	37%	0.369	52%	0.521	S	S	.	.	H	α-helix	trans	-79	-42	177.7	-135	15.8	0	0	0	111.4	E552 E553 L554 T558 R559 L560	E552-N556 WeakPolarHBondContact O-CB 3.49Å; E552-N556 PolarHBondContact O-N 2.89Å; E553-N556 WeakPolarHBondContact O-CA 3.48Å; E553-N556 WeakPolarHBondContact O-CB 3.39Å; E553-N556 PolarHBondContact O-N 3.1Å; L554-N556 VanDerWaalsContact C-N 3.33Å; N556-T558 PolarHBondContact O-N 2.79Å; N556-R559 WeakPolarHBondContact O-CA 3.46Å; N556-R559 WeakPolarHBondContact O-CB 3.41Å; N556-R559 PolarHBondContact O-N 3.47Å; N556-L560 PolarHBondContact O-N 2.88Å
557	D	69.8	Low	60.7	Low	38 Å²	38	104 Å²	104	20%	0.203	52%	0.516	C	S	.	.	H	α-helix	trans	-62.5	-43.5	175.1	-69.9	-5.7	0	0	0	111.2	E553 R559 L560 L561 L578	E553-D557 PolarHBondContact O-N 3.46Å; D557-R559 PolarHBondContact O-N 3.06Å; D557-L560 PolarHBondContact O-N 3.14Å; D557-L561 WeakPolarHBondContact O-CB 3.15Å; D557-L561 PolarHBondContact O-N 3.38Å; D557-L578 HydrophobicContact CB-CD2 4.29Å
558	T	63.9	Low	61.5	Low	69 Å²	69	102.9 Å²	102.9	42%	0.423	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-23.1	175.2	53	0	0	0	0	113.3	L554 L555 N556 K562	L554-T558 WeakPolarHBondContact O-CB 3.33Å; L554-T558 WeakPolarHBondContact O-CG2 3.37Å; L554-T558 PolarHBondContact O-N 3.03Å; L554-T558 VanDerWaalsContact O-N 3.09Å; L554-T558 PolarHBondContact O-OG1 2.87Å; L555-T558 WeakPolarHBondContact CA-OG1 3.29Å; L555-T558 PolarHBondContact O-OG1 3.5Å; L555-T558 VanDerWaalsContact O-OG1 3.09Å; N556-T558 PolarHBondContact O-N 2.79Å; T558-K562 VanDerWaalsContact O-CG 3.29Å; T558-K562 WeakPolarHBondContact O-CG 3.4Å; T558-K562 PolarHBondContact O-N 2.97Å
559	R	73.4	Confident	63	Low	159 Å²	159	98.4 Å²	98.4	60%	0.6	48%	0.483	S	S	*	.	H	α-helix	trans	-78.5	-42.1	171.7	-79.4	171.9	-179.7	175.4	5.3	112.1	L555 N556 D557 L561 K562 K563	L555-R559 WeakPolarHBondContact O-CD 3.44Å; L555-R559 VanDerWaalsContact O-CG 3.24Å; L555-R559 WeakPolarHBondContact O-CG 3.36Å; L555-R559 PolarHBondContact O-N 3.2Å; N556-R559 WeakPolarHBondContact O-CA 3.46Å; N556-R559 WeakPolarHBondContact O-CB 3.41Å; N556-R559 PolarHBondContact O-N 3.47Å; D557-R559 PolarHBondContact O-N 3.06Å; R559-L561 VanDerWaalsContact C-N 3.32Å; R559-K562 PolarHBondContact O-N 3.02Å; R559-K563 WeakPolarHBondContact O-CG 3.31Å; R559-K563 PolarHBondContact O-N 3.02Å
560	L	71.1	Confident	64.5	Low	32 Å²	32	95.7 Å²	95.7	17%	0.168	48%	0.476	C	S	.	.	H	α-helix	trans	-60.9	-43.1	174.6	-79.9	165.8	0	0	0	110.6	N556 D557 K562 K563 L564 I569 F574	N556-L560 PolarHBondContact O-N 2.88Å; D557-L560 PolarHBondContact O-N 3.14Å; L560-K562 VanDerWaalsContact C-N 3.31Å; L560-K562 PolarHBondContact O-N 3.33Å; L560-K563 WeakPolarHBondContact O-CA 3.32Å; L560-K563 WeakPolarHBondContact O-CB 3.49Å; L560-K563 PolarHBondContact O-N 2.97Å; L560-L564 PolarHBondContact O-N 3.38Å; L560-I569 HydrophobicContact CD2-CD1 4.01Å; L560-I569 WeakPolarHBondContact O-CD1 3.35Å; L560-F574 HydrophobicContact CB-CD2 3.8Å; L560-F574 HydrophobicContact CB-CE2 3.72Å
561	L	63.6	Low	65.4	Low	75 Å²	75	96.7 Å²	96.7	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-67.3	-32.4	179	-154.2	145.6	0	0	0	112.2	D557 R559 K563 K565 F574	D557-L561 WeakPolarHBondContact O-CB 3.15Å; D557-L561 PolarHBondContact O-N 3.38Å; R559-L561 VanDerWaalsContact C-N 3.32Å; L561-K563 VanDerWaalsContact C-N 3.35Å; L561-K565 HydrophobicContact CD2-CD 4.07Å; L561-K565 HydrophobicContact CD2-CG 4.47Å; L561-K565 WeakPolarHBondContact O-CB 3.11Å; L561-K565 WeakPolarHBondContact O-CG 3.47Å; L561-K565 PolarHBondContact O-N 2.86Å; L561-F574 HydrophobicContact CB-CE2 3.95Å; L561-F574 HydrophobicContact CB-CZ 4.17Å; L561-F574 HydrophobicContact CD1-CZ 3.97Å; L561-F574 HydrophobicContact CG-CE2 4.36Å; L561-F574 HydrophobicContact CG-CZ 4.13Å
562	K	70.4	Confident	66.3	Low	140 Å²	140	99.4 Å²	99.4	61%	0.609	49%	0.488	S	S	*	.	H	α-helix	trans	-71.1	-26	170.4	-80.1	175.2	-176.9	171.5	0	113.4	T558 R559 L560 K566	T558-K562 VanDerWaalsContact O-CG 3.29Å; T558-K562 WeakPolarHBondContact O-CG 3.4Å; T558-K562 PolarHBondContact O-N 2.97Å; R559-K562 PolarHBondContact O-N 3.02Å; L560-K562 VanDerWaalsContact C-N 3.31Å; L560-K562 PolarHBondContact O-N 3.33Å; K562-K566 WeakPolarHBondContact O-CB 3.41Å; K562-K566 VanDerWaalsContact O-CG 3.26Å; K562-K566 WeakPolarHBondContact O-CG 3.44Å; K562-K566 PolarHBondContact O-N 3.18Å
563	K	70.9	Confident	67	Low	106 Å²	106	98.6 Å²	98.6	46%	0.461	48%	0.484	S	S	.	.	H	α-helix	trans	-78	-40.4	174.4	-73.5	177.3	177.8	-179.3	0	110.9	R559 L560 L561 K566 G567 K568 I569	R559-K563 WeakPolarHBondContact O-CG 3.31Å; R559-K563 PolarHBondContact O-N 3.02Å; L560-K563 WeakPolarHBondContact O-CA 3.32Å; L560-K563 WeakPolarHBondContact O-CB 3.49Å; L560-K563 PolarHBondContact O-N 2.97Å; L561-K563 VanDerWaalsContact C-N 3.35Å; K563-K566 CarbonylContact O-C 3.5Å; K563-K566 PolarHBondContact O-N 3.47Å; K563-K566 VanDerWaalsContact O-N 3.15Å; K563-G567 PolarHBondContact O-N 2.96Å; K563-K568 HydrophobicContact CB-CB 4.34Å; K563-K568 PolarHBondContact O-N 3.32Å; K563-I569 HydrophobicContact CB-CD1 3.96Å; K563-I569 HydrophobicContact CB-CG1 4.01Å; K563-I569 HydrophobicContact CB-CG2 4.36Å
564	L	66.3	Low	67.8	Low	49 Å²	49	96.8 Å²	96.8	26%	0.257	48%	0.476	S	S	.	.	H	α-helix	trans	-60.7	-49.2	173.3	-174.5	70.7	0	0	0	111.1	L560 K566 G567 I569 E571 F574	L560-L564 PolarHBondContact O-N 3.38Å; L564-K566 PolarHBondContact O-N 2.96Å; L564-G567 PolarHBondContact O-N 3.45Å; L564-I569 HydrophobicContact CB-CD1 4.27Å; L564-I569 HydrophobicContact CB-CG1 4.09Å; L564-I569 HydrophobicContact CD1-CG1 4.34Å; L564-E571 HydrophobicContact CD1-CB 4.49Å; L564-F574 HydrophobicContact CB-CD2 4.34Å; L564-F574 HydrophobicContact CD1-CB 4.22Å; L564-F574 HydrophobicContact CD2-CB 4.34Å; L564-F574 HydrophobicContact CD2-CD1 3.89Å; L564-F574 HydrophobicContact CD2-CD2 4.37Å; L564-F574 HydrophobicContact CD2-CE1 4.29Å; L564-F574 HydrophobicContact CD2-CG 3.93Å
565	K	63.6	Low	68.5	Low	172 Å²	172	97.8 Å²	97.8	75%	0.748	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.9	175.7	-75.9	-173.6	175.7	-175.6	0	114.8	L561	L561-K565 HydrophobicContact CD2-CD 4.07Å; L561-K565 HydrophobicContact CD2-CG 4.47Å; L561-K565 WeakPolarHBondContact O-CB 3.11Å; L561-K565 WeakPolarHBondContact O-CG 3.47Å; L561-K565 PolarHBondContact O-N 2.86Å
566	K	74.1	Confident	69.2	Low	156 Å²	156	100.9 Å²	100.9	68%	0.678	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	8.3	175.6	-72.1	-177.5	178.8	-169.2	0	112.5	K562 K563 L564 K568	K562-K566 WeakPolarHBondContact O-CB 3.41Å; K562-K566 VanDerWaalsContact O-CG 3.26Å; K562-K566 WeakPolarHBondContact O-CG 3.44Å; K562-K566 PolarHBondContact O-N 3.18Å; K563-K566 CarbonylContact O-C 3.5Å; K563-K566 PolarHBondContact O-N 3.47Å; K563-K566 VanDerWaalsContact O-N 3.15Å; L564-K566 PolarHBondContact O-N 2.96Å; K566-K568 HydrophobicContact CB-CG 4.2Å; K566-K568 PolarHBondContact O-N 2.83Å
567	G	67.1	Low	69.3	Low	69 Å²	69	98.3 Å²	98.3	71%	0.711	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	21.6	-179.6	0	0	0	0	0	114.2	K563 L564	K563-G567 PolarHBondContact O-N 2.96Å; L564-G567 PolarHBondContact O-N 3.45Å
568	K	66.5	Low	69	Low	161 Å²	161	99.5 Å²	99.5	70%	0.7	48%	0.484	S	S	*	.	S	Bend	trans	-91	-9.4	-174.8	-68.1	-166.7	174.1	-163	0	114.3	K563 K566	K563-K568 HydrophobicContact CB-CB 4.34Å; K563-K568 PolarHBondContact O-N 3.32Å; K566-K568 HydrophobicContact CB-CG 4.2Å; K566-K568 PolarHBondContact O-N 2.83Å
569	I	79.6	Confident	68.6	Low	32 Å²	32	102.1 Å²	102.1	16%	0.164	49%	0.494	C	S	.	.	S	Bend	trans	-143.8	152.1	175.2	59.3	176	0	0	0	107.5	L560 K563 L564 E573 F574	L560-I569 HydrophobicContact CD2-CD1 4.01Å; L560-I569 WeakPolarHBondContact O-CD1 3.35Å; K563-I569 HydrophobicContact CB-CD1 3.96Å; K563-I569 HydrophobicContact CB-CG1 4.01Å; K563-I569 HydrophobicContact CB-CG2 4.36Å; L564-I569 HydrophobicContact CB-CD1 4.27Å; L564-I569 HydrophobicContact CB-CG1 4.09Å; L564-I569 HydrophobicContact CD1-CG1 4.34Å; I569-E573 WeakPolarHBondContact CA-OE2 3.49Å; I569-E573 HydrophobicContact CB-CB 4.31Å; I569-F574 HydrophobicContact CD1-CB 3.97Å; I569-F574 HydrophobicContact CD1-CD2 4.05Å
570	T	77.9	Confident	67.7	Low	76 Å²	76	98.9 Å²	98.9	47%	0.466	49%	0.492	S	S	.	.			trans	-81.3	166.7	174.2	62.4	0	0	0	0	111.3	E572 E573 F574	T570-E572 VanDerWaalsContact C-N 3.33Å; T570-E573 PolarHBondContact N-OE2 3.06Å; T570-E573 VanDerWaalsContact N-OE2 3.12Å; T570-E573 PolarHBondContact O-N 3.08Å; T570-E573 VanDerWaalsContact OG1-CG 3.28Å; T570-E573 WeakPolarHBondContact OG1-CG 3.47Å; T570-E573 PolarHBondContact OG1-N 3.07Å; T570-F574 PolarHBondContact O-N 3.01Å
571	E	64.8	Low	66.8	Low	143 Å²	143	98.4 Å²	98.4	67%	0.668	49%	0.491	S	S	*	.	H	α-helix	trans	-64.7	-37.6	-180	-158.2	158.6	-154.2	0	0	111.6	L564 F574 E575	L564-E571 HydrophobicContact CD1-CB 4.49Å; E571-F574 WeakPolarHBondContact O-CB 3.34Å; E571-F574 PolarHBondContact O-N 3.39Å; E571-E575 PolarHBondContact O-N 3.39Å
572	E	67	Low	65.7	Low	158 Å²	158	97 Å²	97	74%	0.738	49%	0.494	S	S	*	.	H	α-helix	trans	-65.2	-38.4	173.6	-65.6	-178.6	171.2	0	0	113.1	T570 F574 E575 K576	T570-E572 VanDerWaalsContact C-N 3.33Å; E572-F574 VanDerWaalsContact C-N 3.33Å; E572-E575 PolarHBondContact O-N 3.48Å; E572-K576 PolarHBondContact O-N 3.42Å
573	E	66.9	Low	64.3	Low	111 Å²	111	98.6 Å²	98.6	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-31.4	175.6	-73.6	175	164.1	0	0	112.3	I569 T570 G577	I569-E573 WeakPolarHBondContact CA-OE2 3.49Å; I569-E573 HydrophobicContact CB-CB 4.31Å; T570-E573 PolarHBondContact N-OE2 3.06Å; T570-E573 VanDerWaalsContact N-OE2 3.12Å; T570-E573 PolarHBondContact O-N 3.08Å; T570-E573 VanDerWaalsContact OG1-CG 3.28Å; T570-E573 WeakPolarHBondContact OG1-CG 3.47Å; T570-E573 PolarHBondContact OG1-N 3.07Å; E573-G577 PolarHBondContact O-N 3.5Å; E573-G577 VanDerWaalsContact O-N 3.08Å
574	F	71.4	Confident	62.7	Low	27 Å²	27	103.3 Å²	103.3	12%	0.118	52%	0.516	C	S	.	.	H	α-helix	trans	-67.8	-44.6	174.5	176.7	-105.9	0	0	0	111.4	L560 L561 L564 I569 T570 E571 E572 G577 L578	L560-F574 HydrophobicContact CB-CD2 3.8Å; L560-F574 HydrophobicContact CB-CE2 3.72Å; L561-F574 HydrophobicContact CB-CE2 3.95Å; L561-F574 HydrophobicContact CB-CZ 4.17Å; L561-F574 HydrophobicContact CD1-CZ 3.97Å; L561-F574 HydrophobicContact CG-CE2 4.36Å; L561-F574 HydrophobicContact CG-CZ 4.13Å; L564-F574 HydrophobicContact CB-CD2 4.34Å; L564-F574 HydrophobicContact CD1-CB 4.22Å; L564-F574 HydrophobicContact CD2-CB 4.34Å; L564-F574 HydrophobicContact CD2-CD1 3.89Å; L564-F574 HydrophobicContact CD2-CD2 4.37Å; L564-F574 HydrophobicContact CD2-CE1 4.29Å; L564-F574 HydrophobicContact CD2-CG 3.93Å; I569-F574 HydrophobicContact CD1-CB 3.97Å; I569-F574 HydrophobicContact CD1-CD2 4.05Å; T570-F574 PolarHBondContact O-N 3.01Å; E571-F574 WeakPolarHBondContact O-CB 3.34Å; E571-F574 PolarHBondContact O-N 3.39Å; E572-F574 VanDerWaalsContact C-N 3.33Å; F574-G577 PolarHBondContact O-N 3.08Å; F574-L578 HydrophobicContact CD1-CD1 3.93Å; F574-L578 HydrophobicContact CE1-CD1 3.4Å; F574-L578 VanDerWaalsContact CE1-CD1 3.4Å; F574-L578 HydrophobicContact CE2-CD1 4.14Å; F574-L578 HydrophobicContact CZ-CD1 3.51Å; F574-L578 HydrophobicContact CZ-CG 4.37Å; F574-L578 PolarHBondContact O-N 3.2Å; F574-L578 VanDerWaalsContact O-N 3.1Å
575	E	66.8	Low	61.3	Low	120 Å²	120	105.8 Å²	105.8	56%	0.561	53%	0.533	S	S	*	.	H	α-helix	trans	-65.4	-42.8	176.6	-73	-171.9	162.3	0	0	112.7	E571 E572 G577 L578 L579	E571-E575 PolarHBondContact O-N 3.39Å; E572-E575 PolarHBondContact O-N 3.48Å; E575-G577 PolarHBondContact O-N 3.47Å; E575-L578 PolarHBondContact O-N 3.42Å; E575-L579 WeakPolarHBondContact O-CG 3.36Å; E575-L579 PolarHBondContact O-N 3.36Å; E575-L579 VanDerWaalsContact O-N 3.08Å
576	K	72.4	Confident	60	Low	156 Å²	156	104.5 Å²	104.5	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-60.9	-34.9	173.2	-118.5	175.5	-178.4	171.1	0	112.4	E572 T580	E572-K576 PolarHBondContact O-N 3.42Å; K576-T580 PolarHBondContact O-N 3.11Å; K576-T580 PolarHBondContact O-OG1 3.1Å
577	G	68.3	Low	57.9	Low	16 Å²	16	106.2 Å²	106.2	17%	0.165	54%	0.541	C	S	.	.	H	α-helix	trans	-67.7	-37.2	177.1	0	0	0	0	0	113.4	E573 F574 E575 T580 T581	E573-G577 PolarHBondContact O-N 3.5Å; E573-G577 VanDerWaalsContact O-N 3.08Å; F574-G577 PolarHBondContact O-N 3.08Å; E575-G577 PolarHBondContact O-N 3.47Å; G577-T580 PolarHBondContact O-OG1 3.23Å; G577-T580 VanDerWaalsContact O-OG1 3.05Å; G577-T581 PolarHBondContact O-OG1 3.2Å; G577-T581 VanDerWaalsContact O-OG1 3.12Å
578	L	62.3	Low	56	Low	63 Å²	63	109.6 Å²	109.6	33%	0.33	55%	0.548	S	S	.	.	H	α-helix	trans	-71.7	-36.2	175.1	-81.4	157.9	0	0	0	112.6	D557 F574 E575 T580 T581	D557-L578 HydrophobicContact CB-CD2 4.29Å; F574-L578 HydrophobicContact CD1-CD1 3.93Å; F574-L578 HydrophobicContact CE1-CD1 3.4Å; F574-L578 VanDerWaalsContact CE1-CD1 3.4Å; F574-L578 HydrophobicContact CE2-CD1 4.14Å; F574-L578 HydrophobicContact CZ-CD1 3.51Å; F574-L578 HydrophobicContact CZ-CG 4.37Å; F574-L578 PolarHBondContact O-N 3.2Å; F574-L578 VanDerWaalsContact O-N 3.1Å; E575-L578 PolarHBondContact O-N 3.42Å; L578-T580 VanDerWaalsContact C-N 3.31Å; L578-T580 PolarHBondContact O-N 3.08Å; L578-T581 PolarHBondContact O-OG1 3.4Å
579	L	56	Low	54.2	Low	123 Å²	123	108.5 Å²	108.5	64%	0.644	55%	0.554	S	S	*	*	H	α-helix	trans	-73.4	-21.7	-179.5	-72.9	163.7	0	0	0	113.6	E575	E575-L579 WeakPolarHBondContact O-CG 3.36Å; E575-L579 PolarHBondContact O-N 3.36Å; E575-L579 VanDerWaalsContact O-N 3.08Å
580	T	55.5	Low	51.7	Low	91 Å²	91	114.6 Å²	114.6	56%	0.558	59%	0.587	S	S	*	*	H	α-helix	trans	-86.2	-25	-179.5	40.5	0	0	0	0	113.2	K576 G577 L578	K576-T580 PolarHBondContact O-N 3.11Å; K576-T580 PolarHBondContact O-OG1 3.1Å; G577-T580 PolarHBondContact O-OG1 3.23Å; G577-T580 VanDerWaalsContact O-OG1 3.05Å; L578-T580 VanDerWaalsContact C-N 3.31Å; L578-T580 PolarHBondContact O-N 3.08Å
581	T	51.9	Low	49.4	Very low	22 Å²	22	117.9 Å²	117.9	14%	0.135	60%	0.601	C	S	.	*	H	α-helix	trans	-67.8	-44.1	171.1	10.5	0	0	0	0	111.5	E553 G577 L578 K583 R584	E553-T581 HydrophobicContact CG-CG2 4.21Å; G577-T581 PolarHBondContact O-OG1 3.2Å; G577-T581 VanDerWaalsContact O-OG1 3.12Å; L578-T581 PolarHBondContact O-OG1 3.4Å; T581-K583 VanDerWaalsContact C-N 3.26Å; T581-K583 PolarHBondContact O-N 3.48Å; T581-K583 VanDerWaalsContact O-N 3.15Å; T581-R584 PolarHBondContact O-N 3.42Å
582	G	40.9	Very low	47.9	Very low	45 Å²	45	114.9 Å²	114.9	46%	0.464	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.3	-11.2	-179.3	0	0	0	0	0	116.5
583	K	40.8	Very low	46.2	Very low	174 Å²	174	114.7 Å²	114.7	76%	0.757	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-11.7	176.6	-83.4	-174.4	177.3	-179.4	0	114.1	T581 T585	T581-K583 VanDerWaalsContact C-N 3.26Å; T581-K583 PolarHBondContact O-N 3.48Å; T581-K583 VanDerWaalsContact O-N 3.15Å; K583-T585 VanDerWaalsContact C-N 3.34Å
584	R	36.4	Very low	44.4	Very low	205 Å²	205	114.5 Å²	114.5	77%	0.774	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-17.9	-176.9	-80.9	-177.3	174.7	177.5	-2.5	114.2	T581 I586	T581-R584 PolarHBondContact O-N 3.42Å; R584-I586 VanDerWaalsContact C-N 3.27Å; R584-I586 PolarHBondContact O-N 3.43Å
585	T	37.9	Very low	42.5	Very low	102 Å²	102	120.6 Å²	120.6	63%	0.626	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-0.2	-175.1	-16.8	0	0	0	0	114.6	K583	K583-T585 VanDerWaalsContact C-N 3.34Å
586	I	34.8	Very low	40.7	Very low	145 Å²	145	123.2 Å²	123.2	74%	0.744	67%	0.672	S	S	*	*	S	Bend	trans	-119.7	79.9	177.8	-51.4	173.8	0	0	0	108.8	R584	R584-I586 VanDerWaalsContact C-N 3.27Å; R584-I586 PolarHBondContact O-N 3.43Å
587	K	29.9	Very low	38.7	Very low	192 Å²	192	124.1 Å²	124.1	84%	0.835	68%	0.679	S	S	*	*			trans	-179.2	99.7	155.9	-103.3	171.9	-170.8	-164.8	0	109.4
588	T	28.5	Very low	37	Very low	140 Å²	140	130 Å²	130	86%	0.859	71%	0.706	S	S	*	*			trans	161.7	92.8	133	43.4	0	0	0	0	108.9
589	V	28.4	Very low	35.4	Very low	137 Å²	137	134 Å²	134	83%	0.83	73%	0.728	S	S	*	*			trans	-121.9	99.3	150.4	-177.2	0	0	0	0	104	L591	V589-L591 PolarHBondContact O-N 2.99Å
590	D	27.6	Very low	34.3	Very low	160 Å²	160	138 Å²	138	86%	0.856	77%	0.765	S	S	*	*			trans	-67.9	112.7	169.8	-110.1	-22.8	0	0	0	107.5
591	L	29.8	Very low	33.3	Very low	146 Å²	146	140.4 Å²	140.4	76%	0.764	78%	0.775	S	S	*	*			trans	-89.6	109.1	162.3	-82.7	161.7	0	0	0	106.5	V589 I593	V589-L591 PolarHBondContact O-N 2.99Å; L591-I593 PolarHBondContact O-N 3.03Å
592	G	32	Very low	32.3	Very low	79 Å²	79	146.6 Å²	146.6	81%	0.814	81%	0.809	S	S	*	*			trans	-63.8	118.5	165.2	0	0	0	0	0	109.6
593	I	31.9	Very low	31.8	Very low	154 Å²	154	152.3 Å²	152.3	79%	0.79	83%	0.828	S	S	*	*			trans	-130.7	118.2	162.2	-62.6	-179.5	0	0	0	106.1	L591	L591-I593 PolarHBondContact O-N 3.03Å
594	S	29.7	Very low	31.3	Very low	107 Å²	107	151 Å²	151	75%	0.748	83%	0.832	S	S	*	*			trans	-65.5	146.7	174	47.5	0	0	0	0	111.9
595	D	30.8	Very low	31	Very low	156 Å²	156	147.6 Å²	147.6	83%	0.834	84%	0.836	S	S	*	*			trans	-43.8	138.8	168.8	-56.3	-55.7	0	0	0	113.4
596	L	29.3	Very low	30.5	Very low	175 Å²	175	150.7 Å²	150.7	92%	0.916	85%	0.85	S	S	*	*			trans	-156.8	111.6	142.2	-96.7	167.9	0	0	0	107.6
597	E	30.7	Very low	30.2	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.813	86%	0.857	S	S	*	*			trans	-73.2	166.6	167.7	-71.6	175.1	141.4	0	0	111.3
598	D	30.9	Very low	30.2	Very low	139 Å²	139	147.9 Å²	147.9	74%	0.743	86%	0.859	S	S	*	*			trans	98.7	114.7	155.6	-63.1	-20.6	0	0	0	121.5
599	D	30.6	Very low	30.4	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	86%	0.859	S	S	*	*			trans	91.5	119.6	134.3	-72.9	-26	0	0	0	122.7
600	C	32.8	Very low	30.5	Very low	208 Å²	208	149.6 Å²	149.6	100%	1.405	86%	0.861	S	S	*	*			trans	81.4	0	162.2	-81	0	0	0	0	119.9

Retrieved 600 of 600 residues in 297.4 ms (Link to these results)

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