A0A077ZCI5_TRITR Loading...

Acyl-CoA:lysophosphatidylglycerol acyltransferase 1

AlphaFold DB , UniProt , Accession A0A077ZCI5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 363 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	45.8	Very low	77.1	Confident	219 Å²	219	93.5 Å²	93.5	100%	1.079	50%	0.495	S	S	*	.				0	127.4	0	-70.8	165.5	77.2	0	0	107.4
2	S	62.7	Low	77.9	Confident	76 Å²	76	92.3 Å²	92.3	53%	0.531	50%	0.498	S	S	.	.			trans	-67	138	177.6	46.5	0	0	0	0	110.5	V7	S2-V7 WeakPolarHBondContact OG-CG2 3.3Å
3	S	79	Confident	78.3	Confident	54 Å²	54	88.8 Å²	88.8	38%	0.378	49%	0.49	S	S	.	.			trans	-57.7	143.3	179.5	-172.8	0	0	0	0	111.9	W5 Y6 V7	S3-W5 VanDerWaalsContact CB-CD1 3.5Å; S3-W5 PolarHBondContact O-N 2.8Å; S3-W5 VanDerWaalsContact O-N 3.16Å; S3-W5 PolarHBondContact OG-NE1 3.33Å; S3-W5 VanDerWaalsContact OG-NE1 3.16Å; S3-Y6 WeakPolarHBondContact O-CB 3.29Å; S3-Y6 PolarHBondContact O-N 3.09Å; S3-V7 PolarHBondContact O-N 3.48Å
4	P	80.9	Confident	78.3	Confident	112 Å²	112	84.9 Å²	84.9	73%	0.727	46%	0.464	S	S	*	.	H	α-helix	trans	-52.2	-37.4	179.5	-28.1	35	0	0	0	113.8	Y6 V7 G8	P4-Y6 VanDerWaalsContact C-N 3.32Å; P4-Y6 PolarHBondContact O-N 3.32Å; P4-V7 PolarHBondContact O-N 3.37Å; P4-G8 PolarHBondContact O-N 3.31Å
5	W	83.9	Confident	78.7	Confident	173 Å²	173	82.7 Å²	82.7	66%	0.655	45%	0.452	S	S	*	.	H	α-helix	trans	-63.1	-37.9	177.6	72.7	-106.3	0	0	0	112.2	S3 G8 L9	S3-W5 VanDerWaalsContact CB-CD1 3.5Å; S3-W5 PolarHBondContact O-N 2.8Å; S3-W5 VanDerWaalsContact O-N 3.16Å; S3-W5 PolarHBondContact OG-NE1 3.33Å; S3-W5 VanDerWaalsContact OG-NE1 3.16Å; W5-G8 PolarHBondContact O-N 2.8Å; W5-L9 HydrophobicContact CZ3-CD2 4.15Å; W5-L9 WeakPolarHBondContact O-CB 3.35Å; W5-L9 PolarHBondContact O-N 2.96Å
6	Y	81	Confident	79	Confident	116 Å²	116	81.6 Å²	81.6	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-68.7	-40	179.1	177.3	-93.9	0	0	0	110.9	S3 P4 G8 L9 R10	S3-Y6 WeakPolarHBondContact O-CB 3.29Å; S3-Y6 PolarHBondContact O-N 3.09Å; P4-Y6 VanDerWaalsContact C-N 3.32Å; P4-Y6 PolarHBondContact O-N 3.32Å; Y6-G8 VanDerWaalsContact C-N 3.34Å; Y6-L9 PolarHBondContact O-N 3.28Å; Y6-R10 WeakPolarHBondContact O-CB 3.21Å; Y6-R10 PolarHBondContact O-N 3.05Å
7	V	80.7	Confident	79	Confident	49 Å²	49	81.2 Å²	81.2	30%	0.297	45%	0.448	S	S	.	.	H	α-helix	trans	-63.3	-42.6	174.9	-179.7	0	0	0	0	110.5	S2 S3 P4 A11 T261	S2-V7 WeakPolarHBondContact OG-CG2 3.3Å; S3-V7 PolarHBondContact O-N 3.48Å; P4-V7 PolarHBondContact O-N 3.37Å; V7-A11 VanDerWaalsContact O-CB 3.31Å; V7-A11 WeakPolarHBondContact O-CB 3.48Å; V7-A11 PolarHBondContact O-N 3.04Å; V7-T261 HydrophobicContact CG1-CG2 4.4Å
8	G	85.4	Confident	78.8	Confident	34 Å²	34	77.4 Å²	77.4	35%	0.351	43%	0.428	S	S	.	.	H	α-helix	trans	-62.7	-49	175.5	0	0	0	0	0	112.9	P4 W5 Y6 R10 A11 C12	P4-G8 PolarHBondContact O-N 3.31Å; W5-G8 PolarHBondContact O-N 2.8Å; Y6-G8 VanDerWaalsContact C-N 3.34Å; G8-R10 VanDerWaalsContact C-N 3.33Å; G8-R10 PolarHBondContact O-N 2.83Å; G8-A11 WeakPolarHBondContact O-CB 3.25Å; G8-A11 PolarHBondContact O-N 2.98Å; G8-A11 VanDerWaalsContact O-N 3.11Å; G8-C12 PolarHBondContact O-N 3.11Å; G8-C12 PolarHBondContact O-SG 2.63Å; G8-C12 VanDerWaalsContact O-SG 3.39Å
9	L	84.9	Confident	78.9	Confident	110 Å²	110	77.8 Å²	77.8	58%	0.576	43%	0.428	S	S	*	.	H	α-helix	trans	-61	-43.4	178	-175.4	67.4	0	0	0	111.5	W5 Y6 A11 C12 A13	W5-L9 HydrophobicContact CZ3-CD2 4.15Å; W5-L9 WeakPolarHBondContact O-CB 3.35Å; W5-L9 PolarHBondContact O-N 2.96Å; Y6-L9 PolarHBondContact O-N 3.28Å; L9-A11 VanDerWaalsContact C-N 3.35Å; L9-C12 PolarHBondContact O-N 3.44Å; L9-A13 WeakPolarHBondContact O-CB 3.47Å; L9-A13 PolarHBondContact O-N 3.27Å
10	R	80.8	Confident	78.9	Confident	70 Å²	70	78.8 Å²	78.8	26%	0.264	43%	0.432	S	S	.	.	H	α-helix	trans	-59.1	-47.2	172.9	-173	-176.4	-173.3	178.9	7.9	110.7	Y6 G8 C12 A13 Y14	Y6-R10 WeakPolarHBondContact O-CB 3.21Å; Y6-R10 PolarHBondContact O-N 3.05Å; G8-R10 VanDerWaalsContact C-N 3.33Å; G8-R10 PolarHBondContact O-N 2.83Å; R10-C12 VanDerWaalsContact C-N 3.33Å; R10-C12 PolarHBondContact O-N 3.34Å; R10-A13 PolarHBondContact O-N 3.29Å; R10-Y14 HydrophobicContact CG-CD2 3.67Å; R10-Y14 HydrophobicContact CG-CE2 3.44Å; R10-Y14 VanDerWaalsContact CG-CE2 3.44Å; R10-Y14 PolarHBondContact NH2-OH 3.48Å; R10-Y14 WeakPolarHBondContact O-CD2 3.31Å; R10-Y14 PolarHBondContact O-N 3.49Å
11	A	83.3	Confident	78.7	Confident	16 Å²	16	75.1 Å²	75.1	13%	0.132	41%	0.412	C	S	.	.	H	α-helix	trans	-56.9	-46.8	178.8	0	0	0	0	0	112.4	V7 G8 L9 Y14 L15 T259 T261	V7-A11 VanDerWaalsContact O-CB 3.31Å; V7-A11 WeakPolarHBondContact O-CB 3.48Å; V7-A11 PolarHBondContact O-N 3.04Å; G8-A11 WeakPolarHBondContact O-CB 3.25Å; G8-A11 PolarHBondContact O-N 2.98Å; G8-A11 VanDerWaalsContact O-N 3.11Å; L9-A11 VanDerWaalsContact C-N 3.35Å; A11-Y14 PolarHBondContact O-N 2.82Å; A11-L15 VanDerWaalsContact O-CB 3.3Å; A11-L15 WeakPolarHBondContact O-CB 3.42Å; A11-L15 PolarHBondContact O-N 2.91Å; A11-T259 VanDerWaalsContact CA-O 3.29Å; A11-T259 WeakPolarHBondContact CA-O 3.11Å; A11-T261 HydrophobicContact CB-CG2 3.46Å; A11-T261 VanDerWaalsContact CB-CG2 3.46Å
12	C	85.9	Confident	80.2	Confident	78 Å²	78	67.6 Å²	67.6	53%	0.527	38%	0.376	S	S	.	.	H	α-helix	trans	-61.3	-48.7	176.2	-68.4	0	0	0	0	111.6	G8 L9 R10 Y14 L15 S16	G8-C12 PolarHBondContact O-N 3.11Å; G8-C12 PolarHBondContact O-SG 2.63Å; G8-C12 VanDerWaalsContact O-SG 3.39Å; L9-C12 PolarHBondContact O-N 3.44Å; R10-C12 VanDerWaalsContact C-N 3.33Å; R10-C12 PolarHBondContact O-N 3.34Å; C12-Y14 VanDerWaalsContact C-N 3.32Å; C12-Y14 PolarHBondContact O-N 3.5Å; C12-L15 PolarHBondContact O-N 2.78Å; C12-S16 WeakPolarHBondContact O-CB 3.44Å; C12-S16 PolarHBondContact O-N 3.23Å; C12-S16 PolarHBondContact O-OG 3.32Å
13	A	83.3	Confident	80.9	Confident	48 Å²	48	69 Å²	69	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-58.3	-44.3	179.8	0	0	0	0	0	112.2	L9 R10 S16 L17	L9-A13 WeakPolarHBondContact O-CB 3.47Å; L9-A13 PolarHBondContact O-N 3.27Å; R10-A13 PolarHBondContact O-N 3.29Å; A13-S16 PolarHBondContact O-N 3.03Å; A13-L17 VanDerWaalsContact O-CG 3.28Å; A13-L17 WeakPolarHBondContact O-CG 3.31Å; A13-L17 PolarHBondContact O-N 3.04Å
14	Y	78.9	Confident	80.7	Confident	33 Å²	33	71.2 Å²	71.2	13%	0.129	38%	0.383	C	S	.	.	H	α-helix	trans	-68.2	-41.9	179	-85	-113	0	0	0	112.8	R10 A11 C12 S16 L17 T18 I74 A75 C258 T259	R10-Y14 HydrophobicContact CG-CD2 3.67Å; R10-Y14 HydrophobicContact CG-CE2 3.44Å; R10-Y14 VanDerWaalsContact CG-CE2 3.44Å; R10-Y14 PolarHBondContact NH2-OH 3.48Å; R10-Y14 WeakPolarHBondContact O-CD2 3.31Å; R10-Y14 PolarHBondContact O-N 3.49Å; A11-Y14 PolarHBondContact O-N 2.82Å; C12-Y14 VanDerWaalsContact C-N 3.32Å; C12-Y14 PolarHBondContact O-N 3.5Å; Y14-S16 VanDerWaalsContact C-N 3.34Å; Y14-L17 PolarHBondContact O-N 2.89Å; Y14-T18 WeakPolarHBondContact O-CB 3.14Å; Y14-T18 PolarHBondContact O-N 2.87Å; Y14-T18 PolarHBondContact O-OG1 2.65Å; Y14-I74 HydrophobicContact CD1-CB 4.39Å; Y14-I74 HydrophobicContact CD1-CG2 3.86Å; Y14-I74 HydrophobicContact CE1-CB 4.24Å; Y14-I74 HydrophobicContact CE1-CG2 3.49Å; Y14-I74 VanDerWaalsContact CE1-CG2 3.49Å; Y14-I74 WeakPolarHBondContact CE1-O 3.27Å; Y14-A75 HydrophobicContact CD1-CB 4.19Å; Y14-A75 HydrophobicContact CE1-CB 4.41Å; Y14-C258 CarbonylContact C-O 3.49Å; Y14-T259 WeakPolarHBondContact CB-O 3.39Å
15	L	83.9	Confident	80.2	Confident	53 Å²	53	67.1 Å²	67.1	28%	0.277	35%	0.354	S	S	.	.	H	α-helix	trans	-63.4	-43.7	175.5	-178.3	61.7	0	0	0	110.7	A11 C12 L17 T18 I19 W255 C258	A11-L15 VanDerWaalsContact O-CB 3.3Å; A11-L15 WeakPolarHBondContact O-CB 3.42Å; A11-L15 PolarHBondContact O-N 2.91Å; C12-L15 PolarHBondContact O-N 2.78Å; L15-L17 PolarHBondContact O-N 3.49Å; L15-T18 WeakPolarHBondContact O-CB 3.34Å; L15-T18 PolarHBondContact O-N 3.07Å; L15-I19 HydrophobicContact CD1-CD1 4.12Å; L15-I19 HydrophobicContact CD1-CG1 4.37Å; L15-I19 HydrophobicContact CG-CD1 3.89Å; L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.35Å; L15-I19 PolarHBondContact O-N 2.77Å; L15-W255 HydrophobicContact CD2-CH2 4.39Å; L15-C258 HydrophobicContact CD1-CB 4.46Å; L15-C258 PolarHBondContact N-O 3.21Å
16	S	83.6	Confident	79.7	Confident	64 Å²	64	61.7 Å²	61.7	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-45.3	175	-65.5	0	0	0	0	111.7	C12 A13 Y14 T18 I19 L20	C12-S16 WeakPolarHBondContact O-CB 3.44Å; C12-S16 PolarHBondContact O-N 3.23Å; C12-S16 PolarHBondContact O-OG 3.32Å; A13-S16 PolarHBondContact O-N 3.03Å; Y14-S16 VanDerWaalsContact C-N 3.34Å; S16-T18 VanDerWaalsContact C-N 3.33Å; S16-T18 PolarHBondContact O-N 2.89Å; S16-I19 PolarHBondContact O-N 3.27Å; S16-L20 WeakPolarHBondContact O-CB 3.24Å; S16-L20 VanDerWaalsContact O-CG 3.24Å; S16-L20 WeakPolarHBondContact O-CG 3.4Å; S16-L20 PolarHBondContact O-N 3.19Å
17	L	79.4	Confident	79.5	Confident	76 Å²	76	59.3 Å²	59.3	40%	0.398	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-42.3	174.8	-72.4	170	0	0	0	111.7	A13 Y14 L15 L20 D21 I74	A13-L17 VanDerWaalsContact O-CG 3.28Å; A13-L17 WeakPolarHBondContact O-CG 3.31Å; A13-L17 PolarHBondContact O-N 3.04Å; Y14-L17 PolarHBondContact O-N 2.89Å; L15-L17 PolarHBondContact O-N 3.49Å; L17-L20 PolarHBondContact O-N 3.21Å; L17-D21 WeakPolarHBondContact O-CB 3.16Å; L17-D21 PolarHBondContact O-N 2.9Å; L17-I74 HydrophobicContact CD1-CD1 4.01Å; L17-I74 HydrophobicContact CD1-CG2 4.47Å
18	T	74.5	Confident	79.2	Confident	13 Å²	13	59.2 Å²	59.2	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-42.4	177.6	-57.9	0	0	0	0	112	Y14 L15 S16 N22 I71 C258	Y14-T18 WeakPolarHBondContact O-CB 3.14Å; Y14-T18 PolarHBondContact O-N 2.87Å; Y14-T18 PolarHBondContact O-OG1 2.65Å; L15-T18 WeakPolarHBondContact O-CB 3.34Å; L15-T18 PolarHBondContact O-N 3.07Å; S16-T18 VanDerWaalsContact C-N 3.33Å; S16-T18 PolarHBondContact O-N 2.89Å; T18-N22 PolarHBondContact O-N 3.37Å; T18-N22 VanDerWaalsContact O-N 3.14Å; T18-N22 PolarHBondContact O-ND2 3.23Å; T18-I71 HydrophobicContact CG2-CG2 4.11Å; T18-C258 HydrophobicContact CG2-CB 4.43Å; T18-C258 PolarHBondContact OG1-O 3.26Å
19	I	80.9	Confident	78.4	Confident	85 Å²	85	59.7 Å²	59.7	44%	0.436	33%	0.333	S	S	.	.	H	α-helix	trans	-67.8	-48.7	177.6	-69.5	167.8	0	0	0	110.6	L15 S16 D21 N22 I23	L15-I19 HydrophobicContact CD1-CD1 4.12Å; L15-I19 HydrophobicContact CD1-CG1 4.37Å; L15-I19 HydrophobicContact CG-CD1 3.89Å; L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.35Å; L15-I19 PolarHBondContact O-N 2.77Å; S16-I19 PolarHBondContact O-N 3.27Å; I19-D21 VanDerWaalsContact C-N 3.28Å; I19-D21 PolarHBondContact O-N 2.98Å; I19-N22 PolarHBondContact O-N 3.12Å; I19-N22 VanDerWaalsContact O-N 3.14Å; I19-I23 HydrophobicContact CG2-CD1 3.58Å; I19-I23 HydrophobicContact CG2-CG1 4.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.19Å; I19-I23 PolarHBondContact O-N 2.83Å
20	L	79.9	Confident	77.9	Confident	96 Å²	96	58.2 Å²	58.2	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-58.3	-42.3	179.6	-75.6	171	0	0	0	111.5	S16 L17 I23 I24	S16-L20 WeakPolarHBondContact O-CB 3.24Å; S16-L20 VanDerWaalsContact O-CG 3.24Å; S16-L20 WeakPolarHBondContact O-CG 3.4Å; S16-L20 PolarHBondContact O-N 3.19Å; L17-L20 PolarHBondContact O-N 3.21Å; L20-I23 PolarHBondContact O-N 3.2Å; L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.32Å; L20-I24 PolarHBondContact O-N 2.9Å
21	D	74.5	Confident	77.8	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-57.5	-53.6	171.9	168.1	47.9	0	0	0	112.7	L17 I19 I23 I24 F25 F67 I71	L17-D21 WeakPolarHBondContact O-CB 3.16Å; L17-D21 PolarHBondContact O-N 2.9Å; I19-D21 VanDerWaalsContact C-N 3.28Å; I19-D21 PolarHBondContact O-N 2.98Å; D21-I23 PolarHBondContact O-N 3.21Å; D21-I24 PolarHBondContact O-N 3.49Å; D21-F25 WeakPolarHBondContact O-CB 3.31Å; D21-F25 VanDerWaalsContact O-CD2 3.29Å; D21-F25 WeakPolarHBondContact O-CD2 3.49Å; D21-F25 PolarHBondContact O-N 3.35Å; D21-F25 WeakPolarHBondContact OD1-CD2 3.27Å; D21-F25 WeakPolarHBondContact OD1-CE2 3.35Å; D21-F25 WeakPolarHBondContact OD1-CG 3.38Å; D21-F67 HydrophobicContact CB-CE1 4.07Å; D21-F67 WeakPolarHBondContact OD1-CD1 3.47Å; D21-F67 WeakPolarHBondContact OD1-CE1 3.31Å; D21-I71 HydrophobicContact CB-CB 4.1Å; D21-I71 HydrophobicContact CB-CD1 3.29Å; D21-I71 HydrophobicContact CB-CG1 3.49Å; D21-I71 VanDerWaalsContact CB-CG1 3.49Å; D21-I71 HydrophobicContact CB-CG2 3.9Å; D21-I71 WeakPolarHBondContact OD2-CB 3.36Å; D21-I71 VanDerWaalsContact OD2-CG1 3.28Å; D21-I71 WeakPolarHBondContact OD2-CG1 3.14Å; D21-I71 WeakPolarHBondContact OD2-CG2 2.95Å
22	N	76	Confident	77.2	Confident	60 Å²	60	56.8 Å²	56.8	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-35.9	-179.3	-80.7	-88	0	0	0	111.7	T18 I19 V26 P27	T18-N22 PolarHBondContact O-N 3.37Å; T18-N22 VanDerWaalsContact O-N 3.14Å; T18-N22 PolarHBondContact O-ND2 3.23Å; I19-N22 PolarHBondContact O-N 3.12Å; I19-N22 VanDerWaalsContact O-N 3.14Å; N22-V26 HydrophobicContact CB-CG2 4.43Å; N22-V26 WeakPolarHBondContact O-CB 3.48Å; N22-V26 VanDerWaalsContact O-CG2 3.32Å; N22-V26 WeakPolarHBondContact O-CG2 3.25Å; N22-V26 PolarHBondContact O-N 2.84Å; N22-P27 WeakPolarHBondContact O-CD 2.9Å
23	I	78.1	Confident	76.4	Confident	105 Å²	105	55.9 Å²	55.9	54%	0.538	32%	0.317	S	S	.	.	H	α-helix	trans	-67.9	-34.5	175.7	-69	172.2	0	0	0	112.3	I19 L20 D21 P27	I19-I23 HydrophobicContact CG2-CD1 3.58Å; I19-I23 HydrophobicContact CG2-CG1 4.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.19Å; I19-I23 PolarHBondContact O-N 2.83Å; L20-I23 PolarHBondContact O-N 3.2Å; D21-I23 PolarHBondContact O-N 3.21Å; I23-P27 WeakPolarHBondContact O-CD 3.25Å; I23-P27 WeakPolarHBondContact O-CG 3.1Å
24	I	75.6	Confident	76.2	Confident	102 Å²	102	59.7 Å²	59.7	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-79.8	-47.3	178.6	-68.2	165.3	0	0	0	110.3	L20 D21 S28	L20-I24 VanDerWaalsContact O-CG1 3.26Å; L20-I24 WeakPolarHBondContact O-CG1 3.32Å; L20-I24 PolarHBondContact O-N 2.9Å; D21-I24 PolarHBondContact O-N 3.49Å; I24-S28 WeakPolarHBondContact O-CB 3.38Å; I24-S28 PolarHBondContact O-N 3.45Å
25	F	70.1	Confident	76	Confident	26 Å²	26	65.7 Å²	65.7	11%	0.114	36%	0.357	C	S	.	.	H	α-helix	trans	-87.7	-36.8	-165.7	-75	-92	0	0	0	113.8	D21 S28 F29 I64 F67	D21-F25 WeakPolarHBondContact O-CB 3.31Å; D21-F25 VanDerWaalsContact O-CD2 3.29Å; D21-F25 WeakPolarHBondContact O-CD2 3.49Å; D21-F25 PolarHBondContact O-N 3.35Å; D21-F25 WeakPolarHBondContact OD1-CD2 3.27Å; D21-F25 WeakPolarHBondContact OD1-CE2 3.35Å; D21-F25 WeakPolarHBondContact OD1-CG 3.38Å; F25-S28 PolarHBondContact O-N 2.8Å; F25-F29 VanDerWaalsContact O-CB 3.23Å; F25-F29 WeakPolarHBondContact O-CB 3.27Å; F25-F29 PolarHBondContact O-N 3.13Å; F25-I64 HydrophobicContact CD1-CG1 4.21Å; F25-F67 HydrophobicContact CD1-CB 4.07Å; F25-F67 HydrophobicContact CD1-CD1 4.11Å; F25-F67 HydrophobicContact CD1-CG 4.13Å; F25-F67 AromaticContact CD2-CD1 3.54Å; F25-F67 HydrophobicContact CD2-CD1 3.54Å; F25-F67 AromaticContact CD2-CE1 3.64Å; F25-F67 HydrophobicContact CD2-CE1 3.64Å; F25-F67 HydrophobicContact CD2-CG 4.28Å; F25-F67 HydrophobicContact CD2-CZ 4.44Å; F25-F67 HydrophobicContact CE1-CB 3.64Å; F25-F67 AromaticContact CE1-CD1 3.74Å; F25-F67 HydrophobicContact CE1-CD1 3.74Å; F25-F67 AromaticContact CE1-CD2 3.91Å; F25-F67 HydrophobicContact CE1-CD2 3.91Å; F25-F67 HydrophobicContact CE1-CE1 4.37Å; F25-F67 AromaticContact CE1-CG 3.47Å; F25-F67 HydrophobicContact CE1-CG 3.47Å; F25-F67 VanDerWaalsContact CE1-CG 3.47Å; F25-F67 AromaticContact CE2-CD1 3.13Å; F25-F67 HydrophobicContact CE2-CD1 3.13Å; F25-F67 HydrophobicContact CE2-CD2 4.04Å; F25-F67 AromaticContact CE2-CE1 2.98Å; F25-F67 HydrophobicContact CE2-CE1 2.98Å; F25-F67 AromaticContact CE2-CE2 3.92Å; F25-F67 HydrophobicContact CE2-CE2 3.92Å; F25-F67 AromaticContact CE2-CG 3.66Å; F25-F67 HydrophobicContact CE2-CG 3.66Å; F25-F67 AromaticContact CE2-CZ 3.41Å; F25-F67 HydrophobicContact CE2-CZ 3.41Å; F25-F67 VanDerWaalsContact CE2-CZ 3.41Å; F25-F67 HydrophobicContact CG-CD1 4.01Å; F25-F67 HydrophobicContact CG-CG 4.49Å; F25-F67 HydrophobicContact CZ-CB 3.93Å; F25-F67 AromaticContact CZ-CD1 3.24Å; F25-F67 HydrophobicContact CZ-CD1 3.24Å; F25-F67 AromaticContact CZ-CD2 3.37Å; F25-F67 HydrophobicContact CZ-CD2 3.37Å; F25-F67 AromaticContact CZ-CE1 3.43Å; F25-F67 HydrophobicContact CZ-CE1 3.43Å; F25-F67 VanDerWaalsContact CZ-CE1 3.43Å; F25-F67 AromaticContact CZ-CE2 3.55Å; F25-F67 HydrophobicContact CZ-CE2 3.55Å; F25-F67 AromaticContact CZ-CG 3.19Å; F25-F67 HydrophobicContact CZ-CG 3.19Å; F25-F67 AromaticContact CZ-CZ 3.57Å; F25-F67 HydrophobicContact CZ-CZ 3.57Å
26	V	73.4	Confident	75.5	Confident	59 Å²	59	64.1 Å²	64.1	36%	0.358	35%	0.349	S	S	.	.	H	α-helix	trans	-65.4	-47.3	179	178.4	0	0	0	0	111	N22 F29 L30	N22-V26 HydrophobicContact CB-CG2 4.43Å; N22-V26 WeakPolarHBondContact O-CB 3.48Å; N22-V26 VanDerWaalsContact O-CG2 3.32Å; N22-V26 WeakPolarHBondContact O-CG2 3.25Å; N22-V26 PolarHBondContact O-N 2.84Å; V26-F29 WeakPolarHBondContact O-CB 3.44Å; V26-F29 PolarHBondContact O-N 2.93Å; V26-L30 HydrophobicContact CG1-CD1 4.08Å; V26-L30 WeakPolarHBondContact O-CB 3.39Å; V26-L30 WeakPolarHBondContact O-CG 3.42Å; V26-L30 PolarHBondContact O-N 3.39Å
27	P	77	Confident	74.9	Confident	66 Å²	66	69.3 Å²	69.3	43%	0.429	36%	0.359	S	S	.	.	H	α-helix	trans	-65.4	-41.5	173.2	-25.1	39.3	0	0	0	112.9	N22 I23 F29 L30 A31	N22-P27 WeakPolarHBondContact O-CD 2.9Å; I23-P27 WeakPolarHBondContact O-CD 3.25Å; I23-P27 WeakPolarHBondContact O-CG 3.1Å; P27-F29 VanDerWaalsContact C-N 3.29Å; P27-F29 PolarHBondContact O-N 3.49Å; P27-L30 WeakPolarHBondContact O-CB 3.36Å; P27-L30 PolarHBondContact O-N 3.21Å; P27-L30 VanDerWaalsContact O-N 3.15Å; P27-A31 WeakPolarHBondContact O-CB 3.15Å; P27-A31 PolarHBondContact O-N 3.03Å
28	S	74.6	Confident	74.7	Confident	47 Å²	47	68.5 Å²	68.5	33%	0.329	36%	0.358	S	S	.	.	H	α-helix	trans	-58.7	-42	175.1	178.9	0	0	0	0	111.6	I24 F25 T32	I24-S28 WeakPolarHBondContact O-CB 3.38Å; I24-S28 PolarHBondContact O-N 3.45Å; F25-S28 PolarHBondContact O-N 2.8Å; S28-T32 WeakPolarHBondContact O-CB 3.21Å; S28-T32 PolarHBondContact O-N 3.47Å; S28-T32 PolarHBondContact O-OG1 3.38Å
29	F	69	Low	74.4	Confident	43 Å²	43	70.8 Å²	70.8	19%	0.189	37%	0.372	C	S	.	.	H	α-helix	trans	-64.8	-43.3	174.2	179.4	-123.3	0	0	0	112.8	F25 V26 P27 T32 M33 I64 R137	F25-F29 VanDerWaalsContact O-CB 3.23Å; F25-F29 WeakPolarHBondContact O-CB 3.27Å; F25-F29 PolarHBondContact O-N 3.13Å; V26-F29 WeakPolarHBondContact O-CB 3.44Å; V26-F29 PolarHBondContact O-N 2.93Å; P27-F29 VanDerWaalsContact C-N 3.29Å; P27-F29 PolarHBondContact O-N 3.49Å; F29-T32 WeakPolarHBondContact O-CB 3.29Å; F29-T32 PolarHBondContact O-N 2.84Å; F29-M33 HydrophobicContact CD2-CE 4.12Å; F29-M33 HydrophobicContact CD2-CG 4.24Å; F29-M33 HydrophobicContact CE1-CG 4.44Å; F29-M33 HydrophobicContact CE2-CE 3.2Å; F29-M33 HydrophobicContact CE2-CG 3.98Å; F29-M33 HydrophobicContact CE2-SD 4.45Å; F29-M33 HydrophobicContact CZ-CE 3.53Å; F29-M33 HydrophobicContact CZ-CG 4.07Å; F29-M33 WeakPolarHBondContact O-CG 3.25Å; F29-M33 PolarHBondContact O-N 2.83Å; F29-I64 HydrophobicContact CB-CD1 3.47Å; F29-I64 VanDerWaalsContact CB-CD1 3.47Å; F29-I64 HydrophobicContact CB-CG1 4.41Å; F29-I64 HydrophobicContact CD2-CD1 3.29Å; F29-I64 HydrophobicContact CE2-CD1 4.27Å; F29-I64 HydrophobicContact CG-CD1 3.74Å; F29-R137 VanDerWaalsContact CD1-NH2 3.3Å
30	L	74.4	Confident	73.6	Confident	79 Å²	79	73.8 Å²	73.8	41%	0.414	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-49.4	175.8	-81.2	164.3	0	0	0	111.2	V26 P27 T32 M33 L34 R137	V26-L30 HydrophobicContact CG1-CD1 4.08Å; V26-L30 WeakPolarHBondContact O-CB 3.39Å; V26-L30 WeakPolarHBondContact O-CG 3.42Å; V26-L30 PolarHBondContact O-N 3.39Å; P27-L30 WeakPolarHBondContact O-CB 3.36Å; P27-L30 PolarHBondContact O-N 3.21Å; P27-L30 VanDerWaalsContact O-N 3.15Å; L30-T32 VanDerWaalsContact C-N 3.29Å; L30-T32 PolarHBondContact O-N 3.34Å; L30-M33 PolarHBondContact O-N 3.27Å; L30-M33 VanDerWaalsContact O-N 3.1Å; L30-L34 WeakPolarHBondContact O-CB 3.28Å; L30-L34 PolarHBondContact O-N 3.48Å; L30-R137 VanDerWaalsContact CG-NH1 3.27Å
31	A	77.4	Confident	73	Confident	55 Å²	55	77.2 Å²	77.2	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-40.6	176.4	0	0	0	0	0	111.5	P27 M33 L34 F35	P27-A31 WeakPolarHBondContact O-CB 3.15Å; P27-A31 PolarHBondContact O-N 3.03Å; A31-M33 PolarHBondContact O-N 2.99Å; A31-L34 PolarHBondContact O-N 2.87Å; A31-F35 VanDerWaalsContact O-CB 3.27Å; A31-F35 WeakPolarHBondContact O-CB 3.35Å; A31-F35 PolarHBondContact O-N 2.86Å
32	T	70.1	Confident	72.5	Confident	2 Å²	2	84.4 Å²	84.4	1%	0.012	42%	0.415	C	S	.	.	H	α-helix	trans	-57.3	-50	172.3	-51.6	0	0	0	0	111.8	S28 F29 L30 L34 F35 L36 R60	S28-T32 WeakPolarHBondContact O-CB 3.21Å; S28-T32 PolarHBondContact O-N 3.47Å; S28-T32 PolarHBondContact O-OG1 3.38Å; F29-T32 WeakPolarHBondContact O-CB 3.29Å; F29-T32 PolarHBondContact O-N 2.84Å; L30-T32 VanDerWaalsContact C-N 3.29Å; L30-T32 PolarHBondContact O-N 3.34Å; T32-L34 VanDerWaalsContact C-N 3.3Å; T32-L34 PolarHBondContact O-N 3.01Å; T32-F35 PolarHBondContact O-N 3.34Å; T32-L36 HydrophobicContact CG2-CD1 3.58Å; T32-L36 HydrophobicContact CG2-CG 4.29Å; T32-L36 WeakPolarHBondContact O-CB 3.2Å; T32-L36 VanDerWaalsContact O-CG 3.25Å; T32-L36 WeakPolarHBondContact O-CG 3.16Å; T32-L36 PolarHBondContact O-N 2.72Å; T32-R60 HydrophobicContact CG2-CB 4.33Å; T32-R60 HydrophobicContact CG2-CG 3.84Å; T32-R60 PolarHBondContact OG1-NE 2.92Å; T32-R60 PolarHBondContact OG1-NH2 2.79Å
33	M	70.2	Confident	71.5	Confident	59 Å²	59	81.9 Å²	81.9	29%	0.291	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-36.2	-176.6	-74.7	-67.2	170.2	0	0	111.3	F29 L30 A31 W37 V57	F29-M33 HydrophobicContact CD2-CE 4.12Å; F29-M33 HydrophobicContact CD2-CG 4.24Å; F29-M33 HydrophobicContact CE1-CG 4.44Å; F29-M33 HydrophobicContact CE2-CE 3.2Å; F29-M33 HydrophobicContact CE2-CG 3.98Å; F29-M33 HydrophobicContact CE2-SD 4.45Å; F29-M33 HydrophobicContact CZ-CE 3.53Å; F29-M33 HydrophobicContact CZ-CG 4.07Å; F29-M33 WeakPolarHBondContact O-CG 3.25Å; F29-M33 PolarHBondContact O-N 2.83Å; L30-M33 PolarHBondContact O-N 3.27Å; L30-M33 VanDerWaalsContact O-N 3.1Å; A31-M33 PolarHBondContact O-N 2.99Å; M33-W37 WeakPolarHBondContact O-CB 3.2Å; M33-W37 PolarHBondContact O-N 3.45Å; M33-V57 HydrophobicContact CE-CG1 3.6Å; M33-V57 HydrophobicContact SD-CG1 4.42Å
34	L	78.4	Confident	70.3	Confident	128 Å²	128	85.4 Å²	85.4	67%	0.67	42%	0.416	S	S	*	.	H	α-helix	trans	-65.9	-46.8	173.5	-173.9	66.2	0	0	0	111.4	L30 A31 T32 L36 W37 P38	L30-L34 WeakPolarHBondContact O-CB 3.28Å; L30-L34 PolarHBondContact O-N 3.48Å; A31-L34 PolarHBondContact O-N 2.87Å; T32-L34 VanDerWaalsContact C-N 3.3Å; T32-L34 PolarHBondContact O-N 3.01Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 3.32Å; L34-W37 VanDerWaalsContact O-CB 3.27Å; L34-W37 WeakPolarHBondContact O-CB 3.33Å; L34-W37 PolarHBondContact O-N 2.82Å; L34-P38 WeakPolarHBondContact O-CD 3.11Å
35	F	75.6	Confident	69.1	Low	158 Å²	158	84.7 Å²	84.7	69%	0.693	43%	0.425	S	S	*	.	H	α-helix	trans	-66.4	-35.9	-179.7	-168.6	-93.2	0	0	0	112.7	A31 T32 W37 P38	A31-F35 VanDerWaalsContact O-CB 3.27Å; A31-F35 WeakPolarHBondContact O-CB 3.35Å; A31-F35 PolarHBondContact O-N 2.86Å; T32-F35 PolarHBondContact O-N 3.34Å; F35-W37 VanDerWaalsContact C-N 3.34Å; F35-P38 WeakPolarHBondContact O-CD 3.47Å
36	L	72.6	Confident	67.9	Low	20 Å²	20	86.5 Å²	86.5	11%	0.105	44%	0.441	C	S	.	.	H	α-helix	trans	-86.1	-7.5	178.4	-61.1	176.2	0	0	0	112.2	T32 L34 V39 R40 F53 V56 V57	T32-L36 HydrophobicContact CG2-CD1 3.58Å; T32-L36 HydrophobicContact CG2-CG 4.29Å; T32-L36 WeakPolarHBondContact O-CB 3.2Å; T32-L36 VanDerWaalsContact O-CG 3.25Å; T32-L36 WeakPolarHBondContact O-CG 3.16Å; T32-L36 PolarHBondContact O-N 2.72Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 3.32Å; L36-V39 PolarHBondContact O-N 3.35Å; L36-R40 PolarHBondContact O-N 2.85Å; L36-F53 HydrophobicContact CB-CD2 4.2Å; L36-F53 HydrophobicContact CB-CE2 3.66Å; L36-F53 WeakPolarHBondContact O-CE2 3.24Å; L36-V56 HydrophobicContact CD1-CG1 4.28Å; L36-V57 HydrophobicContact CB-CG2 4.29Å; L36-V57 HydrophobicContact CD1-CB 4.45Å; L36-V57 HydrophobicContact CD1-CG2 3.42Å; L36-V57 VanDerWaalsContact CD1-CG2 3.42Å; L36-V57 HydrophobicContact CG-CG2 4.46Å
37	W	71.6	Confident	66.6	Low	174 Å²	174	91.7 Å²	91.7	66%	0.659	46%	0.459	S	S	*	.	H	α-helix	trans	-58.5	-43.2	-179.6	-179.6	68.8	0	0	0	113.8	M33 L34 F35 V39 R40 R41	M33-W37 WeakPolarHBondContact O-CB 3.2Å; M33-W37 PolarHBondContact O-N 3.45Å; L34-W37 VanDerWaalsContact O-CB 3.27Å; L34-W37 WeakPolarHBondContact O-CB 3.33Å; L34-W37 PolarHBondContact O-N 2.82Å; F35-W37 VanDerWaalsContact C-N 3.34Å; W37-V39 PolarHBondContact O-N 2.61Å; W37-R40 VanDerWaalsContact O-CB 3.31Å; W37-R40 WeakPolarHBondContact O-CB 3.45Å; W37-R40 PolarHBondContact O-N 2.9Å; W37-R41 PolarHBondContact O-N 2.89Å; W37-R41 VanDerWaalsContact O-N 3.12Å
38	P	74.6	Confident	65.2	Low	58 Å²	58	91 Å²	91	38%	0.377	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-44.4	174.1	-23.1	34.7	0	0	0	112.3	L34 F35 R40 R41 F42	L34-P38 WeakPolarHBondContact O-CD 3.11Å; F35-P38 WeakPolarHBondContact O-CD 3.47Å; P38-R40 VanDerWaalsContact C-N 3.25Å; P38-R40 PolarHBondContact O-N 2.89Å; P38-R41 WeakPolarHBondContact O-CA 3.32Å; P38-R41 WeakPolarHBondContact O-CB 3.45Å; P38-R41 PolarHBondContact O-N 2.97Å; P38-F42 HydrophobicContact CB-CD2 4.45Å; P38-F42 HydrophobicContact CB-CE2 4.4Å; P38-F42 WeakPolarHBondContact O-CD2 3.34Å; P38-F42 PolarHBondContact O-N 2.79Å
39	V	69.2	Low	63.9	Low	62 Å²	62	93 Å²	93	38%	0.376	47%	0.471	S	S	.	.	H	α-helix	trans	-58.8	-39.9	176.9	-175.5	0	0	0	0	110.7	L36 W37 R41 F42 S43 F53	L36-V39 PolarHBondContact O-N 3.35Å; W37-V39 PolarHBondContact O-N 2.61Å; V39-R41 VanDerWaalsContact C-N 3.28Å; V39-R41 PolarHBondContact O-N 3.45Å; V39-F42 PolarHBondContact O-N 3.21Å; V39-S43 WeakPolarHBondContact O-CB 3.44Å; V39-S43 PolarHBondContact O-N 3.48Å; V39-S43 PolarHBondContact O-OG 3.34Å; V39-F53 HydrophobicContact CB-CD2 3.83Å; V39-F53 HydrophobicContact CB-CE2 4.37Å; V39-F53 HydrophobicContact CG1-CB 3.9Å; V39-F53 HydrophobicContact CG1-CD2 3.65Å; V39-F53 HydrophobicContact CG1-CG 4.11Å
40	R	63.7	Low	63	Low	148 Å²	148	93.6 Å²	93.6	56%	0.558	48%	0.478	S	S	*	.	H	α-helix	trans	-60.1	-38.2	173.1	-168.4	-179	166.6	133.4	-5	112.4	L36 W37 P38 S43 F53	L36-R40 PolarHBondContact O-N 2.85Å; W37-R40 VanDerWaalsContact O-CB 3.31Å; W37-R40 WeakPolarHBondContact O-CB 3.45Å; W37-R40 PolarHBondContact O-N 2.9Å; P38-R40 VanDerWaalsContact C-N 3.25Å; P38-R40 PolarHBondContact O-N 2.89Å; R40-S43 PolarHBondContact O-OG 3.15Å; R40-F53 HydrophobicContact CB-CE1 4.07Å; R40-F53 HydrophobicContact CB-CE2 3.76Å; R40-F53 HydrophobicContact CB-CZ 3.45Å; R40-F53 VanDerWaalsContact CB-CZ 3.45Å; R40-F53 HydrophobicContact CG-CE1 3.97Å; R40-F53 HydrophobicContact CG-CZ 3.73Å
41	R	67.1	Low	61.9	Low	168 Å²	168	93 Å²	93	63%	0.634	48%	0.481	S	S	*	.	H	α-helix	trans	-74.5	-35.4	-176.1	-176.1	61	-174.8	84.1	-2.6	112.8	W37 P38 V39	W37-R41 PolarHBondContact O-N 2.89Å; W37-R41 VanDerWaalsContact O-N 3.12Å; P38-R41 WeakPolarHBondContact O-CA 3.32Å; P38-R41 WeakPolarHBondContact O-CB 3.45Å; P38-R41 PolarHBondContact O-N 2.97Å; V39-R41 VanDerWaalsContact C-N 3.28Å; V39-R41 PolarHBondContact O-N 3.45Å
42	F	64.5	Low	60.6	Low	153 Å²	153	95.6 Å²	95.6	67%	0.671	49%	0.486	S	S	*	.	H	α-helix	trans	-94.5	-24.6	-177.1	-64.8	-68.6	0	0	0	114.1	P38 V39 H44 A45	P38-F42 HydrophobicContact CB-CD2 4.45Å; P38-F42 HydrophobicContact CB-CE2 4.4Å; P38-F42 WeakPolarHBondContact O-CD2 3.34Å; P38-F42 PolarHBondContact O-N 2.79Å; V39-F42 PolarHBondContact O-N 3.21Å; F42-H44 PolarHBondContact O-N 3.35Å; F42-A45 WeakPolarHBondContact O-CB 3.34Å; F42-A45 PolarHBondContact O-N 2.79Å
43	S	54.8	Low	59.9	Low	8 Å²	8	96.7 Å²	96.7	6%	0.056	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-62.2	-15.4	179.4	57.6	0	0	0	0	114.4	V39 R40 A45 S46 V50	V39-S43 WeakPolarHBondContact O-CB 3.44Å; V39-S43 PolarHBondContact O-N 3.48Å; V39-S43 PolarHBondContact O-OG 3.34Å; R40-S43 PolarHBondContact O-OG 3.15Å; S43-A45 PolarHBondContact O-N 2.87Å; S43-S46 PolarHBondContact O-N 3.1Å; S43-V50 WeakPolarHBondContact O-CG2 3.47Å
44	H	51.7	Low	59.2	Low	179 Å²	179	96 Å²	96	83%	0.829	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-57.3	-19.1	168.4	-98.5	-84.4	0	0	0	113.5	F42	F42-H44 PolarHBondContact O-N 3.35Å
45	A	51.1	Low	58	Low	86 Å²	86	93.7 Å²	93.7	71%	0.711	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-90.6	-16.1	-176.7	0	0	0	0	0	115.2	F42 S43	F42-A45 WeakPolarHBondContact O-CB 3.34Å; F42-A45 PolarHBondContact O-N 2.79Å; S43-A45 PolarHBondContact O-N 2.87Å
46	S	45.2	Very low	57	Low	64 Å²	64	89 Å²	89	45%	0.448	46%	0.462	S	S	.	.			trans	-148.9	120.6	-175.4	-65.3	0	0	0	0	112.2	S43 G48 D49	S43-S46 PolarHBondContact O-N 3.1Å; S46-G48 VanDerWaalsContact C-N 3.27Å; S46-G48 PolarHBondContact O-N 2.96Å; S46-D49 PolarHBondContact O-N 3.39Å
47	F	45.9	Very low	56.1	Low	169 Å²	169	89 Å²	89	74%	0.741	46%	0.463	S	S	*	.	H	α-helix	trans	-61.1	-29.6	-168.2	-138.5	-98.6	0	0	0	114	K229	F47-K229 HydrophobicContact CZ-CD 4.39Å
48	G	46.6	Very low	55.3	Low	52 Å²	52	81 Å²	81	54%	0.536	44%	0.435	S	S	.	.	H	α-helix	trans	-69.7	-37.3	178.5	0	0	0	0	0	113.8	S46 S51	S46-G48 VanDerWaalsContact C-N 3.27Å; S46-G48 PolarHBondContact O-N 2.96Å; G48-S51 PolarHBondContact O-OG 2.86Å
49	D	48.8	Very low	54.1	Low	87 Å²	87	82.9 Å²	82.9	47%	0.465	44%	0.437	S	S	.	.	H	α-helix	trans	-76.9	-28	-175.8	-71.3	-35.7	0	0	0	113.1	S46 F53	S46-D49 PolarHBondContact O-N 3.39Å; D49-F53 VanDerWaalsContact O-CB 3.25Å; D49-F53 WeakPolarHBondContact O-CB 3.38Å; D49-F53 PolarHBondContact O-N 2.63Å
50	V	50	Low	53.2	Low	57 Å²	57	84 Å²	84	35%	0.345	44%	0.435	S	S	.	.	H	α-helix	trans	-65	-41.2	176.3	-175.5	0	0	0	0	111	S43 V54	S43-V50 WeakPolarHBondContact O-CG2 3.47Å; V50-V54 HydrophobicContact CG1-CG2 4.23Å; V50-V54 WeakPolarHBondContact O-CB 2.98Å; V50-V54 WeakPolarHBondContact O-CG2 3.45Å; V50-V54 PolarHBondContact O-N 3Å
51	S	50.4	Low	52.6	Low	67 Å²	67	81.2 Å²	81.2	47%	0.469	42%	0.424	S	S	.	.	H	α-helix	trans	-67.4	-45.6	-178.7	82.1	0	0	0	0	110.3	G48 F53 V54 D55	G48-S51 PolarHBondContact O-OG 2.86Å; S51-F53 PolarHBondContact O-N 3.37Å; S51-V54 PolarHBondContact O-N 2.71Å; S51-D55 VanDerWaalsContact O-CB 3.29Å; S51-D55 WeakPolarHBondContact O-CB 3.43Å; S51-D55 VanDerWaalsContact O-CG 3.29Å; S51-D55 PolarHBondContact O-N 3.39Å
52	L	49.9	Very low	51.8	Low	108 Å²	108	75.9 Å²	75.9	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-60.3	-46.8	175.6	-171.9	74.9	0	0	0	111.2	D55 V56	L52-D55 PolarHBondContact O-N 3.37Å; L52-V56 HydrophobicContact CD1-CG2 4.35Å; L52-V56 HydrophobicContact CG-CG2 4.25Å; L52-V56 WeakPolarHBondContact O-CB 3.26Å; L52-V56 VanDerWaalsContact O-CG2 3.24Å; L52-V56 WeakPolarHBondContact O-CG2 3.35Å; L52-V56 PolarHBondContact O-N 3.42Å
53	F	55.3	Low	51	Low	25 Å²	25	71.9 Å²	71.9	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-59.8	-47.6	175.7	170.3	-94.4	0	0	0	111.9	L36 V39 R40 D49 S51 D55 V56 V57	L36-F53 HydrophobicContact CB-CD2 4.2Å; L36-F53 HydrophobicContact CB-CE2 3.66Å; L36-F53 WeakPolarHBondContact O-CE2 3.24Å; V39-F53 HydrophobicContact CB-CD2 3.83Å; V39-F53 HydrophobicContact CB-CE2 4.37Å; V39-F53 HydrophobicContact CG1-CB 3.9Å; V39-F53 HydrophobicContact CG1-CD2 3.65Å; V39-F53 HydrophobicContact CG1-CG 4.11Å; R40-F53 HydrophobicContact CB-CE1 4.07Å; R40-F53 HydrophobicContact CB-CE2 3.76Å; R40-F53 HydrophobicContact CB-CZ 3.45Å; R40-F53 VanDerWaalsContact CB-CZ 3.45Å; R40-F53 HydrophobicContact CG-CE1 3.97Å; R40-F53 HydrophobicContact CG-CZ 3.73Å; D49-F53 VanDerWaalsContact O-CB 3.25Å; D49-F53 WeakPolarHBondContact O-CB 3.38Å; D49-F53 PolarHBondContact O-N 2.63Å; S51-F53 PolarHBondContact O-N 3.37Å; F53-D55 VanDerWaalsContact C-N 3.27Å; F53-D55 PolarHBondContact O-N 3.42Å; F53-V56 PolarHBondContact O-N 3.3Å; F53-V57 HydrophobicContact CD1-CG2 4.3Å; F53-V57 HydrophobicContact CD2-CG2 3.86Å; F53-V57 HydrophobicContact CE1-CG2 3.99Å; F53-V57 HydrophobicContact CE2-CG2 3.54Å; F53-V57 HydrophobicContact CG-CG2 4.23Å; F53-V57 HydrophobicContact CZ-CG2 3.59Å; F53-V57 WeakPolarHBondContact O-CB 2.82Å; F53-V57 WeakPolarHBondContact O-CG2 3.4Å; F53-V57 PolarHBondContact O-N 3.41Å
54	V	55.4	Low	50.8	Low	44 Å²	44	72 Å²	72	27%	0.267	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-35.2	178.3	169.5	0	0	0	0	111.4	V50 S51 G58	V50-V54 HydrophobicContact CG1-CG2 4.23Å; V50-V54 WeakPolarHBondContact O-CB 2.98Å; V50-V54 WeakPolarHBondContact O-CG2 3.45Å; V50-V54 PolarHBondContact O-N 3Å; S51-V54 PolarHBondContact O-N 2.71Å; V54-G58 VanDerWaalsContact O-CA 3.24Å; V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 3.4Å
55	D	54.2	Low	50.8	Low	80 Å²	80	67.2 Å²	67.2	43%	0.428	36%	0.364	S	S	.	.	H	α-helix	trans	-75.7	-43.1	178.5	-76.7	-15.5	0	0	0	112.2	S51 L52 F53 G58 K59	S51-D55 VanDerWaalsContact O-CB 3.29Å; S51-D55 WeakPolarHBondContact O-CB 3.43Å; S51-D55 VanDerWaalsContact O-CG 3.29Å; S51-D55 PolarHBondContact O-N 3.39Å; L52-D55 PolarHBondContact O-N 3.37Å; F53-D55 VanDerWaalsContact C-N 3.27Å; F53-D55 PolarHBondContact O-N 3.42Å; D55-G58 CarbonylContact O-C 3.56Å; D55-G58 PolarHBondContact O-N 3.1Å; D55-K59 WeakPolarHBondContact O-CB 3.29Å; D55-K59 WeakPolarHBondContact O-CG 3.46Å; D55-K59 PolarHBondContact O-N 3.37Å
56	V	54.5	Low	50.7	Low	59 Å²	59	64.3 Å²	64.3	36%	0.358	34%	0.339	S	S	.	.	H	α-helix	trans	-67.5	-50.7	176.7	172.2	0	0	0	0	110.5	L36 L52 F53 G58 K59 R60	L36-V56 HydrophobicContact CD1-CG1 4.28Å; L52-V56 HydrophobicContact CD1-CG2 4.35Å; L52-V56 HydrophobicContact CG-CG2 4.25Å; L52-V56 WeakPolarHBondContact O-CB 3.26Å; L52-V56 VanDerWaalsContact O-CG2 3.24Å; L52-V56 WeakPolarHBondContact O-CG2 3.35Å; L52-V56 PolarHBondContact O-N 3.42Å; F53-V56 PolarHBondContact O-N 3.3Å; V56-G58 PolarHBondContact O-N 3.07Å; V56-K59 PolarHBondContact O-N 3.12Å; V56-R60 WeakPolarHBondContact O-CB 3.26Å; V56-R60 PolarHBondContact O-N 2.94Å
57	V	54.2	Low	50.8	Low	21 Å²	21	64.7 Å²	64.7	13%	0.127	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-42	172.5	174.8	0	0	0	0	109.8	M33 L36 F53 R60 R61	M33-V57 HydrophobicContact CE-CG1 3.6Å; M33-V57 HydrophobicContact SD-CG1 4.42Å; L36-V57 HydrophobicContact CB-CG2 4.29Å; L36-V57 HydrophobicContact CD1-CB 4.45Å; L36-V57 HydrophobicContact CD1-CG2 3.42Å; L36-V57 VanDerWaalsContact CD1-CG2 3.42Å; L36-V57 HydrophobicContact CG-CG2 4.46Å; F53-V57 HydrophobicContact CD1-CG2 4.3Å; F53-V57 HydrophobicContact CD2-CG2 3.86Å; F53-V57 HydrophobicContact CE1-CG2 3.99Å; F53-V57 HydrophobicContact CE2-CG2 3.54Å; F53-V57 HydrophobicContact CG-CG2 4.23Å; F53-V57 HydrophobicContact CZ-CG2 3.59Å; F53-V57 WeakPolarHBondContact O-CB 2.82Å; F53-V57 WeakPolarHBondContact O-CG2 3.4Å; F53-V57 PolarHBondContact O-N 3.41Å; V57-R60 PolarHBondContact O-N 3.28Å; V57-R61 WeakPolarHBondContact O-CA 3.47Å; V57-R61 WeakPolarHBondContact O-CB 3.5Å; V57-R61 PolarHBondContact O-N 3.5Å
58	G	53.6	Low	50.9	Low	7 Å²	7	58.5 Å²	58.5	7%	0.072	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-42.2	179.5	0	0	0	0	0	113.8	V54 D55 V56 R62	V54-G58 VanDerWaalsContact O-CA 3.24Å; V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 3.4Å; D55-G58 CarbonylContact O-C 3.56Å; D55-G58 PolarHBondContact O-N 3.1Å; V56-G58 PolarHBondContact O-N 3.07Å; G58-R62 WeakPolarHBondContact O-CB 3.44Å; G58-R62 PolarHBondContact O-N 2.81Å
59	K	51	Low	51	Low	97 Å²	97	57.2 Å²	57.2	42%	0.422	29%	0.289	S	S	.	.	H	α-helix	trans	-70.4	-39.7	176.1	-76.6	172.1	-176	177.8	0	111.3	D55 V56 R62 L63	D55-K59 WeakPolarHBondContact O-CB 3.29Å; D55-K59 WeakPolarHBondContact O-CG 3.46Å; D55-K59 PolarHBondContact O-N 3.37Å; V56-K59 PolarHBondContact O-N 3.12Å; K59-R62 VanDerWaalsContact O-CB 3.26Å; K59-R62 WeakPolarHBondContact O-CB 3Å; K59-R62 PolarHBondContact O-N 3.05Å; K59-L63 PolarHBondContact O-N 2.93Å
60	R	50.6	Low	51	Low	84 Å²	84	55.8 Å²	55.8	32%	0.317	28%	0.281	S	S	.	.	H	α-helix	trans	-73.9	-40.9	177.7	-164.6	148.5	173.9	-163.4	-3	112.1	T32 V56 V57 R62 L63 I64	T32-R60 HydrophobicContact CG2-CB 4.33Å; T32-R60 HydrophobicContact CG2-CG 3.84Å; T32-R60 PolarHBondContact OG1-NE 2.92Å; T32-R60 PolarHBondContact OG1-NH2 2.79Å; V56-R60 WeakPolarHBondContact O-CB 3.26Å; V56-R60 PolarHBondContact O-N 2.94Å; V57-R60 PolarHBondContact O-N 3.28Å; R60-R62 VanDerWaalsContact C-N 3.27Å; R60-R62 PolarHBondContact O-N 2.93Å; R60-L63 WeakPolarHBondContact O-CB 3.1Å; R60-L63 PolarHBondContact O-N 3.06Å; R60-L63 VanDerWaalsContact O-N 3.12Å; R60-I64 HydrophobicContact CG-CD1 4.47Å; R60-I64 WeakPolarHBondContact O-CD1 3.38Å; R60-I64 PolarHBondContact O-N 3.31Å
61	R	51	Low	50.9	Low	91 Å²	91	53.6 Å²	53.6	34%	0.343	27%	0.267	S	S	.	.	H	α-helix	trans	-55.2	-44.2	166.5	-177.4	178.9	160.8	153.3	14.1	110.1	V57 I64 Y65	V57-R61 WeakPolarHBondContact O-CA 3.47Å; V57-R61 WeakPolarHBondContact O-CB 3.5Å; V57-R61 PolarHBondContact O-N 3.5Å; R61-I64 PolarHBondContact O-N 3.45Å; R61-Y65 HydrophobicContact CG-CD2 3.52Å; R61-Y65 HydrophobicContact CG-CE2 3.3Å; R61-Y65 PolarHBondContact NH2-OH 2.9Å; R61-Y65 VanDerWaalsContact NH2-OH 3.15Å; R61-Y65 WeakPolarHBondContact O-CD2 3.23Å; R61-Y65 PolarHBondContact O-N 2.85Å
62	R	49.5	Very low	51	Low	56 Å²	56	53 Å²	53	21%	0.211	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-47.7	172.7	170.3	-163	-67.9	158.9	4.5	111.9	G58 K59 R60 I64 Y65 C66 C122 Y123	G58-R62 WeakPolarHBondContact O-CB 3.44Å; G58-R62 PolarHBondContact O-N 2.81Å; K59-R62 VanDerWaalsContact O-CB 3.26Å; K59-R62 WeakPolarHBondContact O-CB 3Å; K59-R62 PolarHBondContact O-N 3.05Å; R60-R62 VanDerWaalsContact C-N 3.27Å; R60-R62 PolarHBondContact O-N 2.93Å; R62-I64 VanDerWaalsContact C-N 3.28Å; R62-I64 PolarHBondContact O-N 2.77Å; R62-Y65 PolarHBondContact O-N 3.22Å; R62-C66 VanDerWaalsContact CG-SG 3.54Å; R62-C66 WeakPolarHBondContact O-CB 3.45Å; R62-C66 PolarHBondContact O-N 2.66Å; R62-C66 PolarHBondContact O-SG 2.95Å; R62-C66 VanDerWaalsContact O-SG 3.35Å; R62-C122 PolarHBondContact NE-O 3.38Å; R62-C122 VanDerWaalsContact NE-O 3.1Å; R62-Y123 PolarHBondContact NH2-O 2.82Å
63	L	47.6	Very low	51.2	Low	69 Å²	69	48.1 Å²	48.1	36%	0.361	23%	0.231	S	C	.	.	H	α-helix	trans	-56.5	-45.9	178.5	-166.7	94.1	0	0	0	110.9	K59 R60 F67 F341	K59-L63 PolarHBondContact O-N 2.93Å; R60-L63 WeakPolarHBondContact O-CB 3.1Å; R60-L63 PolarHBondContact O-N 3.06Å; R60-L63 VanDerWaalsContact O-N 3.12Å; L63-F67 VanDerWaalsContact O-CB 3.23Å; L63-F67 WeakPolarHBondContact O-CB 3.21Å; L63-F67 PolarHBondContact O-N 2.74Å; L63-F341 HydrophobicContact CD1-CE2 3.91Å; L63-F341 HydrophobicContact CD1-CZ 3.51Å
64	I	50.9	Low	50.9	Low	9 Å²	9	49 Å²	49	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-37.8	-179.9	-66.8	152.1	0	0	0	111.9	F25 F29 R60 R61 R62 F67 L68	F25-I64 HydrophobicContact CD1-CG1 4.21Å; F29-I64 HydrophobicContact CB-CD1 3.47Å; F29-I64 VanDerWaalsContact CB-CD1 3.47Å; F29-I64 HydrophobicContact CB-CG1 4.41Å; F29-I64 HydrophobicContact CD2-CD1 3.29Å; F29-I64 HydrophobicContact CE2-CD1 4.27Å; F29-I64 HydrophobicContact CG-CD1 3.74Å; R60-I64 HydrophobicContact CG-CD1 4.47Å; R60-I64 WeakPolarHBondContact O-CD1 3.38Å; R60-I64 PolarHBondContact O-N 3.31Å; R61-I64 PolarHBondContact O-N 3.45Å; R62-I64 VanDerWaalsContact C-N 3.28Å; R62-I64 PolarHBondContact O-N 2.77Å; I64-F67 PolarHBondContact O-N 2.15Å; I64-L68 HydrophobicContact CG2-CD1 3.69Å; I64-L68 HydrophobicContact CG2-CG 4.08Å; I64-L68 VanDerWaalsContact O-CB 3.25Å; I64-L68 WeakPolarHBondContact O-CB 3.38Å; I64-L68 VanDerWaalsContact O-CG 3.26Å; I64-L68 WeakPolarHBondContact O-CG 3.18Å; I64-L68 PolarHBondContact O-N 2.99Å
65	Y	51.1	Low	50.5	Low	79 Å²	79	47 Å²	47	31%	0.31	22%	0.224	S	C	.	.	H	α-helix	trans	-70.4	-48.6	173.8	-80.8	-71.3	0	0	0	112	R61 R62 F67 T69 F135	R61-Y65 HydrophobicContact CG-CD2 3.52Å; R61-Y65 HydrophobicContact CG-CE2 3.3Å; R61-Y65 PolarHBondContact NH2-OH 2.9Å; R61-Y65 VanDerWaalsContact NH2-OH 3.15Å; R61-Y65 WeakPolarHBondContact O-CD2 3.23Å; R61-Y65 PolarHBondContact O-N 2.85Å; R62-Y65 PolarHBondContact O-N 3.22Å; Y65-F67 PolarHBondContact O-N 3.35Å; Y65-T69 VanDerWaalsContact O-CB 3.28Å; Y65-T69 WeakPolarHBondContact O-CB 3.29Å; Y65-T69 WeakPolarHBondContact O-CG2 3.43Å; Y65-T69 PolarHBondContact O-N 3.15Å; Y65-T69 PolarHBondContact O-OG1 2.77Å; Y65-F135 VanDerWaalsContact OH-CB 3.23Å; Y65-F135 WeakPolarHBondContact OH-CB 3.44Å
66	C	49	Very low	50.3	Low	25 Å²	25	43.3 Å²	43.3	17%	0.169	21%	0.205	C	C	.	.	H	α-helix	trans	-57.1	-35.5	176.3	-54.8	0	0	0	0	107.4	R62 T69 N70 C122	R62-C66 VanDerWaalsContact CG-SG 3.54Å; R62-C66 WeakPolarHBondContact O-CB 3.45Å; R62-C66 PolarHBondContact O-N 2.66Å; R62-C66 PolarHBondContact O-SG 2.95Å; R62-C66 VanDerWaalsContact O-SG 3.35Å; C66-T69 VanDerWaalsContact C-OG1 3.3Å; C66-T69 WeakPolarHBondContact CA-OG1 2.99Å; C66-T69 PolarHBondContact O-OG1 2.93Å; C66-N70 WeakPolarHBondContact O-CB 3.5Å; C66-N70 VanDerWaalsContact O-CG 3.31Å; C66-N70 PolarHBondContact O-N 3.49Å; C66-N70 PolarHBondContact O-ND2 3.46Å; C66-C122 WeakPolarHBondContact CB-SG 3.19Å; C66-C122 VanDerWaalsContact SG-CB 3.52Å; C66-C122 CovalentContact SG-SG 2.15Å; C66-C122 PolarHBondContact SG-SG 3.04Å
67	F	46.9	Very low	50.2	Low	72 Å²	72	44 Å²	44	32%	0.316	20%	0.203	S	C	.	.	H	α-helix	trans	-79.1	-48	178	-156.4	-81.1	0	0	0	116.1	D21 F25 L63 I64 Y65 T69 N70 I71	D21-F67 HydrophobicContact CB-CE1 4.07Å; D21-F67 WeakPolarHBondContact OD1-CD1 3.47Å; D21-F67 WeakPolarHBondContact OD1-CE1 3.31Å; F25-F67 HydrophobicContact CD1-CB 4.07Å; F25-F67 HydrophobicContact CD1-CD1 4.11Å; F25-F67 HydrophobicContact CD1-CG 4.13Å; F25-F67 AromaticContact CD2-CD1 3.54Å; F25-F67 HydrophobicContact CD2-CD1 3.54Å; F25-F67 AromaticContact CD2-CE1 3.64Å; F25-F67 HydrophobicContact CD2-CE1 3.64Å; F25-F67 HydrophobicContact CD2-CG 4.28Å; F25-F67 HydrophobicContact CD2-CZ 4.44Å; F25-F67 HydrophobicContact CE1-CB 3.64Å; F25-F67 AromaticContact CE1-CD1 3.74Å; F25-F67 HydrophobicContact CE1-CD1 3.74Å; F25-F67 AromaticContact CE1-CD2 3.91Å; F25-F67 HydrophobicContact CE1-CD2 3.91Å; F25-F67 HydrophobicContact CE1-CE1 4.37Å; F25-F67 AromaticContact CE1-CG 3.47Å; F25-F67 HydrophobicContact CE1-CG 3.47Å; F25-F67 VanDerWaalsContact CE1-CG 3.47Å; F25-F67 AromaticContact CE2-CD1 3.13Å; F25-F67 HydrophobicContact CE2-CD1 3.13Å; F25-F67 HydrophobicContact CE2-CD2 4.04Å; F25-F67 AromaticContact CE2-CE1 2.98Å; F25-F67 HydrophobicContact CE2-CE1 2.98Å; F25-F67 AromaticContact CE2-CE2 3.92Å; F25-F67 HydrophobicContact CE2-CE2 3.92Å; F25-F67 AromaticContact CE2-CG 3.66Å; F25-F67 HydrophobicContact CE2-CG 3.66Å; F25-F67 AromaticContact CE2-CZ 3.41Å; F25-F67 HydrophobicContact CE2-CZ 3.41Å; F25-F67 VanDerWaalsContact CE2-CZ 3.41Å; F25-F67 HydrophobicContact CG-CD1 4.01Å; F25-F67 HydrophobicContact CG-CG 4.49Å; F25-F67 HydrophobicContact CZ-CB 3.93Å; F25-F67 AromaticContact CZ-CD1 3.24Å; F25-F67 HydrophobicContact CZ-CD1 3.24Å; F25-F67 AromaticContact CZ-CD2 3.37Å; F25-F67 HydrophobicContact CZ-CD2 3.37Å; F25-F67 AromaticContact CZ-CE1 3.43Å; F25-F67 HydrophobicContact CZ-CE1 3.43Å; F25-F67 VanDerWaalsContact CZ-CE1 3.43Å; F25-F67 AromaticContact CZ-CE2 3.55Å; F25-F67 HydrophobicContact CZ-CE2 3.55Å; F25-F67 AromaticContact CZ-CG 3.19Å; F25-F67 HydrophobicContact CZ-CG 3.19Å; F25-F67 AromaticContact CZ-CZ 3.57Å; F25-F67 HydrophobicContact CZ-CZ 3.57Å; L63-F67 VanDerWaalsContact O-CB 3.23Å; L63-F67 WeakPolarHBondContact O-CB 3.21Å; L63-F67 PolarHBondContact O-N 2.74Å; I64-F67 PolarHBondContact O-N 2.15Å; Y65-F67 PolarHBondContact O-N 3.35Å; F67-T69 PolarHBondContact O-N 3.1Å; F67-N70 CarbonylContact O-C 3.59Å; F67-N70 VanDerWaalsContact O-CA 3.28Å; F67-N70 WeakPolarHBondContact O-CA 3.43Å; F67-N70 VanDerWaalsContact O-CB 3.28Å; F67-N70 WeakPolarHBondContact O-CB 3.34Å; F67-N70 PolarHBondContact O-N 2.85Å; F67-I71 HydrophobicContact CD1-CG1 3.9Å; F67-I71 HydrophobicContact CE1-CD1 3.87Å; F67-I71 HydrophobicContact CE1-CG1 3.51Å; F67-I71 HydrophobicContact CZ-CD1 4.43Å; F67-I71 HydrophobicContact CZ-CG1 4.35Å; F67-I71 PolarHBondContact O-N 3.24Å
68	L	48.2	Very low	50.3	Low	39 Å²	39	43.5 Å²	43.5	20%	0.204	20%	0.2	C	C	.	.	H	α-helix	trans	-56.8	-35.9	171.1	-74.3	171.9	0	0	0	110.2	I64 H72	I64-L68 HydrophobicContact CG2-CD1 3.69Å; I64-L68 HydrophobicContact CG2-CG 4.08Å; I64-L68 VanDerWaalsContact O-CB 3.25Å; I64-L68 WeakPolarHBondContact O-CB 3.38Å; I64-L68 VanDerWaalsContact O-CG 3.26Å; I64-L68 WeakPolarHBondContact O-CG 3.18Å; I64-L68 PolarHBondContact O-N 2.99Å; L68-H72 PolarHBondContact O-N 2.76Å; L68-H72 PolarHBondContact O-ND1 3.26Å
69	T	49.3	Very low	51	Low	25 Å²	25	43.2 Å²	43.2	15%	0.153	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-40.5	169.9	61.6	0	0	0	0	111.6	Y65 C66 F67 I71 F73 V112	Y65-T69 VanDerWaalsContact O-CB 3.28Å; Y65-T69 WeakPolarHBondContact O-CB 3.29Å; Y65-T69 WeakPolarHBondContact O-CG2 3.43Å; Y65-T69 PolarHBondContact O-N 3.15Å; Y65-T69 PolarHBondContact O-OG1 2.77Å; C66-T69 VanDerWaalsContact C-OG1 3.3Å; C66-T69 WeakPolarHBondContact CA-OG1 2.99Å; C66-T69 PolarHBondContact O-OG1 2.93Å; F67-T69 PolarHBondContact O-N 3.1Å; T69-I71 PolarHBondContact O-N 3.38Å; T69-F73 WeakPolarHBondContact O-CB 3.23Å; T69-F73 PolarHBondContact O-N 3.42Å; T69-V112 HydrophobicContact CG2-CB 4.44Å; T69-V112 HydrophobicContact CG2-CG1 3.72Å
70	N	49.2	Very low	52	Low	57 Å²	57	40.2 Å²	40.2	31%	0.305	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-25.6	175.6	-86.9	-60.8	0	0	0	114.1	C66 F67 F73 I74	C66-N70 WeakPolarHBondContact O-CB 3.5Å; C66-N70 VanDerWaalsContact O-CG 3.31Å; C66-N70 PolarHBondContact O-N 3.49Å; C66-N70 PolarHBondContact O-ND2 3.46Å; F67-N70 CarbonylContact O-C 3.59Å; F67-N70 VanDerWaalsContact O-CA 3.28Å; F67-N70 WeakPolarHBondContact O-CA 3.43Å; F67-N70 VanDerWaalsContact O-CB 3.28Å; F67-N70 WeakPolarHBondContact O-CB 3.34Å; F67-N70 PolarHBondContact O-N 2.85Å; N70-F73 VanDerWaalsContact O-CB 3.27Å; N70-F73 WeakPolarHBondContact O-CB 3.14Å; N70-I74 WeakPolarHBondContact O-CG1 3.18Å; N70-I74 PolarHBondContact O-N 3.22Å; N70-I74 VanDerWaalsContact O-N 3.12Å
71	I	48.3	Very low	53.3	Low	11 Å²	11	36.2 Å²	36.2	6%	0.056	17%	0.172	C	C	.	.	H	α-helix	trans	-88.9	-45.2	-178.3	-72.5	-94.9	0	0	0	112.7	T18 D21 F67 T69 F73 I74	T18-I71 HydrophobicContact CG2-CG2 4.11Å; D21-I71 HydrophobicContact CB-CB 4.1Å; D21-I71 HydrophobicContact CB-CD1 3.29Å; D21-I71 HydrophobicContact CB-CG1 3.49Å; D21-I71 VanDerWaalsContact CB-CG1 3.49Å; D21-I71 HydrophobicContact CB-CG2 3.9Å; D21-I71 WeakPolarHBondContact OD2-CB 3.36Å; D21-I71 VanDerWaalsContact OD2-CG1 3.28Å; D21-I71 WeakPolarHBondContact OD2-CG1 3.14Å; D21-I71 WeakPolarHBondContact OD2-CG2 2.95Å; F67-I71 HydrophobicContact CD1-CG1 3.9Å; F67-I71 HydrophobicContact CE1-CD1 3.87Å; F67-I71 HydrophobicContact CE1-CG1 3.51Å; F67-I71 HydrophobicContact CZ-CD1 4.43Å; F67-I71 HydrophobicContact CZ-CG1 4.35Å; F67-I71 PolarHBondContact O-N 3.24Å; T69-I71 PolarHBondContact O-N 3.38Å; I71-F73 PolarHBondContact O-N 2.77Å; I71-F73 VanDerWaalsContact O-N 3.11Å; I71-I74 HydrophobicContact CD1-CD1 4.16Å; I71-I74 PolarHBondContact O-N 2.89Å
72	H	52.5	Low	54.8	Low	54 Å²	54	32.2 Å²	32.2	25%	0.25	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-25.6	164.5	-65	90.9	0	0	0	110.7	L68 L76 I257	L68-H72 PolarHBondContact O-N 2.76Å; L68-H72 PolarHBondContact O-ND1 3.26Å; H72-L76 WeakPolarHBondContact O-CG 3.25Å; H72-L76 PolarHBondContact O-N 2.87Å; H72-I257 HydrophobicContact CB-CG2 3.99Å
73	F	53.2	Low	56.3	Low	6 Å²	6	30.7 Å²	30.7	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-75.1	-29.1	176.1	171.6	-105.8	0	0	0	114.6	T69 N70 I71 A75 L76 F77 H113 L330 A334	T69-F73 WeakPolarHBondContact O-CB 3.23Å; T69-F73 PolarHBondContact O-N 3.42Å; N70-F73 VanDerWaalsContact O-CB 3.27Å; N70-F73 WeakPolarHBondContact O-CB 3.14Å; I71-F73 PolarHBondContact O-N 2.77Å; I71-F73 VanDerWaalsContact O-N 3.11Å; F73-A75 VanDerWaalsContact C-N 3.25Å; F73-A75 PolarHBondContact O-N 2.87Å; F73-L76 CarbonylContact O-C 3.59Å; F73-L76 WeakPolarHBondContact O-CA 2.91Å; F73-L76 PolarHBondContact O-N 2.66Å; F73-F77 HydrophobicContact CD1-CD2 4.25Å; F73-F77 AromaticContact CD1-CE2 3.52Å; F73-F77 HydrophobicContact CD1-CE2 3.52Å; F73-F77 HydrophobicContact CD1-CZ 4.15Å; F73-F77 HydrophobicContact CE1-CD2 4.29Å; F73-F77 AromaticContact CE1-CE2 3.4Å; F73-F77 HydrophobicContact CE1-CE2 3.4Å; F73-F77 AromaticContact CE1-CZ 3.55Å; F73-F77 HydrophobicContact CE1-CZ 3.55Å; F73-F77 HydrophobicContact CG-CE2 4.34Å; F73-F77 HydrophobicContact CZ-CE2 4.12Å; F73-F77 HydrophobicContact CZ-CZ 4.12Å; F73-F77 WeakPolarHBondContact O-CD2 3.24Å; F73-F77 PolarHBondContact O-N 2.92Å; F73-H113 AromaticContact CD2-CE1 3.63Å; F73-H113 AromaticContact CD2-CG 3.95Å; F73-H113 AromaticContact CD2-ND1 3.51Å; F73-H113 AromaticContact CE2-CD2 3.7Å; F73-H113 AromaticContact CE2-CE1 2.92Å; F73-H113 WeakPolarHBondContact CE2-CE1 3.5Å; F73-H113 AromaticContact CE2-CG 3.74Å; F73-H113 AromaticContact CE2-ND1 3.3Å; F73-H113 VanDerWaalsContact CE2-ND1 3.3Å; F73-H113 WeakPolarHBondContact CE2-ND1 3.44Å; F73-H113 AromaticContact CE2-NE2 3.18Å; F73-H113 WeakPolarHBondContact CE2-NE2 3.29Å; F73-H113 AromaticContact CZ-CE1 3.12Å; F73-H113 WeakPolarHBondContact CZ-CE1 3.38Å; F73-H113 AromaticContact CZ-ND1 3.85Å; F73-H113 AromaticContact CZ-NE2 3.56Å; F73-L330 HydrophobicContact CD2-CD2 4.36Å; F73-L330 HydrophobicContact CE2-CB 4.49Å; F73-L330 HydrophobicContact CE2-CD2 3.89Å; F73-A334 HydrophobicContact CE1-CB 3.67Å; F73-A334 HydrophobicContact CE2-CB 4.46Å; F73-A334 HydrophobicContact CZ-CB 3.27Å
74	I	48.8	Very low	58.1	Low	45 Å²	45	29.3 Å²	29.3	23%	0.231	14%	0.144	C	C	.	.	H	α-helix	trans	-55.3	-47.1	172.3	-55.5	-171.7	0	0	0	109	Y14 L17 N70 I71 L76 F77	Y14-I74 HydrophobicContact CD1-CB 4.39Å; Y14-I74 HydrophobicContact CD1-CG2 3.86Å; Y14-I74 HydrophobicContact CE1-CB 4.24Å; Y14-I74 HydrophobicContact CE1-CG2 3.49Å; Y14-I74 VanDerWaalsContact CE1-CG2 3.49Å; Y14-I74 WeakPolarHBondContact CE1-O 3.27Å; L17-I74 HydrophobicContact CD1-CD1 4.01Å; L17-I74 HydrophobicContact CD1-CG2 4.47Å; N70-I74 WeakPolarHBondContact O-CG1 3.18Å; N70-I74 PolarHBondContact O-N 3.22Å; N70-I74 VanDerWaalsContact O-N 3.12Å; I71-I74 HydrophobicContact CD1-CD1 4.16Å; I71-I74 PolarHBondContact O-N 2.89Å; I74-L76 PolarHBondContact O-N 2.79Å; I74-F77 WeakPolarHBondContact O-CB 3.23Å; I74-F77 WeakPolarHBondContact O-CD2 3.33Å; I74-F77 PolarHBondContact O-N 3.39Å; I74-F77 VanDerWaalsContact O-N 3.15Å
75	A	47.7	Very low	59.9	Low	1 Å²	1	31.5 Å²	31.5	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-37	174.9	0	0	0	0	0	114.5	Y14 F73 F77 T78 I257	Y14-A75 HydrophobicContact CD1-CB 4.19Å; Y14-A75 HydrophobicContact CE1-CB 4.41Å; F73-A75 VanDerWaalsContact C-N 3.25Å; F73-A75 PolarHBondContact O-N 2.87Å; A75-F77 VanDerWaalsContact C-N 3.28Å; A75-F77 PolarHBondContact O-N 2.98Å; A75-T78 PolarHBondContact O-OG1 2.75Å; A75-I257 HydrophobicContact CB-CG2 4.41Å; A75-I257 WeakPolarHBondContact CB-O 3.26Å
76	L	50.4	Low	61.8	Low	2 Å²	2	31.3 Å²	31.3	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-73.8	-7.9	174.5	-64.1	170.6	0	0	0	114.1	H72 F73 I74 T78 A79 A106 P109 I110 F252 L330	H72-L76 WeakPolarHBondContact O-CG 3.25Å; H72-L76 PolarHBondContact O-N 2.87Å; F73-L76 CarbonylContact O-C 3.59Å; F73-L76 WeakPolarHBondContact O-CA 2.91Å; F73-L76 PolarHBondContact O-N 2.66Å; I74-L76 PolarHBondContact O-N 2.79Å; L76-T78 PolarHBondContact O-N 3.23Å; L76-A79 PolarHBondContact O-N 3.15Å; L76-A106 HydrophobicContact CD2-CB 4.18Å; L76-P109 HydrophobicContact CD1-CB 4.05Å; L76-P109 HydrophobicContact CD1-CG 4.18Å; L76-I110 HydrophobicContact CD1-CG1 4.03Å; L76-I110 HydrophobicContact CD2-CD1 4.39Å; L76-I110 HydrophobicContact CD2-CG1 4.29Å; L76-F252 HydrophobicContact CD2-CD1 3.87Å; L76-F252 HydrophobicContact CD2-CE1 3.78Å; L76-L330 HydrophobicContact CB-CD1 4.21Å; L76-L330 WeakPolarHBondContact O-CD1 3.48Å
77	F	50.5	Low	63.4	Low	75 Å²	75	34.7 Å²	34.7	33%	0.329	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-16.6	169.8	-87.5	-95.4	0	0	0	113.3	F73 I74 A75 K331 A334	F73-F77 HydrophobicContact CD1-CD2 4.25Å; F73-F77 AromaticContact CD1-CE2 3.52Å; F73-F77 HydrophobicContact CD1-CE2 3.52Å; F73-F77 HydrophobicContact CD1-CZ 4.15Å; F73-F77 HydrophobicContact CE1-CD2 4.29Å; F73-F77 AromaticContact CE1-CE2 3.4Å; F73-F77 HydrophobicContact CE1-CE2 3.4Å; F73-F77 AromaticContact CE1-CZ 3.55Å; F73-F77 HydrophobicContact CE1-CZ 3.55Å; F73-F77 HydrophobicContact CG-CE2 4.34Å; F73-F77 HydrophobicContact CZ-CE2 4.12Å; F73-F77 HydrophobicContact CZ-CZ 4.12Å; F73-F77 WeakPolarHBondContact O-CD2 3.24Å; F73-F77 PolarHBondContact O-N 2.92Å; I74-F77 WeakPolarHBondContact O-CB 3.23Å; I74-F77 WeakPolarHBondContact O-CD2 3.33Å; I74-F77 PolarHBondContact O-N 3.39Å; I74-F77 VanDerWaalsContact O-N 3.15Å; A75-F77 VanDerWaalsContact C-N 3.28Å; A75-F77 PolarHBondContact O-N 2.98Å; F77-K331 HydrophobicContact CD1-CG 3.88Å; F77-K331 HydrophobicContact CE1-CG 4.17Å; F77-A334 HydrophobicContact CE1-CB 4.16Å; F77-A334 HydrophobicContact CZ-CB 4.09Å
78	T	57.6	Low	65.2	Low	9 Å²	9	31.5 Å²	31.5	6%	0.055	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-27.7	171.9	55.6	0	0	0	0	113	A75 L76 S264 K265	A75-T78 PolarHBondContact O-OG1 2.75Å; L76-T78 PolarHBondContact O-N 3.23Å; T78-S264 WeakPolarHBondContact O-CA 3.31Å; T78-S264 WeakPolarHBondContact O-CB 3.36Å; T78-S264 PolarHBondContact O-OG 2.89Å; T78-S264 VanDerWaalsContact O-OG 3.07Å; T78-K265 PolarHBondContact O-N 3.11Å
79	A	66.8	Low	66.8	Low	2 Å²	2	32.5 Å²	32.5	2%	0.017	18%	0.183	C	C	.	.			trans	-80.7	141.8	-178.1	0	0	0	0	0	111.1	L76 F252 K265 V267 L330	L76-A79 PolarHBondContact O-N 3.15Å; A79-F252 HydrophobicContact CB-CZ 4.41Å; A79-K265 CarbonylContact C-O 3.47Å; A79-K265 WeakPolarHBondContact CA-O 3.38Å; A79-V267 HydrophobicContact CB-CG2 4.18Å; A79-L330 HydrophobicContact CB-CD1 3.63Å; A79-L330 WeakPolarHBondContact O-CD1 3.35Å
80	T	73.1	Confident	68.3	Low	33 Å²	33	38.3 Å²	38.3	20%	0.202	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.2	166.9	-55.7	0	0	0	0	107.4	F82 K265 V267 T327	T80-F82 HydrophobicContact CG2-CD2 4.14Å; T80-F82 HydrophobicContact CG2-CE1 4.45Å; T80-F82 HydrophobicContact CG2-CE2 3.4Å; T80-F82 HydrophobicContact CG2-CZ 3.59Å; T80-K265 PolarHBondContact N-O 3.44Å; T80-V267 PolarHBondContact O-N 3.37Å; T80-T327 HydrophobicContact CG2-CG2 4.47Å
81	V	77.3	Confident	70	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.9	177.4	175.9	0	0	0	0	108.5	I110 V114 V267 L269 K328 L330 Y333	V81-I110 HydrophobicContact CG2-CG2 4.2Å; V81-V114 HydrophobicContact CG1-CG2 4.13Å; V81-V267 CarbonylContact C-O 3.46Å; V81-V267 VanDerWaalsContact CA-O 3.3Å; V81-V267 WeakPolarHBondContact CA-O 3.39Å; V81-V267 HydrophobicContact CG2-CB 4.28Å; V81-L269 HydrophobicContact CG1-CD1 3.61Å; V81-L269 HydrophobicContact CG1-CG 3.9Å; V81-K328 CarbonylContact O-C 3.55Å; V81-L330 HydrophobicContact CB-CG 4.37Å; V81-L330 HydrophobicContact CG2-CD1 3.52Å; V81-L330 HydrophobicContact CG2-CD2 4.18Å; V81-L330 HydrophobicContact CG2-CG 3.62Å; V81-Y333 HydrophobicContact CB-CE2 4.45Å
82	F	82.9	Confident	71.4	Confident	7 Å²	7	37.9 Å²	37.9	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.3	173.6	-63.9	-100.5	0	0	0	107.3	T80 K266 V267 V268 L269 T327	T80-F82 HydrophobicContact CG2-CD2 4.14Å; T80-F82 HydrophobicContact CG2-CE1 4.45Å; T80-F82 HydrophobicContact CG2-CE2 3.4Å; T80-F82 HydrophobicContact CG2-CZ 3.59Å; F82-K266 HydrophobicContact CD2-CD 4.17Å; F82-K266 HydrophobicContact CD2-CG 3.69Å; F82-K266 HydrophobicContact CE2-CB 4.37Å; F82-K266 HydrophobicContact CE2-CD 3.87Å; F82-K266 HydrophobicContact CE2-CG 3.58Å; F82-K266 HydrophobicContact CZ-CD 4.48Å; F82-V267 PolarHBondContact N-O 2.96Å; F82-V268 HydrophobicContact CB-CG1 4.46Å; F82-V268 HydrophobicContact CB-CG2 4.27Å; F82-V268 CarbonylContact O-C 3.58Å; F82-V268 WeakPolarHBondContact O-CA 3.21Å; F82-L269 PolarHBondContact O-N 3.36Å; F82-T327 HydrophobicContact CD1-CG2 3.86Å; F82-T327 WeakPolarHBondContact CD1-OG1 3.49Å; F82-T327 HydrophobicContact CE1-CG2 3.32Å; F82-T327 VanDerWaalsContact CE1-OG1 3.24Å; F82-T327 WeakPolarHBondContact CE1-OG1 3.44Å; F82-T327 HydrophobicContact CZ-CG2 3.96Å
83	E	82.1	Confident	72.6	Confident	24 Å²	24	40 Å²	40	11%	0.112	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.9	174.6	-68.6	176.7	-177.8	0	0	108.9	V114 L118 L269 Y271 K328 Y333	E83-V114 WeakPolarHBondContact OE1-CG1 3.32Å; E83-L118 WeakPolarHBondContact OE1-CD1 3.28Å; E83-L269 CarbonylContact C-O 3.47Å; E83-L269 WeakPolarHBondContact CA-O 3.42Å; E83-Y271 HydrophobicContact CB-CE2 3.98Å; E83-Y271 HydrophobicContact CG-CE2 3.78Å; E83-K328 IonicContact OE2-NZ 2.8Å; E83-K328 PolarHBondContact OE2-NZ 3.31Å; E83-Y333 VanDerWaalsContact CG-OH 3.32Å; E83-Y333 WeakPolarHBondContact CG-OH 3.38Å; E83-Y333 WeakPolarHBondContact OE1-CE1 3.21Å; E83-Y333 PolarHBondContact OE1-OH 2.87Å; E83-Y333 PolarHBondContact OE2-OH 3.34Å
84	E	85	Confident	74	Confident	41 Å²	41	41.2 Å²	41.2	19%	0.192	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	169.2	170	66.7	163.2	-138.2	0	0	111.7	V268 L269 R270 Y271 W301 R325	E84-V268 HydrophobicContact CG-CG1 4.04Å; E84-L269 PolarHBondContact N-O 2.77Å; E84-R270 HydrophobicContact CG-CB 3.86Å; E84-R270 HydrophobicContact CG-CG 4.05Å; E84-R270 CarbonylContact O-C 3.56Å; E84-R270 WeakPolarHBondContact O-CA 3.45Å; E84-R270 WeakPolarHBondContact OE1-CD 3.32Å; E84-R270 IonicContact OE1-NE 2.62Å; E84-Y271 PolarHBondContact O-N 2.88Å; E84-W301 HydrophobicContact CG-CZ2 4.38Å; E84-W301 WeakPolarHBondContact OE1-CZ2 3.44Å; E84-W301 PolarHBondContact OE1-NE1 3.46Å; E84-R325 IonicContact OE1-NH2 2.61Å; E84-R325 IonicContact OE2-CZ 3.69Å; E84-R325 IonicContact OE2-NE 3.48Å; E84-R325 PolarHBondContact OE2-NE 2.96Å; E84-R325 IonicContact OE2-NH2 3.99Å; E84-R325 PolarHBondContact OE2-NH2 2.86Å
85	G	88.4	Confident	75.6	Confident	54 Å²	54	39.3 Å²	39.3	56%	0.557	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	88.6	-145.4	-176.3	0	0	0	0	0	111.9	Y271	G85-Y271 WeakPolarHBondContact CA-O 3.33Å
86	D	89.8	Confident	77.4	Confident	76 Å²	76	39.2 Å²	39.2	41%	0.406	21%	0.208	S	C	.	.	S	Bend	trans	-74	149.8	-172.5	-60.2	-25	0	0	0	112.4	I88 Y271 R272 C273	D86-I88 PolarHBondContact O-N 3.46Å; D86-Y271 PolarHBondContact N-O 3.33Å; D86-R272 VanDerWaalsContact OD2-CA 3.31Å; D86-R272 WeakPolarHBondContact OD2-CA 3.32Å; D86-C273 HydrophobicContact CB-CB 4.23Å; D86-C273 PolarHBondContact OD2-N 3.34Å
87	D	84.1	Confident	79.2	Confident	96 Å²	96	39.1 Å²	39.1	51%	0.513	21%	0.207	S	C	.	.			trans	-76.8	115.9	175.1	-172	2.9	0	0	0	111.3	V89	D87-V89 VanDerWaalsContact OD1-CB 3.32Å; D87-V89 WeakPolarHBondContact OD1-CB 3.16Å; D87-V89 WeakPolarHBondContact OD1-CG2 3.22Å; D87-V89 PolarHBondContact OD1-N 3.14Å
88	I	83.6	Confident	81	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.021	19%	0.192	C	C	.	.			trans	-86.5	-3.6	179.7	61.4	169.6	0	0	0	113.9	D86 H90 Y91 F92 L118 W171 I240 Y271	D86-I88 PolarHBondContact O-N 3.46Å; I88-H90 VanDerWaalsContact C-N 3.34Å; I88-H90 PolarHBondContact O-N 2.8Å; I88-Y91 PolarHBondContact O-N 2.79Å; I88-Y91 VanDerWaalsContact O-N 3.08Å; I88-F92 HydrophobicContact CD1-CZ 3.94Å; I88-F92 HydrophobicContact CG1-CE2 4.25Å; I88-F92 HydrophobicContact CG1-CZ 4.15Å; I88-L118 HydrophobicContact CD1-CD1 3.62Å; I88-L118 HydrophobicContact CG1-CD1 3.88Å; I88-W171 HydrophobicContact CD1-CH2 4.31Å; I88-I240 HydrophobicContact CG2-CG2 3.99Å; I88-Y271 HydrophobicContact CD1-CD1 4.15Å; I88-Y271 HydrophobicContact CD1-CD2 4.28Å; I88-Y271 HydrophobicContact CD1-CE1 3.82Å; I88-Y271 HydrophobicContact CD1-CE2 3.93Å; I88-Y271 HydrophobicContact CD1-CG 4.38Å; I88-Y271 HydrophobicContact CG1-CD2 4.38Å; I88-Y271 HydrophobicContact CG1-CE2 4.35Å; I88-Y271 HydrophobicContact CG2-CD1 4.01Å; I88-Y271 HydrophobicContact CG2-CD2 4.13Å; I88-Y271 HydrophobicContact CG2-CG 3.68Å
89	V	81.3	Confident	82.6	Confident	61 Å²	61	35.2 Å²	35.2	37%	0.37	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-59.7	-42.4	-174.8	172.2	0	0	0	0	112.2	D87 Y91 F92	D87-V89 VanDerWaalsContact OD1-CB 3.32Å; D87-V89 WeakPolarHBondContact OD1-CB 3.16Å; D87-V89 WeakPolarHBondContact OD1-CG2 3.22Å; D87-V89 PolarHBondContact OD1-N 3.14Å; V89-Y91 VanDerWaalsContact C-N 3.25Å; V89-Y91 PolarHBondContact O-N 3.14Å; V89-F92 WeakPolarHBondContact O-CD2 3.37Å; V89-F92 PolarHBondContact O-N 3.22Å
90	H	80.9	Confident	83.8	Confident	147 Å²	147	35.1 Å²	35.1	68%	0.681	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-68.5	-23.8	179	-62.4	-65.7	0	0	0	113.2	I88	I88-H90 VanDerWaalsContact C-N 3.34Å; I88-H90 PolarHBondContact O-N 2.8Å
91	Y	84.8	Confident	84.7	Confident	53 Å²	53	33.5 Å²	33.5	21%	0.208	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-83.2	-12.4	-177.9	-65.5	-87.9	0	0	0	113.8	I88 V89 E93 E94 C96 W171 Y238 I240 C273	I88-Y91 PolarHBondContact O-N 2.79Å; I88-Y91 VanDerWaalsContact O-N 3.08Å; V89-Y91 VanDerWaalsContact C-N 3.25Å; V89-Y91 PolarHBondContact O-N 3.14Å; Y91-E93 PolarHBondContact O-N 3.45Å; Y91-E93 VanDerWaalsContact O-N 3.08Å; Y91-E94 PolarHBondContact O-N 2.9Å; Y91-E94 VanDerWaalsContact O-N 3.13Å; Y91-C96 PolarHBondContact O-SG 2.8Å; Y91-W171 PolarHBondContact O-NE1 3.07Å; Y91-Y238 HydrophobicContact CD1-CD1 4.29Å; Y91-Y238 AromaticContact CD1-CD2 3.69Å; Y91-Y238 HydrophobicContact CD1-CD2 3.69Å; Y91-Y238 HydrophobicContact CD1-CE2 4.32Å; Y91-Y238 AromaticContact CD1-CG 3.66Å; Y91-Y238 HydrophobicContact CD1-CG 3.66Å; Y91-Y238 AromaticContact CE1-CD1 3.59Å; Y91-Y238 HydrophobicContact CE1-CD1 3.59Å; Y91-Y238 AromaticContact CE1-CD2 3.8Å; Y91-Y238 HydrophobicContact CE1-CD2 3.8Å; Y91-Y238 HydrophobicContact CE1-CE1 4.04Å; Y91-Y238 HydrophobicContact CE1-CE2 4.24Å; Y91-Y238 AromaticContact CE1-CG 3.45Å; Y91-Y238 HydrophobicContact CE1-CG 3.45Å; Y91-Y238 VanDerWaalsContact CE1-CG 3.45Å; Y91-I240 HydrophobicContact CG-CD1 4.41Å; Y91-C273 HydrophobicContact CE1-CB 4.3Å; Y91-C273 HydrophobicContact CE2-CB 3.81Å; Y91-C273 WeakPolarHBondContact CE2-SG 3.48Å; Y91-C273 WeakPolarHBondContact OH-CB 3.14Å
92	F	78.5	Confident	85.3	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.026	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-60.4	-22.5	176.3	-73.9	-61.4	0	0	0	112.6	I88 V89 I115 L118 V125 R170 W171	I88-F92 HydrophobicContact CD1-CZ 3.94Å; I88-F92 HydrophobicContact CG1-CE2 4.25Å; I88-F92 HydrophobicContact CG1-CZ 4.15Å; V89-F92 WeakPolarHBondContact O-CD2 3.37Å; V89-F92 PolarHBondContact O-N 3.22Å; F92-I115 HydrophobicContact CD1-CG2 4.37Å; F92-I115 HydrophobicContact CE1-CB 4.24Å; F92-I115 HydrophobicContact CE1-CG1 4.31Å; F92-I115 HydrophobicContact CE1-CG2 3.71Å; F92-L118 HydrophobicContact CD2-CB 4.42Å; F92-L118 HydrophobicContact CE1-CB 4.5Å; F92-L118 HydrophobicContact CE2-CB 3.35Å; F92-L118 HydrophobicContact CE2-CD1 4.16Å; F92-L118 HydrophobicContact CE2-CG 4.42Å; F92-L118 HydrophobicContact CZ-CB 3.4Å; F92-L118 HydrophobicContact CZ-CD1 3.9Å; F92-L118 HydrophobicContact CZ-CG 4.35Å; F92-V125 HydrophobicContact CD1-CG2 4.32Å; F92-R170 WeakPolarHBondContact O-CD 3.34Å; F92-R170 PolarHBondContact O-NE 3.45Å; F92-R170 PolarHBondContact O-NH2 2.93Å; F92-W171 AromaticContact CD1-CE2 3.85Å; F92-W171 AromaticContact CD1-CH2 3.59Å; F92-W171 HydrophobicContact CD1-CH2 3.59Å; F92-W171 AromaticContact CD1-CZ2 3.33Å; F92-W171 HydrophobicContact CD1-CZ2 3.33Å; F92-W171 HydrophobicContact CD1-CZ3 4.27Å; F92-W171 HydrophobicContact CE1-CE3 4.42Å; F92-W171 AromaticContact CE1-CH2 3.16Å; F92-W171 HydrophobicContact CE1-CH2 3.16Å; F92-W171 AromaticContact CE1-CZ2 3.48Å; F92-W171 HydrophobicContact CE1-CZ2 3.48Å; F92-W171 VanDerWaalsContact CE1-CZ2 3.48Å; F92-W171 AromaticContact CE1-CZ3 3.7Å; F92-W171 HydrophobicContact CE1-CZ3 3.7Å; F92-W171 HydrophobicContact CG-CH2 4.48Å; F92-W171 HydrophobicContact CG-CZ2 4.02Å; F92-W171 AromaticContact CZ-CH2 3.78Å; F92-W171 HydrophobicContact CZ-CH2 3.78Å; F92-W171 HydrophobicContact CZ-CZ2 4.26Å; F92-W171 HydrophobicContact CZ-CZ3 4.5Å
93	E	77.5	Confident	85.4	Confident	98 Å²	98	35 Å²	35	46%	0.458	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-87.8	-17.3	-178.8	-59	-118.6	103.4	0	0	114.5	Y91 R170 R234	Y91-E93 PolarHBondContact O-N 3.45Å; Y91-E93 VanDerWaalsContact O-N 3.08Å; E93-R170 VanDerWaalsContact CA-CZ 3.49Å; E93-R170 WeakPolarHBondContact O-CD 3.31Å; E93-R170 IonicContact OE1-NH1 2.86Å; E93-R170 PolarHBondContact OE1-NH1 3.3Å; E93-R170 IonicContact OE1-NH2 3.71Å; E93-R234 PolarHBondContact O-NH1 3.07Å
94	E	82.5	Confident	85.5	Confident	32 Å²	32	33.9 Å²	33.9	15%	0.15	18%	0.181	C	C	.	.	S	Bend	trans	-104.8	153.7	-172.8	-66.3	-60.7	119.9	0	0	111.8	Y91 C96 R234 R237 Y238	Y91-E94 PolarHBondContact O-N 2.9Å; Y91-E94 VanDerWaalsContact O-N 3.13Å; E94-C96 PolarHBondContact O-N 2.92Å; E94-C96 PolarHBondContact O-SG 2.76Å; E94-C96 VanDerWaalsContact O-SG 3.33Å; E94-R234 IonicContact OE1-CZ 3.61Å; E94-R234 IonicContact OE1-NH1 3.73Å; E94-R234 PolarHBondContact OE1-NH1 3.31Å; E94-R234 IonicContact OE1-NH2 2.71Å; E94-R234 IonicContact OE2-NH1 3.64Å; E94-R237 WeakPolarHBondContact OE2-CD 3.27Å; E94-R237 IonicContact OE2-NH1 3.73Å; E94-R237 PolarHBondContact OE2-NH1 3.42Å; E94-Y238 HydrophobicContact CB-CD2 3.88Å; E94-Y238 HydrophobicContact CB-CE2 3.91Å; E94-Y238 HydrophobicContact CG-CD2 4.4Å; E94-Y238 HydrophobicContact CG-CE2 3.93Å
95	P	82.6	Confident	85.3	Confident	4 Å²	4	34.2 Å²	34.2	3%	0.026	19%	0.186	C	C	.	.			trans	-72.5	115.3	173.3	-14.6	30.8	0	0	0	110.6	R170 R234 Q235 R237	P95-R170 CarbonylContact C-O 3.18Å; P95-R170 WeakPolarHBondContact CA-O 3.47Å; P95-R234 HydrophobicContact CG-CB 3.67Å; P95-Q235 WeakPolarHBondContact CB-O 3.45Å; P95-Q235 WeakPolarHBondContact CG-O 3.43Å; P95-R237 PolarHBondContact O-N 3.4Å
96	C	85.4	Confident	84.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.1	-172.1	-56.9	0	0	0	0	112.3	Y91 E94 R170 W171 I172 Y238 I240	Y91-C96 PolarHBondContact O-SG 2.8Å; E94-C96 PolarHBondContact O-N 2.92Å; E94-C96 PolarHBondContact O-SG 2.76Å; E94-C96 VanDerWaalsContact O-SG 3.33Å; C96-R170 PolarHBondContact N-O 2.82Å; C96-W171 HydrophobicContact CB-CG 4.4Å; C96-W171 WeakPolarHBondContact O-CA 3.31Å; C96-I172 PolarHBondContact O-N 2.72Å; C96-Y238 CarbonylContact C-O 3.57Å; C96-Y238 VanDerWaalsContact CA-O 3.31Å; C96-Y238 WeakPolarHBondContact CA-O 3.36Å; C96-I240 HydrophobicContact CB-CD1 3.79Å; C96-I240 HydrophobicContact CB-CG1 4.12Å
97	L	88.6	Confident	84.5	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.6	169.3	169.8	58.9	0	0	0	108	I99 I172 V174 M211 V214 L215 L236 Y238 I239 I240	L97-I99 HydrophobicContact CD1-CG2 4.41Å; L97-I99 HydrophobicContact CD2-CG2 4.47Å; L97-I99 HydrophobicContact CG-CG2 4.11Å; L97-I172 HydrophobicContact CD1-CB 4.28Å; L97-I172 HydrophobicContact CD1-CG2 4.21Å; L97-V174 HydrophobicContact CD1-CB 4.37Å; L97-V174 HydrophobicContact CD1-CG2 3.69Å; L97-M211 HydrophobicContact CD2-CE 4.19Å; L97-V214 HydrophobicContact CD1-CG1 4.14Å; L97-V214 HydrophobicContact CD2-CG1 4.28Å; L97-L215 HydrophobicContact CD2-CD2 4.23Å; L97-L236 HydrophobicContact CB-CD1 3.94Å; L97-L236 HydrophobicContact CB-CD2 3.56Å; L97-L236 HydrophobicContact CB-CG 4.17Å; L97-L236 HydrophobicContact CD2-CD2 4.17Å; L97-L236 HydrophobicContact CG-CD2 4.48Å; L97-Y238 PolarHBondContact N-O 3.16Å; L97-I239 CarbonylContact O-C 3.57Å; L97-I239 VanDerWaalsContact O-CA 3.26Å; L97-I239 WeakPolarHBondContact O-CA 3.26Å; L97-I240 PolarHBondContact O-N 3.3Å
98	V	88.4	Confident	84.2	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.5	177.6	-167.4	0	0	0	0	108.6	V100 W171 I172 V173 V174 I240 V242	V98-V100 HydrophobicContact CG1-CG2 3.99Å; V98-W171 HydrophobicContact CG2-CB 4.42Å; V98-W171 HydrophobicContact CG2-CD2 4.06Å; V98-W171 HydrophobicContact CG2-CE3 3.57Å; V98-W171 HydrophobicContact CG2-CG 4.46Å; V98-W171 HydrophobicContact CG2-CZ3 4.01Å; V98-I172 PolarHBondContact N-O 3.42Å; V98-V173 HydrophobicContact CB-CB 4.36Å; V98-V173 HydrophobicContact CB-CG1 4.31Å; V98-V173 HydrophobicContact CB-CG2 3.75Å; V98-V173 HydrophobicContact CG1-CG1 4.5Å; V98-V173 HydrophobicContact CG1-CG2 4.46Å; V98-V173 HydrophobicContact CG2-CG2 3.95Å; V98-V173 WeakPolarHBondContact O-CA 3.24Å; V98-V174 PolarHBondContact O-N 3.08Å; V98-I240 CarbonylContact C-O 3.44Å; V98-I240 VanDerWaalsContact CA-O 3.28Å; V98-I240 WeakPolarHBondContact CA-O 3.39Å; V98-I240 HydrophobicContact CG1-CB 4.36Å; V98-I240 HydrophobicContact CG1-CG2 4.46Å; V98-I240 HydrophobicContact CG2-CB 4.29Å; V98-I240 HydrophobicContact CG2-CD1 4.39Å; V98-V242 HydrophobicContact CG1-CG2 3.45Å; V98-V242 VanDerWaalsContact CG1-CG2 3.45Å
99	I	91.6	Very high	83.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.6	175.8	57.1	178.5	0	0	0	109.1	L97 M211 I239 I240 D241 V242 L291 L294 W295	L97-I99 HydrophobicContact CD1-CG2 4.41Å; L97-I99 HydrophobicContact CD2-CG2 4.47Å; L97-I99 HydrophobicContact CG-CG2 4.11Å; I99-M211 HydrophobicContact CG2-CE 4.31Å; I99-M211 HydrophobicContact CG2-SD 3.8Å; I99-I239 HydrophobicContact CD1-CG2 3.66Å; I99-I239 HydrophobicContact CG1-CG2 3.94Å; I99-I240 PolarHBondContact N-O 3.22Å; I99-D241 HydrophobicContact CD1-CB 4.17Å; I99-D241 HydrophobicContact CG1-CB 4.05Å; I99-D241 WeakPolarHBondContact CG1-OD1 2.87Å; I99-V242 PolarHBondContact O-N 3.48Å; I99-L291 HydrophobicContact CD1-CD2 4.14Å; I99-L294 HydrophobicContact CD1-CD1 3.6Å; I99-W295 HydrophobicContact CD1-CZ3 4.26Å
100	V	90.8	Very high	83.6	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139	-171.9	-161.6	0	0	0	0	110.1	V98 L111 V173 V174 F175 P176 V242 I244	V98-V100 HydrophobicContact CG1-CG2 3.99Å; V100-L111 HydrophobicContact CB-CD1 4.39Å; V100-L111 HydrophobicContact CG1-CD1 3.88Å; V100-L111 HydrophobicContact CG2-CD1 3.84Å; V100-V173 HydrophobicContact CG2-CG1 3.86Å; V100-V174 PolarHBondContact N-O 3.44Å; V100-F175 HydrophobicContact CB-CD1 3.92Å; V100-F175 HydrophobicContact CB-CE1 3.71Å; V100-F175 HydrophobicContact CB-CZ 4.25Å; V100-F175 HydrophobicContact CG1-CD1 4.41Å; V100-F175 HydrophobicContact CG1-CE1 3.89Å; V100-F175 HydrophobicContact CG2-CE1 4.31Å; V100-F175 HydrophobicContact CG2-CZ 4.37Å; V100-P176 WeakPolarHBondContact O-CD 3.04Å; V100-V242 WeakPolarHBondContact CA-O 3.32Å; V100-V242 HydrophobicContact CG1-CB 4.14Å; V100-V242 HydrophobicContact CG1-CG1 4.37Å; V100-V242 HydrophobicContact CG2-CB 4.14Å; V100-V242 HydrophobicContact CG2-CG2 4.39Å; V100-I244 HydrophobicContact CG1-CD1 3.69Å; V100-I244 HydrophobicContact CG1-CG1 3.82Å
101	N	92.7	Very high	83.5	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.			trans	-66.5	162.1	162.1	69.5	-39.5	0	0	0	110.2	Q103 E177 V242 T243 I244 K298	N101-Q103 PolarHBondContact ND2-NE2 3.33Å; N101-E177 WeakPolarHBondContact CB-OE1 3.29Å; N101-V242 PolarHBondContact N-O 3.03Å; N101-T243 WeakPolarHBondContact OD1-CA 3.25Å; N101-I244 PolarHBondContact ND2-O 2.75Å; N101-I244 PolarHBondContact OD1-N 2.88Å; N101-K298 HydrophobicContact CB-CD 4.45Å
102	H	89	Confident	82.9	Confident	12 Å²	12	15 Å²	15	6%	0.056	8%	0.08	C	C	.	.			trans	-131.6	101.5	-174.8	-159.7	22.9	0	0	0	113.1	S104 D107 F175 E177 F180 L181	H102-S104 PolarHBondContact CE1-O 3.4Å; H102-S104 VanDerWaalsContact CE1-O 3.25Å; H102-D107 WeakPolarHBondContact CA-OD2 3.16Å; H102-D107 IonicContact CE1-OD2 2.65Å; H102-D107 IonicContact CG-OD2 3.05Å; H102-D107 IonicContact ND1-OD2 2.83Å; H102-D107 PolarHBondContact ND1-OD2 3.24Å; H102-F175 HydrophobicContact CB-CD1 3.84Å; H102-F175 AromaticContact CG-CD1 3.8Å; H102-F175 AromaticContact ND1-CD1 3.87Å; H102-F175 AromaticContact ND1-CE1 3.98Å; H102-E177 WeakPolarHBondContact CA-OE2 3.39Å; H102-E177 HydrophobicContact CB-CB 4.27Å; H102-E177 VanDerWaalsContact N-CD 3.29Å; H102-E177 PolarHBondContact N-OE2 3.36Å; H102-E177 VanDerWaalsContact O-OE2 3.09Å; H102-F180 AromaticContact CD2-CD1 3.77Å; H102-F180 AromaticContact CE1-CD1 3.57Å; H102-F180 AromaticContact CE1-CE1 3.31Å; H102-F180 WeakPolarHBondContact CE1-CE1 3.16Å; H102-F180 AromaticContact ND1-CD1 3.95Å; H102-F180 AromaticContact NE2-CD1 3.42Å; H102-F180 WeakPolarHBondContact NE2-CD1 3.27Å; H102-F180 AromaticContact NE2-CE1 3.25Å; H102-F180 VanDerWaalsContact NE2-CE1 3.25Å; H102-F180 WeakPolarHBondContact NE2-CE1 3.19Å; H102-F180 WeakPolarHBondContact O-CA 3.26Å; H102-L181 PolarHBondContact O-N 3.45Å
103	Q	85.7	Confident	82.5	Confident	25 Å²	25	15.1 Å²	15.1	12%	0.117	8%	0.081	C	C	.	.			trans	-102.1	-37	-175.4	-61.4	-62.8	-37.7	0	0	111.7	N101 D107 L181 Y202 Y246	N101-Q103 PolarHBondContact ND2-NE2 3.33Å; Q103-D107 PolarHBondContact N-OD2 3.47Å; Q103-L181 VanDerWaalsContact OE1-CD2 3.24Å; Q103-Y202 PolarHBondContact NE2-O 2.9Å; Q103-Y202 VanDerWaalsContact NE2-O 3.12Å; Q103-Y246 HydrophobicContact CB-CD2 3.67Å; Q103-Y246 HydrophobicContact CB-CE2 3.6Å; Q103-Y246 HydrophobicContact CG-CD2 4.15Å; Q103-Y246 HydrophobicContact CG-CE2 4.3Å
104	S	83.4	Confident	82.4	Confident	2 Å²	2	10.4 Å²	10.4	1%	0.014	6%	0.059	C	C	.	.			trans	-153.1	165.2	-166.1	-178.5	0	0	0	0	114.2	H102 A106 D107 F180 F252	H102-S104 PolarHBondContact CE1-O 3.4Å; H102-S104 VanDerWaalsContact CE1-O 3.25Å; S104-A106 PolarHBondContact O-N 2.87Å; S104-A106 PolarHBondContact OG-N 3.16Å; S104-D107 PolarHBondContact N-OD1 3.14Å; S104-D107 PolarHBondContact N-OD2 3.31Å; S104-D107 WeakPolarHBondContact O-CB 2.85Å; S104-D107 PolarHBondContact O-N 2.93Å; S104-D107 VanDerWaalsContact O-OD2 3.1Å; S104-F180 WeakPolarHBondContact O-CE1 3.43Å; S104-F252 VanDerWaalsContact OG-CA 3.25Å; S104-F252 WeakPolarHBondContact OG-CA 3.27Å; S104-F252 WeakPolarHBondContact OG-CB 3.18Å; S104-F252 PolarHBondContact OG-N 2.87Å; S104-F252 PolarHBondContact OG-O 3.44Å
105	T	81.2	Confident	81.9	Confident	48 Å²	48	9.1 Å²	9.1	29%	0.294	5%	0.053	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.6	172.6	-45.4	0	0	0	0	111.3	D107 P109 F180 I257	T105-D107 VanDerWaalsContact C-N 3.28Å; T105-D107 PolarHBondContact O-N 3Å; T105-P109 VanDerWaalsContact O-CD 3.29Å; T105-P109 WeakPolarHBondContact O-CD 3.28Å; T105-F180 VanDerWaalsContact OG1-CZ 3.29Å; T105-F180 WeakPolarHBondContact OG1-CZ 3.37Å; T105-I257 HydrophobicContact CG2-CD1 4.43Å
106	A	79.6	Confident	81.3	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-15.1	179.4	0	0	0	0	0	114.4	L76 S104 V108 P109 I110 F252 I257	L76-A106 HydrophobicContact CD2-CB 4.18Å; S104-A106 PolarHBondContact O-N 2.87Å; S104-A106 PolarHBondContact OG-N 3.16Å; A106-V108 VanDerWaalsContact C-N 3.27Å; A106-V108 PolarHBondContact O-N 3.41Å; A106-P109 WeakPolarHBondContact O-CD 3.28Å; A106-P109 VanDerWaalsContact O-CG 3.25Å; A106-P109 WeakPolarHBondContact O-CG 3.28Å; A106-I110 HydrophobicContact CB-CD1 3.86Å; A106-I110 HydrophobicContact CB-CG1 4.44Å; A106-I110 WeakPolarHBondContact O-CB 3.49Å; A106-I110 WeakPolarHBondContact O-CD1 3.28Å; A106-I110 WeakPolarHBondContact O-CG1 3.35Å; A106-I110 PolarHBondContact O-N 2.99Å; A106-F252 HydrophobicContact CB-CB 3.45Å; A106-F252 VanDerWaalsContact CB-CB 3.45Å; A106-F252 HydrophobicContact CB-CD1 3.69Å; A106-F252 HydrophobicContact CB-CD2 3.8Å; A106-F252 HydrophobicContact CB-CG 3.35Å; A106-I257 HydrophobicContact CB-CD1 3.99Å
107	D	82.1	Confident	80.3	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-55.2	-46.1	-178.7	-58.4	-5.3	0	0	0	111.3	H102 Q103 S104 T105 L111 F175 I244 Y246	H102-D107 WeakPolarHBondContact CA-OD2 3.16Å; H102-D107 IonicContact CE1-OD2 2.65Å; H102-D107 IonicContact CG-OD2 3.05Å; H102-D107 IonicContact ND1-OD2 2.83Å; H102-D107 PolarHBondContact ND1-OD2 3.24Å; Q103-D107 PolarHBondContact N-OD2 3.47Å; S104-D107 PolarHBondContact N-OD1 3.14Å; S104-D107 PolarHBondContact N-OD2 3.31Å; S104-D107 WeakPolarHBondContact O-CB 2.85Å; S104-D107 PolarHBondContact O-N 2.93Å; S104-D107 VanDerWaalsContact O-OD2 3.1Å; T105-D107 VanDerWaalsContact C-N 3.28Å; T105-D107 PolarHBondContact O-N 3Å; D107-L111 WeakPolarHBondContact O-CB 3.22Å; D107-L111 VanDerWaalsContact O-CG 3.23Å; D107-L111 WeakPolarHBondContact O-CG 3.28Å; D107-L111 PolarHBondContact O-N 2.9Å; D107-F175 HydrophobicContact CB-CE1 4.34Å; D107-I244 HydrophobicContact CB-CD1 3.85Å; D107-Y246 WeakPolarHBondContact OD1-CE2 3.32Å; D107-Y246 VanDerWaalsContact OD1-CZ 3.3Å; D107-Y246 PolarHBondContact OD1-OH 3.42Å
108	V	78.3	Confident	79.3	Confident	43 Å²	43	10.1 Å²	10.1	26%	0.261	6%	0.058	S	C	.	.	H	α-helix	trans	-61.5	-57.5	-179.3	171.4	0	0	0	0	111.8	A106 I110 L111 V112 F129 A131 F175	A106-V108 VanDerWaalsContact C-N 3.27Å; A106-V108 PolarHBondContact O-N 3.41Å; V108-I110 PolarHBondContact O-N 2.94Å; V108-L111 PolarHBondContact O-N 3.44Å; V108-V112 VanDerWaalsContact O-CG2 3.31Å; V108-V112 WeakPolarHBondContact O-CG2 3.42Å; V108-V112 PolarHBondContact O-N 2.96Å; V108-F129 HydrophobicContact CB-CD1 4.34Å; V108-F129 HydrophobicContact CB-CE1 3.86Å; V108-F129 HydrophobicContact CB-CZ 4.21Å; V108-F129 HydrophobicContact CG1-CD1 3.84Å; V108-F129 HydrophobicContact CG1-CD2 4.22Å; V108-F129 HydrophobicContact CG1-CE1 3.58Å; V108-F129 HydrophobicContact CG1-CE2 3.97Å; V108-F129 HydrophobicContact CG1-CG 4.18Å; V108-F129 HydrophobicContact CG1-CZ 3.64Å; V108-F129 HydrophobicContact CG2-CD1 3.85Å; V108-F129 HydrophobicContact CG2-CE1 3.65Å; V108-F129 HydrophobicContact CG2-CZ 4.48Å; V108-A131 HydrophobicContact CG2-CB 4.47Å; V108-F175 HydrophobicContact CG2-CE2 4.47Å; V108-F175 HydrophobicContact CG2-CZ 4.16Å
109	P	73.8	Confident	78.1	Confident	21 Å²	21	10.6 Å²	10.6	14%	0.136	6%	0.061	C	C	.	.	H	α-helix	trans	-64.6	-35.4	179.2	23	-32.9	0	0	0	113.4	L76 T105 A106 V112 H113	L76-P109 HydrophobicContact CD1-CB 4.05Å; L76-P109 HydrophobicContact CD1-CG 4.18Å; T105-P109 VanDerWaalsContact O-CD 3.29Å; T105-P109 WeakPolarHBondContact O-CD 3.28Å; A106-P109 WeakPolarHBondContact O-CD 3.28Å; A106-P109 VanDerWaalsContact O-CG 3.25Å; A106-P109 WeakPolarHBondContact O-CG 3.28Å; P109-V112 PolarHBondContact O-N 3.07Å; P109-H113 VanDerWaalsContact O-CB 3.3Å; P109-H113 WeakPolarHBondContact O-CB 3.28Å; P109-H113 PolarHBondContact O-N 2.74Å
110	I	77.5	Confident	76.1	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.7	-49.8	175.4	-70.9	167.9	0	0	0	110.2	L76 V81 A106 V108 H113 V114 Y246 V267 L269	L76-I110 HydrophobicContact CD1-CG1 4.03Å; L76-I110 HydrophobicContact CD2-CD1 4.39Å; L76-I110 HydrophobicContact CD2-CG1 4.29Å; V81-I110 HydrophobicContact CG2-CG2 4.2Å; A106-I110 HydrophobicContact CB-CD1 3.86Å; A106-I110 HydrophobicContact CB-CG1 4.44Å; A106-I110 WeakPolarHBondContact O-CB 3.49Å; A106-I110 WeakPolarHBondContact O-CD1 3.28Å; A106-I110 WeakPolarHBondContact O-CG1 3.35Å; A106-I110 PolarHBondContact O-N 2.99Å; V108-I110 PolarHBondContact O-N 2.94Å; I110-H113 PolarHBondContact O-N 3.07Å; I110-V114 HydrophobicContact CG2-CG2 4.5Å; I110-V114 WeakPolarHBondContact O-CG2 3.35Å; I110-V114 PolarHBondContact O-N 3.01Å; I110-Y246 HydrophobicContact CD1-CE1 4.16Å; I110-V267 HydrophobicContact CD1-CG1 4.27Å; I110-V267 HydrophobicContact CD1-CG2 4.2Å; I110-L269 HydrophobicContact CG2-CD1 4.11Å; I110-L269 HydrophobicContact CG2-CD2 4.37Å
111	L	78.6	Confident	73.8	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-61.9	-46.9	178.5	-74.1	171.6	0	0	0	112.2	V100 D107 V108 H113 V114 I115 M127 F129 F175 V242 I244	V100-L111 HydrophobicContact CB-CD1 4.39Å; V100-L111 HydrophobicContact CG1-CD1 3.88Å; V100-L111 HydrophobicContact CG2-CD1 3.84Å; D107-L111 WeakPolarHBondContact O-CB 3.22Å; D107-L111 VanDerWaalsContact O-CG 3.23Å; D107-L111 WeakPolarHBondContact O-CG 3.28Å; D107-L111 PolarHBondContact O-N 2.9Å; V108-L111 PolarHBondContact O-N 3.44Å; L111-H113 PolarHBondContact O-N 2.88Å; L111-V114 PolarHBondContact O-N 3.4Å; L111-I115 HydrophobicContact CB-CD1 4.41Å; L111-I115 WeakPolarHBondContact O-CB 3.17Å; L111-I115 WeakPolarHBondContact O-CD1 3.39Å; L111-I115 WeakPolarHBondContact O-CG1 3.5Å; L111-I115 PolarHBondContact O-N 3.29Å; L111-M127 HydrophobicContact CB-CE 4.26Å; L111-F129 HydrophobicContact CB-CZ 4.46Å; L111-F175 HydrophobicContact CD1-CE1 4.39Å; L111-F175 HydrophobicContact CD1-CZ 3.93Å; L111-V242 HydrophobicContact CD2-CG1 4.03Å; L111-I244 HydrophobicContact CD1-CD1 4.08Å; L111-I244 HydrophobicContact CD2-CD1 4.24Å; L111-I244 HydrophobicContact CG-CD1 4.01Å
112	V	73.3	Confident	71.1	Confident	21 Å²	21	21.3 Å²	21.3	13%	0.127	13%	0.127	C	C	.	.	H	α-helix	trans	-54.1	-45.2	176.5	172.2	0	0	0	0	110.4	T69 V108 P109 N116 F129	T69-V112 HydrophobicContact CG2-CB 4.44Å; T69-V112 HydrophobicContact CG2-CG1 3.72Å; V108-V112 VanDerWaalsContact O-CG2 3.31Å; V108-V112 WeakPolarHBondContact O-CG2 3.42Å; V108-V112 PolarHBondContact O-N 2.96Å; P109-V112 PolarHBondContact O-N 3.07Å; V112-N116 WeakPolarHBondContact CG1-ND2 3.48Å; V112-N116 VanDerWaalsContact O-CB 3.26Å; V112-N116 WeakPolarHBondContact O-CB 3.25Å; V112-N116 PolarHBondContact O-N 2.9Å; V112-N116 PolarHBondContact O-ND2 2.82Å; V112-F129 HydrophobicContact CG2-CD2 4.35Å; V112-F129 HydrophobicContact CG2-CE2 3.27Å; V112-F129 HydrophobicContact CG2-CZ 3.69Å
113	H	70.4	Confident	68.4	Low	8 Å²	8	27.3 Å²	27.3	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-51.2	-175.5	-173.8	77.2	0	0	0	112.5	F73 P109 I110 L111 I115 N116 A117 L330 Y333 A334 N337	F73-H113 AromaticContact CD2-CE1 3.63Å; F73-H113 AromaticContact CD2-CG 3.95Å; F73-H113 AromaticContact CD2-ND1 3.51Å; F73-H113 AromaticContact CE2-CD2 3.7Å; F73-H113 AromaticContact CE2-CE1 2.92Å; F73-H113 WeakPolarHBondContact CE2-CE1 3.5Å; F73-H113 AromaticContact CE2-CG 3.74Å; F73-H113 AromaticContact CE2-ND1 3.3Å; F73-H113 VanDerWaalsContact CE2-ND1 3.3Å; F73-H113 WeakPolarHBondContact CE2-ND1 3.44Å; F73-H113 AromaticContact CE2-NE2 3.18Å; F73-H113 WeakPolarHBondContact CE2-NE2 3.29Å; F73-H113 AromaticContact CZ-CE1 3.12Å; F73-H113 WeakPolarHBondContact CZ-CE1 3.38Å; F73-H113 AromaticContact CZ-ND1 3.85Å; F73-H113 AromaticContact CZ-NE2 3.56Å; P109-H113 VanDerWaalsContact O-CB 3.3Å; P109-H113 WeakPolarHBondContact O-CB 3.28Å; P109-H113 PolarHBondContact O-N 2.74Å; I110-H113 PolarHBondContact O-N 3.07Å; L111-H113 PolarHBondContact O-N 2.88Å; H113-I115 VanDerWaalsContact C-N 3.3Å; H113-I115 PolarHBondContact O-N 2.81Å; H113-N116 PolarHBondContact O-N 2.99Å; H113-A117 WeakPolarHBondContact O-CB 3.25Å; H113-A117 PolarHBondContact O-N 2.92Å; H113-L330 WeakPolarHBondContact CD2-CD2 3.47Å; H113-Y333 VanDerWaalsContact CD2-CB 3.47Å; H113-Y333 WeakPolarHBondContact CD2-CB 3.5Å; H113-Y333 VanDerWaalsContact NE2-C 3.33Å; H113-Y333 WeakPolarHBondContact NE2-CB 3.4Å; H113-A334 PolarHBondContact NE2-N 3.24Å; H113-N337 PolarHBondContact CE1-ND2 2.97Å; H113-N337 PolarHBondContact ND1-ND2 3.4Å
114	V	74.3	Confident	65.7	Low	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-45.6	179.3	169.4	0	0	0	0	110.3	V81 E83 I110 L111 A117 L118 L269 Y271 Y333	V81-V114 HydrophobicContact CG1-CG2 4.13Å; E83-V114 WeakPolarHBondContact OE1-CG1 3.32Å; I110-V114 HydrophobicContact CG2-CG2 4.5Å; I110-V114 WeakPolarHBondContact O-CG2 3.35Å; I110-V114 PolarHBondContact O-N 3.01Å; L111-V114 PolarHBondContact O-N 3.4Å; V114-A117 PolarHBondContact O-N 3.27Å; V114-L118 HydrophobicContact CG1-CD1 3.66Å; V114-L118 HydrophobicContact CG1-CG 4.14Å; V114-L118 WeakPolarHBondContact O-CB 3Å; V114-L118 VanDerWaalsContact O-CG 3.28Å; V114-L118 WeakPolarHBondContact O-CG 3.47Å; V114-L118 PolarHBondContact O-N 2.83Å; V114-L269 HydrophobicContact CB-CD1 4.31Å; V114-L269 HydrophobicContact CG1-CD1 4.27Å; V114-L269 HydrophobicContact CG2-CD1 3.79Å; V114-Y271 WeakPolarHBondContact CG1-OH 3.28Å; V114-Y333 HydrophobicContact CG1-CE1 4.47Å
115	I	73.5	Confident	63.2	Low	5 Å²	5	30.9 Å²	30.9	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-64.9	-44	179.5	-71.4	167.7	0	0	0	112	F92 L111 H113 A117 S119 V125 M127 W171	F92-I115 HydrophobicContact CD1-CG2 4.37Å; F92-I115 HydrophobicContact CE1-CB 4.24Å; F92-I115 HydrophobicContact CE1-CG1 4.31Å; F92-I115 HydrophobicContact CE1-CG2 3.71Å; L111-I115 HydrophobicContact CB-CD1 4.41Å; L111-I115 WeakPolarHBondContact O-CB 3.17Å; L111-I115 WeakPolarHBondContact O-CD1 3.39Å; L111-I115 WeakPolarHBondContact O-CG1 3.5Å; L111-I115 PolarHBondContact O-N 3.29Å; H113-I115 VanDerWaalsContact C-N 3.3Å; H113-I115 PolarHBondContact O-N 2.81Å; I115-A117 VanDerWaalsContact C-N 3.31Å; I115-A117 PolarHBondContact O-N 2.84Å; I115-S119 VanDerWaalsContact O-CB 3.26Å; I115-S119 WeakPolarHBondContact O-CB 3.34Å; I115-S119 PolarHBondContact O-N 2.95Å; I115-S119 PolarHBondContact O-OG 3.29Å; I115-V125 HydrophobicContact CB-CG1 4.49Å; I115-V125 HydrophobicContact CG2-CB 3.42Å; I115-V125 VanDerWaalsContact CG2-CB 3.42Å; I115-V125 HydrophobicContact CG2-CG1 3.28Å; I115-V125 HydrophobicContact CG2-CG2 3.26Å; I115-M127 HydrophobicContact CD1-CE 3.32Å; I115-M127 HydrophobicContact CD1-SD 3.78Å; I115-W171 HydrophobicContact CD1-CE3 3.83Å; I115-W171 HydrophobicContact CD1-CZ3 3.62Å; I115-W171 HydrophobicContact CG1-CE3 4.24Å; I115-W171 HydrophobicContact CG1-CZ3 3.67Å; I115-W171 HydrophobicContact CG2-CE3 4.24Å; I115-W171 HydrophobicContact CG2-CZ3 4.23Å
116	N	68.6	Low	60.9	Low	14 Å²	14	32 Å²	32	8%	0.075	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-42.1	176.6	-76.6	-18.1	0	0	0	111.5	V112 H113 S119	V112-N116 WeakPolarHBondContact CG1-ND2 3.48Å; V112-N116 VanDerWaalsContact O-CB 3.26Å; V112-N116 WeakPolarHBondContact O-CB 3.25Å; V112-N116 PolarHBondContact O-N 2.9Å; V112-N116 PolarHBondContact O-ND2 2.82Å; H113-N116 PolarHBondContact O-N 2.99Å; N116-S119 PolarHBondContact O-OG 3.12Å; N116-S119 VanDerWaalsContact O-OG 3.07Å
117	A	65.5	Low	58.6	Low	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71.4	-42	-179.2	0	0	0	0	0	112.8	H113 V114 I115 G120 Y333 K336 N337	H113-A117 WeakPolarHBondContact O-CB 3.25Å; H113-A117 PolarHBondContact O-N 2.92Å; V114-A117 PolarHBondContact O-N 3.27Å; I115-A117 VanDerWaalsContact C-N 3.31Å; I115-A117 PolarHBondContact O-N 2.84Å; A117-G120 PolarHBondContact O-N 3.08Å; A117-Y333 HydrophobicContact CB-CD1 3.46Å; A117-Y333 VanDerWaalsContact CB-CD1 3.46Å; A117-Y333 HydrophobicContact CB-CG 3.97Å; A117-K336 VanDerWaalsContact O-CD 3.22Å; A117-K336 WeakPolarHBondContact O-CD 3.21Å; A117-K336 WeakPolarHBondContact O-CE 3.21Å; A117-K336 PolarHBondContact O-NZ 3.16Å; A117-N337 VanDerWaalsContact CA-OD1 3.31Å; A117-N337 WeakPolarHBondContact CA-OD1 3.35Å; A117-N337 PolarHBondContact N-OD1 3.47Å
118	L	66.1	Low	56.3	Low	10 Å²	10	34.6 Å²	34.6	5%	0.052	19%	0.185	C	C	.	.	H	α-helix	trans	-69.8	-41.2	-179.8	-72.7	178.5	0	0	0	111.9	E83 I88 F92 V114 G120 Y333	E83-L118 WeakPolarHBondContact OE1-CD1 3.28Å; I88-L118 HydrophobicContact CD1-CD1 3.62Å; I88-L118 HydrophobicContact CG1-CD1 3.88Å; F92-L118 HydrophobicContact CD2-CB 4.42Å; F92-L118 HydrophobicContact CE1-CB 4.5Å; F92-L118 HydrophobicContact CE2-CB 3.35Å; F92-L118 HydrophobicContact CE2-CD1 4.16Å; F92-L118 HydrophobicContact CE2-CG 4.42Å; F92-L118 HydrophobicContact CZ-CB 3.4Å; F92-L118 HydrophobicContact CZ-CD1 3.9Å; F92-L118 HydrophobicContact CZ-CG 4.35Å; V114-L118 HydrophobicContact CG1-CD1 3.66Å; V114-L118 HydrophobicContact CG1-CG 4.14Å; V114-L118 WeakPolarHBondContact O-CB 3Å; V114-L118 VanDerWaalsContact O-CG 3.28Å; V114-L118 WeakPolarHBondContact O-CG 3.47Å; V114-L118 PolarHBondContact O-N 2.83Å; L118-G120 PolarHBondContact O-N 3.41Å; L118-Y333 HydrophobicContact CD2-CE1 3.99Å; L118-Y333 HydrophobicContact CG-CE1 4.16Å
119	S	64	Low	54.1	Low	12 Å²	12	34.6 Å²	34.6	8%	0.084	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.3	179.5	63.7	0	0	0	0	113.3	I115 N116 Y121	I115-S119 VanDerWaalsContact O-CB 3.26Å; I115-S119 WeakPolarHBondContact O-CB 3.34Å; I115-S119 PolarHBondContact O-N 2.95Å; I115-S119 PolarHBondContact O-OG 3.29Å; N116-S119 PolarHBondContact O-OG 3.12Å; N116-S119 VanDerWaalsContact O-OG 3.07Å; S119-Y121 WeakPolarHBondContact O-CD2 3.37Å; S119-Y121 PolarHBondContact O-N 2.89Å; S119-Y121 PolarHBondContact OG-N 3.35Å; S119-Y121 PolarHBondContact OG-O 3.11Å
120	G	49.9	Very low	52.1	Low	58 Å²	58	36.5 Å²	36.5	60%	0.598	19%	0.19	S	C	*	.	S	Bend	trans	63.7	0.3	-173.6	0	0	0	0	0	113.3	A117 L118	A117-G120 PolarHBondContact O-N 3.08Å; L118-G120 PolarHBondContact O-N 3.41Å
121	Y	41.6	Very low	49.7	Very low	123 Å²	123	37.4 Å²	37.4	48%	0.482	20%	0.198	S	C	.	.			trans	-132	99.7	-173.9	-69.1	-72.2	0	0	0	106.4	S119 Y123	S119-Y121 WeakPolarHBondContact O-CD2 3.37Å; S119-Y121 PolarHBondContact O-N 2.89Å; S119-Y121 PolarHBondContact OG-N 3.35Å; S119-Y121 PolarHBondContact OG-O 3.11Å; Y121-Y123 HydrophobicContact CD1-CD2 4.44Å; Y121-Y123 PolarHBondContact O-N 2.76Å
122	C	37.3	Very low	47.2	Very low	43 Å²	43	44 Å²	44	29%	0.291	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	11	162.1	-139.4	0	0	0	0	110.8	R62 C66	R62-C122 PolarHBondContact NE-O 3.38Å; R62-C122 VanDerWaalsContact NE-O 3.1Å; C66-C122 WeakPolarHBondContact CB-SG 3.19Å; C66-C122 VanDerWaalsContact SG-CB 3.52Å; C66-C122 CovalentContact SG-SG 2.15Å; C66-C122 PolarHBondContact SG-SG 3.04Å
123	Y	31.4	Very low	44.9	Very low	139 Å²	139	44.7 Å²	44.7	55%	0.545	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-40.1	-166.3	-71.1	-108.9	0	0	0	115.2	R62 Y121	R62-Y123 PolarHBondContact NH2-O 2.82Å; Y121-Y123 HydrophobicContact CD1-CD2 4.44Å; Y121-Y123 PolarHBondContact O-N 2.76Å
124	K	29	Very low	42.7	Very low	86 Å²	86	46.4 Å²	46.4	37%	0.374	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-19.3	-160.6	-71.5	-178	-179.9	172.5	0	115.5	R126 R170	K124-R126 PolarHBondContact O-N 3.34Å; K124-R170 VanDerWaalsContact NZ-NH1 3.17Å
125	V	31.5	Very low	40.2	Very low	16 Å²	16	54 Å²	54	10%	0.097	28%	0.284	C	S	.	.			trans	-87.6	64.2	172.8	-162.9	0	0	0	0	109.3	F92 I115 M127 W171	F92-V125 HydrophobicContact CD1-CG2 4.32Å; I115-V125 HydrophobicContact CB-CG1 4.49Å; I115-V125 HydrophobicContact CG2-CB 3.42Å; I115-V125 VanDerWaalsContact CG2-CB 3.42Å; I115-V125 HydrophobicContact CG2-CG1 3.28Å; I115-V125 HydrophobicContact CG2-CG2 3.26Å; V125-M127 HydrophobicContact CG1-CB 4.45Å; V125-M127 HydrophobicContact CG1-CG 3.37Å; V125-M127 HydrophobicContact CG1-SD 3.27Å; V125-M127 WeakPolarHBondContact CG1-SD 3.38Å; V125-M127 PolarHBondContact O-N 2.7Å; V125-W171 HydrophobicContact CG1-CB 4.27Å; V125-W171 HydrophobicContact CG1-CE3 4.44Å
126	R	32.7	Very low	37.8	Very low	70 Å²	70	58.7 Å²	58.7	26%	0.264	31%	0.309	S	S	.	.			trans	-68.2	76.7	154.2	-73.9	178.3	175.6	149.6	-3.6	106.2	K124 G128 R169	K124-R126 PolarHBondContact O-N 3.34Å; R126-G128 PolarHBondContact O-N 3.16Å; R126-R169 HydrophobicContact CB-CG 4.06Å; R126-R169 WeakPolarHBondContact O-CD 3.31Å; R126-R169 PolarHBondContact O-NE 2.84Å
127	M	31.6	Very low	35.6	Very low	27 Å²	27	63.6 Å²	63.6	13%	0.133	33%	0.326	C	S	.	.			trans	-49	110.3	171.5	-63.5	-79.2	-101	0	0	106.8	L111 I115 V125 F129 V173	L111-M127 HydrophobicContact CB-CE 4.26Å; I115-M127 HydrophobicContact CD1-CE 3.32Å; I115-M127 HydrophobicContact CD1-SD 3.78Å; V125-M127 HydrophobicContact CG1-CB 4.45Å; V125-M127 HydrophobicContact CG1-CG 3.37Å; V125-M127 HydrophobicContact CG1-SD 3.27Å; V125-M127 WeakPolarHBondContact CG1-SD 3.38Å; V125-M127 PolarHBondContact O-N 2.7Å; M127-F129 HydrophobicContact CB-CD2 3.36Å; M127-F129 HydrophobicContact CB-CE2 3.36Å; M127-F129 HydrophobicContact CB-CG 4.37Å; M127-F129 HydrophobicContact CB-CZ 4.39Å; M127-F129 HydrophobicContact CE-CE1 4.18Å; M127-F129 HydrophobicContact CE-CE2 3.63Å; M127-F129 HydrophobicContact CE-CZ 3.38Å; M127-F129 HydrophobicContact CG-CD2 4.12Å; M127-F129 HydrophobicContact CG-CE2 3.57Å; M127-F129 HydrophobicContact CG-CZ 4.33Å; M127-F129 PolarHBondContact O-N 3.41Å; M127-F129 HydrophobicContact SD-CE2 4.39Å; M127-V173 HydrophobicContact CE-CB 3.99Å; M127-V173 HydrophobicContact CE-CG1 4.11Å; M127-V173 HydrophobicContact CE-CG2 3.25Å; M127-V173 HydrophobicContact SD-CB 4.3Å; M127-V173 HydrophobicContact SD-CG2 3.18Å; M127-V173 WeakPolarHBondContact SD-CG2 3.38Å
128	G	32.9	Very low	33.5	Very low	28 Å²	28	71.2 Å²	71.2	29%	0.289	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	83.8	152	0	0	0	0	0	104.5	R126 L130 V173	R126-G128 PolarHBondContact O-N 3.16Å; G128-L130 VanDerWaalsContact C-N 3.3Å; G128-L130 PolarHBondContact O-N 3.24Å; G128-V173 PolarHBondContact O-N 2.97Å
129	F	32.9	Very low	31.5	Very low	44 Å²	44	79.1 Å²	79.1	19%	0.193	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	108	163.2	-88.4	-86.4	0	0	0	105.4	V108 L111 V112 M127 A131 V173 F175	V108-F129 HydrophobicContact CB-CD1 4.34Å; V108-F129 HydrophobicContact CB-CE1 3.86Å; V108-F129 HydrophobicContact CB-CZ 4.21Å; V108-F129 HydrophobicContact CG1-CD1 3.84Å; V108-F129 HydrophobicContact CG1-CD2 4.22Å; V108-F129 HydrophobicContact CG1-CE1 3.58Å; V108-F129 HydrophobicContact CG1-CE2 3.97Å; V108-F129 HydrophobicContact CG1-CG 4.18Å; V108-F129 HydrophobicContact CG1-CZ 3.64Å; V108-F129 HydrophobicContact CG2-CD1 3.85Å; V108-F129 HydrophobicContact CG2-CE1 3.65Å; V108-F129 HydrophobicContact CG2-CZ 4.48Å; L111-F129 HydrophobicContact CB-CZ 4.46Å; V112-F129 HydrophobicContact CG2-CD2 4.35Å; V112-F129 HydrophobicContact CG2-CE2 3.27Å; V112-F129 HydrophobicContact CG2-CZ 3.69Å; M127-F129 HydrophobicContact CB-CD2 3.36Å; M127-F129 HydrophobicContact CB-CE2 3.36Å; M127-F129 HydrophobicContact CB-CG 4.37Å; M127-F129 HydrophobicContact CB-CZ 4.39Å; M127-F129 HydrophobicContact CE-CE1 4.18Å; M127-F129 HydrophobicContact CE-CE2 3.63Å; M127-F129 HydrophobicContact CE-CZ 3.38Å; M127-F129 HydrophobicContact CG-CD2 4.12Å; M127-F129 HydrophobicContact CG-CE2 3.57Å; M127-F129 HydrophobicContact CG-CZ 4.33Å; M127-F129 PolarHBondContact O-N 3.41Å; M127-F129 HydrophobicContact SD-CE2 4.39Å; F129-A131 HydrophobicContact CB-CB 4.39Å; F129-A131 HydrophobicContact CD1-CB 4.1Å; F129-A131 PolarHBondContact O-N 3.39Å; F129-V173 HydrophobicContact CE1-CG1 4.31Å; F129-F175 AromaticContact CD1-CE2 3.64Å; F129-F175 HydrophobicContact CD1-CE2 3.64Å; F129-F175 HydrophobicContact CD1-CZ 4.26Å; F129-F175 AromaticContact CE1-CE2 3.66Å; F129-F175 HydrophobicContact CE1-CE2 3.66Å; F129-F175 AromaticContact CE1-CZ 3.83Å; F129-F175 HydrophobicContact CE1-CZ 3.83Å
130	L	30.9	Very low	29.6	Very low	60 Å²	60	82.6 Å²	82.6	31%	0.314	42%	0.421	S	S	.	.			trans	-82.9	22.9	161.1	-65.4	171.3	0	0	0	110	G128 L156 I172 V173 V174 V214	G128-L130 VanDerWaalsContact C-N 3.3Å; G128-L130 PolarHBondContact O-N 3.24Å; L130-L156 HydrophobicContact CD1-CD1 3.71Å; L130-L156 HydrophobicContact CD1-CD2 4.23Å; L130-L156 HydrophobicContact CD2-CD1 3.23Å; L130-L156 HydrophobicContact CD2-CG 4.5Å; L130-L156 HydrophobicContact CG-CD1 4.11Å; L130-I172 HydrophobicContact CD1-CG2 3.7Å; L130-V173 PolarHBondContact N-O 2.98Å; L130-V173 VanDerWaalsContact N-O 3.12Å; L130-V174 HydrophobicContact CD1-CG2 4.11Å; L130-V214 HydrophobicContact CD1-CG2 4.1Å
131	A	26.9	Very low	28.3	Very low	20 Å²	20	86 Å²	86	17%	0.165	43%	0.43	C	S	.	.	S	Bend	trans	-87.2	124.7	156.2	0	0	0	0	0	108.1	V108 F129 G133 F175	V108-A131 HydrophobicContact CG2-CB 4.47Å; F129-A131 HydrophobicContact CB-CB 4.39Å; F129-A131 HydrophobicContact CD1-CB 4.1Å; F129-A131 PolarHBondContact O-N 3.39Å; A131-G133 PolarHBondContact O-N 3.41Å; A131-F175 HydrophobicContact CB-CD2 3.7Å; A131-F175 HydrophobicContact CB-CE2 3.89Å
132	K	27	Very low	27.3	Very low	140 Å²	140	89.5 Å²	89.5	61%	0.609	45%	0.447	S	S	*	.	S	Bend	trans	18.2	103.4	158.8	-70.2	175.6	178.6	168.7	0	115.6
133	G	25.4	Very low	26.8	Very low	35 Å²	35	90.3 Å²	90.3	36%	0.361	46%	0.457	S	S	.	.			trans	104	85.2	162.4	0	0	0	0	0	113.2	A131 F135	A131-G133 PolarHBondContact O-N 3.41Å; G133-F135 PolarHBondContact O-N 3.44Å
134	C	23.8	Very low	26.5	Very low	44 Å²	44	91.7 Å²	91.7	30%	0.297	47%	0.468	S	S	.	.			trans	-59.7	107	157.5	-154.3	0	0	0	0	106.8	D136 L140 Q159 K163	C134-D136 PolarHBondContact O-N 2.94Å; C134-L140 HydrophobicContact CB-CD1 3.62Å; C134-Q159 PolarHBondContact SG-OE1 3.45Å; C134-Q159 VanDerWaalsContact SG-OE1 3.34Å; C134-K163 PolarHBondContact SG-NZ 3.3Å; C134-K163 VanDerWaalsContact SG-NZ 3.44Å
135	F	22.6	Very low	26.3	Very low	161 Å²	161	89.6 Å²	89.6	71%	0.706	47%	0.471	S	S	*	.			trans	-68.2	77.9	165.1	-83.3	-89.9	0	0	0	108.5	Y65 G133	Y65-F135 VanDerWaalsContact OH-CB 3.23Å; Y65-F135 WeakPolarHBondContact OH-CB 3.44Å; G133-F135 PolarHBondContact O-N 3.44Å
136	D	21.9	Very low	26.2	Very low	103 Å²	103	98.3 Å²	98.3	55%	0.551	51%	0.508	S	S	*	.	S	Bend	trans	-129	132.7	143.9	-155.6	-13.7	0	0	0	106.2	C134 N138	C134-D136 PolarHBondContact O-N 2.94Å; D136-N138 PolarHBondContact O-N 2.87Å
137	R	22.6	Very low	25.8	Very low	116 Å²	116	102.8 Å²	102.8	44%	0.438	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	13.1	-143.5	-141.9	-175.4	-57.8	-116.9	7.6	115.7	F29 L30	F29-R137 VanDerWaalsContact CD1-NH2 3.3Å; L30-R137 VanDerWaalsContact CG-NH1 3.27Å
138	N	22.1	Very low	26	Very low	161 Å²	161	103.8 Å²	103.8	86%	0.861	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.5	12.4	-173.6	-86.8	-23.9	0	0	0	117.7	D136	D136-N138 PolarHBondContact O-N 2.87Å
139	Q	24	Very low	26.2	Very low	175 Å²	175	108.3 Å²	108.3	82%	0.818	56%	0.555	S	S	*	*	S	Bend	trans	-137.9	-4.3	-178.2	-95.2	-172.9	-3	0	0	121.4
140	L	23.2	Very low	26.2	Very low	86 Å²	86	117.2 Å²	117.2	45%	0.45	59%	0.587	S	S	.	*			trans	-136.6	37.2	-177.4	-82.2	164.2	0	0	0	115.3	C134	C134-L140 HydrophobicContact CB-CD1 3.62Å
141	V	22.6	Very low	26.7	Very low	130 Å²	130	124.1 Å²	124.1	79%	0.788	61%	0.61	S	S	*	*	S	Bend	trans	-84.7	122.5	157.7	173	0	0	0	0	107.3
142	K	21.9	Very low	28.2	Very low	196 Å²	196	124.9 Å²	124.9	85%	0.852	62%	0.621	S	S	*	*			trans	73	99.4	175.6	-60.9	170.9	-178.6	-177.9	0	116.3
143	A	25.6	Very low	29.9	Very low	60 Å²	60	121 Å²	121	50%	0.496	61%	0.607	S	S	.	*			trans	-149.9	51.3	149.8	0	0	0	0	0	110.4	G145 S148	A143-G145 VanDerWaalsContact C-N 3.27Å; A143-G145 PolarHBondContact O-N 3.26Å; A143-S148 VanDerWaalsContact O-CB 3.31Å; A143-S148 WeakPolarHBondContact O-CB 3.39Å; A143-S148 PolarHBondContact O-OG 2.86Å
144	Q	25.5	Very low	31.7	Very low	167 Å²	167	122.2 Å²	122.2	78%	0.78	62%	0.618	S	S	*	*			trans	-70.1	90.1	159.9	-82.9	-168.7	-23.4	0	0	107.6
145	G	24.4	Very low	34.2	Very low	42 Å²	42	123 Å²	123	43%	0.433	62%	0.62	S	S	.	*	S	Bend	trans	175.8	148.5	177.7	0	0	0	0	0	111.7	A143 E147 S148	A143-G145 VanDerWaalsContact C-N 3.27Å; A143-G145 PolarHBondContact O-N 3.26Å; G145-E147 PolarHBondContact O-N 2.89Å; G145-S148 WeakPolarHBondContact O-CB 3.42Å; G145-S148 PolarHBondContact O-N 3.2Å; G145-S148 PolarHBondContact O-OG 3.49Å
146	K	29.1	Very low	36.8	Very low	199 Å²	199	116 Å²	116	87%	0.865	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-23.5	176.4	-76	179.6	173.7	178.3	0	112.8	Q149	K146-Q149 WeakPolarHBondContact O-CB 3.4Å; K146-Q149 PolarHBondContact O-N 2.81Å
147	E	25.4	Very low	39.3	Very low	165 Å²	165	117.4 Å²	117.4	77%	0.771	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-23.5	176.5	-73.7	-167.2	135.1	0	0	115	G145 Q149 R150	G145-E147 PolarHBondContact O-N 2.89Å; E147-Q149 PolarHBondContact O-N 3.02Å; E147-R150 PolarHBondContact O-N 3.03Å
148	S	34.5	Very low	41.8	Very low	47 Å²	47	113.6 Å²	113.6	33%	0.329	58%	0.581	S	S	.	*	H	α-helix	trans	-65.1	-20.2	174.5	67.3	0	0	0	0	113.7	A143 G145 R150 G152	A143-S148 VanDerWaalsContact O-CB 3.31Å; A143-S148 WeakPolarHBondContact O-CB 3.39Å; A143-S148 PolarHBondContact O-OG 2.86Å; G145-S148 WeakPolarHBondContact O-CB 3.42Å; G145-S148 PolarHBondContact O-N 3.2Å; G145-S148 PolarHBondContact O-OG 3.49Å; S148-R150 PolarHBondContact O-N 3.35Å; S148-G152 PolarHBondContact O-N 2.84Å; S148-G152 VanDerWaalsContact O-N 3.13Å
149	Q	38.4	Very low	44.2	Very low	123 Å²	123	107.6 Å²	107.6	58%	0.575	55%	0.547	S	S	*	.	H	α-helix	trans	-68.8	-22.3	179.1	-149.5	171.1	6.1	0	0	111.7	K146 E147	K146-Q149 WeakPolarHBondContact O-CB 3.4Å; K146-Q149 PolarHBondContact O-N 2.81Å; E147-Q149 PolarHBondContact O-N 3.02Å
150	R	33.3	Very low	46.6	Very low	231 Å²	231	99.7 Å²	99.7	87%	0.872	51%	0.511	S	S	*	.	H	α-helix	trans	-85.5	-37.9	178.1	-72.1	-174.2	172.6	179.9	-2.8	113.6	E147 S148	E147-R150 PolarHBondContact O-N 3.03Å; S148-R150 PolarHBondContact O-N 3.35Å
151	Y	40.9	Very low	49.1	Very low	205 Å²	205	98.4 Å²	98.4	80%	0.804	50%	0.503	S	S	*	.	H	α-helix	trans	-85.9	-19.5	179.7	-73.4	-82	0	0	0	114.1
152	G	58.1	Low	51.3	Low	37 Å²	37	100 Å²	100	38%	0.381	50%	0.495	S	S	.	.	H	α-helix	trans	-82.8	-30.4	-168.8	0	0	0	0	0	117.5	S148 L156	S148-G152 PolarHBondContact O-N 2.84Å; S148-G152 VanDerWaalsContact O-N 3.13Å; G152-L156 WeakPolarHBondContact O-CB 3.18Å; G152-L156 PolarHBondContact O-N 2.99Å
153	L	63.7	Low	53.4	Low	59 Å²	59	93.5 Å²	93.5	31%	0.309	47%	0.467	S	S	.	.	H	α-helix	trans	-85.3	-40.6	-170	-66.2	-178.6	0	0	0	113.8	D155 L156 R157 G209 V213	L153-D155 VanDerWaalsContact C-N 3.34Å; L153-L156 WeakPolarHBondContact O-CB 3.12Å; L153-L156 PolarHBondContact O-N 3.43Å; L153-R157 PolarHBondContact O-N 3.34Å; L153-G209 WeakPolarHBondContact CD2-O 3.35Å; L153-V213 HydrophobicContact CB-CG2 3.91Å; L153-V213 HydrophobicContact CD2-CG2 3.88Å; L153-V213 HydrophobicContact CG-CG2 4.31Å
154	G	62.5	Low	55.4	Low	59 Å²	59	91 Å²	91	61%	0.608	45%	0.445	S	S	*	.	H	α-helix	trans	-63.7	-41.8	175.3	0	0	0	0	0	111.9	L156 R157 A158	G154-L156 VanDerWaalsContact C-N 3.34Å; G154-R157 PolarHBondContact O-N 3.36Å; G154-A158 PolarHBondContact O-N 3.47Å
155	D	75.7	Confident	57.4	Low	62 Å²	62	84.1 Å²	84.1	33%	0.332	41%	0.412	S	S	.	.	H	α-helix	trans	-66.8	-35.5	175.1	-173.2	36.3	0	0	0	111.8	L153 R157 A158 Q159	L153-D155 VanDerWaalsContact C-N 3.34Å; D155-R157 PolarHBondContact O-N 3.48Å; D155-A158 PolarHBondContact O-N 3.13Å; D155-Q159 WeakPolarHBondContact O-CB 2.92Å; D155-Q159 VanDerWaalsContact O-CG 3.28Å; D155-Q159 WeakPolarHBondContact O-CG 3.3Å; D155-Q159 PolarHBondContact O-N 3.33Å; D155-Q159 PolarHBondContact OD2-NE2 3.39Å
156	L	77	Confident	59.3	Low	14 Å²	14	85.5 Å²	85.5	7%	0.073	41%	0.413	C	S	.	.	H	α-helix	trans	-57	-48.3	175.3	175.6	55.3	0	0	0	112.3	L130 G152 L153 G154 A158 Q159 L160 A210 V213	L130-L156 HydrophobicContact CD1-CD1 3.71Å; L130-L156 HydrophobicContact CD1-CD2 4.23Å; L130-L156 HydrophobicContact CD2-CD1 3.23Å; L130-L156 HydrophobicContact CD2-CG 4.5Å; L130-L156 HydrophobicContact CG-CD1 4.11Å; G152-L156 WeakPolarHBondContact O-CB 3.18Å; G152-L156 PolarHBondContact O-N 2.99Å; L153-L156 WeakPolarHBondContact O-CB 3.12Å; L153-L156 PolarHBondContact O-N 3.43Å; G154-L156 VanDerWaalsContact C-N 3.34Å; L156-A158 VanDerWaalsContact C-N 3.34Å; L156-A158 PolarHBondContact O-N 3.08Å; L156-Q159 PolarHBondContact O-N 3.3Å; L156-Q159 VanDerWaalsContact O-N 3.16Å; L156-L160 HydrophobicContact CD1-CD1 4.18Å; L156-L160 HydrophobicContact CD1-CG 4.06Å; L156-L160 HydrophobicContact CG-CD1 4.2Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.01Å; L156-A210 HydrophobicContact CD2-CB 4.4Å; L156-V213 HydrophobicContact CB-CG1 4.12Å; L156-V213 HydrophobicContact CD2-CB 3.97Å; L156-V213 HydrophobicContact CD2-CG1 3.93Å; L156-V213 HydrophobicContact CG-CB 4.37Å; L156-V213 HydrophobicContact CG-CG1 3.75Å
157	R	75	Confident	61	Low	131 Å²	131	80.4 Å²	80.4	49%	0.494	39%	0.388	S	S	.	.	H	α-helix	trans	-56.8	-48.3	177	-179	170.7	-175.3	144.1	1	111.5	L153 G154 D155 Q159 L160 M161 V213 T217	L153-R157 PolarHBondContact O-N 3.34Å; G154-R157 PolarHBondContact O-N 3.36Å; D155-R157 PolarHBondContact O-N 3.48Å; R157-Q159 VanDerWaalsContact C-N 3.31Å; R157-Q159 PolarHBondContact O-N 2.98Å; R157-L160 PolarHBondContact O-N 2.85Å; R157-M161 WeakPolarHBondContact O-CG 3.3Å; R157-M161 PolarHBondContact O-N 3.31Å; R157-M161 VanDerWaalsContact O-N 3.08Å; R157-V213 HydrophobicContact CB-CG1 3.92Å; R157-T217 HydrophobicContact CG-CG2 4.18Å
158	A	74.6	Confident	63	Low	37 Å²	37	80.8 Å²	80.8	31%	0.306	38%	0.383	S	S	.	.	H	α-helix	trans	-62.7	-38.3	178.3	0	0	0	0	0	112.1	G154 D155 L156 R162	G154-A158 PolarHBondContact O-N 3.47Å; D155-A158 PolarHBondContact O-N 3.13Å; L156-A158 VanDerWaalsContact C-N 3.34Å; L156-A158 PolarHBondContact O-N 3.08Å; A158-R162 WeakPolarHBondContact O-CB 3.36Å; A158-R162 PolarHBondContact O-N 3.34Å
159	Q	72.7	Confident	64.7	Low	34 Å²	34	80 Å²	80	16%	0.159	37%	0.372	C	S	.	.	H	α-helix	trans	-67.8	-39	176.4	-72.6	-168.1	49.1	0	0	112.6	C134 D155 L156 R157 K163	C134-Q159 PolarHBondContact SG-OE1 3.45Å; C134-Q159 VanDerWaalsContact SG-OE1 3.34Å; D155-Q159 WeakPolarHBondContact O-CB 2.92Å; D155-Q159 VanDerWaalsContact O-CG 3.28Å; D155-Q159 WeakPolarHBondContact O-CG 3.3Å; D155-Q159 PolarHBondContact O-N 3.33Å; D155-Q159 PolarHBondContact OD2-NE2 3.39Å; L156-Q159 PolarHBondContact O-N 3.3Å; L156-Q159 VanDerWaalsContact O-N 3.16Å; R157-Q159 VanDerWaalsContact C-N 3.31Å; R157-Q159 PolarHBondContact O-N 2.98Å; Q159-K163 WeakPolarHBondContact O-CA 3.19Å; Q159-K163 WeakPolarHBondContact O-CB 3.21Å; Q159-K163 PolarHBondContact O-N 2.85Å
160	L	75	Confident	66.6	Low	9 Å²	9	75.6 Å²	75.6	5%	0.047	35%	0.35	C	S	.	.	I	π-helix	trans	-61.1	-51.4	174.3	-69.7	170.1	0	0	0	110.3	L156 R157 R162 F164 W165 I172 V213 V214 T217	L156-L160 HydrophobicContact CD1-CD1 4.18Å; L156-L160 HydrophobicContact CD1-CG 4.06Å; L156-L160 HydrophobicContact CG-CD1 4.2Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.01Å; R157-L160 PolarHBondContact O-N 2.85Å; L160-R162 PolarHBondContact O-N 3.22Å; L160-F164 HydrophobicContact CD2-CB 4.1Å; L160-F164 HydrophobicContact CD2-CG 4.34Å; L160-F164 WeakPolarHBondContact O-CA 3.18Å; L160-F164 WeakPolarHBondContact O-CB 3.11Å; L160-F164 PolarHBondContact O-N 3.41Å; L160-W165 PolarHBondContact O-N 3.45Å; L160-I172 HydrophobicContact CD2-CD1 3.88Å; L160-V213 HydrophobicContact CD1-CG1 4.39Å; L160-V214 HydrophobicContact CD1-CG2 4.07Å; L160-T217 HydrophobicContact CB-CG2 4.07Å; L160-T217 HydrophobicContact CD1-CG2 4.29Å
161	M	74.6	Confident	69	Low	59 Å²	59	64.8 Å²	64.8	29%	0.291	31%	0.31	S	S	.	.	I	π-helix	trans	-63.5	-39.6	179.6	-65.6	-54.9	-69.2	0	0	113.3	R157 P166 T217 I228	R157-M161 WeakPolarHBondContact O-CG 3.3Å; R157-M161 PolarHBondContact O-N 3.31Å; R157-M161 VanDerWaalsContact O-N 3.08Å; M161-P166 WeakPolarHBondContact O-CD 3.18Å; M161-P166 VanDerWaalsContact O-CG 3.29Å; M161-P166 WeakPolarHBondContact O-CG 3.39Å; M161-T217 HydrophobicContact CG-CG2 3.94Å; M161-T217 HydrophobicContact SD-CG2 3.67Å; M161-I228 HydrophobicContact CE-CD1 4.23Å
162	R	68.9	Low	71.1	Confident	164 Å²	164	55.2 Å²	55.2	62%	0.619	27%	0.272	S	S	*	.	I	π-helix	trans	-82.8	-32.9	-176.7	-165.4	-173.9	-49	163.8	8.9	113.2	A158 L160	A158-R162 WeakPolarHBondContact O-CB 3.36Å; A158-R162 PolarHBondContact O-N 3.34Å; L160-R162 PolarHBondContact O-N 3.22Å
163	K	67.1	Low	72.3	Confident	59 Å²	59	53.4 Å²	53.4	26%	0.257	25%	0.254	S	S	.	.	I	π-helix	trans	-112.1	-43.7	-170.6	-56.7	179.3	-179.8	169.3	0	113.4	C134 Q159 R167 R169	C134-K163 PolarHBondContact SG-NZ 3.3Å; C134-K163 VanDerWaalsContact SG-NZ 3.44Å; Q159-K163 WeakPolarHBondContact O-CA 3.19Å; Q159-K163 WeakPolarHBondContact O-CB 3.21Å; Q159-K163 PolarHBondContact O-N 2.85Å; K163-R167 VanDerWaalsContact CA-NH1 3.28Å; K163-R167 VanDerWaalsContact O-CB 3.31Å; K163-R167 WeakPolarHBondContact O-CB 3.18Å; K163-R167 WeakPolarHBondContact O-CG 3.43Å; K163-R169 PolarHBondContact O-NH1 3.35Å
164	F	66.9	Low	73.5	Confident	7 Å²	7	50.8 Å²	50.8	3%	0.031	24%	0.24	C	C	.	.	I	π-helix	trans	-72.1	-61.9	-171.1	-175.9	-98.5	0	0	0	111.4	L160 R167 R168 R169 I172	L160-F164 HydrophobicContact CD2-CB 4.1Å; L160-F164 HydrophobicContact CD2-CG 4.34Å; L160-F164 WeakPolarHBondContact O-CA 3.18Å; L160-F164 WeakPolarHBondContact O-CB 3.11Å; L160-F164 PolarHBondContact O-N 3.41Å; F164-R167 PolarHBondContact O-N 2.84Å; F164-R168 PolarHBondContact O-N 2.86Å; F164-R169 HydrophobicContact CD2-CB 3.35Å; F164-R169 HydrophobicContact CD2-CG 4.14Å; F164-R169 HydrophobicContact CE2-CB 3.31Å; F164-R169 HydrophobicContact CE2-CG 4.44Å; F164-R169 HydrophobicContact CG-CB 4Å; F164-R169 HydrophobicContact CZ-CB 3.97Å; F164-R169 VanDerWaalsContact CZ-O 3.24Å; F164-R169 WeakPolarHBondContact CZ-O 3.34Å; F164-R169 PolarHBondContact O-N 2.99Å; F164-I172 HydrophobicContact CD1-CD1 4.22Å; F164-I172 HydrophobicContact CD1-CG1 4.5Å; F164-I172 HydrophobicContact CD2-CD1 4.23Å; F164-I172 HydrophobicContact CD2-CG1 3.72Å; F164-I172 HydrophobicContact CE1-CD1 3.91Å; F164-I172 HydrophobicContact CE1-CG1 4.06Å; F164-I172 HydrophobicContact CE2-CB 4.45Å; F164-I172 HydrophobicContact CE2-CD1 3.95Å; F164-I172 HydrophobicContact CE2-CG1 3.2Å; F164-I172 HydrophobicContact CG-CD1 4.39Å; F164-I172 HydrophobicContact CG-CG1 4.37Å; F164-I172 HydrophobicContact CZ-CD1 3.78Å; F164-I172 HydrophobicContact CZ-CG1 3.4Å; F164-I172 VanDerWaalsContact CZ-CG1 3.4Å
165	W	68.6	Low	74.8	Confident	24 Å²	24	48.7 Å²	48.7	9%	0.091	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-65.8	-49.1	-175.8	-58.2	124.3	0	0	0	114.8	L160 R167 R168 C218 I228 V233 R234	L160-W165 PolarHBondContact O-N 3.45Å; W165-R167 PolarHBondContact O-N 2.98Å; W165-R168 PolarHBondContact O-N 3.02Å; W165-C218 HydrophobicContact CH2-CB 4.28Å; W165-C218 HydrophobicContact CZ2-CB 3.55Å; W165-I228 HydrophobicContact CB-CD1 3.6Å; W165-I228 HydrophobicContact CG-CD1 4.25Å; W165-V233 HydrophobicContact CB-CG1 4.04Å; W165-V233 HydrophobicContact CD2-CG1 3.31Å; W165-V233 HydrophobicContact CE3-CG1 3.12Å; W165-V233 HydrophobicContact CG-CG1 3.77Å; W165-V233 HydrophobicContact CH2-CG1 4.17Å; W165-V233 HydrophobicContact CZ2-CG1 4.32Å; W165-V233 HydrophobicContact CZ3-CG1 3.61Å; W165-R234 WeakPolarHBondContact CH2-O 3.34Å; W165-R234 WeakPolarHBondContact CZ3-O 3.46Å
166	P	64.3	Low	75.4	Confident	70 Å²	70	45.9 Å²	45.9	46%	0.455	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-65.5	-15.6	-177.8	-21.9	35.4	0	0	0	113.1	M161 I228	M161-P166 WeakPolarHBondContact O-CD 3.18Å; M161-P166 VanDerWaalsContact O-CG 3.29Å; M161-P166 WeakPolarHBondContact O-CG 3.39Å; P166-I228 HydrophobicContact CG-CG2 4.44Å
167	R	63.8	Low	75.9	Confident	93 Å²	93	45.3 Å²	45.3	35%	0.351	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-102.4	13.3	177.3	-64.5	-166	177.4	80.9	-4.5	113.1	K163 F164 W165 R169	K163-R167 VanDerWaalsContact CA-NH1 3.28Å; K163-R167 VanDerWaalsContact O-CB 3.31Å; K163-R167 WeakPolarHBondContact O-CB 3.18Å; K163-R167 WeakPolarHBondContact O-CG 3.43Å; F164-R167 PolarHBondContact O-N 2.84Å; W165-R167 PolarHBondContact O-N 2.98Å; R167-R169 HydrophobicContact CB-CG 4.42Å; R167-R169 PolarHBondContact O-N 2.91Å; R167-R169 VanDerWaalsContact O-N 3.1Å
168	R	68.3	Low	76.2	Confident	173 Å²	173	40.5 Å²	40.5	65%	0.653	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	40.8	179	-61	-177.9	175	172.1	-1.5	112.3	F164 W165 E231	F164-R168 PolarHBondContact O-N 2.86Å; W165-R168 PolarHBondContact O-N 3.02Å; R168-E231 IonicContact CZ-OE2 3.97Å; R168-E231 IonicContact NE-OE2 3.3Å; R168-E231 IonicContact NH2-OE1 3.59Å; R168-E231 PolarHBondContact NH2-OE1 3.35Å; R168-E231 IonicContact NH2-OE2 2.93Å; R168-E231 PolarHBondContact NH2-OE2 3.32Å
169	R	69.3	Low	76.6	Confident	30 Å²	30	38.9 Å²	38.9	11%	0.113	18%	0.175	C	C	.	.			trans	-70.9	144	174.1	-72.1	-169.5	168.7	81.7	-3.8	108.9	R126 K163 F164 R167	R126-R169 HydrophobicContact CB-CG 4.06Å; R126-R169 WeakPolarHBondContact O-CD 3.31Å; R126-R169 PolarHBondContact O-NE 2.84Å; K163-R169 PolarHBondContact O-NH1 3.35Å; F164-R169 HydrophobicContact CD2-CB 3.35Å; F164-R169 HydrophobicContact CD2-CG 4.14Å; F164-R169 HydrophobicContact CE2-CB 3.31Å; F164-R169 HydrophobicContact CE2-CG 4.44Å; F164-R169 HydrophobicContact CG-CB 4Å; F164-R169 HydrophobicContact CZ-CB 3.97Å; F164-R169 VanDerWaalsContact CZ-O 3.24Å; F164-R169 WeakPolarHBondContact CZ-O 3.34Å; F164-R169 PolarHBondContact O-N 2.99Å; R167-R169 HydrophobicContact CB-CG 4.42Å; R167-R169 PolarHBondContact O-N 2.91Å; R167-R169 VanDerWaalsContact O-N 3.1Å
170	R	77.8	Confident	77.1	Confident	30 Å²	30	38.9 Å²	38.9	11%	0.113	17%	0.174	C	C	.	.			trans	-103.6	-38.8	-178.3	-62.4	-164.3	-76.2	-158.5	16.4	111.7	F92 E93 P95 C96 K124	F92-R170 WeakPolarHBondContact O-CD 3.34Å; F92-R170 PolarHBondContact O-NE 3.45Å; F92-R170 PolarHBondContact O-NH2 2.93Å; E93-R170 VanDerWaalsContact CA-CZ 3.49Å; E93-R170 WeakPolarHBondContact O-CD 3.31Å; E93-R170 IonicContact OE1-NH1 2.86Å; E93-R170 PolarHBondContact OE1-NH1 3.3Å; E93-R170 IonicContact OE1-NH2 3.71Å; P95-R170 CarbonylContact C-O 3.18Å; P95-R170 WeakPolarHBondContact CA-O 3.47Å; C96-R170 PolarHBondContact N-O 2.82Å; K124-R170 VanDerWaalsContact NZ-NH1 3.17Å
171	W	84.5	Confident	77.7	Confident	5 Å²	5	39.5 Å²	39.5	2%	0.019	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.9	-170.1	-69.8	17.6	0	0	0	112.8	I88 Y91 F92 C96 V98 I115 V125 I240	I88-W171 HydrophobicContact CD1-CH2 4.31Å; Y91-W171 PolarHBondContact O-NE1 3.07Å; F92-W171 AromaticContact CD1-CE2 3.85Å; F92-W171 AromaticContact CD1-CH2 3.59Å; F92-W171 HydrophobicContact CD1-CH2 3.59Å; F92-W171 AromaticContact CD1-CZ2 3.33Å; F92-W171 HydrophobicContact CD1-CZ2 3.33Å; F92-W171 HydrophobicContact CD1-CZ3 4.27Å; F92-W171 HydrophobicContact CE1-CE3 4.42Å; F92-W171 AromaticContact CE1-CH2 3.16Å; F92-W171 HydrophobicContact CE1-CH2 3.16Å; F92-W171 AromaticContact CE1-CZ2 3.48Å; F92-W171 HydrophobicContact CE1-CZ2 3.48Å; F92-W171 VanDerWaalsContact CE1-CZ2 3.48Å; F92-W171 AromaticContact CE1-CZ3 3.7Å; F92-W171 HydrophobicContact CE1-CZ3 3.7Å; F92-W171 HydrophobicContact CG-CH2 4.48Å; F92-W171 HydrophobicContact CG-CZ2 4.02Å; F92-W171 AromaticContact CZ-CH2 3.78Å; F92-W171 HydrophobicContact CZ-CH2 3.78Å; F92-W171 HydrophobicContact CZ-CZ2 4.26Å; F92-W171 HydrophobicContact CZ-CZ3 4.5Å; C96-W171 HydrophobicContact CB-CG 4.4Å; C96-W171 WeakPolarHBondContact O-CA 3.31Å; V98-W171 HydrophobicContact CG2-CB 4.42Å; V98-W171 HydrophobicContact CG2-CD2 4.06Å; V98-W171 HydrophobicContact CG2-CE3 3.57Å; V98-W171 HydrophobicContact CG2-CG 4.46Å; V98-W171 HydrophobicContact CG2-CZ3 4.01Å; I115-W171 HydrophobicContact CD1-CE3 3.83Å; I115-W171 HydrophobicContact CD1-CZ3 3.62Å; I115-W171 HydrophobicContact CG1-CE3 4.24Å; I115-W171 HydrophobicContact CG1-CZ3 3.67Å; I115-W171 HydrophobicContact CG2-CE3 4.24Å; I115-W171 HydrophobicContact CG2-CZ3 4.23Å; V125-W171 HydrophobicContact CG1-CB 4.27Å; V125-W171 HydrophobicContact CG1-CE3 4.44Å; W171-I240 HydrophobicContact CH2-CD1 3.6Å; W171-I240 HydrophobicContact CZ2-CD1 3.51Å; W171-I240 HydrophobicContact CZ3-CD1 4.2Å
172	I	84	Confident	78.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.8	171.1	-58.6	174.7	0	0	0	107.5	C96 L97 V98 L130 L160 F164 V174 V214	C96-I172 PolarHBondContact O-N 2.72Å; L97-I172 HydrophobicContact CD1-CB 4.28Å; L97-I172 HydrophobicContact CD1-CG2 4.21Å; V98-I172 PolarHBondContact N-O 3.42Å; L130-I172 HydrophobicContact CD1-CG2 3.7Å; L160-I172 HydrophobicContact CD2-CD1 3.88Å; F164-I172 HydrophobicContact CD1-CD1 4.22Å; F164-I172 HydrophobicContact CD1-CG1 4.5Å; F164-I172 HydrophobicContact CD2-CD1 4.23Å; F164-I172 HydrophobicContact CD2-CG1 3.72Å; F164-I172 HydrophobicContact CE1-CD1 3.91Å; F164-I172 HydrophobicContact CE1-CG1 4.06Å; F164-I172 HydrophobicContact CE2-CB 4.45Å; F164-I172 HydrophobicContact CE2-CD1 3.95Å; F164-I172 HydrophobicContact CE2-CG1 3.2Å; F164-I172 HydrophobicContact CG-CD1 4.39Å; F164-I172 HydrophobicContact CG-CG1 4.37Å; F164-I172 HydrophobicContact CZ-CD1 3.78Å; F164-I172 HydrophobicContact CZ-CG1 3.4Å; F164-I172 VanDerWaalsContact CZ-CG1 3.4Å; I172-V174 HydrophobicContact CG2-CG2 4.17Å; I172-V214 HydrophobicContact CD1-CG1 3.8Å; I172-V214 HydrophobicContact CG2-CG1 4.39Å; I172-V214 HydrophobicContact CG2-CG2 4.03Å
173	V	84.3	Confident	79	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.7	-177.6	-174.7	0	0	0	0	110.8	V98 V100 M127 G128 F129 L130 F175	V98-V173 HydrophobicContact CB-CB 4.36Å; V98-V173 HydrophobicContact CB-CG1 4.31Å; V98-V173 HydrophobicContact CB-CG2 3.75Å; V98-V173 HydrophobicContact CG1-CG1 4.5Å; V98-V173 HydrophobicContact CG1-CG2 4.46Å; V98-V173 HydrophobicContact CG2-CG2 3.95Å; V98-V173 WeakPolarHBondContact O-CA 3.24Å; V100-V173 HydrophobicContact CG2-CG1 3.86Å; M127-V173 HydrophobicContact CE-CB 3.99Å; M127-V173 HydrophobicContact CE-CG1 4.11Å; M127-V173 HydrophobicContact CE-CG2 3.25Å; M127-V173 HydrophobicContact SD-CB 4.3Å; M127-V173 HydrophobicContact SD-CG2 3.18Å; M127-V173 WeakPolarHBondContact SD-CG2 3.38Å; G128-V173 PolarHBondContact O-N 2.97Å; F129-V173 HydrophobicContact CE1-CG1 4.31Å; L130-V173 PolarHBondContact N-O 2.98Å; L130-V173 VanDerWaalsContact N-O 3.12Å; V173-F175 HydrophobicContact CG1-CE2 3.81Å; V173-F175 HydrophobicContact CG1-CZ 4.28Å
174	V	87.8	Confident	80	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.018	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	140.3	-175.9	-177.2	0	0	0	0	109.2	L97 V98 V100 L130 I172 P176 A210 M211	L97-V174 HydrophobicContact CD1-CB 4.37Å; L97-V174 HydrophobicContact CD1-CG2 3.69Å; V98-V174 PolarHBondContact O-N 3.08Å; V100-V174 PolarHBondContact N-O 3.44Å; L130-V174 HydrophobicContact CD1-CG2 4.11Å; I172-V174 HydrophobicContact CG2-CG2 4.17Å; V174-P176 HydrophobicContact CG1-CG 4.25Å; V174-P176 WeakPolarHBondContact O-CD 3.16Å; V174-A210 HydrophobicContact CG1-CB 4.03Å; V174-M211 HydrophobicContact CG1-CG 4.12Å
175	F	89.7	Confident	81.2	Confident	16 Å²	16	44 Å²	44	7%	0.07	20%	0.2	C	C	.	.			trans	-113.9	89.7	172.8	-67.7	-95.4	0	0	0	108.5	V100 H102 D107 V108 L111 F129 A131 V173 E177 G178	V100-F175 HydrophobicContact CB-CD1 3.92Å; V100-F175 HydrophobicContact CB-CE1 3.71Å; V100-F175 HydrophobicContact CB-CZ 4.25Å; V100-F175 HydrophobicContact CG1-CD1 4.41Å; V100-F175 HydrophobicContact CG1-CE1 3.89Å; V100-F175 HydrophobicContact CG2-CE1 4.31Å; V100-F175 HydrophobicContact CG2-CZ 4.37Å; H102-F175 HydrophobicContact CB-CD1 3.84Å; H102-F175 AromaticContact CG-CD1 3.8Å; H102-F175 AromaticContact ND1-CD1 3.87Å; H102-F175 AromaticContact ND1-CE1 3.98Å; D107-F175 HydrophobicContact CB-CE1 4.34Å; V108-F175 HydrophobicContact CG2-CE2 4.47Å; V108-F175 HydrophobicContact CG2-CZ 4.16Å; L111-F175 HydrophobicContact CD1-CE1 4.39Å; L111-F175 HydrophobicContact CD1-CZ 3.93Å; F129-F175 AromaticContact CD1-CE2 3.64Å; F129-F175 HydrophobicContact CD1-CE2 3.64Å; F129-F175 HydrophobicContact CD1-CZ 4.26Å; F129-F175 AromaticContact CE1-CE2 3.66Å; F129-F175 HydrophobicContact CE1-CE2 3.66Å; F129-F175 AromaticContact CE1-CZ 3.83Å; F129-F175 HydrophobicContact CE1-CZ 3.83Å; A131-F175 HydrophobicContact CB-CD2 3.7Å; A131-F175 HydrophobicContact CB-CE2 3.89Å; V173-F175 HydrophobicContact CG1-CE2 3.81Å; V173-F175 HydrophobicContact CG1-CZ 4.28Å; F175-E177 PolarHBondContact O-N 2.98Å; F175-E177 VanDerWaalsContact O-N 3.11Å; F175-G178 PolarHBondContact O-N 3.44Å; F175-G178 VanDerWaalsContact O-N 3.1Å
176	P	90.3	Very high	82.3	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.019	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-24.3	-173.8	-28.1	39.2	0	0	0	113.8	V100 V174 G178 P206 R207 M211 W295	V100-P176 WeakPolarHBondContact O-CD 3.04Å; V174-P176 HydrophobicContact CG1-CG 4.25Å; V174-P176 WeakPolarHBondContact O-CD 3.16Å; P176-G178 PolarHBondContact O-N 2.76Å; P176-P206 HydrophobicContact CB-CB 3.59Å; P176-R207 VanDerWaalsContact O-CB 3.28Å; P176-R207 WeakPolarHBondContact O-CB 3.09Å; P176-R207 WeakPolarHBondContact O-CG 2.72Å; P176-R207 PolarHBondContact O-N 3.23Å; P176-M211 HydrophobicContact CG-SD 4.19Å; P176-W295 HydrophobicContact CB-CH2 4Å; P176-W295 HydrophobicContact CB-CZ2 3.88Å; P176-W295 HydrophobicContact CG-CH2 3.59Å; P176-W295 HydrophobicContact CG-CZ2 3.93Å
177	E	87.1	Confident	83.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.5	178	-58.6	-167.2	171.1	0	0	113.6	N101 H102 F175 G179 V204 W295	N101-E177 WeakPolarHBondContact CB-OE1 3.29Å; H102-E177 WeakPolarHBondContact CA-OE2 3.39Å; H102-E177 HydrophobicContact CB-CB 4.27Å; H102-E177 VanDerWaalsContact N-CD 3.29Å; H102-E177 PolarHBondContact N-OE2 3.36Å; H102-E177 VanDerWaalsContact O-OE2 3.09Å; F175-E177 PolarHBondContact O-N 2.98Å; F175-E177 VanDerWaalsContact O-N 3.11Å; E177-G179 PolarHBondContact O-N 3.28Å; E177-V204 HydrophobicContact CB-CB 3.89Å; E177-V204 HydrophobicContact CB-CG1 4.4Å; E177-V204 HydrophobicContact CB-CG2 4.38Å; E177-V204 HydrophobicContact CG-CB 3.85Å; E177-V204 HydrophobicContact CG-CG2 4.47Å; E177-V204 PolarHBondContact OE1-N 3.48Å; E177-W295 HydrophobicContact CG-CZ2 4.37Å
178	G	79.9	Confident	85.1	Confident	31 Å²	31	39.8 Å²	39.8	32%	0.32	20%	0.195	S	C	.	.			trans	68.9	11.9	177.5	0	0	0	0	0	115.1	F175 P176	F175-G178 PolarHBondContact O-N 3.44Å; F175-G178 VanDerWaalsContact O-N 3.1Å; P176-G178 PolarHBondContact O-N 2.76Å
179	G	82.8	Confident	86.4	Confident	3 Å²	3	33.7 Å²	33.7	3%	0.031	17%	0.174	C	C	.	.	S	Bend	trans	161.3	172	176.8	0	0	0	0	0	111.6	E177	E177-G179 PolarHBondContact O-N 3.28Å
180	F	85	Confident	87.7	Confident	33 Å²	33	40.6 Å²	40.6	15%	0.145	20%	0.2	C	C	.	.			trans	-59.7	140.2	-178	-50.5	-46.3	0	0	0	112.7	H102 S104 T105 R182 N183 R184	H102-F180 AromaticContact CD2-CD1 3.77Å; H102-F180 AromaticContact CE1-CD1 3.57Å; H102-F180 AromaticContact CE1-CE1 3.31Å; H102-F180 WeakPolarHBondContact CE1-CE1 3.16Å; H102-F180 AromaticContact ND1-CD1 3.95Å; H102-F180 AromaticContact NE2-CD1 3.42Å; H102-F180 WeakPolarHBondContact NE2-CD1 3.27Å; H102-F180 AromaticContact NE2-CE1 3.25Å; H102-F180 VanDerWaalsContact NE2-CE1 3.25Å; H102-F180 WeakPolarHBondContact NE2-CE1 3.19Å; H102-F180 WeakPolarHBondContact O-CA 3.26Å; S104-F180 WeakPolarHBondContact O-CE1 3.43Å; T105-F180 VanDerWaalsContact OG1-CZ 3.29Å; T105-F180 WeakPolarHBondContact OG1-CZ 3.37Å; F180-R182 HydrophobicContact CB-CG 4.41Å; F180-R182 PolarHBondContact O-N 3.36Å; F180-N183 PolarHBondContact O-N 3.01Å; F180-R184 PolarHBondContact O-N 3.39Å
181	L	86.7	Confident	88.5	Confident	23 Å²	23	44.9 Å²	44.9	12%	0.12	22%	0.217	C	C	.	.	H	α-helix	trans	-41.4	-58.3	175.1	179.6	67.1	0	0	0	112.6	H102 Q103 N183 R184 L185 Y202 V204	H102-L181 PolarHBondContact O-N 3.45Å; Q103-L181 VanDerWaalsContact OE1-CD2 3.24Å; L181-N183 PolarHBondContact O-N 2.98Å; L181-R184 PolarHBondContact O-N 3.15Å; L181-L185 HydrophobicContact CD1-CB 4.38Å; L181-L185 HydrophobicContact CD1-CD1 4.03Å; L181-L185 WeakPolarHBondContact O-CB 3.33Å; L181-L185 PolarHBondContact O-N 3.31Å; L181-Y202 WeakPolarHBondContact CD2-O 3.29Å; L181-V204 HydrophobicContact CB-CG2 4.4Å; L181-V204 HydrophobicContact CD1-CG2 3.57Å
182	R	85.3	Confident	89	Confident	171 Å²	171	44.7 Å²	44.7	65%	0.645	22%	0.217	S	C	*	.	H	α-helix	trans	-54.1	-32.2	-176.9	67.7	176.2	-177	170	-0.8	114.6	F180	F180-R182 HydrophobicContact CB-CG 4.41Å; F180-R182 PolarHBondContact O-N 3.36Å
183	N	85.8	Confident	89.6	Confident	98 Å²	98	51.9 Å²	51.9	52%	0.524	25%	0.248	S	C	.	.	H	α-helix	trans	-88.6	-18.2	-177.5	-69.5	-13.6	0	0	0	112.4	F180 L181	F180-N183 PolarHBondContact O-N 3.01Å; L181-N183 PolarHBondContact O-N 2.98Å
184	R	88.5	Confident	90.2	Very high	71 Å²	71	60.6 Å²	60.6	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-113	-25	-171.1	-66.7	-55.8	-169.9	-154.9	0.1	113.5	F180 L181 G186 S187 S188 V204	F180-R184 PolarHBondContact O-N 3.39Å; L181-R184 PolarHBondContact O-N 3.15Å; R184-G186 PolarHBondContact O-N 2.92Å; R184-S187 PolarHBondContact O-N 3.04Å; R184-S187 VanDerWaalsContact O-N 3.11Å; R184-S187 PolarHBondContact O-OG 3.33Å; R184-S188 WeakPolarHBondContact O-CB 3.4Å; R184-S188 PolarHBondContact O-N 3.47Å; R184-V204 HydrophobicContact CB-CG1 3.84Å; R184-V204 HydrophobicContact CB-CG2 3.89Å
185	L	91.5	Very high	90.5	Very high	42 Å²	42	64 Å²	64	22%	0.22	30%	0.304	C	S	.	.	H	α-helix	trans	-48	-60.2	-173.8	-175.7	61.2	0	0	0	112.4	L181 S187 S188 Q189 F200	L181-L185 HydrophobicContact CD1-CB 4.38Å; L181-L185 HydrophobicContact CD1-CD1 4.03Å; L181-L185 WeakPolarHBondContact O-CB 3.33Å; L181-L185 PolarHBondContact O-N 3.31Å; L185-S187 VanDerWaalsContact C-N 3.31Å; L185-S187 PolarHBondContact O-N 2.99Å; L185-S188 WeakPolarHBondContact O-CB 3.43Å; L185-S188 PolarHBondContact O-N 3.38Å; L185-S188 VanDerWaalsContact O-N 3.08Å; L185-Q189 HydrophobicContact CD1-CG 4.1Å; L185-Q189 HydrophobicContact CG-CG 4.48Å; L185-Q189 WeakPolarHBondContact O-CG 3.21Å; L185-Q189 PolarHBondContact O-N 3.46Å; L185-F200 WeakPolarHBondContact CD1-O 3.37Å
186	G	92.6	Very high	90.6	Very high	32 Å²	32	66.6 Å²	66.6	33%	0.33	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-35.5	-177.5	0	0	0	0	0	114.2	R184 R190	R184-G186 PolarHBondContact O-N 2.92Å; G186-R190 WeakPolarHBondContact O-CG 3.36Å; G186-R190 PolarHBondContact O-N 3.26Å; G186-R190 PolarHBondContact O-NH1 3.17Å
187	S	93.3	Very high	90.8	Very high	52 Å²	52	70.1 Å²	70.1	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-72.2	-36.9	175.7	66.9	0	0	0	0	112.8	R184 L185 Y191	R184-S187 PolarHBondContact O-N 3.04Å; R184-S187 VanDerWaalsContact O-N 3.11Å; R184-S187 PolarHBondContact O-OG 3.33Å; L185-S187 VanDerWaalsContact C-N 3.31Å; L185-S187 PolarHBondContact O-N 2.99Å; S187-Y191 PolarHBondContact O-N 2.67Å; S187-Y191 VanDerWaalsContact O-N 3.09Å
188	S	92.6	Very high	91.1	Very high	16 Å²	16	73 Å²	73	11%	0.112	37%	0.367	C	S	.	.	H	α-helix	trans	-68	-45.2	177.9	-176.7	0	0	0	0	111	R184 L185 R190 Y191 A192 L205	R184-S188 WeakPolarHBondContact O-CB 3.4Å; R184-S188 PolarHBondContact O-N 3.47Å; L185-S188 WeakPolarHBondContact O-CB 3.43Å; L185-S188 PolarHBondContact O-N 3.38Å; L185-S188 VanDerWaalsContact O-N 3.08Å; S188-R190 PolarHBondContact O-N 3Å; S188-Y191 PolarHBondContact O-N 3.47Å; S188-Y191 VanDerWaalsContact O-N 3.16Å; S188-A192 WeakPolarHBondContact O-CB 3.47Å; S188-A192 PolarHBondContact O-N 3.36Å; S188-L205 WeakPolarHBondContact OG-CB 3.27Å; S188-L205 PolarHBondContact OG-N 3.29Å
189	Q	96	Very high	91.9	Very high	44 Å²	44	74.3 Å²	74.3	21%	0.206	37%	0.369	C	S	.	.	H	α-helix	trans	-62.9	-40.8	177.7	-68.7	-179	-22.2	0	0	112	L185 Y191 A192 K193 V199 F200 N201	L185-Q189 HydrophobicContact CD1-CG 4.1Å; L185-Q189 HydrophobicContact CG-CG 4.48Å; L185-Q189 WeakPolarHBondContact O-CG 3.21Å; L185-Q189 PolarHBondContact O-N 3.46Å; Q189-Y191 VanDerWaalsContact C-N 3.34Å; Q189-Y191 PolarHBondContact O-N 3.47Å; Q189-A192 PolarHBondContact O-N 3.36Å; Q189-K193 WeakPolarHBondContact O-CB 3.3Å; Q189-K193 VanDerWaalsContact O-CG 3.31Å; Q189-K193 WeakPolarHBondContact O-CG 3.29Å; Q189-K193 PolarHBondContact O-N 3.27Å; Q189-V199 HydrophobicContact CB-CG1 4.1Å; Q189-V199 HydrophobicContact CG-CG1 3.79Å; Q189-F200 PolarHBondContact NE2-O 3.11Å; Q189-N201 PolarHBondContact NE2-OD1 3.39Å; Q189-N201 VanDerWaalsContact NE2-OD1 3.1Å
190	R	96.7	Very high	92.5	Very high	175 Å²	175	74.8 Å²	74.8	66%	0.66	37%	0.37	S	S	*	.	H	α-helix	trans	-61	-42.9	172.8	-75.6	-170.7	-65.7	-93.8	6	112.1	G186 S188 K194	G186-R190 WeakPolarHBondContact O-CG 3.36Å; G186-R190 PolarHBondContact O-N 3.26Å; G186-R190 PolarHBondContact O-NH1 3.17Å; S188-R190 PolarHBondContact O-N 3Å; R190-K194 WeakPolarHBondContact O-CB 3.39Å; R190-K194 PolarHBondContact O-N 2.99Å; R190-K194 VanDerWaalsContact O-N 3.1Å
191	Y	94.2	Very high	92.9	Very high	121 Å²	121	77.5 Å²	77.5	48%	0.475	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-42.3	177.3	-178.8	-94.9	0	0	0	111.9	S187 S188 Q189 K194 N195 Y197 L205	S187-Y191 PolarHBondContact O-N 2.67Å; S187-Y191 VanDerWaalsContact O-N 3.09Å; S188-Y191 PolarHBondContact O-N 3.47Å; S188-Y191 VanDerWaalsContact O-N 3.16Å; Q189-Y191 VanDerWaalsContact C-N 3.34Å; Q189-Y191 PolarHBondContact O-N 3.47Å; Y191-K194 PolarHBondContact O-N 3.36Å; Y191-N195 WeakPolarHBondContact CD2-ND2 3.44Å; Y191-N195 VanDerWaalsContact CE2-ND2 3.25Å; Y191-N195 WeakPolarHBondContact CE2-ND2 3.11Å; Y191-N195 PolarHBondContact O-N 2.9Å; Y191-N195 VanDerWaalsContact O-N 3.14Å; Y191-N195 PolarHBondContact O-ND2 3.42Å; Y191-Y197 HydrophobicContact CD1-CD2 4.45Å; Y191-Y197 HydrophobicContact CE1-CD2 4.04Å; Y191-Y197 AromaticContact CE1-CE2 3.9Å; Y191-Y197 HydrophobicContact CE1-CE2 3.9Å; Y191-L205 HydrophobicContact CD1-CD2 3.58Å; Y191-L205 HydrophobicContact CE1-CD2 3.77Å
192	A	95.2	Very high	93.1	Very high	1 Å²	1	80.5 Å²	80.5	1%	0.008	40%	0.396	C	S	.	.	H	α-helix	trans	-61.6	-50.4	177.7	0	0	0	0	0	111.4	S188 Q189 K194 N195 G196 Y197 P198 V199	S188-A192 WeakPolarHBondContact O-CB 3.47Å; S188-A192 PolarHBondContact O-N 3.36Å; Q189-A192 PolarHBondContact O-N 3.36Å; A192-K194 VanDerWaalsContact C-N 3.3Å; A192-K194 PolarHBondContact O-N 3.39Å; A192-N195 PolarHBondContact O-N 2.94Å; A192-G196 PolarHBondContact O-N 3.48Å; A192-Y197 PolarHBondContact O-N 3.23Å; A192-P198 WeakPolarHBondContact CB-O 3.37Å; A192-V199 HydrophobicContact CB-CG2 4.2Å
193	K	96.3	Very high	93.5	Very high	154 Å²	154	72.3 Å²	72.3	67%	0.67	37%	0.366	S	S	*	.	H	α-helix	trans	-57.6	-40	175.8	-71.4	178.8	-178.2	-174.5	0	112.8	Q189 V199	Q189-K193 WeakPolarHBondContact O-CB 3.3Å; Q189-K193 VanDerWaalsContact O-CG 3.31Å; Q189-K193 WeakPolarHBondContact O-CG 3.29Å; Q189-K193 PolarHBondContact O-N 3.27Å; K193-V199 HydrophobicContact CG-CG2 3.76Å
194	K	96.4	Very high	93.8	Very high	182 Å²	182	67.9 Å²	67.9	79%	0.791	34%	0.342	S	S	*	.	H	α-helix	trans	-67.8	-33.9	179.8	-178.2	174.6	178.2	177.6	0	113.2	R190 Y191 A192	R190-K194 WeakPolarHBondContact O-CB 3.39Å; R190-K194 PolarHBondContact O-N 2.99Å; R190-K194 VanDerWaalsContact O-N 3.1Å; Y191-K194 PolarHBondContact O-N 3.36Å; A192-K194 VanDerWaalsContact C-N 3.3Å; A192-K194 PolarHBondContact O-N 3.39Å
195	N	94	Very high	94	Very high	75 Å²	75	65.1 Å²	65.1	40%	0.401	33%	0.332	S	S	.	.	H	α-helix	trans	-107.3	6.2	-174.3	-61.4	-86.9	0	0	0	113.2	Y191 A192 Y197	Y191-N195 WeakPolarHBondContact CD2-ND2 3.44Å; Y191-N195 VanDerWaalsContact CE2-ND2 3.25Å; Y191-N195 WeakPolarHBondContact CE2-ND2 3.11Å; Y191-N195 PolarHBondContact O-N 2.9Å; Y191-N195 VanDerWaalsContact O-N 3.14Å; Y191-N195 PolarHBondContact O-ND2 3.42Å; A192-N195 PolarHBondContact O-N 2.94Å; N195-Y197 VanDerWaalsContact C-N 3.34Å; N195-Y197 HydrophobicContact CB-CD2 3.6Å; N195-Y197 HydrophobicContact CB-CE2 3.45Å; N195-Y197 VanDerWaalsContact CB-CE2 3.45Å; N195-Y197 PolarHBondContact O-N 2.95Å
196	G	93.3	Very high	94.1	Very high	70 Å²	70	63.4 Å²	63.4	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	23	-179.5	0	0	0	0	0	114.8	A192	A192-G196 PolarHBondContact O-N 3.48Å
197	Y	94.4	Very high	94	Very high	78 Å²	78	67.6 Å²	67.6	31%	0.306	33%	0.33	S	S	.	.			trans	-85	158.2	174.1	-62.2	-58.7	0	0	0	111.9	Y191 A192 N195 V199 L205 L288	Y191-Y197 HydrophobicContact CD1-CD2 4.45Å; Y191-Y197 HydrophobicContact CE1-CD2 4.04Å; Y191-Y197 AromaticContact CE1-CE2 3.9Å; Y191-Y197 HydrophobicContact CE1-CE2 3.9Å; A192-Y197 PolarHBondContact O-N 3.23Å; N195-Y197 VanDerWaalsContact C-N 3.34Å; N195-Y197 HydrophobicContact CB-CD2 3.6Å; N195-Y197 HydrophobicContact CB-CE2 3.45Å; N195-Y197 VanDerWaalsContact CB-CE2 3.45Å; N195-Y197 PolarHBondContact O-N 2.95Å; Y197-V199 PolarHBondContact O-N 2.85Å; Y197-L205 HydrophobicContact CD2-CD2 3.83Å; Y197-L205 HydrophobicContact CG-CD1 4.42Å; Y197-L205 HydrophobicContact CG-CD2 4.24Å; Y197-L288 HydrophobicContact CE1-CD2 3.77Å; Y197-L288 HydrophobicContact CE2-CD2 4.22Å; Y197-L288 WeakPolarHBondContact OH-CD2 3.03Å
198	P	93.8	Very high	93.8	Very high	61 Å²	61	66.1 Å²	66.1	40%	0.396	32%	0.319	S	S	.	.			trans	-53.5	137.8	172.8	-25.8	34.7	0	0	0	112.3	A192 F200	A192-P198 WeakPolarHBondContact CB-O 3.37Å; P198-F200 HydrophobicContact CB-CE1 3.85Å; P198-F200 HydrophobicContact CB-CE2 4.26Å; P198-F200 HydrophobicContact CB-CZ 3.7Å; P198-F200 HydrophobicContact CG-CZ 4.35Å
199	V	95.1	Very high	93.5	Very high	59 Å²	59	66.2 Å²	66.2	36%	0.358	32%	0.322	S	S	.	.			trans	-97.5	105.3	179.4	-177	0	0	0	0	108.6	Q189 A192 K193 Y197	Q189-V199 HydrophobicContact CB-CG1 4.1Å; Q189-V199 HydrophobicContact CG-CG1 3.79Å; A192-V199 HydrophobicContact CB-CG2 4.2Å; K193-V199 HydrophobicContact CG-CG2 3.76Å; Y197-V199 PolarHBondContact O-N 2.85Å
200	F	95.2	Very high	93	Very high	12 Å²	12	65.5 Å²	65.5	5%	0.053	32%	0.324	C	S	.	.			trans	-89.7	154.5	178.6	-56.9	-56.4	0	0	0	112.6	L185 Q189 P198 V203 L205 W295 E299	L185-F200 WeakPolarHBondContact CD1-O 3.37Å; Q189-F200 PolarHBondContact NE2-O 3.11Å; P198-F200 HydrophobicContact CB-CE1 3.85Å; P198-F200 HydrophobicContact CB-CE2 4.26Å; P198-F200 HydrophobicContact CB-CZ 3.7Å; P198-F200 HydrophobicContact CG-CZ 4.35Å; F200-V203 HydrophobicContact CB-CG2 3.66Å; F200-V203 WeakPolarHBondContact CB-O 3.32Å; F200-V203 HydrophobicContact CD1-CG2 4.05Å; F200-V203 HydrophobicContact CD2-CG2 3.95Å; F200-V203 HydrophobicContact CG-CG2 3.63Å; F200-L205 HydrophobicContact CE2-CD1 4.04Å; F200-W295 HydrophobicContact CE2-CB 3.99Å; F200-W295 HydrophobicContact CZ-CB 3.98Å; F200-E299 HydrophobicContact CD1-CB 3.87Å; F200-E299 HydrophobicContact CD1-CG 3.9Å; F200-E299 HydrophobicContact CE1-CB 4.32Å
201	N	93.4	Very high	92.4	Very high	90 Å²	90	57.2 Å²	57.2	48%	0.481	29%	0.293	S	S	.	.	S	Bend	trans	-119.1	-34.2	178.4	-61.9	-65.1	0	0	0	113	Q189 E299	Q189-N201 PolarHBondContact NE2-OD1 3.39Å; Q189-N201 VanDerWaalsContact NE2-OD1 3.1Å; N201-E299 WeakPolarHBondContact CA-OE1 2.96Å; N201-E299 WeakPolarHBondContact CB-OE1 3.22Å; N201-E299 VanDerWaalsContact N-CD 3.34Å; N201-E299 PolarHBondContact N-OE1 3.24Å; N201-E299 PolarHBondContact N-OE2 3.25Å
202	Y	92.6	Very high	92	Very high	86 Å²	86	53 Å²	53	34%	0.337	28%	0.278	S	S	.	.	S	Bend	trans	-100.3	-17.2	-179.3	-61.7	-81.3	0	0	0	112.9	Q103 L181 E299 L302 K303 A306	Q103-Y202 PolarHBondContact NE2-O 2.9Å; Q103-Y202 VanDerWaalsContact NE2-O 3.12Å; L181-Y202 WeakPolarHBondContact CD2-O 3.29Å; Y202-E299 WeakPolarHBondContact CA-OE2 3.41Å; Y202-E299 WeakPolarHBondContact CB-OE2 3.37Å; Y202-E299 WeakPolarHBondContact CD2-OE1 3.27Å; Y202-E299 PolarHBondContact N-OE1 3.39Å; Y202-E299 PolarHBondContact N-OE2 3.35Å; Y202-L302 HydrophobicContact CG-CB 4.15Å; Y202-K303 HydrophobicContact CD2-CB 3.86Å; Y202-K303 HydrophobicContact CE2-CB 3.58Å; Y202-K303 HydrophobicContact CE2-CD 4.46Å; Y202-K303 HydrophobicContact CE2-CG 3.8Å; Y202-A306 HydrophobicContact CE1-CB 3.87Å
203	V	93.8	Very high	91.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-126.1	167.4	171.4	-60.4	0	0	0	0	112.3	F200 W295 K298 E299 L302	F200-V203 HydrophobicContact CB-CG2 3.66Å; F200-V203 WeakPolarHBondContact CB-O 3.32Å; F200-V203 HydrophobicContact CD1-CG2 4.05Å; F200-V203 HydrophobicContact CD2-CG2 3.95Å; F200-V203 HydrophobicContact CG-CG2 3.63Å; V203-W295 HydrophobicContact CG2-CB 4.24Å; V203-W295 VanDerWaalsContact CG2-CD1 3.46Å; V203-W295 HydrophobicContact CG2-CG 4.17Å; V203-K298 HydrophobicContact CG1-CB 3.94Å; V203-E299 HydrophobicContact CG2-CB 4.18Å; V203-E299 PolarHBondContact N-OE2 3.46Å; V203-L302 HydrophobicContact CG1-CD1 3.57Å
204	V	91.6	Very high	90.9	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.03	25%	0.249	C	C	.	.			trans	-105.8	141.5	176	-178.2	0	0	0	0	109.3	E177 L181 R184 W295	E177-V204 HydrophobicContact CB-CB 3.89Å; E177-V204 HydrophobicContact CB-CG1 4.4Å; E177-V204 HydrophobicContact CB-CG2 4.38Å; E177-V204 HydrophobicContact CG-CB 3.85Å; E177-V204 HydrophobicContact CG-CG2 4.47Å; E177-V204 PolarHBondContact OE1-N 3.48Å; L181-V204 HydrophobicContact CB-CG2 4.4Å; L181-V204 HydrophobicContact CD1-CG2 3.57Å; R184-V204 HydrophobicContact CB-CG1 3.84Å; R184-V204 HydrophobicContact CB-CG2 3.89Å; V204-W295 PolarHBondContact O-NE1 2.89Å
205	L	93.1	Very high	90.4	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.063	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-53	124.1	175.2	-171.7	77	0	0	0	109.8	S188 Y191 Y197 F200	S188-L205 WeakPolarHBondContact OG-CB 3.27Å; S188-L205 PolarHBondContact OG-N 3.29Å; Y191-L205 HydrophobicContact CD1-CD2 3.58Å; Y191-L205 HydrophobicContact CE1-CD2 3.77Å; Y197-L205 HydrophobicContact CD2-CD2 3.83Å; Y197-L205 HydrophobicContact CG-CD1 4.42Å; Y197-L205 HydrophobicContact CG-CD2 4.24Å; F200-L205 HydrophobicContact CE2-CD1 4.04Å
206	P	93.3	Very high	89.9	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.039	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-71.8	148.2	-171.7	26	-31.7	0	0	0	111.9	P176 L288 L291 W295	P176-P206 HydrophobicContact CB-CB 3.59Å; P206-L288 HydrophobicContact CG-CD1 4.41Å; P206-L291 HydrophobicContact CB-CB 3.99Å; P206-L291 HydrophobicContact CB-CD1 4.01Å; P206-L291 HydrophobicContact CG-CB 3.53Å; P206-L291 HydrophobicContact CG-CD1 4.38Å; P206-W295 HydrophobicContact CB-CD2 4.15Å; P206-W295 HydrophobicContact CB-CZ2 4.22Å; P206-W295 HydrophobicContact CG-CD2 4.01Å; P206-W295 HydrophobicContact CG-CE3 4.46Å; P206-W295 HydrophobicContact CG-CG 4.05Å
207	R	90.7	Very high	89.2	Confident	120 Å²	120	34.3 Å²	34.3	45%	0.453	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-98.2	135.4	172	-57.6	179.6	-178.1	-153.2	-4.4	109.8	P176	P176-R207 VanDerWaalsContact O-CB 3.28Å; P176-R207 WeakPolarHBondContact O-CB 3.09Å; P176-R207 WeakPolarHBondContact O-CG 2.72Å; P176-R207 PolarHBondContact O-N 3.23Å
208	T	89	Confident	88.4	Confident	21 Å²	21	30.8 Å²	30.8	13%	0.129	16%	0.162	C	C	.	.			trans	-91.2	-21.4	-174.4	56.1	0	0	0	0	114.8	A210 M211 Q212 K284 I287 L288 L291	T208-A210 PolarHBondContact O-N 3.28Å; T208-M211 PolarHBondContact O-N 3.13Å; T208-Q212 PolarHBondContact O-N 3.39Å; T208-K284 WeakPolarHBondContact CG2-O 3.22Å; T208-I287 HydrophobicContact CG2-CB 4.11Å; T208-I287 HydrophobicContact CG2-CG2 3.79Å; T208-L288 HydrophobicContact CG2-CB 3.61Å; T208-L288 HydrophobicContact CG2-CD1 4.1Å; T208-L288 HydrophobicContact CG2-CG 4.42Å; T208-L291 HydrophobicContact CG2-CD1 4.27Å
209	G	86.2	Confident	87.6	Confident	18 Å²	18	28.7 Å²	28.7	19%	0.186	15%	0.15	C	C	.	.	H	α-helix	trans	-56	-43.4	-167.5	0	0	0	0	0	115.2	L153 V213	L153-G209 WeakPolarHBondContact CD2-O 3.35Å; G209-V213 PolarHBondContact O-N 2.93Å
210	A	84.9	Confident	86	Confident	30 Å²	30	32.8 Å²	32.8	25%	0.248	16%	0.159	C	C	.	.	H	α-helix	trans	-68.4	-40.5	178.2	0	0	0	0	0	111.9	L156 V174 T208 V213 V214	L156-A210 HydrophobicContact CD2-CB 4.4Å; V174-A210 HydrophobicContact CG1-CB 4.03Å; T208-A210 PolarHBondContact O-N 3.28Å; A210-V213 PolarHBondContact O-N 2.88Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.42Å; A210-V214 PolarHBondContact O-N 3.17Å; A210-V214 VanDerWaalsContact O-N 3.1Å
211	M	84.9	Confident	83.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-42.2	177.4	-77.9	-172.1	55.4	0	0	112	L97 I99 V174 P176 T208 V213 V214 L215 I279 I287 L291	L97-M211 HydrophobicContact CD2-CE 4.19Å; I99-M211 HydrophobicContact CG2-CE 4.31Å; I99-M211 HydrophobicContact CG2-SD 3.8Å; V174-M211 HydrophobicContact CG1-CG 4.12Å; P176-M211 HydrophobicContact CG-SD 4.19Å; T208-M211 PolarHBondContact O-N 3.13Å; M211-V213 VanDerWaalsContact C-N 3.31Å; M211-V213 PolarHBondContact O-N 2.87Å; M211-V214 CarbonylContact O-C 3.58Å; M211-V214 PolarHBondContact O-N 3.3Å; M211-L215 WeakPolarHBondContact O-CG 3.22Å; M211-L215 PolarHBondContact O-N 3.35Å; M211-I279 HydrophobicContact CE-CD1 4.21Å; M211-I287 HydrophobicContact CB-CG2 4.09Å; M211-I287 HydrophobicContact CE-CG2 4.1Å; M211-L291 HydrophobicContact CE-CD1 4.23Å; M211-L291 HydrophobicContact CE-CD2 3.91Å; M211-L291 HydrophobicContact CE-CG 4.23Å; M211-L291 HydrophobicContact SD-CD1 3.52Å; M211-L291 VanDerWaalsContact SD-CD1 3.52Å; M211-L291 HydrophobicContact SD-CD2 3.56Å; M211-L291 VanDerWaalsContact SD-CD2 3.56Å; M211-L291 HydrophobicContact SD-CG 3.99Å
212	Q	85.5	Confident	81.3	Confident	34 Å²	34	34.4 Å²	34.4	16%	0.159	18%	0.176	C	C	.	.	H	α-helix	trans	-53.3	-50.6	175.9	-176.1	-176.9	3.7	0	0	110.9	T208 V214 L215 E216 I287	T208-Q212 PolarHBondContact O-N 3.39Å; Q212-V214 VanDerWaalsContact C-N 3.32Å; Q212-V214 PolarHBondContact O-N 2.89Å; Q212-L215 PolarHBondContact O-N 2.97Å; Q212-E216 HydrophobicContact CG-CG 4.37Å; Q212-E216 WeakPolarHBondContact CG-OE1 3.26Å; Q212-E216 PolarHBondContact NE2-OE1 3.06Å; Q212-E216 VanDerWaalsContact O-CB 3.32Å; Q212-E216 WeakPolarHBondContact O-CB 3.37Å; Q212-E216 VanDerWaalsContact O-CG 3.25Å; Q212-E216 WeakPolarHBondContact O-CG 3.32Å; Q212-E216 PolarHBondContact O-N 3.32Å; Q212-I287 HydrophobicContact CB-CD1 3.88Å; Q212-I287 HydrophobicContact CG-CD1 4.29Å
213	V	83.8	Confident	78.8	Confident	13 Å²	13	39.6 Å²	39.6	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-40	178	176.1	0	0	0	0	111.8	L153 L156 R157 L160 G209 A210 M211 T217	L153-V213 HydrophobicContact CB-CG2 3.91Å; L153-V213 HydrophobicContact CD2-CG2 3.88Å; L153-V213 HydrophobicContact CG-CG2 4.31Å; L156-V213 HydrophobicContact CB-CG1 4.12Å; L156-V213 HydrophobicContact CD2-CB 3.97Å; L156-V213 HydrophobicContact CD2-CG1 3.93Å; L156-V213 HydrophobicContact CG-CB 4.37Å; L156-V213 HydrophobicContact CG-CG1 3.75Å; R157-V213 HydrophobicContact CB-CG1 3.92Å; L160-V213 HydrophobicContact CD1-CG1 4.39Å; G209-V213 PolarHBondContact O-N 2.93Å; A210-V213 PolarHBondContact O-N 2.88Å; M211-V213 VanDerWaalsContact C-N 3.31Å; M211-V213 PolarHBondContact O-N 2.87Å; V213-T217 WeakPolarHBondContact O-CB 3.26Å; V213-T217 PolarHBondContact O-N 2.46Å; V213-T217 PolarHBondContact O-OG1 3.32Å
214	V	84.6	Confident	76.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-47.7	177.9	171.9	0	0	0	0	111	L97 L130 L160 I172 A210 M211 Q212 T217 C218 L236	L97-V214 HydrophobicContact CD1-CG1 4.14Å; L97-V214 HydrophobicContact CD2-CG1 4.28Å; L130-V214 HydrophobicContact CD1-CG2 4.1Å; L160-V214 HydrophobicContact CD1-CG2 4.07Å; I172-V214 HydrophobicContact CD1-CG1 3.8Å; I172-V214 HydrophobicContact CG2-CG1 4.39Å; I172-V214 HydrophobicContact CG2-CG2 4.03Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.42Å; A210-V214 PolarHBondContact O-N 3.17Å; A210-V214 VanDerWaalsContact O-N 3.1Å; M211-V214 CarbonylContact O-C 3.58Å; M211-V214 PolarHBondContact O-N 3.3Å; Q212-V214 VanDerWaalsContact C-N 3.32Å; Q212-V214 PolarHBondContact O-N 2.89Å; V214-T217 PolarHBondContact O-N 2.82Å; V214-C218 HydrophobicContact CG1-CB 4.42Å; V214-C218 WeakPolarHBondContact O-CA 3.35Å; V214-C218 WeakPolarHBondContact O-CB 3.32Å; V214-C218 PolarHBondContact O-N 2.78Å; V214-C218 PolarHBondContact O-SG 2.89Å; V214-L236 HydrophobicContact CG1-CD2 4.31Å
215	L	85.4	Confident	74.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-43.7	-180	-64	177.5	0	0	0	111.7	L97 M211 Q212 T217 A219 R220 L236 I276 I279 I287	L97-L215 HydrophobicContact CD2-CD2 4.23Å; M211-L215 WeakPolarHBondContact O-CG 3.22Å; M211-L215 PolarHBondContact O-N 3.35Å; Q212-L215 PolarHBondContact O-N 2.97Å; L215-T217 VanDerWaalsContact C-N 3.28Å; L215-T217 PolarHBondContact O-N 2.87Å; L215-A219 HydrophobicContact CB-CB 4.29Å; L215-A219 HydrophobicContact CD2-CB 3.96Å; L215-A219 WeakPolarHBondContact O-CA 3.42Å; L215-A219 VanDerWaalsContact O-CB 3.26Å; L215-A219 WeakPolarHBondContact O-CB 3.23Å; L215-A219 PolarHBondContact O-N 2.89Å; L215-R220 PolarHBondContact O-N 3.34Å; L215-L236 HydrophobicContact CD2-CD2 4.25Å; L215-I276 HydrophobicContact CD2-CD1 3.45Å; L215-I276 VanDerWaalsContact CD2-CD1 3.45Å; L215-I276 HydrophobicContact CD2-CG1 4.28Å; L215-I279 HydrophobicContact CD1-CD1 3.86Å; L215-I279 HydrophobicContact CD1-CG2 4.13Å; L215-I279 HydrophobicContact CD2-CD1 4.46Å; L215-I287 HydrophobicContact CD1-CD1 3.78Å; L215-I287 HydrophobicContact CD1-CG1 3.92Å
216	E	83.3	Confident	72	Confident	68 Å²	68	51.8 Å²	51.8	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-35.5	175.6	-74.4	174.5	-174.4	0	0	112.8	Q212	Q212-E216 HydrophobicContact CG-CG 4.37Å; Q212-E216 WeakPolarHBondContact CG-OE1 3.26Å; Q212-E216 PolarHBondContact NE2-OE1 3.06Å; Q212-E216 VanDerWaalsContact O-CB 3.32Å; Q212-E216 WeakPolarHBondContact O-CB 3.37Å; Q212-E216 VanDerWaalsContact O-CG 3.25Å; Q212-E216 WeakPolarHBondContact O-CG 3.32Å; Q212-E216 PolarHBondContact O-N 3.32Å
217	T	78.1	Confident	69.8	Low	7 Å²	7	55.8 Å²	55.8	4%	0.043	29%	0.286	C	S	.	.	H	α-helix	trans	-91.7	-26.2	-175.7	-50	0	0	0	0	112.8	R157 L160 M161 V213 V214 L215	R157-T217 HydrophobicContact CG-CG2 4.18Å; L160-T217 HydrophobicContact CB-CG2 4.07Å; L160-T217 HydrophobicContact CD1-CG2 4.29Å; M161-T217 HydrophobicContact CG-CG2 3.94Å; M161-T217 HydrophobicContact SD-CG2 3.67Å; V213-T217 WeakPolarHBondContact O-CB 3.26Å; V213-T217 PolarHBondContact O-N 2.46Å; V213-T217 PolarHBondContact O-OG1 3.32Å; V214-T217 PolarHBondContact O-N 2.82Å; L215-T217 VanDerWaalsContact C-N 3.28Å; L215-T217 PolarHBondContact O-N 2.87Å
218	C	79.1	Confident	67.9	Low	4 Å²	4	52.1 Å²	52.1	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-125.3	-21.5	-166.9	-51.7	0	0	0	0	115.2	W165 V214 L236	W165-C218 HydrophobicContact CH2-CB 4.28Å; W165-C218 HydrophobicContact CZ2-CB 3.55Å; V214-C218 HydrophobicContact CG1-CB 4.42Å; V214-C218 WeakPolarHBondContact O-CA 3.35Å; V214-C218 WeakPolarHBondContact O-CB 3.32Å; V214-C218 PolarHBondContact O-N 2.78Å; V214-C218 PolarHBondContact O-SG 2.89Å; C218-L236 HydrophobicContact CB-CB 4.21Å; C218-L236 WeakPolarHBondContact O-CB 3.19Å; C218-L236 PolarHBondContact O-N 3.34Å
219	A	75.6	Confident	66	Low	17 Å²	17	59.4 Å²	59.4	14%	0.14	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-26.5	-179.5	0	0	0	0	0	113.2	L215 L236 I276	L215-A219 HydrophobicContact CB-CB 4.29Å; L215-A219 HydrophobicContact CD2-CB 3.96Å; L215-A219 WeakPolarHBondContact O-CA 3.42Å; L215-A219 VanDerWaalsContact O-CB 3.26Å; L215-A219 WeakPolarHBondContact O-CB 3.23Å; L215-A219 PolarHBondContact O-N 2.89Å; A219-L236 HydrophobicContact CB-CB 4.49Å; A219-I276 HydrophobicContact CB-CD1 4.43Å; A219-I276 HydrophobicContact CB-CG1 3.91Å
220	R	62.1	Low	64.3	Low	145 Å²	145	61.5 Å²	61.5	55%	0.547	33%	0.327	S	S	.	.			trans	-97.4	115.8	178.7	-77	-173.8	173.5	168.7	-2.7	113.2	L215 H282	L215-R220 PolarHBondContact O-N 3.34Å; R220-H282 PolarHBondContact NE-ND1 2.81Å
221	S	46.1	Very low	62.5	Low	21 Å²	21	65.2 Å²	65.2	15%	0.147	34%	0.339	C	S	.	.				158.2	104.5	110.5	-167.5	0	0	0	0	111.2	K223 D224 Q235	S221-K223 PolarHBondContact O-N 2.8Å; S221-K223 PolarHBondContact OG-N 2.95Å; S221-D224 CarbonylContact O-C 3.57Å; S221-D224 PolarHBondContact OG-N 2.98Å; S221-D224 PolarHBondContact OG-OD2 2.95Å; S221-D224 VanDerWaalsContact OG-OD2 3.07Å; S221-Q235 PolarHBondContact O-NE2 3.4Å
222	P	43.6	Very low	60.9	Low	115 Å²	115	73.6 Å²	73.6	75%	0.747	37%	0.372	S	S	*	.	S	Bend	trans	-63.1	-17.1	164.7	-20.8	32.1	0	0	0	113.5
223	K	40.2	Very low	59.5	Low	195 Å²	195	73.9 Å²	73.9	85%	0.848	38%	0.376	S	S	*	.	S	Bend	trans	-92.7	-31.9	-179.6	-71.6	-171.4	175.9	-177.4	0	113	S221 N225	S221-K223 PolarHBondContact O-N 2.8Å; S221-K223 PolarHBondContact OG-N 2.95Å; K223-N225 PolarHBondContact O-N 3.27Å
224	D	44.7	Very low	58.6	Low	99 Å²	99	79.9 Å²	79.9	53%	0.529	40%	0.397	S	S	.	.			trans	-99.6	81	170.9	-57	-59.2	0	0	0	107.9	S221 H226	S221-D224 CarbonylContact O-C 3.57Å; S221-D224 PolarHBondContact OG-N 2.98Å; S221-D224 PolarHBondContact OG-OD2 2.95Å; S221-D224 VanDerWaalsContact OG-OD2 3.07Å; D224-H226 PolarHBondContact O-N 3.06Å
225	N	43.2	Very low	58.3	Low	87 Å²	87	83.2 Å²	83.2	47%	0.465	41%	0.413	S	S	.	.			trans	-53.8	97.2	156.2	-72.8	-42.1	0	0	0	106.4	K223 V227 Y232	K223-N225 PolarHBondContact O-N 3.27Å; N225-V227 HydrophobicContact CB-CG2 4.36Å; N225-V227 PolarHBondContact O-N 3.12Å; N225-Y232 HydrophobicContact CB-CD1 4.32Å; N225-Y232 HydrophobicContact CB-CE1 4.14Å; N225-Y232 VanDerWaalsContact CG-CE1 3.47Å; N225-Y232 WeakPolarHBondContact OD1-CE1 3.38Å
226	H	46.8	Very low	58.1	Low	87 Å²	87	83.3 Å²	83.3	40%	0.403	41%	0.414	S	S	.	.			trans	-66.6	88.4	169.7	-78.8	-51.6	0	0	0	106.5	D224 I228 V233	D224-H226 PolarHBondContact O-N 3.06Å; H226-I228 VanDerWaalsContact C-N 3.26Å; H226-I228 PolarHBondContact O-N 3.04Å; H226-V233 WeakPolarHBondContact O-CG2 3.38Å
227	V	48.3	Very low	58.2	Low	90 Å²	90	85.8 Å²	85.8	55%	0.545	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	88.8	169.7	178.9	0	0	0	0	106.1	N225 K229 G230	N225-V227 HydrophobicContact CB-CG2 4.36Å; N225-V227 PolarHBondContact O-N 3.12Å; V227-K229 PolarHBondContact O-N 3.47Å; V227-G230 VanDerWaalsContact CG1-N 3.26Å
228	I	51.4	Low	58.8	Low	44 Å²	44	88.4 Å²	88.4	23%	0.226	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	106.2	167.5	-60.9	-178.7	0	0	0	106	M161 W165 P166 H226 G230 E231 V233	M161-I228 HydrophobicContact CE-CD1 4.23Å; W165-I228 HydrophobicContact CB-CD1 3.6Å; W165-I228 HydrophobicContact CG-CD1 4.25Å; P166-I228 HydrophobicContact CG-CG2 4.44Å; H226-I228 VanDerWaalsContact C-N 3.26Å; H226-I228 PolarHBondContact O-N 3.04Å; I228-G230 PolarHBondContact O-N 3.1Å; I228-E231 PolarHBondContact O-N 3.38Å; I228-V233 HydrophobicContact CB-CG2 3.9Å; I228-V233 HydrophobicContact CD1-CG2 3.77Å; I228-V233 HydrophobicContact CG1-CG2 3.76Å
229	K	49.3	Very low	59.5	Low	173 Å²	173	88.2 Å²	88.2	75%	0.752	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	43.9	179.1	-60.2	-173.7	172.6	-168.8	0	114.4	F47 V227 E231	F47-K229 HydrophobicContact CZ-CD 4.39Å; V227-K229 PolarHBondContact O-N 3.47Å; K229-E231 VanDerWaalsContact C-N 3.32Å; K229-E231 PolarHBondContact O-N 3.07Å
230	G	48.6	Very low	60.2	Low	63 Å²	63	87.4 Å²	87.4	65%	0.649	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-6.8	173.7	0	0	0	0	0	115.8	V227 I228	V227-G230 VanDerWaalsContact CG1-N 3.26Å; I228-G230 PolarHBondContact O-N 3.1Å
231	E	48.1	Very low	61.8	Low	107 Å²	107	80.7 Å²	80.7	50%	0.5	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.8	178.3	-71.8	-174.8	166.2	0	0	112.3	R168 I228 K229 V233	R168-E231 IonicContact CZ-OE2 3.97Å; R168-E231 IonicContact NE-OE2 3.3Å; R168-E231 IonicContact NH2-OE1 3.59Å; R168-E231 PolarHBondContact NH2-OE1 3.35Å; R168-E231 IonicContact NH2-OE2 2.93Å; R168-E231 PolarHBondContact NH2-OE2 3.32Å; I228-E231 PolarHBondContact O-N 3.38Å; K229-E231 VanDerWaalsContact C-N 3.32Å; K229-E231 PolarHBondContact O-N 3.07Å; E231-V233 PolarHBondContact O-N 2.82Å
232	Y	51.3	Low	64	Low	177 Å²	177	79.9 Å²	79.9	69%	0.694	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	118.2	169.7	-72.2	-91.1	0	0	0	110	N225 R234	N225-Y232 HydrophobicContact CB-CD1 4.32Å; N225-Y232 HydrophobicContact CB-CE1 4.14Å; N225-Y232 VanDerWaalsContact CG-CE1 3.47Å; N225-Y232 WeakPolarHBondContact OD1-CE1 3.38Å; Y232-R234 PolarHBondContact O-N 2.85Å
233	V	56.2	Low	66.5	Low	40 Å²	40	74.6 Å²	74.6	24%	0.242	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-78.8	119.1	174.9	-179.3	0	0	0	0	108.8	W165 H226 I228 E231 Q235	W165-V233 HydrophobicContact CB-CG1 4.04Å; W165-V233 HydrophobicContact CD2-CG1 3.31Å; W165-V233 HydrophobicContact CE3-CG1 3.12Å; W165-V233 HydrophobicContact CG-CG1 3.77Å; W165-V233 HydrophobicContact CH2-CG1 4.17Å; W165-V233 HydrophobicContact CZ2-CG1 4.32Å; W165-V233 HydrophobicContact CZ3-CG1 3.61Å; H226-V233 WeakPolarHBondContact O-CG2 3.38Å; I228-V233 HydrophobicContact CB-CG2 3.9Å; I228-V233 HydrophobicContact CD1-CG2 3.77Å; I228-V233 HydrophobicContact CG1-CG2 3.76Å; E231-V233 PolarHBondContact O-N 2.82Å; V233-Q235 PolarHBondContact O-N 2.83Å
234	R	64.4	Low	68.9	Low	138 Å²	138	65.3 Å²	65.3	52%	0.521	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-59.7	128.6	173.7	-72.3	-176.3	155.9	-154.8	-10.4	109.7	E93 E94 P95 W165 Y232	E93-R234 PolarHBondContact O-NH1 3.07Å; E94-R234 IonicContact OE1-CZ 3.61Å; E94-R234 IonicContact OE1-NH1 3.73Å; E94-R234 PolarHBondContact OE1-NH1 3.31Å; E94-R234 IonicContact OE1-NH2 2.71Å; E94-R234 IonicContact OE2-NH1 3.64Å; P95-R234 HydrophobicContact CG-CB 3.67Å; W165-R234 WeakPolarHBondContact CH2-O 3.34Å; W165-R234 WeakPolarHBondContact CZ3-O 3.46Å; Y232-R234 PolarHBondContact O-N 2.85Å
235	Q	77.6	Confident	71	Confident	70 Å²	70	60.8 Å²	60.8	33%	0.327	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-76.1	160.6	177.2	-70.3	170.3	-7.2	0	0	112	P95 S221 V233 R237	P95-Q235 WeakPolarHBondContact CB-O 3.45Å; P95-Q235 WeakPolarHBondContact CG-O 3.43Å; S221-Q235 PolarHBondContact O-NE2 3.4Å; V233-Q235 PolarHBondContact O-N 2.83Å; Q235-R237 PolarHBondContact O-N 3.36Å
236	L	81.6	Confident	73.1	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-60.1	126.1	167.6	-164	73.9	0	0	0	109.4	L97 V214 L215 C218 A219 I276	L97-L236 HydrophobicContact CB-CD1 3.94Å; L97-L236 HydrophobicContact CB-CD2 3.56Å; L97-L236 HydrophobicContact CB-CG 4.17Å; L97-L236 HydrophobicContact CD2-CD2 4.17Å; L97-L236 HydrophobicContact CG-CD2 4.48Å; V214-L236 HydrophobicContact CG1-CD2 4.31Å; L215-L236 HydrophobicContact CD2-CD2 4.25Å; C218-L236 HydrophobicContact CB-CB 4.21Å; C218-L236 WeakPolarHBondContact O-CB 3.19Å; C218-L236 PolarHBondContact O-N 3.34Å; A219-L236 HydrophobicContact CB-CB 4.49Å; L236-I276 HydrophobicContact CD2-CD1 3.61Å; L236-I276 HydrophobicContact CD2-CG1 4.3Å; L236-I276 HydrophobicContact CG-CD1 4.26Å
237	R	85.7	Confident	74.7	Confident	120 Å²	120	57.7 Å²	57.7	45%	0.453	27%	0.274	S	S	.	.			trans	-114.9	-32	-176.4	-73.5	-179.1	172.3	-165.2	-9.6	114	E94 P95 Q235 I276	E94-R237 WeakPolarHBondContact OE2-CD 3.27Å; E94-R237 IonicContact OE2-NH1 3.73Å; E94-R237 PolarHBondContact OE2-NH1 3.42Å; P95-R237 PolarHBondContact O-N 3.4Å; Q235-R237 PolarHBondContact O-N 3.36Å; R237-I276 WeakPolarHBondContact O-CB 3.32Å; R237-I276 WeakPolarHBondContact O-CG2 3.16Å; R237-I276 PolarHBondContact O-N 2.96Å
238	Y	91.4	Very high	75.7	Confident	61 Å²	61	61.2 Å²	61.2	24%	0.239	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.3	-171.1	-55.2	-72.9	0	0	0	111.6	Y91 E94 C96 L97 H274	Y91-Y238 HydrophobicContact CD1-CD1 4.29Å; Y91-Y238 AromaticContact CD1-CD2 3.69Å; Y91-Y238 HydrophobicContact CD1-CD2 3.69Å; Y91-Y238 HydrophobicContact CD1-CE2 4.32Å; Y91-Y238 AromaticContact CD1-CG 3.66Å; Y91-Y238 HydrophobicContact CD1-CG 3.66Å; Y91-Y238 AromaticContact CE1-CD1 3.59Å; Y91-Y238 HydrophobicContact CE1-CD1 3.59Å; Y91-Y238 AromaticContact CE1-CD2 3.8Å; Y91-Y238 HydrophobicContact CE1-CD2 3.8Å; Y91-Y238 HydrophobicContact CE1-CE1 4.04Å; Y91-Y238 HydrophobicContact CE1-CE2 4.24Å; Y91-Y238 AromaticContact CE1-CG 3.45Å; Y91-Y238 HydrophobicContact CE1-CG 3.45Å; Y91-Y238 VanDerWaalsContact CE1-CG 3.45Å; E94-Y238 HydrophobicContact CB-CD2 3.88Å; E94-Y238 HydrophobicContact CB-CE2 3.91Å; E94-Y238 HydrophobicContact CG-CD2 4.4Å; E94-Y238 HydrophobicContact CG-CE2 3.93Å; C96-Y238 CarbonylContact C-O 3.57Å; C96-Y238 VanDerWaalsContact CA-O 3.31Å; C96-Y238 WeakPolarHBondContact CA-O 3.36Å; L97-Y238 PolarHBondContact N-O 3.16Å; Y238-H274 WeakPolarHBondContact CA-O 3.25Å
239	I	92.3	Very high	76.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.2	169.1	-56.1	168.4	0	0	0	107.2	L97 I99 H274 I276 I279 Y290	L97-I239 CarbonylContact O-C 3.57Å; L97-I239 VanDerWaalsContact O-CA 3.26Å; L97-I239 WeakPolarHBondContact O-CA 3.26Å; I99-I239 HydrophobicContact CD1-CG2 3.66Å; I99-I239 HydrophobicContact CG1-CG2 3.94Å; I239-H274 HydrophobicContact CB-CB 4.15Å; I239-H274 PolarHBondContact N-O 3.19Å; I239-H274 PolarHBondContact O-N 3.24Å; I239-I276 HydrophobicContact CD1-CD1 3.84Å; I239-I276 HydrophobicContact CG1-CD1 3.61Å; I239-I279 HydrophobicContact CD1-CD1 3.45Å; I239-I279 VanDerWaalsContact CD1-CD1 3.45Å; I239-I279 HydrophobicContact CD1-CG1 3.88Å; I239-Y290 HydrophobicContact CD1-CE1 4.1Å
240	I	91.8	Very high	77	Confident	1 Å²	1	58 Å²	58	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	105	173.1	-56.2	175.2	0	0	0	106.7	I88 Y91 C96 L97 V98 I99 W171 V242	I88-I240 HydrophobicContact CG2-CG2 3.99Å; Y91-I240 HydrophobicContact CG-CD1 4.41Å; C96-I240 HydrophobicContact CB-CD1 3.79Å; C96-I240 HydrophobicContact CB-CG1 4.12Å; L97-I240 PolarHBondContact O-N 3.3Å; V98-I240 CarbonylContact C-O 3.44Å; V98-I240 VanDerWaalsContact CA-O 3.28Å; V98-I240 WeakPolarHBondContact CA-O 3.39Å; V98-I240 HydrophobicContact CG1-CB 4.36Å; V98-I240 HydrophobicContact CG1-CG2 4.46Å; V98-I240 HydrophobicContact CG2-CB 4.29Å; V98-I240 HydrophobicContact CG2-CD1 4.39Å; I99-I240 PolarHBondContact N-O 3.22Å; W171-I240 HydrophobicContact CH2-CD1 3.6Å; W171-I240 HydrophobicContact CZ2-CD1 3.51Å; W171-I240 HydrophobicContact CZ3-CD1 4.2Å; I240-V242 HydrophobicContact CG2-CG2 4Å
241	D	95.1	Very high	77.9	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	119.4	173	-174.1	43.8	0	0	0	110.3	I99 Y271 R272 K298	I99-D241 HydrophobicContact CD1-CB 4.17Å; I99-D241 HydrophobicContact CG1-CB 4.05Å; I99-D241 WeakPolarHBondContact CG1-OD1 2.87Å; D241-Y271 CarbonylContact O-C 3.57Å; D241-Y271 WeakPolarHBondContact O-CA 3.4Å; D241-R272 HydrophobicContact CB-CB 4.27Å; D241-R272 PolarHBondContact N-O 2.85Å; D241-R272 PolarHBondContact O-N 2.77Å; D241-K298 WeakPolarHBondContact OD1-CE 3.37Å; D241-K298 IonicContact OD1-NZ 2.77Å; D241-K298 PolarHBondContact OD1-NZ 3.36Å; D241-K298 WeakPolarHBondContact OD2-CE 3.36Å; D241-K298 IonicContact OD2-NZ 3.62Å
242	V	93.1	Very high	79.1	Confident	3 Å²	3	53 Å²	53	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	179	-168.6	0	0	0	0	109.3	V98 I99 V100 N101 L111 I240 I244 R270 Y271 K298	V98-V242 HydrophobicContact CG1-CG2 3.45Å; V98-V242 VanDerWaalsContact CG1-CG2 3.45Å; I99-V242 PolarHBondContact O-N 3.48Å; V100-V242 WeakPolarHBondContact CA-O 3.32Å; V100-V242 HydrophobicContact CG1-CB 4.14Å; V100-V242 HydrophobicContact CG1-CG1 4.37Å; V100-V242 HydrophobicContact CG2-CB 4.14Å; V100-V242 HydrophobicContact CG2-CG2 4.39Å; N101-V242 PolarHBondContact N-O 3.03Å; L111-V242 HydrophobicContact CD2-CG1 4.03Å; I240-V242 HydrophobicContact CG2-CG2 4Å; V242-I244 HydrophobicContact CG1-CG1 4.27Å; V242-R270 WeakPolarHBondContact CA-O 3.41Å; V242-Y271 HydrophobicContact CB-CD1 4.46Å; V242-Y271 HydrophobicContact CG1-CD1 4.06Å; V242-Y271 HydrophobicContact CG1-CE1 3.83Å; V242-Y271 HydrophobicContact CG2-CD1 3.95Å; V242-Y271 HydrophobicContact CG2-CE1 4.14Å; V242-K298 PolarHBondContact O-NZ 2.81Å
243	T	94.5	Very high	80.1	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.8	171.2	-48.1	0	0	0	0	109.3	N101 R270 K298 W301 L302	N101-T243 WeakPolarHBondContact OD1-CA 3.25Å; T243-R270 PolarHBondContact N-O 2.87Å; T243-R270 PolarHBondContact O-N 2.89Å; T243-K298 HydrophobicContact CG2-CB 4.23Å; T243-K298 HydrophobicContact CG2-CD 4.14Å; T243-K298 HydrophobicContact CG2-CG 4.04Å; T243-K298 WeakPolarHBondContact OG1-CD 2.96Å; T243-K298 VanDerWaalsContact OG1-CE 3.28Å; T243-K298 WeakPolarHBondContact OG1-CE 3.37Å; T243-K298 WeakPolarHBondContact OG1-CG 3.41Å; T243-W301 HydrophobicContact CG2-CE3 3.66Å; T243-W301 HydrophobicContact CG2-CZ3 3.55Å; T243-L302 HydrophobicContact CG2-CD1 4.16Å; T243-L302 HydrophobicContact CG2-CD2 4.15Å; T243-L302 HydrophobicContact CG2-CG 4.09Å
244	I	90.9	Very high	81.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.5	175.6	-48.8	-170.9	0	0	0	107.8	V100 N101 D107 L111 V242 Y246 V267 V268 L269	V100-I244 HydrophobicContact CG1-CD1 3.69Å; V100-I244 HydrophobicContact CG1-CG1 3.82Å; N101-I244 PolarHBondContact ND2-O 2.75Å; N101-I244 PolarHBondContact OD1-N 2.88Å; D107-I244 HydrophobicContact CB-CD1 3.85Å; L111-I244 HydrophobicContact CD1-CD1 4.08Å; L111-I244 HydrophobicContact CD2-CD1 4.24Å; L111-I244 HydrophobicContact CG-CD1 4.01Å; V242-I244 HydrophobicContact CG1-CG1 4.27Å; I244-Y246 HydrophobicContact CG2-CD2 4.19Å; I244-Y246 HydrophobicContact CG2-CE1 4.48Å; I244-Y246 HydrophobicContact CG2-CE2 3.53Å; I244-V267 HydrophobicContact CG2-CG1 3.86Å; I244-V268 WeakPolarHBondContact CA-O 3.39Å; I244-L269 HydrophobicContact CB-CD2 4.09Å; I244-L269 HydrophobicContact CD1-CD2 4.03Å; I244-L269 HydrophobicContact CG1-CD2 3.59Å; I244-L269 HydrophobicContact CG2-CD2 3.9Å
245	A	89.6	Confident	81.8	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.033	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.2	170.5	0	0	0	0	0	110.1	V267 V268 W301 L302 M305	A245-V267 WeakPolarHBondContact O-CA 3.46Å; A245-V268 HydrophobicContact CB-CB 4.35Å; A245-V268 PolarHBondContact N-O 2.9Å; A245-V268 PolarHBondContact O-N 2.8Å; A245-W301 HydrophobicContact CB-CH2 3.86Å; A245-W301 HydrophobicContact CB-CZ3 3.73Å; A245-L302 HydrophobicContact CB-CD2 3.54Å; A245-M305 HydrophobicContact CB-CE 3.78Å; A245-M305 HydrophobicContact CB-SD 3.59Å; A245-M305 VanDerWaalsContact CB-SD 3.59Å
246	Y	86.3	Confident	81.7	Confident	30 Å²	30	49.4 Å²	49.4	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.6	174.3	-69.8	-75.1	0	0	0	108.3	Q103 D107 I110 I244 F252 V267	Q103-Y246 HydrophobicContact CB-CD2 3.67Å; Q103-Y246 HydrophobicContact CB-CE2 3.6Å; Q103-Y246 HydrophobicContact CG-CD2 4.15Å; Q103-Y246 HydrophobicContact CG-CE2 4.3Å; D107-Y246 WeakPolarHBondContact OD1-CE2 3.32Å; D107-Y246 VanDerWaalsContact OD1-CZ 3.3Å; D107-Y246 PolarHBondContact OD1-OH 3.42Å; I110-Y246 HydrophobicContact CD1-CE1 4.16Å; I244-Y246 HydrophobicContact CG2-CD2 4.19Å; I244-Y246 HydrophobicContact CG2-CE1 4.48Å; I244-Y246 HydrophobicContact CG2-CE2 3.53Å; Y246-F252 AromaticContact CD1-CD2 3.96Å; Y246-F252 HydrophobicContact CD1-CD2 3.96Å; Y246-F252 AromaticContact CD1-CE2 3.34Å; Y246-F252 HydrophobicContact CD1-CE2 3.34Å; Y246-F252 HydrophobicContact CD1-CZ 4.35Å; Y246-F252 AromaticContact CE1-CD2 3.47Å; Y246-F252 HydrophobicContact CE1-CD2 3.47Å; Y246-F252 VanDerWaalsContact CE1-CD2 3.47Å; Y246-F252 AromaticContact CE1-CE2 3.09Å; Y246-F252 HydrophobicContact CE1-CE2 3.09Å; Y246-F252 HydrophobicContact CE1-CZ 4.06Å; Y246-F252 HydrophobicContact CG-CE2 4.44Å; Y246-V267 HydrophobicContact CD1-CB 4.39Å; Y246-V267 HydrophobicContact CD1-CG1 4.11Å; Y246-V267 HydrophobicContact CD1-CG2 3.73Å; Y246-V267 HydrophobicContact CE1-CB 4.29Å; Y246-V267 HydrophobicContact CE1-CG1 3.78Å; Y246-V267 HydrophobicContact CE1-CG2 3.58Å
247	E	80.6	Confident	81.4	Confident	78 Å²	78	49.4 Å²	49.4	36%	0.364	23%	0.23	S	C	.	.			trans	-54.3	152	167.6	-171	173.9	-168.2	0	0	110.5	D249 A250 K266 E309	E247-D249 PolarHBondContact O-N 3.28Å; E247-A250 HydrophobicContact CB-CB 4.15Å; E247-A250 WeakPolarHBondContact O-CA 3.4Å; E247-A250 WeakPolarHBondContact O-CB 3.41Å; E247-A250 PolarHBondContact O-N 3.21Å; E247-K266 HydrophobicContact CB-CB 4.48Å; E247-K266 PolarHBondContact N-O 3.2Å; E247-E309 WeakPolarHBondContact CA-OE1 3.22Å; E247-E309 WeakPolarHBondContact CA-OE2 3.31Å
248	K	70.9	Confident	80.8	Confident	165 Å²	165	44.8 Å²	44.8	72%	0.717	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48	135.4	-178.5	-168.5	175.6	177.6	177.1	0	112.8	A250 E309	K248-A250 PolarHBondContact O-N 3.41Å; K248-A250 VanDerWaalsContact O-N 3.16Å; K248-E309 PolarHBondContact N-OE2 3.42Å
249	D	62.9	Low	80.1	Confident	147 Å²	147	42 Å²	42	79%	0.786	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	13.2	-176.6	-55.7	-45.9	0	0	0	115.5	E247 T251	E247-D249 PolarHBondContact O-N 3.28Å; D249-T251 PolarHBondContact O-N 3.37Å
250	A	64.7	Low	79.2	Confident	3 Å²	3	42 Å²	42	3%	0.025	21%	0.205	C	C	.	.			trans	-89.1	13.5	-170.2	0	0	0	0	0	116	E247 K248 F252 K265	E247-A250 HydrophobicContact CB-CB 4.15Å; E247-A250 WeakPolarHBondContact O-CA 3.4Å; E247-A250 WeakPolarHBondContact O-CB 3.41Å; E247-A250 PolarHBondContact O-N 3.21Å; K248-A250 PolarHBondContact O-N 3.41Å; K248-A250 VanDerWaalsContact O-N 3.16Å; A250-F252 WeakPolarHBondContact O-CD2 3.31Å; A250-F252 WeakPolarHBondContact O-CE2 3.39Å; A250-F252 PolarHBondContact O-N 3.34Å; A250-K265 HydrophobicContact CB-CD 3.79Å; A250-K265 HydrophobicContact CB-CG 3.98Å; A250-K265 PolarHBondContact O-NZ 3.19Å
251	T	67.8	Low	78.3	Confident	59 Å²	59	44.3 Å²	44.3	36%	0.362	22%	0.22	S	C	.	.			trans	-58.6	140.9	178	68.5	0	0	0	0	112.1	D249	D249-T251 PolarHBondContact O-N 3.37Å
252	F	71.5	Confident	77	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.018	22%	0.221	C	C	.	.			trans	-95.7	115.2	-177.5	-56.4	-118.4	0	0	0	109.3	L76 A79 S104 A106 Y246 A250 I257 M262 K265 V267	L76-F252 HydrophobicContact CD2-CD1 3.87Å; L76-F252 HydrophobicContact CD2-CE1 3.78Å; A79-F252 HydrophobicContact CB-CZ 4.41Å; S104-F252 VanDerWaalsContact OG-CA 3.25Å; S104-F252 WeakPolarHBondContact OG-CA 3.27Å; S104-F252 WeakPolarHBondContact OG-CB 3.18Å; S104-F252 PolarHBondContact OG-N 2.87Å; S104-F252 PolarHBondContact OG-O 3.44Å; A106-F252 HydrophobicContact CB-CB 3.45Å; A106-F252 VanDerWaalsContact CB-CB 3.45Å; A106-F252 HydrophobicContact CB-CD1 3.69Å; A106-F252 HydrophobicContact CB-CD2 3.8Å; A106-F252 HydrophobicContact CB-CG 3.35Å; Y246-F252 AromaticContact CD1-CD2 3.96Å; Y246-F252 HydrophobicContact CD1-CD2 3.96Å; Y246-F252 AromaticContact CD1-CE2 3.34Å; Y246-F252 HydrophobicContact CD1-CE2 3.34Å; Y246-F252 HydrophobicContact CD1-CZ 4.35Å; Y246-F252 AromaticContact CE1-CD2 3.47Å; Y246-F252 HydrophobicContact CE1-CD2 3.47Å; Y246-F252 VanDerWaalsContact CE1-CD2 3.47Å; Y246-F252 AromaticContact CE1-CE2 3.09Å; Y246-F252 HydrophobicContact CE1-CE2 3.09Å; Y246-F252 HydrophobicContact CE1-CZ 4.06Å; Y246-F252 HydrophobicContact CG-CE2 4.44Å; A250-F252 WeakPolarHBondContact O-CD2 3.31Å; A250-F252 WeakPolarHBondContact O-CE2 3.39Å; A250-F252 PolarHBondContact O-N 3.34Å; F252-I257 HydrophobicContact CB-CD1 4.01Å; F252-I257 HydrophobicContact CB-CG1 4.06Å; F252-I257 HydrophobicContact CD1-CG1 4.4Å; F252-M262 HydrophobicContact CB-CE 3.99Å; F252-M262 HydrophobicContact CB-SD 4.41Å; F252-M262 HydrophobicContact CD1-CE 3.21Å; F252-M262 HydrophobicContact CD1-SD 3.03Å; F252-M262 WeakPolarHBondContact CD1-SD 3.24Å; F252-M262 HydrophobicContact CD2-CE 4.25Å; F252-M262 HydrophobicContact CE1-CE 3.48Å; F252-M262 VanDerWaalsContact CE1-CE 3.48Å; F252-M262 HydrophobicContact CE1-SD 3.28Å; F252-M262 WeakPolarHBondContact CE1-SD 3.47Å; F252-M262 HydrophobicContact CE2-CE 4.43Å; F252-M262 HydrophobicContact CG-CE 3.57Å; F252-M262 HydrophobicContact CG-SD 3.97Å; F252-M262 HydrophobicContact CZ-CE 4.1Å; F252-M262 HydrophobicContact CZ-SD 4.38Å; F252-K265 HydrophobicContact CE1-CD 4.46Å; F252-K265 HydrophobicContact CE2-CD 4.36Å; F252-K265 HydrophobicContact CZ-CB 4.08Å; F252-K265 HydrophobicContact CZ-CD 3.95Å; F252-V267 HydrophobicContact CE2-CG2 4.43Å; F252-V267 HydrophobicContact CZ-CG2 4.27Å
253	G	73.3	Confident	75.7	Confident	15 Å²	15	53.5 Å²	53.5	16%	0.155	25%	0.254	C	S	.	.			trans	-80.7	163.6	162.8	0	0	0	0	0	110.4	W255 E256 I257	G253-W255 PolarHBondContact O-N 2.98Å; G253-E256 WeakPolarHBondContact CA-OE2 3.44Å; G253-E256 PolarHBondContact N-OE2 3.41Å; G253-E256 VanDerWaalsContact N-OE2 3.13Å; G253-E256 PolarHBondContact O-N 3.17Å; G253-I257 VanDerWaalsContact O-CG1 3.31Å; G253-I257 WeakPolarHBondContact O-CG1 3.44Å; G253-I257 PolarHBondContact O-N 3.21Å
254	L	76.8	Confident	74.2	Confident	101 Å²	101	57.4 Å²	57.4	53%	0.529	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-35.9	176.7	-179.1	61.5	0	0	0	111.3	I257 C258	L254-I257 PolarHBondContact O-N 2.69Å; L254-C258 PolarHBondContact O-N 3.34Å; L254-C258 PolarHBondContact O-SG 3.34Å
255	W	79.2	Confident	73.4	Confident	166 Å²	166	59.1 Å²	59.1	63%	0.629	29%	0.29	S	S	*	.	H	α-helix	trans	-64	-44.7	179.8	179.8	-108.7	0	0	0	112.5	L15 G253 I257 C258 T259	L15-W255 HydrophobicContact CD2-CH2 4.39Å; G253-W255 PolarHBondContact O-N 2.98Å; W255-I257 VanDerWaalsContact C-N 3.27Å; W255-I257 PolarHBondContact O-N 3.04Å; W255-C258 PolarHBondContact O-N 3.01Å; W255-C258 VanDerWaalsContact O-N 3.17Å; W255-T259 HydrophobicContact CD2-CG2 3.86Å; W255-T259 HydrophobicContact CE3-CG2 4.18Å; W255-T259 HydrophobicContact CG-CG2 4.49Å; W255-T259 HydrophobicContact CH2-CG2 3.91Å; W255-T259 HydrophobicContact CZ2-CG2 3.56Å; W255-T259 HydrophobicContact CZ3-CG2 4.2Å; W255-T259 WeakPolarHBondContact O-CB 3.29Å; W255-T259 WeakPolarHBondContact O-CG2 3.41Å; W255-T259 PolarHBondContact O-N 3.02Å; W255-T259 PolarHBondContact O-OG1 2.79Å
256	E	76.1	Confident	72.8	Confident	68 Å²	68	60.4 Å²	60.4	32%	0.318	29%	0.294	S	S	.	.	H	α-helix	trans	-63.8	-35.5	176.7	-67.8	88	167.9	0	0	111.8	G253 G260 M262	G253-E256 WeakPolarHBondContact CA-OE2 3.44Å; G253-E256 PolarHBondContact N-OE2 3.41Å; G253-E256 VanDerWaalsContact N-OE2 3.13Å; G253-E256 PolarHBondContact O-N 3.17Å; E256-G260 WeakPolarHBondContact O-CA 3.31Å; E256-G260 PolarHBondContact O-N 2.84Å; E256-M262 HydrophobicContact CB-CE 3.76Å; E256-M262 HydrophobicContact CB-CG 3.68Å; E256-M262 HydrophobicContact CB-SD 3.72Å; E256-M262 HydrophobicContact CG-CE 4.31Å; E256-M262 HydrophobicContact CG-CG 4.49Å
257	I	74.6	Confident	72.6	Confident	3 Å²	3	59 Å²	59	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-71	-35.3	173.4	-60.9	165.1	0	0	0	111.3	H72 A75 T105 A106 F252 G253 L254 W255	H72-I257 HydrophobicContact CB-CG2 3.99Å; A75-I257 HydrophobicContact CB-CG2 4.41Å; A75-I257 WeakPolarHBondContact CB-O 3.26Å; T105-I257 HydrophobicContact CG2-CD1 4.43Å; A106-I257 HydrophobicContact CB-CD1 3.99Å; F252-I257 HydrophobicContact CB-CD1 4.01Å; F252-I257 HydrophobicContact CB-CG1 4.06Å; F252-I257 HydrophobicContact CD1-CG1 4.4Å; G253-I257 VanDerWaalsContact O-CG1 3.31Å; G253-I257 WeakPolarHBondContact O-CG1 3.44Å; G253-I257 PolarHBondContact O-N 3.21Å; L254-I257 PolarHBondContact O-N 2.69Å; W255-I257 VanDerWaalsContact C-N 3.27Å; W255-I257 PolarHBondContact O-N 3.04Å
258	C	74.5	Confident	72.9	Confident	23 Å²	23	55.3 Å²	55.3	16%	0.155	27%	0.272	C	S	.	.	H	α-helix	trans	-77	-31.9	178.4	-67.3	0	0	0	0	112.6	Y14 L15 T18 L254 W255	Y14-C258 CarbonylContact C-O 3.49Å; L15-C258 HydrophobicContact CD1-CB 4.46Å; L15-C258 PolarHBondContact N-O 3.21Å; T18-C258 HydrophobicContact CG2-CB 4.43Å; T18-C258 PolarHBondContact OG1-O 3.26Å; L254-C258 PolarHBondContact O-N 3.34Å; L254-C258 PolarHBondContact O-SG 3.34Å; W255-C258 PolarHBondContact O-N 3.01Å; W255-C258 VanDerWaalsContact O-N 3.17Å
259	T	75.7	Confident	73.8	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-96.8	-15.8	-175.6	58.4	0	0	0	0	113.5	A11 Y14 W255 T261	A11-T259 VanDerWaalsContact CA-O 3.29Å; A11-T259 WeakPolarHBondContact CA-O 3.11Å; Y14-T259 WeakPolarHBondContact CB-O 3.39Å; W255-T259 HydrophobicContact CD2-CG2 3.86Å; W255-T259 HydrophobicContact CE3-CG2 4.18Å; W255-T259 HydrophobicContact CG-CG2 4.49Å; W255-T259 HydrophobicContact CH2-CG2 3.91Å; W255-T259 HydrophobicContact CZ2-CG2 3.56Å; W255-T259 HydrophobicContact CZ3-CG2 4.2Å; W255-T259 WeakPolarHBondContact O-CB 3.29Å; W255-T259 WeakPolarHBondContact O-CG2 3.41Å; W255-T259 PolarHBondContact O-N 3.02Å; W255-T259 PolarHBondContact O-OG1 2.79Å; T259-T261 PolarHBondContact O-N 3.02Å; T259-T261 WeakPolarHBondContact OG1-CG2 3.39Å; T259-T261 PolarHBondContact OG1-OG1 3.22Å
260	G	73.5	Confident	75.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.			trans	58.2	21.4	-174.9	0	0	0	0	0	113.7	E256 M262	E256-G260 WeakPolarHBondContact O-CA 3.31Å; E256-G260 PolarHBondContact O-N 2.84Å; G260-M262 PolarHBondContact O-N 2.85Å; G260-M262 VanDerWaalsContact O-N 3.07Å
261	T	72.5	Confident	76.5	Confident	51 Å²	51	43 Å²	43	31%	0.313	21%	0.209	S	C	.	.			trans	-68.8	-0	176.6	45.3	0	0	0	0	113	V7 A11 T259	V7-T261 HydrophobicContact CG1-CG2 4.4Å; A11-T261 HydrophobicContact CB-CG2 3.46Å; A11-T261 VanDerWaalsContact CB-CG2 3.46Å; T259-T261 PolarHBondContact O-N 3.02Å; T259-T261 WeakPolarHBondContact OG1-CG2 3.39Å; T259-T261 PolarHBondContact OG1-OG1 3.22Å
262	M	68	Low	77.8	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.039	20%	0.204	C	C	.	.			trans	-66.4	135.5	-177.8	-51	-156.5	83	0	0	110.8	F252 E256 G260 K265	F252-M262 HydrophobicContact CB-CE 3.99Å; F252-M262 HydrophobicContact CB-SD 4.41Å; F252-M262 HydrophobicContact CD1-CE 3.21Å; F252-M262 HydrophobicContact CD1-SD 3.03Å; F252-M262 WeakPolarHBondContact CD1-SD 3.24Å; F252-M262 HydrophobicContact CD2-CE 4.25Å; F252-M262 HydrophobicContact CE1-CE 3.48Å; F252-M262 VanDerWaalsContact CE1-CE 3.48Å; F252-M262 HydrophobicContact CE1-SD 3.28Å; F252-M262 WeakPolarHBondContact CE1-SD 3.47Å; F252-M262 HydrophobicContact CE2-CE 4.43Å; F252-M262 HydrophobicContact CG-CE 3.57Å; F252-M262 HydrophobicContact CG-SD 3.97Å; F252-M262 HydrophobicContact CZ-CE 4.1Å; F252-M262 HydrophobicContact CZ-SD 4.38Å; E256-M262 HydrophobicContact CB-CE 3.76Å; E256-M262 HydrophobicContact CB-CG 3.68Å; E256-M262 HydrophobicContact CB-SD 3.72Å; E256-M262 HydrophobicContact CG-CE 4.31Å; E256-M262 HydrophobicContact CG-CG 4.49Å; G260-M262 PolarHBondContact O-N 2.85Å; G260-M262 VanDerWaalsContact O-N 3.07Å; M262-K265 HydrophobicContact CE-CD 3.8Å; M262-K265 VanDerWaalsContact CE-NZ 3.33Å
263	R	65.6	Low	78.8	Confident	191 Å²	191	44.3 Å²	44.3	72%	0.721	21%	0.21	S	C	*	.			trans	-64.8	155.3	160.8	-69	-173.7	-179.7	-179.8	2.4	108.7	K265	R263-K265 VanDerWaalsContact O-CG 3.32Å; R263-K265 WeakPolarHBondContact O-CG 3.5Å; R263-K265 PolarHBondContact O-N 3.22Å
264	S	63.8	Low	79.8	Confident	88 Å²	88	44.9 Å²	44.9	62%	0.615	21%	0.209	S	C	*	.			trans	-55.9	114.6	172.9	-177.3	0	0	0	0	108.7	T78	T78-S264 WeakPolarHBondContact O-CA 3.31Å; T78-S264 WeakPolarHBondContact O-CB 3.36Å; T78-S264 PolarHBondContact O-OG 2.89Å; T78-S264 VanDerWaalsContact O-OG 3.07Å
265	K	72.9	Confident	80.5	Confident	36 Å²	36	43.1 Å²	43.1	16%	0.157	20%	0.2	C	C	.	.			trans	-117.9	137.9	-170.4	-84	167.9	171.9	-160.2	0	110.1	T78 A79 T80 A250 F252 M262 R263	T78-K265 PolarHBondContact O-N 3.11Å; A79-K265 CarbonylContact C-O 3.47Å; A79-K265 WeakPolarHBondContact CA-O 3.38Å; T80-K265 PolarHBondContact N-O 3.44Å; A250-K265 HydrophobicContact CB-CD 3.79Å; A250-K265 HydrophobicContact CB-CG 3.98Å; A250-K265 PolarHBondContact O-NZ 3.19Å; F252-K265 HydrophobicContact CE1-CD 4.46Å; F252-K265 HydrophobicContact CE2-CD 4.36Å; F252-K265 HydrophobicContact CZ-CB 4.08Å; F252-K265 HydrophobicContact CZ-CD 3.95Å; M262-K265 HydrophobicContact CE-CD 3.8Å; M262-K265 VanDerWaalsContact CE-NZ 3.33Å; R263-K265 VanDerWaalsContact O-CG 3.32Å; R263-K265 WeakPolarHBondContact O-CG 3.5Å; R263-K265 PolarHBondContact O-N 3.22Å
266	K	76.8	Confident	81	Confident	31 Å²	31	36.4 Å²	36.4	14%	0.135	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.1	175	178.4	169	179	-168.9	0	110.5	F82 E247 V268	F82-K266 HydrophobicContact CD2-CD 4.17Å; F82-K266 HydrophobicContact CD2-CG 3.69Å; F82-K266 HydrophobicContact CE2-CB 4.37Å; F82-K266 HydrophobicContact CE2-CD 3.87Å; F82-K266 HydrophobicContact CE2-CG 3.58Å; F82-K266 HydrophobicContact CZ-CD 4.48Å; E247-K266 HydrophobicContact CB-CB 4.48Å; E247-K266 PolarHBondContact N-O 3.2Å; K266-V268 HydrophobicContact CD-CG2 4.46Å; K266-V268 HydrophobicContact CG-CG2 4.13Å
267	V	83.6	Confident	81.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.3	171.3	-172.1	0	0	0	0	107.6	A79 T80 V81 F82 I110 I244 A245 Y246 F252 L269	A79-V267 HydrophobicContact CB-CG2 4.18Å; T80-V267 PolarHBondContact O-N 3.37Å; V81-V267 CarbonylContact C-O 3.46Å; V81-V267 VanDerWaalsContact CA-O 3.3Å; V81-V267 WeakPolarHBondContact CA-O 3.39Å; V81-V267 HydrophobicContact CG2-CB 4.28Å; F82-V267 PolarHBondContact N-O 2.96Å; I110-V267 HydrophobicContact CD1-CG1 4.27Å; I110-V267 HydrophobicContact CD1-CG2 4.2Å; I244-V267 HydrophobicContact CG2-CG1 3.86Å; A245-V267 WeakPolarHBondContact O-CA 3.46Å; Y246-V267 HydrophobicContact CD1-CB 4.39Å; Y246-V267 HydrophobicContact CD1-CG1 4.11Å; Y246-V267 HydrophobicContact CD1-CG2 3.73Å; Y246-V267 HydrophobicContact CE1-CB 4.29Å; Y246-V267 HydrophobicContact CE1-CG1 3.78Å; Y246-V267 HydrophobicContact CE1-CG2 3.58Å; F252-V267 HydrophobicContact CE2-CG2 4.43Å; F252-V267 HydrophobicContact CZ-CG2 4.27Å; V267-L269 HydrophobicContact CG1-CD2 4.38Å
268	V	86.8	Confident	82.2	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.7	176.6	-173	0	0	0	0	108.5	F82 E84 I244 A245 K266 W301 M305	F82-V268 HydrophobicContact CB-CG1 4.46Å; F82-V268 HydrophobicContact CB-CG2 4.27Å; F82-V268 CarbonylContact O-C 3.58Å; F82-V268 WeakPolarHBondContact O-CA 3.21Å; E84-V268 HydrophobicContact CG-CG1 4.04Å; I244-V268 WeakPolarHBondContact CA-O 3.39Å; A245-V268 HydrophobicContact CB-CB 4.35Å; A245-V268 PolarHBondContact N-O 2.9Å; A245-V268 PolarHBondContact O-N 2.8Å; K266-V268 HydrophobicContact CD-CG2 4.46Å; K266-V268 HydrophobicContact CG-CG2 4.13Å; V268-W301 HydrophobicContact CB-CH2 4.3Å; V268-W301 HydrophobicContact CG1-CH2 3.95Å; V268-W301 HydrophobicContact CG1-CZ2 4.03Å; V268-M305 HydrophobicContact CB-CE 4.05Å; V268-M305 HydrophobicContact CB-SD 4.4Å; V268-M305 HydrophobicContact CG2-CE 3.67Å
269	L	89.2	Confident	82.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.1	173.7	-59.4	-179.1	0	0	0	107.7	V81 F82 E83 E84 I110 V114 I244 V267 Y271	V81-L269 HydrophobicContact CG1-CD1 3.61Å; V81-L269 HydrophobicContact CG1-CG 3.9Å; F82-L269 PolarHBondContact O-N 3.36Å; E83-L269 CarbonylContact C-O 3.47Å; E83-L269 WeakPolarHBondContact CA-O 3.42Å; E84-L269 PolarHBondContact N-O 2.77Å; I110-L269 HydrophobicContact CG2-CD1 4.11Å; I110-L269 HydrophobicContact CG2-CD2 4.37Å; V114-L269 HydrophobicContact CB-CD1 4.31Å; V114-L269 HydrophobicContact CG1-CD1 4.27Å; V114-L269 HydrophobicContact CG2-CD1 3.79Å; I244-L269 HydrophobicContact CB-CD2 4.09Å; I244-L269 HydrophobicContact CD1-CD2 4.03Å; I244-L269 HydrophobicContact CG1-CD2 3.59Å; I244-L269 HydrophobicContact CG2-CD2 3.9Å; V267-L269 HydrophobicContact CG1-CD2 4.38Å; L269-Y271 HydrophobicContact CB-CE1 4.28Å; L269-Y271 HydrophobicContact CB-CE2 4.38Å; L269-Y271 WeakPolarHBondContact CD1-OH 3.3Å
270	R	91.2	Very high	83.1	Confident	50 Å²	50	46.8 Å²	46.8	19%	0.189	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.8	172.1	-178.6	177	-174.3	-167.2	5.4	109.8	E84 V242 T243 R272 W301	E84-R270 HydrophobicContact CG-CB 3.86Å; E84-R270 HydrophobicContact CG-CG 4.05Å; E84-R270 CarbonylContact O-C 3.56Å; E84-R270 WeakPolarHBondContact O-CA 3.45Å; E84-R270 WeakPolarHBondContact OE1-CD 3.32Å; E84-R270 IonicContact OE1-NE 2.62Å; V242-R270 WeakPolarHBondContact CA-O 3.41Å; T243-R270 PolarHBondContact N-O 2.87Å; T243-R270 PolarHBondContact O-N 2.89Å; R270-R272 VanDerWaalsContact NH2-CZ 3.33Å; R270-W301 HydrophobicContact CB-CH2 3.7Å; R270-W301 HydrophobicContact CB-CZ2 3.8Å; R270-W301 HydrophobicContact CB-CZ3 4.18Å; R270-W301 HydrophobicContact CG-CZ2 4.41Å
271	Y	92.6	Very high	83.7	Confident	7 Å²	7	50.7 Å²	50.7	3%	0.027	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.6	176	-53.4	-61.8	0	0	0	110.7	E83 E84 G85 D86 I88 V114 D241 V242 L269	E83-Y271 HydrophobicContact CB-CE2 3.98Å; E83-Y271 HydrophobicContact CG-CE2 3.78Å; E84-Y271 PolarHBondContact O-N 2.88Å; G85-Y271 WeakPolarHBondContact CA-O 3.33Å; D86-Y271 PolarHBondContact N-O 3.33Å; I88-Y271 HydrophobicContact CD1-CD1 4.15Å; I88-Y271 HydrophobicContact CD1-CD2 4.28Å; I88-Y271 HydrophobicContact CD1-CE1 3.82Å; I88-Y271 HydrophobicContact CD1-CE2 3.93Å; I88-Y271 HydrophobicContact CD1-CG 4.38Å; I88-Y271 HydrophobicContact CG1-CD2 4.38Å; I88-Y271 HydrophobicContact CG1-CE2 4.35Å; I88-Y271 HydrophobicContact CG2-CD1 4.01Å; I88-Y271 HydrophobicContact CG2-CD2 4.13Å; I88-Y271 HydrophobicContact CG2-CG 3.68Å; V114-Y271 WeakPolarHBondContact CG1-OH 3.28Å; D241-Y271 CarbonylContact O-C 3.57Å; D241-Y271 WeakPolarHBondContact O-CA 3.4Å; V242-Y271 HydrophobicContact CB-CD1 4.46Å; V242-Y271 HydrophobicContact CG1-CD1 4.06Å; V242-Y271 HydrophobicContact CG1-CE1 3.83Å; V242-Y271 HydrophobicContact CG2-CD1 3.95Å; V242-Y271 HydrophobicContact CG2-CE1 4.14Å; L269-Y271 HydrophobicContact CB-CE1 4.28Å; L269-Y271 HydrophobicContact CB-CE2 4.38Å; L269-Y271 WeakPolarHBondContact CD1-OH 3.3Å
272	R	94.7	Very high	84.3	Confident	68 Å²	68	49.4 Å²	49.4	26%	0.257	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.6	161.3	-63.6	-164.8	-173.8	-166.1	21.6	110.1	D86 D241 R270 E297	D86-R272 VanDerWaalsContact OD2-CA 3.31Å; D86-R272 WeakPolarHBondContact OD2-CA 3.32Å; D241-R272 HydrophobicContact CB-CB 4.27Å; D241-R272 PolarHBondContact N-O 2.85Å; D241-R272 PolarHBondContact O-N 2.77Å; R270-R272 VanDerWaalsContact NH2-CZ 3.33Å; R272-E297 IonicContact CZ-OE2 3.03Å; R272-E297 IonicContact NE-OE2 2.87Å; R272-E297 IonicContact NH1-OE2 3.8Å; R272-E297 PolarHBondContact NH1-OE2 2.91Å; R272-E297 IonicContact NH2-OE2 3.06Å; R272-E297 PolarHBondContact NH2-OE2 3.1Å
273	C	93.6	Very high	85.2	Confident	21 Å²	21	50.6 Å²	50.6	14%	0.142	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.6	-177.4	-68.3	0	0	0	0	109.6	D86 Y91	D86-C273 HydrophobicContact CB-CB 4.23Å; D86-C273 PolarHBondContact OD2-N 3.34Å; Y91-C273 HydrophobicContact CE1-CB 4.3Å; Y91-C273 HydrophobicContact CE2-CB 3.81Å; Y91-C273 WeakPolarHBondContact CE2-SG 3.48Å; Y91-C273 WeakPolarHBondContact OH-CB 3.14Å
274	H	94.1	Very high	86.2	Confident	27 Å²	27	46.9 Å²	46.9	13%	0.125	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.3	-176.9	-65.2	-84.3	0	0	0	109.7	Y238 I239 E278	Y238-H274 WeakPolarHBondContact CA-O 3.25Å; I239-H274 HydrophobicContact CB-CB 4.15Å; I239-H274 PolarHBondContact N-O 3.19Å; I239-H274 PolarHBondContact O-N 3.24Å; H274-E278 WeakPolarHBondContact CA-OE1 3.43Å; H274-E278 WeakPolarHBondContact CB-OE1 3.44Å; H274-E278 IonicContact CE1-OE2 3.86Å; H274-E278 IonicContact CG-OE1 3.93Å; H274-E278 IonicContact CG-OE2 3.96Å; H274-E278 IonicContact ND1-OE1 3.74Å; H274-E278 PolarHBondContact ND1-OE1 2.93Å; H274-E278 IonicContact ND1-OE2 3.31Å; H274-E278 PolarHBondContact ND1-OE2 2.91Å
275	D	92.1	Very high	87.5	Confident	65 Å²	65	49 Å²	49	35%	0.348	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	144.2	169.6	-158.7	-58.2	0	0	0	109.6	S277 E278	D275-S277 PolarHBondContact O-N 3.47Å; D275-S277 WeakPolarHBondContact OD1-CB 3.46Å; D275-S277 PolarHBondContact OD1-N 2.84Å; D275-S277 PolarHBondContact OD1-OG 3.32Å; D275-E278 PolarHBondContact N-OE1 3.04Å; D275-E278 WeakPolarHBondContact O-CB 3.36Å; D275-E278 WeakPolarHBondContact O-CG 3.2Å; D275-E278 PolarHBondContact O-N 2.82Å; D275-E278 VanDerWaalsContact O-N 3.11Å
276	I	89.2	Confident	88.3	Confident	24 Å²	24	47.7 Å²	47.7	12%	0.123	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-59.6	-26.9	172.7	-160	62.7	0	0	0	111.8	L215 A219 L236 R237 I239 E278 I279	L215-I276 HydrophobicContact CD2-CD1 3.45Å; L215-I276 VanDerWaalsContact CD2-CD1 3.45Å; L215-I276 HydrophobicContact CD2-CG1 4.28Å; A219-I276 HydrophobicContact CB-CD1 4.43Å; A219-I276 HydrophobicContact CB-CG1 3.91Å; L236-I276 HydrophobicContact CD2-CD1 3.61Å; L236-I276 HydrophobicContact CD2-CG1 4.3Å; L236-I276 HydrophobicContact CG-CD1 4.26Å; R237-I276 WeakPolarHBondContact O-CB 3.32Å; R237-I276 WeakPolarHBondContact O-CG2 3.16Å; R237-I276 PolarHBondContact O-N 2.96Å; I239-I276 HydrophobicContact CD1-CD1 3.84Å; I239-I276 HydrophobicContact CG1-CD1 3.61Å; I276-E278 PolarHBondContact O-N 3.36Å; I276-I279 PolarHBondContact O-N 2.56Å
277	S	87	Confident	89.1	Confident	77 Å²	77	46.2 Å²	46.2	54%	0.538	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-65	-13.3	177	69.6	0	0	0	0	113.7	D275 I279	D275-S277 PolarHBondContact O-N 3.47Å; D275-S277 WeakPolarHBondContact OD1-CB 3.46Å; D275-S277 PolarHBondContact OD1-N 2.84Å; D275-S277 PolarHBondContact OD1-OG 3.32Å; S277-I279 PolarHBondContact O-N 3.07Å
278	E	88.8	Confident	89.5	Confident	84 Å²	84	47.2 Å²	47.2	39%	0.393	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-69.5	-17.4	174.1	-66.1	178.8	-149.9	0	0	113	H274 D275 I276 D280 Y290	H274-E278 WeakPolarHBondContact CA-OE1 3.43Å; H274-E278 WeakPolarHBondContact CB-OE1 3.44Å; H274-E278 IonicContact CE1-OE2 3.86Å; H274-E278 IonicContact CG-OE1 3.93Å; H274-E278 IonicContact CG-OE2 3.96Å; H274-E278 IonicContact ND1-OE1 3.74Å; H274-E278 PolarHBondContact ND1-OE1 2.93Å; H274-E278 IonicContact ND1-OE2 3.31Å; H274-E278 PolarHBondContact ND1-OE2 2.91Å; D275-E278 PolarHBondContact N-OE1 3.04Å; D275-E278 WeakPolarHBondContact O-CB 3.36Å; D275-E278 WeakPolarHBondContact O-CG 3.2Å; D275-E278 PolarHBondContact O-N 2.82Å; D275-E278 VanDerWaalsContact O-N 3.11Å; I276-E278 PolarHBondContact O-N 3.36Å; E278-D280 PolarHBondContact O-N 3.46Å; E278-Y290 HydrophobicContact CB-CE2 3.89Å; E278-Y290 PolarHBondContact OE2-OH 3.01Å
279	I	87.7	Confident	89.9	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	27%	0.266	C	S	.	.			trans	-95.2	82.3	173.4	-51.8	-178.2	0	0	0	108.7	M211 L215 I239 I276 S277 H282 I287 Y290	M211-I279 HydrophobicContact CE-CD1 4.21Å; L215-I279 HydrophobicContact CD1-CD1 3.86Å; L215-I279 HydrophobicContact CD1-CG2 4.13Å; L215-I279 HydrophobicContact CD2-CD1 4.46Å; I239-I279 HydrophobicContact CD1-CD1 3.45Å; I239-I279 VanDerWaalsContact CD1-CD1 3.45Å; I239-I279 HydrophobicContact CD1-CG1 3.88Å; I276-I279 PolarHBondContact O-N 2.56Å; S277-I279 PolarHBondContact O-N 3.07Å; I279-H282 PolarHBondContact O-CD2 3.21Å; I279-H282 VanDerWaalsContact O-CD2 3.24Å; I279-H282 PolarHBondContact O-NE2 2.81Å; I279-I287 HydrophobicContact CG2-CG1 4.28Å; I279-Y290 HydrophobicContact CD1-CD1 3.81Å; I279-Y290 HydrophobicContact CD1-CE1 3.85Å; I279-Y290 HydrophobicContact CD1-CG 4.44Å; I279-Y290 HydrophobicContact CG1-CD1 3.78Å; I279-Y290 HydrophobicContact CG1-CD2 4.18Å; I279-Y290 HydrophobicContact CG1-CE1 3.83Å; I279-Y290 HydrophobicContact CG1-CE2 4.24Å; I279-Y290 HydrophobicContact CG1-CG 3.96Å
280	D	82.1	Confident	90.1	Very high	148 Å²	148	52 Å²	52	79%	0.791	27%	0.27	S	S	*	.			trans	-65	-40.4	177.5	-65.6	-47.1	0	0	0	112.1	E278	E278-D280 PolarHBondContact O-N 3.46Å
281	D	85	Confident	90.3	Very high	81 Å²	81	49.6 Å²	49.6	43%	0.433	26%	0.261	S	S	.	.			trans	-104.1	105.9	-177.7	-176.6	15.6	0	0	0	112.1	S283 G286 I287	D281-S283 PolarHBondContact O-N 3.24Å; D281-S283 WeakPolarHBondContact OD1-CB 3.49Å; D281-S283 PolarHBondContact OD1-N 2.73Å; D281-S283 PolarHBondContact OD1-OG 2.95Å; D281-S283 VanDerWaalsContact OD1-OG 3.1Å; D281-S283 WeakPolarHBondContact OD2-CB 3.11Å; D281-S283 PolarHBondContact OD2-OG 2.76Å; D281-G286 CarbonylContact O-C 3.56Å; D281-G286 WeakPolarHBondContact OD2-CA 3.45Å; D281-G286 PolarHBondContact OD2-N 2.92Å; D281-I287 PolarHBondContact O-N 3.13Å
282	H	84.5	Confident	90.4	Very high	24 Å²	24	49.9 Å²	49.9	11%	0.111	27%	0.265	C	S	.	.			trans	-79.6	6.1	176	-65.4	-158.9	0	0	0	113.1	R220 I279 I287	R220-H282 PolarHBondContact NE-ND1 2.81Å; I279-H282 PolarHBondContact O-CD2 3.21Å; I279-H282 VanDerWaalsContact O-CD2 3.24Å; I279-H282 PolarHBondContact O-NE2 2.81Å; H282-I287 WeakPolarHBondContact O-CD1 3.21Å
283	S	86.9	Confident	90.5	Very high	34 Å²	34	53.1 Å²	53.1	24%	0.238	28%	0.28	C	S	.	.	S	Bend	trans	-64	166.6	170.4	81.9	0	0	0	0	111.4	D281 E285 G286 I287	D281-S283 PolarHBondContact O-N 3.24Å; D281-S283 WeakPolarHBondContact OD1-CB 3.49Å; D281-S283 PolarHBondContact OD1-N 2.73Å; D281-S283 PolarHBondContact OD1-OG 2.95Å; D281-S283 VanDerWaalsContact OD1-OG 3.1Å; D281-S283 WeakPolarHBondContact OD2-CB 3.11Å; D281-S283 PolarHBondContact OD2-OG 2.76Å; S283-E285 PolarHBondContact O-N 3.25Å; S283-E285 PolarHBondContact OG-N 2.77Å; S283-G286 PolarHBondContact OG-N 3.22Å; S283-I287 WeakPolarHBondContact O-CB 3.37Å; S283-I287 WeakPolarHBondContact O-CD1 3.32Å; S283-I287 WeakPolarHBondContact O-CG1 3.45Å; S283-I287 PolarHBondContact O-N 3.05Å
284	K	87.7	Confident	90.6	Very high	112 Å²	112	52.3 Å²	52.3	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-35.7	177.2	-73.2	176.1	-177.7	167.5	0	111.2	T208 L288	T208-K284 WeakPolarHBondContact CG2-O 3.22Å; K284-L288 VanDerWaalsContact O-CB 3.23Å; K284-L288 WeakPolarHBondContact O-CB 3.28Å; K284-L288 PolarHBondContact O-N 3.39Å
285	E	90.4	Very high	90.7	Very high	132 Å²	132	51 Å²	51	62%	0.617	27%	0.269	S	S	*	.	H	α-helix	trans	-74	-44	-177.3	-64.8	67.1	-148	0	0	110.7	S283 L288 S289	S283-E285 PolarHBondContact O-N 3.25Å; S283-E285 PolarHBondContact OG-N 2.77Å; E285-L288 PolarHBondContact O-N 2.93Å; E285-S289 PolarHBondContact O-N 3.3Å; E285-S289 PolarHBondContact O-OG 3.35Å
286	G	91.3	Very high	90.9	Very high	9 Å²	9	50.5 Å²	50.5	9%	0.093	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-44	175.5	0	0	0	0	0	113.2	D281 S283 L288 S289 Y290	D281-G286 CarbonylContact O-C 3.56Å; D281-G286 WeakPolarHBondContact OD2-CA 3.45Å; D281-G286 PolarHBondContact OD2-N 2.92Å; S283-G286 PolarHBondContact OG-N 3.22Å; G286-L288 VanDerWaalsContact C-N 3.3Å; G286-L288 PolarHBondContact O-N 3.1Å; G286-S289 PolarHBondContact O-N 3.11Å; G286-S289 PolarHBondContact O-OG 2.79Å; G286-Y290 WeakPolarHBondContact O-CB 3.1Å; G286-Y290 PolarHBondContact O-N 3.16Å
287	I	91.9	Very high	91.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.1	-39	173.6	-64.2	167.1	0	0	0	110.5	T208 M211 Q212 L215 I279 D281 H282 S283 L291	T208-I287 HydrophobicContact CG2-CB 4.11Å; T208-I287 HydrophobicContact CG2-CG2 3.79Å; M211-I287 HydrophobicContact CB-CG2 4.09Å; M211-I287 HydrophobicContact CE-CG2 4.1Å; Q212-I287 HydrophobicContact CB-CD1 3.88Å; Q212-I287 HydrophobicContact CG-CD1 4.29Å; L215-I287 HydrophobicContact CD1-CD1 3.78Å; L215-I287 HydrophobicContact CD1-CG1 3.92Å; I279-I287 HydrophobicContact CG2-CG1 4.28Å; D281-I287 PolarHBondContact O-N 3.13Å; H282-I287 WeakPolarHBondContact O-CD1 3.21Å; S283-I287 WeakPolarHBondContact O-CB 3.37Å; S283-I287 WeakPolarHBondContact O-CD1 3.32Å; S283-I287 WeakPolarHBondContact O-CG1 3.45Å; S283-I287 PolarHBondContact O-N 3.05Å; I287-L291 HydrophobicContact CG2-CD1 3.77Å; I287-L291 HydrophobicContact CG2-CG 4.28Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 VanDerWaalsContact O-CG 3.22Å; I287-L291 WeakPolarHBondContact O-CG 3.25Å; I287-L291 PolarHBondContact O-N 3.43Å
288	L	93.5	Very high	91.6	Very high	22 Å²	22	48.4 Å²	48.4	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-43.8	179.7	-177.4	58.9	0	0	0	111.2	Y197 P206 T208 K284 E285 G286 L291 C292	Y197-L288 HydrophobicContact CE1-CD2 3.77Å; Y197-L288 HydrophobicContact CE2-CD2 4.22Å; Y197-L288 WeakPolarHBondContact OH-CD2 3.03Å; P206-L288 HydrophobicContact CG-CD1 4.41Å; T208-L288 HydrophobicContact CG2-CB 3.61Å; T208-L288 HydrophobicContact CG2-CD1 4.1Å; T208-L288 HydrophobicContact CG2-CG 4.42Å; K284-L288 VanDerWaalsContact O-CB 3.23Å; K284-L288 WeakPolarHBondContact O-CB 3.28Å; K284-L288 PolarHBondContact O-N 3.39Å; E285-L288 PolarHBondContact O-N 2.93Å; G286-L288 VanDerWaalsContact C-N 3.3Å; G286-L288 PolarHBondContact O-N 3.1Å; L288-L291 PolarHBondContact O-N 2.88Å; L288-C292 VanDerWaalsContact O-CB 3.31Å; L288-C292 WeakPolarHBondContact O-CB 3.42Å; L288-C292 PolarHBondContact O-N 2.77Å; L288-C292 PolarHBondContact O-SG 3.38Å
289	S	93.7	Very high	92	Very high	75 Å²	75	45.1 Å²	45.1	52%	0.524	23%	0.234	S	C	.	.	H	α-helix	trans	-63.7	-44	179.2	67.3	0	0	0	0	111.5	E285 G286 C292 K293	E285-S289 PolarHBondContact O-N 3.3Å; E285-S289 PolarHBondContact O-OG 3.35Å; G286-S289 PolarHBondContact O-N 3.11Å; G286-S289 PolarHBondContact O-OG 2.79Å; S289-C292 PolarHBondContact O-N 2.61Å; S289-K293 PolarHBondContact O-N 3.2Å
290	Y	94.6	Very high	92.3	Very high	25 Å²	25	49.4 Å²	49.4	10%	0.098	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-49.4	173.9	179.2	-98.7	0	0	0	111.7	I239 E278 I279 G286 C292 K293 L294	I239-Y290 HydrophobicContact CD1-CE1 4.1Å; E278-Y290 HydrophobicContact CB-CE2 3.89Å; E278-Y290 PolarHBondContact OE2-OH 3.01Å; I279-Y290 HydrophobicContact CD1-CD1 3.81Å; I279-Y290 HydrophobicContact CD1-CE1 3.85Å; I279-Y290 HydrophobicContact CD1-CG 4.44Å; I279-Y290 HydrophobicContact CG1-CD1 3.78Å; I279-Y290 HydrophobicContact CG1-CD2 4.18Å; I279-Y290 HydrophobicContact CG1-CE1 3.83Å; I279-Y290 HydrophobicContact CG1-CE2 4.24Å; I279-Y290 HydrophobicContact CG1-CG 3.96Å; G286-Y290 WeakPolarHBondContact O-CB 3.1Å; G286-Y290 PolarHBondContact O-N 3.16Å; Y290-C292 VanDerWaalsContact C-N 3.34Å; Y290-C292 PolarHBondContact O-N 2.65Å; Y290-K293 WeakPolarHBondContact O-CB 3.19Å; Y290-K293 PolarHBondContact O-N 2.83Å; Y290-L294 HydrophobicContact CD1-CD1 4.14Å; Y290-L294 HydrophobicContact CE1-CD1 3.46Å; Y290-L294 VanDerWaalsContact CE1-CD1 3.46Å; Y290-L294 HydrophobicContact CE1-CG 4.22Å; Y290-L294 PolarHBondContact O-N 3Å
291	L	95	Very high	92.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-37	178.3	-71.1	172.4	0	0	0	112.5	I99 P206 T208 M211 I287 L288 K293 L294 W295	I99-L291 HydrophobicContact CD1-CD2 4.14Å; P206-L291 HydrophobicContact CB-CB 3.99Å; P206-L291 HydrophobicContact CB-CD1 4.01Å; P206-L291 HydrophobicContact CG-CB 3.53Å; P206-L291 HydrophobicContact CG-CD1 4.38Å; T208-L291 HydrophobicContact CG2-CD1 4.27Å; M211-L291 HydrophobicContact CE-CD1 4.23Å; M211-L291 HydrophobicContact CE-CD2 3.91Å; M211-L291 HydrophobicContact CE-CG 4.23Å; M211-L291 HydrophobicContact SD-CD1 3.52Å; M211-L291 VanDerWaalsContact SD-CD1 3.52Å; M211-L291 HydrophobicContact SD-CD2 3.56Å; M211-L291 VanDerWaalsContact SD-CD2 3.56Å; M211-L291 HydrophobicContact SD-CG 3.99Å; I287-L291 HydrophobicContact CG2-CD1 3.77Å; I287-L291 HydrophobicContact CG2-CG 4.28Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 VanDerWaalsContact O-CG 3.22Å; I287-L291 WeakPolarHBondContact O-CG 3.25Å; I287-L291 PolarHBondContact O-N 3.43Å; L288-L291 PolarHBondContact O-N 2.88Å; L291-K293 VanDerWaalsContact C-N 3.3Å; L291-K293 PolarHBondContact O-N 2.9Å; L291-L294 PolarHBondContact O-N 3.43Å; L291-W295 HydrophobicContact CB-CE3 4.4Å; L291-W295 HydrophobicContact CD2-CE3 4.22Å; L291-W295 HydrophobicContact CD2-CH2 4.28Å; L291-W295 HydrophobicContact CD2-CZ3 3.64Å; L291-W295 VanDerWaalsContact O-CB 3.31Å; L291-W295 WeakPolarHBondContact O-CB 3.21Å; L291-W295 PolarHBondContact O-N 3.19Å
292	C	95.2	Very high	93.2	Very high	14 Å²	14	40.7 Å²	40.7	10%	0.095	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-39	174.9	-78.9	0	0	0	0	111.6	L288 S289 Y290 W295 T296	L288-C292 VanDerWaalsContact O-CB 3.31Å; L288-C292 WeakPolarHBondContact O-CB 3.42Å; L288-C292 PolarHBondContact O-N 2.77Å; L288-C292 PolarHBondContact O-SG 3.38Å; S289-C292 PolarHBondContact O-N 2.61Å; Y290-C292 VanDerWaalsContact C-N 3.34Å; Y290-C292 PolarHBondContact O-N 2.65Å; C292-W295 PolarHBondContact O-N 3.49Å; C292-T296 PolarHBondContact O-N 3.42Å; C292-T296 PolarHBondContact O-OG1 2.96Å
293	K	95.5	Very high	93.5	Very high	135 Å²	135	44 Å²	44	59%	0.587	22%	0.222	S	C	*	.	H	α-helix	trans	-60.1	-52.2	174.4	-176.1	-175.2	175.3	-172.8	0	111.1	S289 Y290 L291 W295 T296 E297	S289-K293 PolarHBondContact O-N 3.2Å; Y290-K293 WeakPolarHBondContact O-CB 3.19Å; Y290-K293 PolarHBondContact O-N 2.83Å; L291-K293 VanDerWaalsContact C-N 3.3Å; L291-K293 PolarHBondContact O-N 2.9Å; K293-W295 VanDerWaalsContact C-N 3.3Å; K293-W295 PolarHBondContact O-N 3.06Å; K293-T296 PolarHBondContact O-N 3.43Å; K293-E297 PolarHBondContact O-N 2.98Å
294	L	96	Very high	93.7	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-41.1	177.2	-64.8	-177.1	0	0	0	111.6	I99 Y290 L291 T296 E297 K298	I99-L294 HydrophobicContact CD1-CD1 3.6Å; Y290-L294 HydrophobicContact CD1-CD1 4.14Å; Y290-L294 HydrophobicContact CE1-CD1 3.46Å; Y290-L294 VanDerWaalsContact CE1-CD1 3.46Å; Y290-L294 HydrophobicContact CE1-CG 4.22Å; Y290-L294 PolarHBondContact O-N 3Å; L291-L294 PolarHBondContact O-N 3.43Å; L294-T296 PolarHBondContact O-N 3.07Å; L294-E297 WeakPolarHBondContact O-CB 3.45Å; L294-E297 PolarHBondContact O-N 3.49Å; L294-K298 WeakPolarHBondContact O-CG 3.28Å; L294-K298 PolarHBondContact O-N 3.36Å
295	W	96.5	Very high	93.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.9	-32.5	179.9	-97.1	-118.9	0	0	0	113	I99 P176 E177 F200 V203 V204 P206 L291 C292 K293 K298 E299	I99-W295 HydrophobicContact CD1-CZ3 4.26Å; P176-W295 HydrophobicContact CB-CH2 4Å; P176-W295 HydrophobicContact CB-CZ2 3.88Å; P176-W295 HydrophobicContact CG-CH2 3.59Å; P176-W295 HydrophobicContact CG-CZ2 3.93Å; E177-W295 HydrophobicContact CG-CZ2 4.37Å; F200-W295 HydrophobicContact CE2-CB 3.99Å; F200-W295 HydrophobicContact CZ-CB 3.98Å; V203-W295 HydrophobicContact CG2-CB 4.24Å; V203-W295 VanDerWaalsContact CG2-CD1 3.46Å; V203-W295 HydrophobicContact CG2-CG 4.17Å; V204-W295 PolarHBondContact O-NE1 2.89Å; P206-W295 HydrophobicContact CB-CD2 4.15Å; P206-W295 HydrophobicContact CB-CZ2 4.22Å; P206-W295 HydrophobicContact CG-CD2 4.01Å; P206-W295 HydrophobicContact CG-CE3 4.46Å; P206-W295 HydrophobicContact CG-CG 4.05Å; L291-W295 HydrophobicContact CB-CE3 4.4Å; L291-W295 HydrophobicContact CD2-CE3 4.22Å; L291-W295 HydrophobicContact CD2-CH2 4.28Å; L291-W295 HydrophobicContact CD2-CZ3 3.64Å; L291-W295 VanDerWaalsContact O-CB 3.31Å; L291-W295 WeakPolarHBondContact O-CB 3.21Å; L291-W295 PolarHBondContact O-N 3.19Å; C292-W295 PolarHBondContact O-N 3.49Å; K293-W295 VanDerWaalsContact C-N 3.3Å; K293-W295 PolarHBondContact O-N 3.06Å; W295-K298 HydrophobicContact CD2-CD 4.41Å; W295-K298 HydrophobicContact CE3-CD 4.42Å; W295-K298 PolarHBondContact O-N 3.33Å; W295-E299 WeakPolarHBondContact O-CB 3.42Å; W295-E299 PolarHBondContact O-N 2.97Å
296	T	96.6	Very high	93.3	Very high	54 Å²	54	34.8 Å²	34.8	33%	0.331	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-45.1	170.5	-59.4	0	0	0	0	110.7	C292 K293 L294 K298 E299 D300	C292-T296 PolarHBondContact O-N 3.42Å; C292-T296 PolarHBondContact O-OG1 2.96Å; K293-T296 PolarHBondContact O-N 3.43Å; L294-T296 PolarHBondContact O-N 3.07Å; T296-K298 VanDerWaalsContact C-N 3.29Å; T296-K298 PolarHBondContact O-N 2.89Å; T296-E299 WeakPolarHBondContact O-CB 3.31Å; T296-E299 PolarHBondContact O-N 3.04Å; T296-D300 PolarHBondContact O-N 2.95Å
297	E	95.6	Very high	93	Very high	55 Å²	55	39.1 Å²	39.1	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-64.3	-34.4	176.9	-62.8	-178.9	-153	0	0	112.6	R272 K293 L294 W301	R272-E297 IonicContact CZ-OE2 3.03Å; R272-E297 IonicContact NE-OE2 2.87Å; R272-E297 IonicContact NH1-OE2 3.8Å; R272-E297 PolarHBondContact NH1-OE2 2.91Å; R272-E297 IonicContact NH2-OE2 3.06Å; R272-E297 PolarHBondContact NH2-OE2 3.1Å; K293-E297 PolarHBondContact O-N 2.98Å; L294-E297 WeakPolarHBondContact O-CB 3.45Å; L294-E297 PolarHBondContact O-N 3.49Å; E297-W301 WeakPolarHBondContact O-CB 3.27Å; E297-W301 PolarHBondContact O-N 2.57Å; E297-W301 VanDerWaalsContact O-N 3.11Å
298	K	96.2	Very high	92.4	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-67.1	-44.7	172.4	-67.3	-171.7	-177	-169.9	0	112.2	N101 V203 D241 V242 T243 L294 W295 T296 W301 L302	N101-K298 HydrophobicContact CB-CD 4.45Å; V203-K298 HydrophobicContact CG1-CB 3.94Å; D241-K298 WeakPolarHBondContact OD1-CE 3.37Å; D241-K298 IonicContact OD1-NZ 2.77Å; D241-K298 PolarHBondContact OD1-NZ 3.36Å; D241-K298 WeakPolarHBondContact OD2-CE 3.36Å; D241-K298 IonicContact OD2-NZ 3.62Å; V242-K298 PolarHBondContact O-NZ 2.81Å; T243-K298 HydrophobicContact CG2-CB 4.23Å; T243-K298 HydrophobicContact CG2-CD 4.14Å; T243-K298 HydrophobicContact CG2-CG 4.04Å; T243-K298 WeakPolarHBondContact OG1-CD 2.96Å; T243-K298 VanDerWaalsContact OG1-CE 3.28Å; T243-K298 WeakPolarHBondContact OG1-CE 3.37Å; T243-K298 WeakPolarHBondContact OG1-CG 3.41Å; L294-K298 WeakPolarHBondContact O-CG 3.28Å; L294-K298 PolarHBondContact O-N 3.36Å; W295-K298 HydrophobicContact CD2-CD 4.41Å; W295-K298 HydrophobicContact CE3-CD 4.42Å; W295-K298 PolarHBondContact O-N 3.33Å; T296-K298 VanDerWaalsContact C-N 3.29Å; T296-K298 PolarHBondContact O-N 2.89Å; K298-W301 PolarHBondContact O-N 3.46Å; K298-L302 VanDerWaalsContact O-CB 3.28Å; K298-L302 WeakPolarHBondContact O-CB 3.25Å; K298-L302 WeakPolarHBondContact O-CG 3.42Å; K298-L302 PolarHBondContact O-N 3.04Å
299	E	95.2	Very high	91.3	Very high	15 Å²	15	43.6 Å²	43.6	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-57	-51	177.3	178.8	74.1	-176.7	0	0	110.1	F200 N201 Y202 V203 W295 T296 W301 L302 K303	F200-E299 HydrophobicContact CD1-CB 3.87Å; F200-E299 HydrophobicContact CD1-CG 3.9Å; F200-E299 HydrophobicContact CE1-CB 4.32Å; N201-E299 WeakPolarHBondContact CA-OE1 2.96Å; N201-E299 WeakPolarHBondContact CB-OE1 3.22Å; N201-E299 VanDerWaalsContact N-CD 3.34Å; N201-E299 PolarHBondContact N-OE1 3.24Å; N201-E299 PolarHBondContact N-OE2 3.25Å; Y202-E299 WeakPolarHBondContact CA-OE2 3.41Å; Y202-E299 WeakPolarHBondContact CB-OE2 3.37Å; Y202-E299 WeakPolarHBondContact CD2-OE1 3.27Å; Y202-E299 PolarHBondContact N-OE1 3.39Å; Y202-E299 PolarHBondContact N-OE2 3.35Å; V203-E299 HydrophobicContact CG2-CB 4.18Å; V203-E299 PolarHBondContact N-OE2 3.46Å; W295-E299 WeakPolarHBondContact O-CB 3.42Å; W295-E299 PolarHBondContact O-N 2.97Å; T296-E299 WeakPolarHBondContact O-CB 3.31Å; T296-E299 PolarHBondContact O-N 3.04Å; E299-W301 PolarHBondContact O-N 3.16Å; E299-L302 PolarHBondContact O-N 3.04Å; E299-K303 WeakPolarHBondContact O-CB 2.88Å; E299-K303 PolarHBondContact O-N 3.29Å
300	D	94.9	Very high	90.2	Very high	95 Å²	95	43 Å²	43	51%	0.508	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-41.9	-178.6	-68.9	-25	0	0	0	111.7	T296 K303 A304	T296-D300 PolarHBondContact O-N 2.95Å; D300-K303 PolarHBondContact O-N 2.94Å; D300-A304 WeakPolarHBondContact O-CB 3.44Å; D300-A304 PolarHBondContact O-N 2.82Å
301	W	93.3	Very high	88.8	Confident	32 Å²	32	48.7 Å²	48.7	12%	0.121	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-42.6	178.2	-179.1	77.8	0	0	0	112.9	E84 T243 A245 V268 R270 E297 K298 E299 K303 A304 M305	E84-W301 HydrophobicContact CG-CZ2 4.38Å; E84-W301 WeakPolarHBondContact OE1-CZ2 3.44Å; E84-W301 PolarHBondContact OE1-NE1 3.46Å; T243-W301 HydrophobicContact CG2-CE3 3.66Å; T243-W301 HydrophobicContact CG2-CZ3 3.55Å; A245-W301 HydrophobicContact CB-CH2 3.86Å; A245-W301 HydrophobicContact CB-CZ3 3.73Å; V268-W301 HydrophobicContact CB-CH2 4.3Å; V268-W301 HydrophobicContact CG1-CH2 3.95Å; V268-W301 HydrophobicContact CG1-CZ2 4.03Å; R270-W301 HydrophobicContact CB-CH2 3.7Å; R270-W301 HydrophobicContact CB-CZ2 3.8Å; R270-W301 HydrophobicContact CB-CZ3 4.18Å; R270-W301 HydrophobicContact CG-CZ2 4.41Å; E297-W301 WeakPolarHBondContact O-CB 3.27Å; E297-W301 PolarHBondContact O-N 2.57Å; E297-W301 VanDerWaalsContact O-N 3.11Å; K298-W301 PolarHBondContact O-N 3.46Å; E299-W301 PolarHBondContact O-N 3.16Å; W301-K303 VanDerWaalsContact C-N 3.31Å; W301-K303 PolarHBondContact O-N 3.36Å; W301-A304 PolarHBondContact O-N 2.98Å; W301-M305 HydrophobicContact CD2-CG 4.45Å; W301-M305 HydrophobicContact CD2-SD 4.24Å; W301-M305 HydrophobicContact CE3-SD 4.22Å; W301-M305 HydrophobicContact CH2-SD 3.27Å; W301-M305 WeakPolarHBondContact CH2-SD 3.48Å; W301-M305 HydrophobicContact CZ2-CG 4.19Å; W301-M305 HydrophobicContact CZ2-SD 3.22Å; W301-M305 WeakPolarHBondContact CZ2-SD 3.28Å; W301-M305 HydrophobicContact CZ3-SD 3.78Å; W301-M305 PolarHBondContact O-N 3.22Å
302	L	92.5	Very high	87	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-36.8	176.3	-72.9	169.8	0	0	0	111.5	Y202 V203 T243 A245 K298 E299 M305 A306	Y202-L302 HydrophobicContact CG-CB 4.15Å; V203-L302 HydrophobicContact CG1-CD1 3.57Å; T243-L302 HydrophobicContact CG2-CD1 4.16Å; T243-L302 HydrophobicContact CG2-CD2 4.15Å; T243-L302 HydrophobicContact CG2-CG 4.09Å; A245-L302 HydrophobicContact CB-CD2 3.54Å; K298-L302 VanDerWaalsContact O-CB 3.28Å; K298-L302 WeakPolarHBondContact O-CB 3.25Å; K298-L302 WeakPolarHBondContact O-CG 3.42Å; K298-L302 PolarHBondContact O-N 3.04Å; E299-L302 PolarHBondContact O-N 3.04Å; L302-M305 PolarHBondContact O-N 2.62Å; L302-A306 WeakPolarHBondContact O-CB 3.32Å; L302-A306 PolarHBondContact O-N 3.23Å
303	K	91.5	Very high	84.7	Confident	93 Å²	93	51.7 Å²	51.7	40%	0.404	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-49.6	173.1	-179.6	179.3	171	-173	0	111.3	Y202 E299 D300 W301 M305 A306 E307	Y202-K303 HydrophobicContact CD2-CB 3.86Å; Y202-K303 HydrophobicContact CE2-CB 3.58Å; Y202-K303 HydrophobicContact CE2-CD 4.46Å; Y202-K303 HydrophobicContact CE2-CG 3.8Å; E299-K303 WeakPolarHBondContact O-CB 2.88Å; E299-K303 PolarHBondContact O-N 3.29Å; D300-K303 PolarHBondContact O-N 2.94Å; W301-K303 VanDerWaalsContact C-N 3.31Å; W301-K303 PolarHBondContact O-N 3.36Å; K303-M305 VanDerWaalsContact C-N 3.31Å; K303-M305 PolarHBondContact O-N 3.49Å; K303-A306 PolarHBondContact O-N 3.25Å; K303-A306 VanDerWaalsContact O-N 3.11Å; K303-E307 WeakPolarHBondContact CE-OE1 3.36Å; K303-E307 WeakPolarHBondContact CG-OE1 2.87Å; K303-E307 IonicContact NZ-OE1 4Å; K303-E307 WeakPolarHBondContact O-CG 2.99Å; K303-E307 PolarHBondContact O-N 3.23Å
304	A	89.8	Confident	82.4	Confident	38 Å²	38	53.6 Å²	53.6	31%	0.314	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-42.9	177.3	0	0	0	0	0	111.7	D300 W301 A306 E307 E308	D300-A304 WeakPolarHBondContact O-CB 3.44Å; D300-A304 PolarHBondContact O-N 2.82Å; W301-A304 PolarHBondContact O-N 2.98Å; A304-A306 PolarHBondContact O-N 3.41Å; A304-E307 PolarHBondContact O-N 3.36Å; A304-E308 WeakPolarHBondContact O-CB 3.22Å; A304-E308 WeakPolarHBondContact O-CG 3.42Å; A304-E308 PolarHBondContact O-N 3.06Å
305	M	84.6	Confident	80	Confident	9 Å²	9	57.2 Å²	57.2	4%	0.044	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-42.6	174.2	-80.5	-161.2	61.1	0	0	112.9	A245 V268 W301 L302 K303 E307 E309	A245-M305 HydrophobicContact CB-CE 3.78Å; A245-M305 HydrophobicContact CB-SD 3.59Å; A245-M305 VanDerWaalsContact CB-SD 3.59Å; V268-M305 HydrophobicContact CB-CE 4.05Å; V268-M305 HydrophobicContact CB-SD 4.4Å; V268-M305 HydrophobicContact CG2-CE 3.67Å; W301-M305 HydrophobicContact CD2-CG 4.45Å; W301-M305 HydrophobicContact CD2-SD 4.24Å; W301-M305 HydrophobicContact CE3-SD 4.22Å; W301-M305 HydrophobicContact CH2-SD 3.27Å; W301-M305 WeakPolarHBondContact CH2-SD 3.48Å; W301-M305 HydrophobicContact CZ2-CG 4.19Å; W301-M305 HydrophobicContact CZ2-SD 3.22Å; W301-M305 WeakPolarHBondContact CZ2-SD 3.28Å; W301-M305 HydrophobicContact CZ3-SD 3.78Å; W301-M305 PolarHBondContact O-N 3.22Å; L302-M305 PolarHBondContact O-N 2.62Å; K303-M305 VanDerWaalsContact C-N 3.31Å; K303-M305 PolarHBondContact O-N 3.49Å; M305-E307 VanDerWaalsContact C-N 3.35Å; M305-E309 WeakPolarHBondContact O-CG 3.48Å; M305-E309 PolarHBondContact O-N 2.97Å; M305-E309 VanDerWaalsContact O-N 3.08Å
306	A	85	Confident	77.5	Confident	39 Å²	39	60.6 Å²	60.6	32%	0.322	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-35.8	178.4	0	0	0	0	0	112.5	Y202 L302 K303 A304 G310	Y202-A306 HydrophobicContact CE1-CB 3.87Å; L302-A306 WeakPolarHBondContact O-CB 3.32Å; L302-A306 PolarHBondContact O-N 3.23Å; K303-A306 PolarHBondContact O-N 3.25Å; K303-A306 VanDerWaalsContact O-N 3.11Å; A304-A306 PolarHBondContact O-N 3.41Å; A306-G310 PolarHBondContact O-N 2.84Å
307	E	85.2	Confident	74.9	Confident	100 Å²	100	62.2 Å²	62.2	47%	0.467	34%	0.343	S	S	.	.	H	α-helix	trans	-71.3	-43.9	176.6	-71.6	172.5	-179.2	0	0	112.1	K303 A304 M305 E309 G310 N311	K303-E307 WeakPolarHBondContact CE-OE1 3.36Å; K303-E307 WeakPolarHBondContact CG-OE1 2.87Å; K303-E307 IonicContact NZ-OE1 4Å; K303-E307 WeakPolarHBondContact O-CG 2.99Å; K303-E307 PolarHBondContact O-N 3.23Å; A304-E307 PolarHBondContact O-N 3.36Å; M305-E307 VanDerWaalsContact C-N 3.35Å; E307-E309 VanDerWaalsContact C-N 3.31Å; E307-E309 PolarHBondContact O-N 3.36Å; E307-G310 PolarHBondContact O-N 3.14Å; E307-G310 VanDerWaalsContact O-N 3.15Å; E307-N311 PolarHBondContact O-N 3.19Å; E307-N311 VanDerWaalsContact O-N 3.07Å
308	E	79.3	Confident	72.1	Confident	85 Å²	85	65.9 Å²	65.9	40%	0.397	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-42	173.8	-75.5	178.7	-178.4	0	0	111.7	A304 G310 N311 A312 F321	A304-E308 WeakPolarHBondContact O-CB 3.22Å; A304-E308 WeakPolarHBondContact O-CG 3.42Å; A304-E308 PolarHBondContact O-N 3.06Å; E308-G310 VanDerWaalsContact C-N 3.33Å; E308-G310 PolarHBondContact O-N 2.86Å; E308-N311 PolarHBondContact O-N 3.4Å; E308-A312 WeakPolarHBondContact O-CB 3.37Å; E308-A312 PolarHBondContact O-N 3.49Å; E308-F321 HydrophobicContact CB-CZ 4.33Å
309	E	72	Confident	69	Low	30 Å²	30	69.8 Å²	69.8	14%	0.14	38%	0.384	C	S	.	.	H	α-helix	trans	-65.8	-33.7	176	-78	-175.5	-175.5	0	0	113.3	E247 K248 M305 E307	E247-E309 WeakPolarHBondContact CA-OE1 3.22Å; E247-E309 WeakPolarHBondContact CA-OE2 3.31Å; K248-E309 PolarHBondContact N-OE2 3.42Å; M305-E309 WeakPolarHBondContact O-CG 3.48Å; M305-E309 PolarHBondContact O-N 2.97Å; M305-E309 VanDerWaalsContact O-N 3.08Å; E307-E309 VanDerWaalsContact C-N 3.31Å; E307-E309 PolarHBondContact O-N 3.36Å
310	G	70.7	Confident	66.3	Low	63 Å²	63	73.8 Å²	73.8	65%	0.649	41%	0.405	S	S	*	.	H	α-helix	trans	-70.5	-35.4	177.2	0	0	0	0	0	113.6	A306 E307 E308	A306-G310 PolarHBondContact O-N 2.84Å; E307-G310 PolarHBondContact O-N 3.14Å; E307-G310 VanDerWaalsContact O-N 3.15Å; E308-G310 VanDerWaalsContact C-N 3.33Å; E308-G310 PolarHBondContact O-N 2.86Å
311	N	64.3	Low	63.5	Low	145 Å²	145	70.4 Å²	70.4	78%	0.775	39%	0.386	S	S	*	.	H	α-helix	trans	-89.9	-20.1	-174.4	-71	-16.9	0	0	0	114.4	E307 E308	E307-N311 PolarHBondContact O-N 3.19Å; E307-N311 VanDerWaalsContact O-N 3.07Å; E308-N311 PolarHBondContact O-N 3.4Å
312	A	56.6	Low	60.8	Low	20 Å²	20	75.1 Å²	75.1	17%	0.165	41%	0.405	C	S	.	.			trans	-73.2	130.3	-176.5	0	0	0	0	0	112.9	E308 K317	E308-A312 WeakPolarHBondContact O-CB 3.37Å; E308-A312 PolarHBondContact O-N 3.49Å; A312-K317 HydrophobicContact CB-CG 3.58Å; A312-K317 WeakPolarHBondContact O-CE 3.44Å
313	S	47.5	Very low	58.2	Low	56 Å²	56	82.4 Å²	82.4	39%	0.392	44%	0.438	S	S	.	.			trans	-69.7	154.3	167	87	0	0	0	0	110.6	S315 D316 K317	S313-S315 PolarHBondContact O-N 3.34Å; S313-S315 VanDerWaalsContact O-N 3.1Å; S313-S315 PolarHBondContact OG-OG 2.96Å; S313-D316 PolarHBondContact O-N 3.11Å; S313-D316 VanDerWaalsContact OG-CG 3.23Å; S313-D316 PolarHBondContact OG-OD2 3.19Å; S313-K317 WeakPolarHBondContact O-CG 3.43Å; S313-K317 PolarHBondContact O-N 3.23Å
314	F	46.4	Very low	55.8	Low	176 Å²	176	88.2 Å²	88.2	77%	0.772	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.5	-170.3	-167.9	-95.7	0	0	0	114.2
315	S	45.4	Very low	54	Low	79 Å²	79	88.1 Å²	88.1	55%	0.552	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-35.1	174.7	52.7	0	0	0	0	113.1	S313 K317 Q318 T319	S313-S315 PolarHBondContact O-N 3.34Å; S313-S315 VanDerWaalsContact O-N 3.1Å; S313-S315 PolarHBondContact OG-OG 2.96Å; S315-K317 VanDerWaalsContact C-N 3.3Å; S315-K317 PolarHBondContact O-N 3.35Å; S315-Q318 PolarHBondContact O-N 3.46Å; S315-T319 PolarHBondContact O-OG1 3.36Å
316	D	44.3	Very low	52.5	Low	71 Å²	71	90.2 Å²	90.2	38%	0.38	47%	0.473	S	S	.	.	H	α-helix	trans	-71.7	-27.8	179.4	-63.8	-33.5	0	0	0	111.9	S313 Q318 T319 I320	S313-D316 PolarHBondContact O-N 3.11Å; S313-D316 VanDerWaalsContact OG-CG 3.23Å; S313-D316 PolarHBondContact OG-OD2 3.19Å; D316-Q318 PolarHBondContact O-N 3.26Å; D316-T319 PolarHBondContact O-N 2.92Å; D316-I320 HydrophobicContact CB-CD1 3.89Å; D316-I320 HydrophobicContact CB-CG1 4.45Å; D316-I320 PolarHBondContact O-N 2.82Å; D316-I320 VanDerWaalsContact O-N 3.14Å
317	K	42.3	Very low	50.8	Low	88 Å²	88	91.1 Å²	91.1	38%	0.383	48%	0.475	S	S	.	.	H	α-helix	trans	-57.5	-29.9	174.3	-72.2	-178.7	-168.8	-159	0	113.8	A312 S313 S315 F321	A312-K317 HydrophobicContact CB-CG 3.58Å; A312-K317 WeakPolarHBondContact O-CE 3.44Å; S313-K317 WeakPolarHBondContact O-CG 3.43Å; S313-K317 PolarHBondContact O-N 3.23Å; S315-K317 VanDerWaalsContact C-N 3.3Å; S315-K317 PolarHBondContact O-N 3.35Å; K317-F321 VanDerWaalsContact O-CD2 3.26Å; K317-F321 WeakPolarHBondContact O-CD2 3.46Å
318	Q	36.7	Very low	49.5	Very low	133 Å²	133	89.2 Å²	89.2	62%	0.621	47%	0.465	S	S	*	.	H	α-helix	trans	-91.8	-23	178.4	-74.9	-174.2	0.4	0	0	113.6	S315 D316 Y322	S315-Q318 PolarHBondContact O-N 3.46Å; D316-Q318 PolarHBondContact O-N 3.26Å; Q318-Y322 WeakPolarHBondContact O-CD2 3.08Å; Q318-Y322 WeakPolarHBondContact O-CE2 3.45Å
319	T	32.2	Very low	48.2	Very low	85 Å²	85	87.2 Å²	87.2	52%	0.521	46%	0.46	S	S	.	.	H	α-helix	trans	-99.2	-45.1	-170.9	-47.9	0	0	0	0	112.3	S315 D316 F321	S315-T319 PolarHBondContact O-OG1 3.36Å; D316-T319 PolarHBondContact O-N 2.92Å; T319-F321 VanDerWaalsContact C-N 3.31Å; T319-F321 PolarHBondContact O-N 3.38Å
320	I	37.8	Very low	47.1	Very low	99 Å²	99	85.8 Å²	85.8	51%	0.508	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-35.9	-176.1	-62.1	178	0	0	0	111.3	D316	D316-I320 HydrophobicContact CB-CD1 3.89Å; D316-I320 HydrophobicContact CB-CG1 4.45Å; D316-I320 PolarHBondContact O-N 2.82Å; D316-I320 VanDerWaalsContact O-N 3.14Å
321	F	36.3	Very low	46	Very low	23 Å²	23	89 Å²	89	10%	0.101	45%	0.45	C	S	.	.	H	α-helix	trans	-79.9	-24.8	-172.6	-75.1	-79.1	0	0	0	115	E308 K317 T319	E308-F321 HydrophobicContact CB-CZ 4.33Å; K317-F321 VanDerWaalsContact O-CD2 3.26Å; K317-F321 WeakPolarHBondContact O-CD2 3.46Å; T319-F321 VanDerWaalsContact C-N 3.31Å; T319-F321 PolarHBondContact O-N 3.38Å
322	Y	37.2	Very low	45.4	Very low	131 Å²	131	87.5 Å²	87.5	51%	0.514	43%	0.434	S	S	.	.	H	α-helix	trans	-81.4	-27.9	179.6	-77.4	-101.2	0	0	0	112.4	Q318 R324 T327	Q318-Y322 WeakPolarHBondContact O-CD2 3.08Å; Q318-Y322 WeakPolarHBondContact O-CE2 3.45Å; Y322-R324 VanDerWaalsContact C-N 3.32Å; Y322-R324 PolarHBondContact O-N 3.35Å; Y322-T327 HydrophobicContact CD1-CG2 4.38Å; Y322-T327 HydrophobicContact CE1-CG2 4.06Å
323	Q	36.4	Very low	45.2	Very low	168 Å²	168	86.6 Å²	86.6	79%	0.785	43%	0.426	S	S	*	.	H	α-helix	trans	-69.8	-25.7	-177.5	-74.6	-175.8	-24	0	0	113.8
324	R	41.4	Very low	45.2	Very low	214 Å²	214	84.4 Å²	84.4	81%	0.808	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-13.2	-176.6	-77.2	-172.3	176.6	-176.6	-0.3	115.5	Y322	Y322-R324 VanDerWaalsContact C-N 3.32Å; Y322-R324 PolarHBondContact O-N 3.35Å
325	R	51.6	Low	45.3	Very low	36 Å²	36	78.3 Å²	78.3	14%	0.136	39%	0.394	C	S	.	.	S	Bend	trans	-134.3	138.2	-162.3	-66.9	179.8	173.7	159.9	2.7	114.1	E84 T327	E84-R325 IonicContact OE1-NH2 2.61Å; E84-R325 IonicContact OE2-CZ 3.69Å; E84-R325 IonicContact OE2-NE 3.48Å; E84-R325 PolarHBondContact OE2-NE 2.96Å; E84-R325 IonicContact OE2-NH2 3.99Å; E84-R325 PolarHBondContact OE2-NH2 2.86Å; R325-T327 PolarHBondContact O-N 3.45Å; R325-T327 PolarHBondContact O-OG1 3.06Å
326	G	54.8	Low	45.5	Very low	53 Å²	53	77.9 Å²	77.9	55%	0.546	38%	0.382	S	S	.	.			trans	-61.7	104.8	166.3	0	0	0	0	0	110.2
327	T	47.9	Very low	45.6	Very low	58 Å²	58	76.2 Å²	76.2	36%	0.356	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.1	-178.1	-58	0	0	0	0	109.9	T80 F82 Y322 R325	T80-T327 HydrophobicContact CG2-CG2 4.47Å; F82-T327 HydrophobicContact CD1-CG2 3.86Å; F82-T327 WeakPolarHBondContact CD1-OG1 3.49Å; F82-T327 HydrophobicContact CE1-CG2 3.32Å; F82-T327 VanDerWaalsContact CE1-OG1 3.24Å; F82-T327 WeakPolarHBondContact CE1-OG1 3.44Å; F82-T327 HydrophobicContact CZ-CG2 3.96Å; Y322-T327 HydrophobicContact CD1-CG2 4.38Å; Y322-T327 HydrophobicContact CE1-CG2 4.06Å; R325-T327 PolarHBondContact O-N 3.45Å; R325-T327 PolarHBondContact O-OG1 3.06Å
328	K	58.2	Low	45.7	Very low	60 Å²	60	76.1 Å²	76.1	26%	0.261	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	104.7	175.4	-71.8	169.4	-175.4	165.3	0	108.9	V81 E83 Y332 Y333	V81-K328 CarbonylContact O-C 3.55Å; E83-K328 IonicContact OE2-NZ 2.8Å; E83-K328 PolarHBondContact OE2-NZ 3.31Å; K328-Y332 HydrophobicContact CB-CD1 3.79Å; K328-Y332 HydrophobicContact CB-CE1 4.35Å; K328-Y332 HydrophobicContact CB-CG 4.33Å; K328-Y332 HydrophobicContact CD-CD1 4.01Å; K328-Y332 HydrophobicContact CD-CE1 3.72Å; K328-Y332 HydrophobicContact CG-CD1 3.81Å; K328-Y332 HydrophobicContact CG-CE1 3.89Å; K328-Y332 HydrophobicContact CG-CG 4.42Å; K328-Y333 HydrophobicContact CB-CD2 4.47Å; K328-Y333 HydrophobicContact CB-CE1 4.47Å; K328-Y333 HydrophobicContact CB-CE2 3.55Å; K328-Y333 VanDerWaalsContact CB-OH 3.27Å; K328-Y333 WeakPolarHBondContact CB-OH 3.31Å; K328-Y333 HydrophobicContact CD-CE1 4.02Å; K328-Y333 WeakPolarHBondContact CD-OH 3.23Å; K328-Y333 VanDerWaalsContact O-CE2 3.27Å; K328-Y333 WeakPolarHBondContact O-CE2 3.28Å
329	S	51.8	Low	46	Very low	43 Å²	43	77.2 Å²	77.2	30%	0.301	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	156.3	178.6	72.9	0	0	0	0	111.9	K331 Y332 Y333	S329-K331 PolarHBondContact O-N 2.81Å; S329-K331 WeakPolarHBondContact OG-CB 2.93Å; S329-K331 PolarHBondContact OG-N 3.43Å; S329-Y332 WeakPolarHBondContact O-CA 3.34Å; S329-Y332 VanDerWaalsContact O-CB 3.25Å; S329-Y332 WeakPolarHBondContact O-CB 3.26Å; S329-Y332 PolarHBondContact O-N 3.12Å; S329-Y332 PolarHBondContact OG-N 3.07Å; S329-Y333 VanDerWaalsContact O-CD2 3.29Å; S329-Y333 WeakPolarHBondContact O-CD2 3.47Å; S329-Y333 PolarHBondContact O-N 3.24Å
330	L	49.1	Very low	46.5	Very low	1 Å²	1	76.1 Å²	76.1	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-56.9	-23.2	169.9	-89.9	155.7	0	0	0	112.4	F73 L76 A79 V81 H113 Y333 A334	F73-L330 HydrophobicContact CD2-CD2 4.36Å; F73-L330 HydrophobicContact CE2-CB 4.49Å; F73-L330 HydrophobicContact CE2-CD2 3.89Å; L76-L330 HydrophobicContact CB-CD1 4.21Å; L76-L330 WeakPolarHBondContact O-CD1 3.48Å; A79-L330 HydrophobicContact CB-CD1 3.63Å; A79-L330 WeakPolarHBondContact O-CD1 3.35Å; V81-L330 HydrophobicContact CB-CG 4.37Å; V81-L330 HydrophobicContact CG2-CD1 3.52Å; V81-L330 HydrophobicContact CG2-CD2 4.18Å; V81-L330 HydrophobicContact CG2-CG 3.62Å; H113-L330 WeakPolarHBondContact CD2-CD2 3.47Å; L330-Y333 PolarHBondContact O-N 2.98Å; L330-A334 WeakPolarHBondContact O-CB 3.34Å; L330-A334 PolarHBondContact O-N 2.87Å
331	K	47.8	Very low	46.6	Very low	131 Å²	131	76.2 Å²	76.2	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-65.9	-36.6	170	-58.7	179.2	178.6	179.5	0	113.2	F77 S329 A334 A335	F77-K331 HydrophobicContact CD1-CG 3.88Å; F77-K331 HydrophobicContact CE1-CG 4.17Å; S329-K331 PolarHBondContact O-N 2.81Å; S329-K331 WeakPolarHBondContact OG-CB 2.93Å; S329-K331 PolarHBondContact OG-N 3.43Å; K331-A334 VanDerWaalsContact O-CB 3.25Å; K331-A334 WeakPolarHBondContact O-CB 3.39Å; K331-A334 PolarHBondContact O-N 2.97Å; K331-A335 WeakPolarHBondContact O-CB 3.31Å; K331-A335 PolarHBondContact O-N 3.11Å
332	Y	52.3	Low	46.7	Very low	113 Å²	113	78 Å²	78	44%	0.443	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-46.4	175.2	169.5	-94.1	0	0	0	110.4	K328 S329 A335 K336	K328-Y332 HydrophobicContact CB-CD1 3.79Å; K328-Y332 HydrophobicContact CB-CE1 4.35Å; K328-Y332 HydrophobicContact CB-CG 4.33Å; K328-Y332 HydrophobicContact CD-CD1 4.01Å; K328-Y332 HydrophobicContact CD-CE1 3.72Å; K328-Y332 HydrophobicContact CG-CD1 3.81Å; K328-Y332 HydrophobicContact CG-CE1 3.89Å; K328-Y332 HydrophobicContact CG-CG 4.42Å; S329-Y332 WeakPolarHBondContact O-CA 3.34Å; S329-Y332 VanDerWaalsContact O-CB 3.25Å; S329-Y332 WeakPolarHBondContact O-CB 3.26Å; S329-Y332 PolarHBondContact O-N 3.12Å; S329-Y332 PolarHBondContact OG-N 3.07Å; Y332-A335 PolarHBondContact O-N 2.86Å; Y332-K336 WeakPolarHBondContact O-CB 3.46Å; Y332-K336 PolarHBondContact O-N 2.78Å
333	Y	51.8	Low	46.7	Very low	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-71.3	-31.4	175.8	-58.1	-76	0	0	0	112.8	V81 E83 H113 V114 A117 L118 K328 S329 L330 N337	V81-Y333 HydrophobicContact CB-CE2 4.45Å; E83-Y333 VanDerWaalsContact CG-OH 3.32Å; E83-Y333 WeakPolarHBondContact CG-OH 3.38Å; E83-Y333 WeakPolarHBondContact OE1-CE1 3.21Å; E83-Y333 PolarHBondContact OE1-OH 2.87Å; E83-Y333 PolarHBondContact OE2-OH 3.34Å; H113-Y333 VanDerWaalsContact CD2-CB 3.47Å; H113-Y333 WeakPolarHBondContact CD2-CB 3.5Å; H113-Y333 VanDerWaalsContact NE2-C 3.33Å; H113-Y333 WeakPolarHBondContact NE2-CB 3.4Å; V114-Y333 HydrophobicContact CG1-CE1 4.47Å; A117-Y333 HydrophobicContact CB-CD1 3.46Å; A117-Y333 VanDerWaalsContact CB-CD1 3.46Å; A117-Y333 HydrophobicContact CB-CG 3.97Å; L118-Y333 HydrophobicContact CD2-CE1 3.99Å; L118-Y333 HydrophobicContact CG-CE1 4.16Å; K328-Y333 HydrophobicContact CB-CD2 4.47Å; K328-Y333 HydrophobicContact CB-CE1 4.47Å; K328-Y333 HydrophobicContact CB-CE2 3.55Å; K328-Y333 VanDerWaalsContact CB-OH 3.27Å; K328-Y333 WeakPolarHBondContact CB-OH 3.31Å; K328-Y333 HydrophobicContact CD-CE1 4.02Å; K328-Y333 WeakPolarHBondContact CD-OH 3.23Å; K328-Y333 VanDerWaalsContact O-CE2 3.27Å; K328-Y333 WeakPolarHBondContact O-CE2 3.28Å; S329-Y333 VanDerWaalsContact O-CD2 3.29Å; S329-Y333 WeakPolarHBondContact O-CD2 3.47Å; S329-Y333 PolarHBondContact O-N 3.24Å; L330-Y333 PolarHBondContact O-N 2.98Å; Y333-N337 WeakPolarHBondContact O-CB 3.34Å; Y333-N337 PolarHBondContact O-N 3.09Å; Y333-N337 PolarHBondContact O-ND2 3.36Å; Y333-N337 VanDerWaalsContact O-ND2 3.14Å
334	A	47.7	Very low	47	Very low	10 Å²	10	76.9 Å²	76.9	8%	0.083	40%	0.401	C	S	.	.	H	α-helix	trans	-55.2	-57.2	169.3	0	0	0	0	0	110.6	F73 F77 H113 L330 K331 K336 N337 V338	F73-A334 HydrophobicContact CE1-CB 3.67Å; F73-A334 HydrophobicContact CE2-CB 4.46Å; F73-A334 HydrophobicContact CZ-CB 3.27Å; F77-A334 HydrophobicContact CE1-CB 4.16Å; F77-A334 HydrophobicContact CZ-CB 4.09Å; H113-A334 PolarHBondContact NE2-N 3.24Å; L330-A334 WeakPolarHBondContact O-CB 3.34Å; L330-A334 PolarHBondContact O-N 2.87Å; K331-A334 VanDerWaalsContact O-CB 3.25Å; K331-A334 WeakPolarHBondContact O-CB 3.39Å; K331-A334 PolarHBondContact O-N 2.97Å; A334-K336 VanDerWaalsContact C-N 3.3Å; A334-K336 PolarHBondContact O-N 3.08Å; A334-N337 PolarHBondContact O-N 2.78Å; A334-N337 VanDerWaalsContact O-N 3.16Å; A334-V338 WeakPolarHBondContact O-CB 3.43Å; A334-V338 VanDerWaalsContact O-CG2 3.27Å; A334-V338 WeakPolarHBondContact O-CG2 3.44Å; A334-V338 PolarHBondContact O-N 3.04Å
335	A	48.6	Very low	47.1	Very low	48 Å²	48	69.3 Å²	69.3	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-58.9	-45.8	-177.6	0	0	0	0	0	109.8	K331 Y332 N337 V338 E339	K331-A335 WeakPolarHBondContact O-CB 3.31Å; K331-A335 PolarHBondContact O-N 3.11Å; Y332-A335 PolarHBondContact O-N 2.86Å; A335-N337 PolarHBondContact O-N 3.46Å; A335-V338 CarbonylContact O-C 3.6Å; A335-V338 PolarHBondContact O-N 3.1Å; A335-V338 VanDerWaalsContact O-N 3.15Å; A335-E339 WeakPolarHBondContact O-CB 3.37Å; A335-E339 WeakPolarHBondContact O-CG 3.39Å; A335-E339 PolarHBondContact O-N 3.48Å
336	K	49.1	Very low	46.5	Very low	71 Å²	71	68.9 Å²	68.9	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-63.4	-37.3	177.7	-164.6	174.8	179.4	-158.7	0	113.5	A117 Y332 A334	A117-K336 VanDerWaalsContact O-CD 3.22Å; A117-K336 WeakPolarHBondContact O-CD 3.21Å; A117-K336 WeakPolarHBondContact O-CE 3.21Å; A117-K336 PolarHBondContact O-NZ 3.16Å; Y332-K336 WeakPolarHBondContact O-CB 3.46Å; Y332-K336 PolarHBondContact O-N 2.78Å; A334-K336 VanDerWaalsContact C-N 3.3Å; A334-K336 PolarHBondContact O-N 3.08Å
337	N	46.5	Very low	45.8	Very low	36 Å²	36	70.7 Å²	70.7	19%	0.193	38%	0.377	C	S	.	.	H	α-helix	trans	-71.1	-33.5	174.7	-81.4	-43.1	0	0	0	112.5	H113 A117 Y333 A334 A335	H113-N337 PolarHBondContact CE1-ND2 2.97Å; H113-N337 PolarHBondContact ND1-ND2 3.4Å; A117-N337 VanDerWaalsContact CA-OD1 3.31Å; A117-N337 WeakPolarHBondContact CA-OD1 3.35Å; A117-N337 PolarHBondContact N-OD1 3.47Å; Y333-N337 WeakPolarHBondContact O-CB 3.34Å; Y333-N337 PolarHBondContact O-N 3.09Å; Y333-N337 PolarHBondContact O-ND2 3.36Å; Y333-N337 VanDerWaalsContact O-ND2 3.14Å; A334-N337 PolarHBondContact O-N 2.78Å; A334-N337 VanDerWaalsContact O-N 3.16Å; A335-N337 PolarHBondContact O-N 3.46Å
338	V	44.6	Very low	45.7	Very low	85 Å²	85	74.5 Å²	74.5	52%	0.515	39%	0.385	S	S	.	.	H	α-helix	trans	-79.2	-34	178.6	174.7	0	0	0	0	112	A334 A335 G340 F341	A334-V338 WeakPolarHBondContact O-CB 3.43Å; A334-V338 VanDerWaalsContact O-CG2 3.27Å; A334-V338 WeakPolarHBondContact O-CG2 3.44Å; A334-V338 PolarHBondContact O-N 3.04Å; A335-V338 CarbonylContact O-C 3.6Å; A335-V338 PolarHBondContact O-N 3.1Å; A335-V338 VanDerWaalsContact O-N 3.15Å; V338-G340 PolarHBondContact O-N 3.08Å; V338-F341 CarbonylContact O-C 3.51Å; V338-F341 WeakPolarHBondContact O-CA 3.25Å; V338-F341 PolarHBondContact O-N 3.42Å; V338-F341 VanDerWaalsContact O-O 3.09Å
339	E	42.4	Very low	44.9	Very low	156 Å²	156	75.9 Å²	75.9	73%	0.729	39%	0.392	S	S	*	.	H	α-helix	trans	-58.3	-30.4	172.5	-81.3	177.1	178.7	0	0	111.8	A335	A335-E339 WeakPolarHBondContact O-CB 3.37Å; A335-E339 WeakPolarHBondContact O-CG 3.39Å; A335-E339 PolarHBondContact O-N 3.48Å
340	G	42.6	Very low	44.3	Very low	63 Å²	63	78.3 Å²	78.3	65%	0.649	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.7	171.7	0	0	0	0	0	115.4	V338	V338-G340 PolarHBondContact O-N 3.08Å
341	F	40.6	Very low	44.1	Very low	101 Å²	101	83 Å²	83	44%	0.443	43%	0.425	S	S	.	.	S	Bend	trans	-138	79.3	-175.7	-163.9	-95.9	0	0	0	110.5	L63 V338 A346	L63-F341 HydrophobicContact CD1-CE2 3.91Å; L63-F341 HydrophobicContact CD1-CZ 3.51Å; V338-F341 CarbonylContact O-C 3.51Å; V338-F341 WeakPolarHBondContact O-CA 3.25Å; V338-F341 PolarHBondContact O-N 3.42Å; V338-F341 VanDerWaalsContact O-O 3.09Å; F341-A346 HydrophobicContact CE1-CB 3.89Å; F341-A346 HydrophobicContact CZ-CB 4.01Å
342	T	37.3	Very low	43.9	Very low	60 Å²	60	78.9 Å²	78.9	37%	0.368	41%	0.412	S	S	.	.			trans	-72.7	153.9	178.9	66.6	0	0	0	0	110.9	K344 D345 A346	T342-K344 PolarHBondContact O-N 2.9Å; T342-K344 VanDerWaalsContact O-N 3.13Å; T342-K344 WeakPolarHBondContact OG1-CB 3.38Å; T342-K344 PolarHBondContact OG1-N 3.44Å; T342-D345 WeakPolarHBondContact CB-OD2 3.35Å; T342-D345 PolarHBondContact N-OD2 3.47Å; T342-D345 WeakPolarHBondContact O-CA 2.9Å; T342-D345 WeakPolarHBondContact O-CB 3.5Å; T342-D345 PolarHBondContact O-N 3Å; T342-D345 PolarHBondContact OG1-N 3.39Å; T342-D345 PolarHBondContact OG1-OD2 3.21Å; T342-A346 PolarHBondContact O-N 3.29Å
343	I	39	Very low	43.1	Very low	137 Å²	137	76.9 Å²	76.9	70%	0.703	41%	0.412	S	S	*	.	H	α-helix	trans	-53.1	-32.5	167.3	-67.4	172.4	0	0	0	110.4	D345 A346 L347	I343-D345 VanDerWaalsContact C-N 3.35Å; I343-A346 PolarHBondContact O-N 3.44Å; I343-L347 HydrophobicContact CG2-CD1 3.91Å; I343-L347 HydrophobicContact CG2-CG 4.32Å; I343-L347 WeakPolarHBondContact O-CB 3.42Å; I343-L347 WeakPolarHBondContact O-CG 3.2Å; I343-L347 PolarHBondContact O-N 2.95Å
344	K	41.8	Very low	42.3	Very low	138 Å²	138	81.5 Å²	81.5	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-65.5	-35.7	174.9	-153.9	174.8	-173.5	174.4	0	112.1	T342 R348	T342-K344 PolarHBondContact O-N 2.9Å; T342-K344 VanDerWaalsContact O-N 3.13Å; T342-K344 WeakPolarHBondContact OG1-CB 3.38Å; T342-K344 PolarHBondContact OG1-N 3.44Å; K344-R348 VanDerWaalsContact O-CB 3.27Å; K344-R348 WeakPolarHBondContact O-CB 3.43Å; K344-R348 VanDerWaalsContact O-CG 3.31Å; K344-R348 WeakPolarHBondContact O-CG 3.48Å; K344-R348 PolarHBondContact O-N 3.11Å
345	D	43.6	Very low	41.9	Very low	55 Å²	55	85.8 Å²	85.8	29%	0.294	46%	0.462	S	S	.	.	H	α-helix	trans	-71	-41.6	173.1	-60.5	-45.4	0	0	0	111.4	T342 I343 R348 H349	T342-D345 WeakPolarHBondContact CB-OD2 3.35Å; T342-D345 PolarHBondContact N-OD2 3.47Å; T342-D345 WeakPolarHBondContact O-CA 2.9Å; T342-D345 WeakPolarHBondContact O-CB 3.5Å; T342-D345 PolarHBondContact O-N 3Å; T342-D345 PolarHBondContact OG1-N 3.39Å; T342-D345 PolarHBondContact OG1-OD2 3.21Å; I343-D345 VanDerWaalsContact C-N 3.35Å; D345-R348 PolarHBondContact O-N 2.95Å; D345-R348 IonicContact OD1-NH1 2.93Å; D345-R348 PolarHBondContact OD1-NH1 3.5Å; D345-H349 VanDerWaalsContact O-CB 3.28Å; D345-H349 WeakPolarHBondContact O-CB 3.46Å; D345-H349 PolarHBondContact O-N 2.86Å
346	A	39.7	Very low	41.3	Very low	27 Å²	27	90.6 Å²	90.6	22%	0.223	48%	0.48	C	S	.	.	H	α-helix	trans	-59	-47.5	172.7	0	0	0	0	0	111.5	F341 T342 I343 H349 I350	F341-A346 HydrophobicContact CE1-CB 3.89Å; F341-A346 HydrophobicContact CZ-CB 4.01Å; T342-A346 PolarHBondContact O-N 3.29Å; I343-A346 PolarHBondContact O-N 3.44Å; A346-H349 PolarHBondContact O-N 3.45Å; A346-I350 VanDerWaalsContact O-CG1 3.25Å; A346-I350 WeakPolarHBondContact O-CG1 3.43Å; A346-I350 PolarHBondContact O-N 3.23Å
347	L	38.8	Very low	40.7	Very low	91 Å²	91	90.1 Å²	90.1	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-46.2	177.5	-74.7	171	0	0	0	112.3	I343 H349 I350 I351	I343-L347 HydrophobicContact CG2-CD1 3.91Å; I343-L347 HydrophobicContact CG2-CG 4.32Å; I343-L347 WeakPolarHBondContact O-CB 3.42Å; I343-L347 WeakPolarHBondContact O-CG 3.2Å; I343-L347 PolarHBondContact O-N 2.95Å; L347-H349 PolarHBondContact O-N 2.96Å; L347-I350 PolarHBondContact O-N 2.79Å; L347-I351 VanDerWaalsContact O-CB 3.31Å; L347-I351 WeakPolarHBondContact O-CB 3.41Å; L347-I351 WeakPolarHBondContact O-CD1 3.48Å; L347-I351 WeakPolarHBondContact O-CG1 3.44Å; L347-I351 PolarHBondContact O-N 2.78Å
348	R	46.8	Very low	39.9	Very low	139 Å²	139	91.3 Å²	91.3	53%	0.525	51%	0.51	S	S	.	.	H	α-helix	trans	-57.1	-37.8	173.6	-83.3	-170.3	-152.1	125.3	-6.6	111.2	K344 D345 S352	K344-R348 VanDerWaalsContact O-CB 3.27Å; K344-R348 WeakPolarHBondContact O-CB 3.43Å; K344-R348 VanDerWaalsContact O-CG 3.31Å; K344-R348 WeakPolarHBondContact O-CG 3.48Å; K344-R348 PolarHBondContact O-N 3.11Å; D345-R348 PolarHBondContact O-N 2.95Å; D345-R348 IonicContact OD1-NH1 2.93Å; D345-R348 PolarHBondContact OD1-NH1 3.5Å; R348-S352 WeakPolarHBondContact O-CB 3.46Å; R348-S352 PolarHBondContact O-N 2.95Å
349	H	42	Very low	39.3	Very low	89 Å²	89	94.1 Å²	94.1	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-74.6	-39.1	-179.9	-136.7	27.2	0	0	0	112	D345 A346 L347 S352 T353	D345-H349 VanDerWaalsContact O-CB 3.28Å; D345-H349 WeakPolarHBondContact O-CB 3.46Å; D345-H349 PolarHBondContact O-N 2.86Å; A346-H349 PolarHBondContact O-N 3.45Å; L347-H349 PolarHBondContact O-N 2.96Å; H349-S352 PolarHBondContact O-N 3.47Å; H349-T353 WeakPolarHBondContact O-CB 3.42Å; H349-T353 PolarHBondContact O-N 3.18Å; H349-T353 PolarHBondContact O-OG1 3.18Å
350	I	39.3	Very low	38.9	Very low	94 Å²	94	93 Å²	93	48%	0.482	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-48.7	171.3	-69.5	163.7	0	0	0	110	A346 L347 S352 T353 L354	A346-I350 VanDerWaalsContact O-CG1 3.25Å; A346-I350 WeakPolarHBondContact O-CG1 3.43Å; A346-I350 PolarHBondContact O-N 3.23Å; L347-I350 PolarHBondContact O-N 2.79Å; I350-S352 PolarHBondContact O-N 3.31Å; I350-T353 CarbonylContact O-C 3.51Å; I350-T353 WeakPolarHBondContact O-CA 3.4Å; I350-T353 WeakPolarHBondContact O-CB 3.46Å; I350-T353 PolarHBondContact O-N 2.93Å; I350-T353 VanDerWaalsContact O-N 3.07Å; I350-L354 HydrophobicContact CG2-CD1 3.89Å; I350-L354 HydrophobicContact CG2-CG 4.4Å; I350-L354 WeakPolarHBondContact O-CG 3.38Å; I350-L354 PolarHBondContact O-N 3.25Å
351	I	43.1	Very low	38.4	Very low	100 Å²	100	95.2 Å²	95.2	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-60.4	-48.3	178.2	-68	164.5	0	0	0	110.2	L347 T353 L354 T355	L347-I351 VanDerWaalsContact O-CB 3.31Å; L347-I351 WeakPolarHBondContact O-CB 3.41Å; L347-I351 WeakPolarHBondContact O-CD1 3.48Å; L347-I351 WeakPolarHBondContact O-CG1 3.44Å; L347-I351 PolarHBondContact O-N 2.78Å; I351-T353 PolarHBondContact O-N 3.29Å; I351-L354 CarbonylContact O-C 3.59Å; I351-L354 PolarHBondContact O-N 3.1Å; I351-L354 VanDerWaalsContact O-N 3.11Å; I351-T355 PolarHBondContact O-N 2.94Å; I351-T355 PolarHBondContact O-OG1 3.47Å
352	S	43.9	Very low	38	Very low	43 Å²	43	100.2 Å²	100.2	30%	0.301	54%	0.542	S	S	.	.	H	α-helix	trans	-57.5	-36.3	173.7	162.3	0	0	0	0	112.4	R348 H349 I350 T355 L356	R348-S352 WeakPolarHBondContact O-CB 3.46Å; R348-S352 PolarHBondContact O-N 2.95Å; H349-S352 PolarHBondContact O-N 3.47Å; I350-S352 PolarHBondContact O-N 3.31Å; S352-T355 VanDerWaalsContact CA-OG1 3.3Å; S352-T355 WeakPolarHBondContact CA-OG1 3.41Å; S352-T355 PolarHBondContact O-OG1 3.38Å; S352-L356 VanDerWaalsContact O-CB 3.29Å; S352-L356 WeakPolarHBondContact O-CB 3.38Å; S352-L356 WeakPolarHBondContact O-CD1 3.45Å; S352-L356 VanDerWaalsContact O-CG 3.25Å; S352-L356 WeakPolarHBondContact O-CG 3.31Å; S352-L356 PolarHBondContact O-N 3.49Å
353	T	36.9	Very low	37.9	Very low	71 Å²	71	111.1 Å²	111.1	44%	0.436	58%	0.584	S	S	.	*	H	α-helix	trans	-72.8	-36.3	177.6	-54	0	0	0	0	111.2	H349 I350 I351 A357	H349-T353 WeakPolarHBondContact O-CB 3.42Å; H349-T353 PolarHBondContact O-N 3.18Å; H349-T353 PolarHBondContact O-OG1 3.18Å; I350-T353 CarbonylContact O-C 3.51Å; I350-T353 WeakPolarHBondContact O-CA 3.4Å; I350-T353 WeakPolarHBondContact O-CB 3.46Å; I350-T353 PolarHBondContact O-N 2.93Å; I350-T353 VanDerWaalsContact O-N 3.07Å; I351-T353 PolarHBondContact O-N 3.29Å; T353-A357 WeakPolarHBondContact O-CB 2.91Å; T353-A357 PolarHBondContact O-N 3.34Å
354	L	33.5	Very low	37.8	Very low	97 Å²	97	109.8 Å²	109.8	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-72.2	-36.5	175.2	-68.9	170	0	0	0	112.1	I350 I351 A357	I350-L354 HydrophobicContact CG2-CD1 3.89Å; I350-L354 HydrophobicContact CG2-CG 4.4Å; I350-L354 WeakPolarHBondContact O-CG 3.38Å; I350-L354 PolarHBondContact O-N 3.25Å; I351-L354 CarbonylContact O-C 3.59Å; I351-L354 PolarHBondContact O-N 3.1Å; I351-L354 VanDerWaalsContact O-N 3.11Å; L354-A357 PolarHBondContact O-N 3.1Å
355	T	39.9	Very low	37.6	Very low	101 Å²	101	108.3 Å²	108.3	62%	0.62	58%	0.577	S	S	*	*	H	α-helix	trans	-71.2	-39.6	174.8	15.6	0	0	0	0	111.8	I351 S352 A357 G358	I351-T355 PolarHBondContact O-N 2.94Å; I351-T355 PolarHBondContact O-OG1 3.47Å; S352-T355 VanDerWaalsContact CA-OG1 3.3Å; S352-T355 WeakPolarHBondContact CA-OG1 3.41Å; S352-T355 PolarHBondContact O-OG1 3.38Å; T355-A357 PolarHBondContact O-N 2.94Å; T355-G358 PolarHBondContact O-N 2.8Å
356	L	36.3	Very low	37.3	Very low	148 Å²	148	111.3 Å²	111.3	78%	0.775	59%	0.593	S	S	*	*	H	α-helix	trans	-69	-19.5	171.6	-74.5	168.2	0	0	0	112.8	S352 G358	S352-L356 VanDerWaalsContact O-CB 3.29Å; S352-L356 WeakPolarHBondContact O-CB 3.38Å; S352-L356 WeakPolarHBondContact O-CD1 3.45Å; S352-L356 VanDerWaalsContact O-CG 3.25Å; S352-L356 WeakPolarHBondContact O-CG 3.31Å; S352-L356 PolarHBondContact O-N 3.49Å; L356-G358 VanDerWaalsContact C-N 3.26Å; L356-G358 PolarHBondContact O-N 3.14Å
357	A	35.2	Very low	37.1	Very low	62 Å²	62	116.2 Å²	116.2	51%	0.512	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	7.6	175.2	0	0	0	0	0	113.8	T353 L354 T355 L359	T353-A357 WeakPolarHBondContact O-CB 2.91Å; T353-A357 PolarHBondContact O-N 3.34Å; L354-A357 PolarHBondContact O-N 3.1Å; T355-A357 PolarHBondContact O-N 2.94Å; A357-L359 PolarHBondContact O-N 3.48Å
358	G	30.6	Very low	37	Very low	60 Å²	60	117.8 Å²	117.8	62%	0.619	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.4	27.6	164.9	0	0	0	0	0	115.4	T355 L356 D360	T355-G358 PolarHBondContact O-N 2.8Å; L356-G358 VanDerWaalsContact C-N 3.26Å; L356-G358 PolarHBondContact O-N 3.14Å; G358-D360 PolarHBondContact O-N 2.62Å; G358-D360 VanDerWaalsContact O-N 3.09Å
359	L	33	Very low	36.4	Very low	145 Å²	145	116.4 Å²	116.4	76%	0.759	63%	0.63	S	S	*	*			trans	-82.8	70.8	159.5	-75.1	165.7	0	0	0	108	A357 S361	A357-L359 PolarHBondContact O-N 3.48Å; L359-S361 PolarHBondContact O-N 3.07Å
360	D	33.7	Very low	36	Very low	131 Å²	131	118.4 Å²	118.4	70%	0.701	65%	0.646	S	S	*	*			trans	-64.6	119.5	165.1	-156.4	-3.8	0	0	0	106.8	G358 R362	G358-D360 PolarHBondContact O-N 2.62Å; G358-D360 VanDerWaalsContact O-N 3.09Å; D360-R362 PolarHBondContact O-N 3.15Å
361	S	31.2	Very low	35.7	Very low	110 Å²	110	120.2 Å²	120.2	77%	0.769	66%	0.658	S	S	*	*	S	Bend	trans	-70.3	78.3	-176.5	55.1	0	0	0	0	110.1	L359	L359-S361 PolarHBondContact O-N 3.07Å
362	R	31.8	Very low	35.1	Very low	206 Å²	206	121.9 Å²	121.9	78%	0.777	67%	0.67	S	S	*	*			trans	-140.3	59.5	161	-64.7	-165.3	-152.4	-163.1	6.5	110.5	D360	D360-R362 PolarHBondContact O-N 3.15Å
363	F	35.1	Very low	34.3	Very low	289 Å²	289	129.1 Å²	129.1	100%	1.268	70%	0.704	S	S	*	*			trans	-149.2	0	148.4	-82	-69.2	0	0	0	109

Retrieved 363 of 363 residues in 159.6 ms (Link to these results)

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