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Claudin

Claudins function as major constituents of the tight junction complexes that regulate the permeability of epithelia.

AlphaFold DB , UniProt , Accession A0A060YMZ3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 214 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	44.2	Very low	77.3	Confident	228 Å²	228	76.8 Å²	76.8	100%	1.123	43%	0.431	S	S	*	.				0	116.8	0	-71.1	-175	-81.2	0	0	107.7	S3	M1-S3 PolarHBondContact O-N 3.17Å
2	A	52.3	Low	78.6	Confident	42 Å²	42	80 Å²	80	35%	0.347	44%	0.443	S	S	.	.			trans	-63.3	132.6	167.9	0	0	0	0	0	108.7	Q4 N184	A2-Q4 PolarHBondContact O-N 2.7Å; A2-N184 HydrophobicContact CB-CB 4.29Å; A2-N184 WeakPolarHBondContact CB-OD1 3.26Å
3	S	67.7	Low	79.9	Confident	83 Å²	83	76.5 Å²	76.5	58%	0.58	42%	0.423	S	S	*	.			trans	-54.1	131.7	-177.3	168.6	0	0	0	0	109.9	M1 G5 L6	M1-S3 PolarHBondContact O-N 3.17Å; S3-G5 PolarHBondContact O-N 3.34Å; S3-G5 PolarHBondContact OG-N 3.28Å; S3-L6 WeakPolarHBondContact O-CB 3.06Å; S3-L6 PolarHBondContact O-N 2.97Å
4	Q	74.8	Confident	80.9	Confident	126 Å²	126	71.1 Å²	71.1	59%	0.589	39%	0.392	S	S	*	.	H	α-helix	trans	-50	-31	172.7	-70.8	178.7	-58	0	0	111.7	A2 L6 Q7 I8 K103	A2-Q4 PolarHBondContact O-N 2.7Å; Q4-L6 VanDerWaalsContact C-N 3.34Å; Q4-L6 PolarHBondContact O-N 3.39Å; Q4-Q7 PolarHBondContact O-N 3.21Å; Q4-I8 WeakPolarHBondContact O-CD1 3.31Å; Q4-I8 VanDerWaalsContact O-CG1 3.27Å; Q4-I8 WeakPolarHBondContact O-CG1 3.27Å; Q4-I8 PolarHBondContact O-N 3.11Å; Q4-I8 VanDerWaalsContact O-N 3.08Å; Q4-K103 HydrophobicContact CG-CD 3.94Å
5	G	81	Confident	81.8	Confident	42 Å²	42	70.3 Å²	70.3	43%	0.433	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-36.8	175.8	0	0	0	0	0	113.9	S3 I8 M9	S3-G5 PolarHBondContact O-N 3.34Å; S3-G5 PolarHBondContact OG-N 3.28Å; G5-I8 PolarHBondContact O-N 2.92Å; G5-M9 VanDerWaalsContact O-CB 3.26Å; G5-M9 WeakPolarHBondContact O-CB 3.35Å; G5-M9 PolarHBondContact O-N 2.85Å
6	L	84.1	Confident	82.7	Confident	59 Å²	59	72.1 Å²	72.1	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-69.6	-40.8	-179.6	-164.6	67.1	0	0	0	111.7	S3 Q4 G10 L180	S3-L6 WeakPolarHBondContact O-CB 3.06Å; S3-L6 PolarHBondContact O-N 2.97Å; Q4-L6 VanDerWaalsContact C-N 3.34Å; Q4-L6 PolarHBondContact O-N 3.39Å; L6-G10 PolarHBondContact O-N 3.24Å; L6-L180 HydrophobicContact CD1-CD1 4.44Å; L6-L180 HydrophobicContact CD1-CD2 3.75Å; L6-L180 HydrophobicContact CG-CD2 4.35Å
7	Q	85	Confident	83.5	Confident	21 Å²	21	67.9 Å²	67.9	10%	0.098	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-46.4	175.8	-174.5	-178.6	-5.5	0	0	111	Q4 M9 G10 V11 G101 C118 L181	Q4-Q7 PolarHBondContact O-N 3.21Å; Q7-M9 PolarHBondContact O-N 3.49Å; Q7-G10 PolarHBondContact O-N 3.1Å; Q7-V11 WeakPolarHBondContact O-CG2 3.48Å; Q7-V11 PolarHBondContact O-N 2.76Å; Q7-G101 PolarHBondContact NE2-O 3.1Å; Q7-C118 PolarHBondContact NE2-SG 3.05Å; Q7-L181 HydrophobicContact CG-CD2 4.27Å
8	I	87.7	Confident	84.2	Confident	95 Å²	95	66.3 Å²	66.3	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-45.8	178.3	-66.2	164.6	0	0	0	110.4	Q4 G5 G10 V11 M12	Q4-I8 WeakPolarHBondContact O-CD1 3.31Å; Q4-I8 VanDerWaalsContact O-CG1 3.27Å; Q4-I8 WeakPolarHBondContact O-CG1 3.27Å; Q4-I8 PolarHBondContact O-N 3.11Å; Q4-I8 VanDerWaalsContact O-N 3.08Å; G5-I8 PolarHBondContact O-N 2.92Å; I8-G10 PolarHBondContact O-N 2.94Å; I8-V11 PolarHBondContact O-N 3.36Å; I8-M12 HydrophobicContact CG2-CG 4.37Å; I8-M12 VanDerWaalsContact O-CG 3.27Å; I8-M12 WeakPolarHBondContact O-CG 3.32Å; I8-M12 PolarHBondContact O-N 2.86Å
9	M	90.8	Very high	84.8	Confident	110 Å²	110	67.7 Å²	67.7	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-43.8	177.1	-175	173.1	179.8	0	0	111.8	G5 Q7 M12 L13 L180	G5-M9 VanDerWaalsContact O-CB 3.26Å; G5-M9 WeakPolarHBondContact O-CB 3.35Å; G5-M9 PolarHBondContact O-N 2.85Å; Q7-M9 PolarHBondContact O-N 3.49Å; M9-M12 PolarHBondContact O-N 3.25Å; M9-L13 HydrophobicContact CE-CD1 4.17Å; M9-L13 HydrophobicContact CG-CD1 3.86Å; M9-L13 HydrophobicContact CG-CG 4.5Å; M9-L13 WeakPolarHBondContact O-CB 3.39Å; M9-L13 WeakPolarHBondContact O-CD1 3.37Å; M9-L13 VanDerWaalsContact O-CG 3.31Å; M9-L13 WeakPolarHBondContact O-CG 3.41Å; M9-L13 PolarHBondContact O-N 3.25Å; M9-L180 HydrophobicContact CG-CD1 4.43Å
10	G	91.6	Very high	85.3	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-45.2	176.5	0	0	0	0	0	112.8	L6 Q7 I8 A14 G177	L6-G10 PolarHBondContact O-N 3.24Å; Q7-G10 PolarHBondContact O-N 3.1Å; I8-G10 PolarHBondContact O-N 2.94Å; G10-A14 WeakPolarHBondContact O-CB 3.36Å; G10-A14 PolarHBondContact O-N 3.17Å; G10-G177 WeakPolarHBondContact O-CA 3.29Å
11	V	91.1	Very high	85.7	Confident	39 Å²	39	61.8 Å²	61.8	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-45.6	175.4	175.6	0	0	0	0	111.2	Q7 I8 L13 A14 M15 A98 L181	Q7-V11 WeakPolarHBondContact O-CG2 3.48Å; Q7-V11 PolarHBondContact O-N 2.76Å; I8-V11 PolarHBondContact O-N 3.36Å; V11-L13 PolarHBondContact O-N 3.22Å; V11-A14 PolarHBondContact O-N 3.44Å; V11-M15 HydrophobicContact CG1-CG 4.12Å; V11-M15 WeakPolarHBondContact O-CB 3.45Å; V11-M15 VanDerWaalsContact O-CG 3.25Å; V11-M15 WeakPolarHBondContact O-CG 3.43Å; V11-M15 PolarHBondContact O-N 3.24Å; V11-A98 HydrophobicContact CG2-CB 4.47Å; V11-L181 HydrophobicContact CG2-CD2 3.92Å
12	M	93.4	Very high	88.2	Confident	115 Å²	115	53.8 Å²	53.8	57%	0.567	30%	0.297	S	S	*	.	H	α-helix	trans	-61	-45.1	179.8	-71.4	-65.8	-179.4	0	0	112	I8 M9 M15 I16	I8-M12 HydrophobicContact CG2-CG 4.37Å; I8-M12 VanDerWaalsContact O-CG 3.27Å; I8-M12 WeakPolarHBondContact O-CG 3.32Å; I8-M12 PolarHBondContact O-N 2.86Å; M9-M12 PolarHBondContact O-N 3.25Å; M12-M15 PolarHBondContact O-N 3.44Å; M12-I16 VanDerWaalsContact O-CG1 3.29Å; M12-I16 WeakPolarHBondContact O-CG1 3.35Å; M12-I16 PolarHBondContact O-N 3.04Å
13	L	94.7	Very high	90.2	Very high	35 Å²	35	56.4 Å²	56.4	18%	0.183	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-45.2	175.5	-73.5	162.4	0	0	0	111.6	M9 V11 M15 I16 G17 L173 L180	M9-L13 HydrophobicContact CE-CD1 4.17Å; M9-L13 HydrophobicContact CG-CD1 3.86Å; M9-L13 HydrophobicContact CG-CG 4.5Å; M9-L13 WeakPolarHBondContact O-CB 3.39Å; M9-L13 WeakPolarHBondContact O-CD1 3.37Å; M9-L13 VanDerWaalsContact O-CG 3.31Å; M9-L13 WeakPolarHBondContact O-CG 3.41Å; M9-L13 PolarHBondContact O-N 3.25Å; V11-L13 PolarHBondContact O-N 3.22Å; L13-M15 PolarHBondContact O-N 2.9Å; L13-I16 PolarHBondContact O-N 2.97Å; L13-G17 PolarHBondContact O-N 3.38Å; L13-L173 HydrophobicContact CD2-CD2 3.57Å; L13-L180 HydrophobicContact CD1-CD1 3.72Å
14	A	94.3	Very high	91.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-39.3	178.2	0	0	0	0	0	112.3	G10 V11 G17 W18 F125 L174	G10-A14 WeakPolarHBondContact O-CB 3.36Å; G10-A14 PolarHBondContact O-N 3.17Å; V11-A14 PolarHBondContact O-N 3.44Å; A14-G17 PolarHBondContact O-N 3.31Å; A14-W18 WeakPolarHBondContact O-CB 3.44Å; A14-W18 PolarHBondContact O-N 3.22Å; A14-F125 HydrophobicContact CB-CD1 4.02Å; A14-F125 HydrophobicContact CB-CD2 3.72Å; A14-F125 HydrophobicContact CB-CE1 4.04Å; A14-F125 HydrophobicContact CB-CE2 3.73Å; A14-F125 HydrophobicContact CB-CG 3.86Å; A14-F125 HydrophobicContact CB-CZ 3.89Å; A14-L174 WeakPolarHBondContact O-CD2 3.36Å
15	M	94.4	Very high	92.2	Very high	59 Å²	59	47.3 Å²	47.3	29%	0.291	26%	0.255	S	S	.	.	H	α-helix	trans	-65.1	-46.1	176.3	-72.4	-60.7	-65.1	0	0	112	V11 M12 L13 G17 W18 L19 V95	V11-M15 HydrophobicContact CG1-CG 4.12Å; V11-M15 WeakPolarHBondContact O-CB 3.45Å; V11-M15 VanDerWaalsContact O-CG 3.25Å; V11-M15 WeakPolarHBondContact O-CG 3.43Å; V11-M15 PolarHBondContact O-N 3.24Å; M12-M15 PolarHBondContact O-N 3.44Å; L13-M15 PolarHBondContact O-N 2.9Å; M15-G17 VanDerWaalsContact C-N 3.34Å; M15-W18 HydrophobicContact CE-CE3 4.39Å; M15-W18 PolarHBondContact O-N 3.08Å; M15-L19 WeakPolarHBondContact O-CG 3.49Å; M15-L19 PolarHBondContact O-N 3.45Å; M15-V95 HydrophobicContact CE-CG1 4.08Å; M15-V95 HydrophobicContact CE-CG2 4.42Å; M15-V95 HydrophobicContact SD-CB 4.21Å; M15-V95 HydrophobicContact SD-CG1 3.67Å; M15-V95 HydrophobicContact SD-CG2 3.54Å; M15-V95 VanDerWaalsContact SD-CG2 3.54Å
16	I	96.2	Very high	92.7	Very high	100 Å²	100	48.1 Å²	48.1	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-42.6	176.8	-64.1	166.1	0	0	0	110.1	M12 L13 W18 L19 G20 L173	M12-I16 VanDerWaalsContact O-CG1 3.29Å; M12-I16 WeakPolarHBondContact O-CG1 3.35Å; M12-I16 PolarHBondContact O-N 3.04Å; L13-I16 PolarHBondContact O-N 2.97Å; I16-W18 PolarHBondContact O-N 3.3Å; I16-L19 PolarHBondContact O-N 2.97Å; I16-G20 PolarHBondContact O-N 3.25Å; I16-L173 HydrophobicContact CG2-CD1 3.83Å
17	G	95.7	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-43.2	175.8	0	0	0	0	0	112.6	L13 A14 M15 G20 T21 S170	L13-G17 PolarHBondContact O-N 3.38Å; A14-G17 PolarHBondContact O-N 3.31Å; M15-G17 VanDerWaalsContact C-N 3.34Å; G17-G20 PolarHBondContact O-N 3.28Å; G17-T21 PolarHBondContact O-N 3.05Å; G17-T21 PolarHBondContact O-OG1 3.29Å; G17-S170 VanDerWaalsContact O-CB 3.24Å; G17-S170 WeakPolarHBondContact O-CB 3.49Å
18	W	96.3	Very high	93.1	Very high	39 Å²	39	47.5 Å²	47.5	15%	0.148	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-42.5	176.2	178.5	65.3	0	0	0	112.6	A14 M15 I16 G20 T21 I22 V88 V92 V95 L174	A14-W18 WeakPolarHBondContact O-CB 3.44Å; A14-W18 PolarHBondContact O-N 3.22Å; M15-W18 HydrophobicContact CE-CE3 4.39Å; M15-W18 PolarHBondContact O-N 3.08Å; I16-W18 PolarHBondContact O-N 3.3Å; W18-G20 VanDerWaalsContact C-N 3.32Å; W18-G20 PolarHBondContact O-N 3.19Å; W18-T21 WeakPolarHBondContact O-CB 3.43Å; W18-T21 PolarHBondContact O-N 2.93Å; W18-T21 VanDerWaalsContact O-N 3.1Å; W18-I22 HydrophobicContact CD2-CD1 4.12Å; W18-I22 HydrophobicContact CE3-CD1 4.28Å; W18-I22 HydrophobicContact CH2-CD1 3.84Å; W18-I22 HydrophobicContact CZ2-CD1 3.63Å; W18-I22 HydrophobicContact CZ3-CD1 4.16Å; W18-I22 PolarHBondContact O-N 3.45Å; W18-I22 VanDerWaalsContact O-N 3.16Å; W18-V88 PolarHBondContact NE1-O 3.23Å; W18-V92 HydrophobicContact CH2-CG2 4.4Å; W18-V92 HydrophobicContact CZ2-CG2 3.49Å; W18-V92 VanDerWaalsContact CZ2-CG2 3.49Å; W18-V95 HydrophobicContact CD2-CG2 3.99Å; W18-V95 HydrophobicContact CE3-CG2 3.96Å; W18-V95 HydrophobicContact CG-CG2 4.34Å; W18-V95 HydrophobicContact CZ3-CG2 4.44Å; W18-L174 HydrophobicContact CB-CD2 4.29Å
19	L	95.8	Very high	93.2	Very high	93 Å²	93	45.3 Å²	45.3	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-61.3	-41.4	172.4	-71.4	173.2	0	0	0	111.8	M15 I16 T21 I22 L23	M15-L19 WeakPolarHBondContact O-CG 3.49Å; M15-L19 PolarHBondContact O-N 3.45Å; I16-L19 PolarHBondContact O-N 2.97Å; L19-T21 PolarHBondContact O-N 2.94Å; L19-I22 PolarHBondContact O-N 3.14Å; L19-I22 VanDerWaalsContact O-N 3.17Å; L19-L23 WeakPolarHBondContact O-CG 3.32Å; L19-L23 PolarHBondContact O-N 3.29Å
20	G	95	Very high	93.1	Very high	11 Å²	11	40.1 Å²	40.1	11%	0.113	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-35.1	173.4	0	0	0	0	0	112.7	I16 G17 W18 L23 T24	I16-G20 PolarHBondContact O-N 3.25Å; G17-G20 PolarHBondContact O-N 3.28Å; W18-G20 VanDerWaalsContact C-N 3.32Å; W18-G20 PolarHBondContact O-N 3.19Å; G20-L23 PolarHBondContact O-N 3.19Å; G20-T24 PolarHBondContact O-N 3.17Å; G20-T24 PolarHBondContact O-OG1 2.82Å
21	T	94.4	Very high	92.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-45.2	175	-51.2	0	0	0	0	111.6	G17 W18 L19 L23 T24 C25 V88 I132	G17-T21 PolarHBondContact O-N 3.05Å; G17-T21 PolarHBondContact O-OG1 3.29Å; W18-T21 WeakPolarHBondContact O-CB 3.43Å; W18-T21 PolarHBondContact O-N 2.93Å; W18-T21 VanDerWaalsContact O-N 3.1Å; L19-T21 PolarHBondContact O-N 2.94Å; T21-L23 VanDerWaalsContact C-N 3.3Å; T21-L23 PolarHBondContact O-N 3.45Å; T21-T24 PolarHBondContact O-N 3.03Å; T21-C25 PolarHBondContact O-N 3.32Å; T21-V88 HydrophobicContact CG2-CG2 3.87Å; T21-I132 HydrophobicContact CG2-CD1 3.22Å; T21-I132 HydrophobicContact CG2-CG1 3.59Å; T21-I132 WeakPolarHBondContact OG1-CD1 3.49Å
22	I	94.9	Very high	92.8	Very high	60 Å²	60	39.2 Å²	39.2	31%	0.308	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-42.7	177.5	-64.8	167.1	0	0	0	109.8	W18 L19 C25 A26 V88	W18-I22 HydrophobicContact CD2-CD1 4.12Å; W18-I22 HydrophobicContact CE3-CD1 4.28Å; W18-I22 HydrophobicContact CH2-CD1 3.84Å; W18-I22 HydrophobicContact CZ2-CD1 3.63Å; W18-I22 HydrophobicContact CZ3-CD1 4.16Å; W18-I22 PolarHBondContact O-N 3.45Å; W18-I22 VanDerWaalsContact O-N 3.16Å; L19-I22 PolarHBondContact O-N 3.14Å; L19-I22 VanDerWaalsContact O-N 3.17Å; I22-C25 WeakPolarHBondContact O-CB 3.41Å; I22-C25 PolarHBondContact O-N 2.73Å; I22-A26 WeakPolarHBondContact O-CB 3.48Å; I22-A26 PolarHBondContact O-N 2.05Å; I22-V88 HydrophobicContact CG1-CG1 4.23Å; I22-V88 HydrophobicContact CG1-CG2 4.33Å
23	L	94.6	Very high	92.3	Very high	97 Å²	97	34.1 Å²	34.1	51%	0.508	19%	0.188	S	C	.	.	H	α-helix	trans	-62	-45.9	175.9	-70.5	175.3	0	0	0	112	L19 G20 T21 C25 A26 M27	L19-L23 WeakPolarHBondContact O-CG 3.32Å; L19-L23 PolarHBondContact O-N 3.29Å; G20-L23 PolarHBondContact O-N 3.19Å; T21-L23 VanDerWaalsContact C-N 3.3Å; T21-L23 PolarHBondContact O-N 3.45Å; L23-C25 VanDerWaalsContact C-N 3.26Å; L23-C25 PolarHBondContact O-N 3.39Å; L23-A26 PolarHBondContact O-N 2.93Å; L23-M27 HydrophobicContact CB-CE 3.93Å; L23-M27 WeakPolarHBondContact O-CB 3.22Å; L23-M27 WeakPolarHBondContact O-CE 3.47Å; L23-M27 PolarHBondContact O-N 3.12Å
24	T	93.3	Very high	91.5	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-37.2	174.6	-67.5	0	0	0	0	111.7	G20 T21 W30 S163 I166 G167	G20-T24 PolarHBondContact O-N 3.17Å; G20-T24 PolarHBondContact O-OG1 2.82Å; T21-T24 PolarHBondContact O-N 3.03Å; T24-W30 HydrophobicContact CG2-CZ2 3.68Å; T24-W30 PolarHBondContact O-NE1 2.95Å; T24-S163 WeakPolarHBondContact CG2-O 3.09Å; T24-S163 PolarHBondContact OG1-O 2.95Å; T24-I166 WeakPolarHBondContact OG1-CG2 3.46Å; T24-G167 WeakPolarHBondContact OG1-CA 3.1Å; T24-G167 PolarHBondContact OG1-N 2.9Å; T24-G167 VanDerWaalsContact OG1-N 3.11Å
25	C	92.2	Very high	90.5	Very high	17 Å²	17	36.3 Å²	36.3	12%	0.115	20%	0.202	C	C	.	.	H	α-helix	trans	-66.9	-42.4	175.4	-170.5	0	0	0	0	112.6	T21 I22 L23 W51 V84	T21-C25 PolarHBondContact O-N 3.32Å; I22-C25 WeakPolarHBondContact O-CB 3.41Å; I22-C25 PolarHBondContact O-N 2.73Å; L23-C25 VanDerWaalsContact C-N 3.26Å; L23-C25 PolarHBondContact O-N 3.39Å; C25-W51 PolarHBondContact O-NE1 3.05Å; C25-W51 PolarHBondContact SG-NE1 3.48Å; C25-W51 VanDerWaalsContact SG-NE1 3.38Å; C25-V84 HydrophobicContact CB-CG1 3.55Å
26	A	90.6	Very high	89	Confident	59 Å²	59	38.8 Å²	38.8	49%	0.488	22%	0.22	S	C	.	.	H	α-helix	trans	-80.6	-31.9	-173.8	0	0	0	0	0	113.7	I22 L23	I22-A26 WeakPolarHBondContact O-CB 3.48Å; I22-A26 PolarHBondContact O-N 2.05Å; L23-A26 PolarHBondContact O-N 2.93Å
27	M	90.3	Very high	87.2	Confident	39 Å²	39	35.8 Å²	35.8	19%	0.192	21%	0.214	C	C	.	.			trans	-71.2	133.1	-175.5	-87.1	-174.3	-73.4	0	0	112.6	L23 M29 I166	L23-M27 HydrophobicContact CB-CE 3.93Å; L23-M27 WeakPolarHBondContact O-CB 3.22Å; L23-M27 WeakPolarHBondContact O-CE 3.47Å; L23-M27 PolarHBondContact O-N 3.12Å; M27-M29 HydrophobicContact CB-CE 4.31Å; M27-M29 HydrophobicContact CG-CE 4.02Å; M27-M29 PolarHBondContact O-N 2.85Å; M27-M29 HydrophobicContact SD-CE 3.37Å; M27-M29 WeakPolarHBondContact SD-CE 3.21Å; M27-I166 HydrophobicContact CE-CD1 3.31Å; M27-I166 HydrophobicContact CE-CG1 4.48Å; M27-I166 HydrophobicContact CE-CG2 4.38Å; M27-I166 HydrophobicContact SD-CD1 4.17Å
28	P	88.3	Confident	85.4	Confident	28 Å²	28	41 Å²	41	18%	0.182	26%	0.257	C	S	.	.	S	Bend	trans	-83	27.8	-178.9	35.7	-37.1	0	0	0	113.9	W47 E48 G49 M52	P28-W47 CarbonylContact O-C 3.54Å; P28-E48 CarbonylContact O-C 3.59Å; P28-E48 VanDerWaalsContact O-C 3.24Å; P28-G49 VanDerWaalsContact CA-CA 3.45Å; P28-G49 PolarHBondContact O-N 3.05Å; P28-M52 HydrophobicContact CB-CG 3.63Å; P28-M52 HydrophobicContact CB-SD 4.31Å; P28-M52 HydrophobicContact CG-CG 4.35Å; P28-M52 HydrophobicContact CG-SD 4.41Å
29	M	88.8	Confident	83.3	Confident	49 Å²	49	44.7 Å²	44.7	24%	0.241	28%	0.28	C	S	.	.			trans	-118.5	51.1	-170	-55.3	-171.7	-82.3	0	0	111	M27 W47 G161 A162 S163	M27-M29 HydrophobicContact CB-CE 4.31Å; M27-M29 HydrophobicContact CG-CE 4.02Å; M27-M29 PolarHBondContact O-N 2.85Å; M27-M29 HydrophobicContact SD-CE 3.37Å; M27-M29 WeakPolarHBondContact SD-CE 3.21Å; M29-W47 HydrophobicContact CB-CE3 3.96Å; M29-W47 HydrophobicContact CB-CZ3 4.27Å; M29-W47 HydrophobicContact CG-CD2 4.48Å; M29-W47 HydrophobicContact CG-CE3 3.48Å; M29-W47 VanDerWaalsContact CG-CE3 3.48Å; M29-W47 HydrophobicContact CG-CZ3 3.81Å; M29-W47 HydrophobicContact SD-CE3 3.78Å; M29-W47 HydrophobicContact SD-CH2 4.36Å; M29-W47 HydrophobicContact SD-CZ3 3.46Å; M29-W47 WeakPolarHBondContact SD-CZ3 3.48Å; M29-G161 CarbonylContact O-C 3.14Å; M29-G161 WeakPolarHBondContact O-CA 3.43Å; M29-A162 HydrophobicContact CB-CB 4.35Å; M29-A162 HydrophobicContact CE-CB 4.27Å; M29-A162 PolarHBondContact O-N 3.35Å; M29-A162 HydrophobicContact SD-CB 4.24Å; M29-S163 VanDerWaalsContact O-CB 3.27Å; M29-S163 WeakPolarHBondContact O-CB 3.46Å; M29-S163 PolarHBondContact O-N 3.38Å; M29-S163 PolarHBondContact O-OG 3.25Å
30	W	90.3	Very high	81.4	Confident	1 Å²	1	47 Å²	47	0%	0.004	29%	0.291	C	S	.	.	S	Bend	trans	-85.9	-43.9	177.6	-86.6	66.9	0	0	0	111.7	T24 E48 L50 A80 V84 V136 G161 S163 L164	T24-W30 HydrophobicContact CG2-CZ2 3.68Å; T24-W30 PolarHBondContact O-NE1 2.95Å; W30-E48 WeakPolarHBondContact CA-O 3.23Å; W30-E48 WeakPolarHBondContact CB-O 3.45Å; W30-E48 PolarHBondContact N-O 2.91Å; W30-L50 HydrophobicContact CD2-CD1 3.53Å; W30-L50 HydrophobicContact CE3-CD1 3.89Å; W30-L50 HydrophobicContact CG-CD1 3.94Å; W30-L50 HydrophobicContact CH2-CD1 4.2Å; W30-L50 HydrophobicContact CZ2-CD1 3.85Å; W30-L50 HydrophobicContact CZ2-CD2 4.08Å; W30-L50 HydrophobicContact CZ3-CD1 4.22Å; W30-A80 HydrophobicContact CH2-CB 4.23Å; W30-A80 HydrophobicContact CZ3-CB 3.95Å; W30-V84 HydrophobicContact CH2-CG2 3.89Å; W30-V84 HydrophobicContact CZ2-CG2 4.02Å; W30-V136 HydrophobicContact CH2-CG2 4.04Å; W30-G161 PolarHBondContact O-N 3.05Å; W30-S163 VanDerWaalsContact CA-OG 3.25Å; W30-S163 WeakPolarHBondContact CA-OG 3.42Å; W30-S163 PolarHBondContact N-OG 2.92Å; W30-S163 PolarHBondContact NE1-OG 3.27Å; W30-L164 HydrophobicContact CD2-CD2 4.24Å; W30-L164 HydrophobicContact CE3-CD2 3.66Å; W30-L164 HydrophobicContact CZ3-CD2 3.94Å; W30-L164 WeakPolarHBondContact O-CD1 3.29Å
31	R	87.3	Confident	79.6	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.5	174.9	-44.1	-180	87.9	175.5	7.1	108.5	E48 L77 L143 D146 R158	R31-E48 HydrophobicContact CB-CB 4.18Å; R31-E48 PolarHBondContact N-O 3.36Å; R31-E48 PolarHBondContact O-N 3.47Å; R31-L77 HydrophobicContact CG-CD1 4.35Å; R31-L143 HydrophobicContact CB-CD2 4.08Å; R31-L143 HydrophobicContact CG-CD1 4.2Å; R31-L143 HydrophobicContact CG-CD2 4.06Å; R31-L143 VanDerWaalsContact NE-CD2 3.33Å; R31-D146 IonicContact NH2-OD2 3.78Å; R31-D146 PolarHBondContact NH2-OD2 2.77Å; R31-R158 VanDerWaalsContact NH2-NH1 3.18Å
32	V	87.3	Confident	78	Confident	15 Å²	15	57.3 Å²	57.3	9%	0.091	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.5	175	-179.6	0	0	0	0	107.8	V45 I46 W47 R158 E159	V32-V45 HydrophobicContact CG1-CG1 4.02Å; V32-I46 WeakPolarHBondContact CA-O 3.33Å; V32-W47 HydrophobicContact CG2-CD2 4.25Å; V32-W47 HydrophobicContact CG2-CE3 3.65Å; V32-W47 HydrophobicContact CG2-CZ3 3.96Å; V32-R158 CarbonylContact O-C 3.24Å; V32-R158 WeakPolarHBondContact O-CA 3.34Å; V32-E159 HydrophobicContact CB-CB 4.33Å; V32-E159 PolarHBondContact N-O 2.84Å; V32-E159 VanDerWaalsContact N-O 3.1Å; V32-E159 PolarHBondContact O-N 3.15Å
33	T	83.3	Confident	76.6	Confident	8 Å²	8	55.9 Å²	55.9	5%	0.049	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.3	173.4	54.1	0	0	0	0	109.3	I46 R158	T33-I46 PolarHBondContact N-O 3.1Å; T33-I46 PolarHBondContact O-N 2.87Å; T33-I46 WeakPolarHBondContact OG1-CB 3.5Å; T33-R158 HydrophobicContact CG2-CB 4.04Å; T33-R158 HydrophobicContact CG2-CG 3.64Å
34	A	79.3	Confident	75.8	Confident	32 Å²	32	54.5 Å²	54.5	26%	0.264	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	107.9	173.7	0	0	0	0	0	109	V36	A34-V36 HydrophobicContact CB-CG2 4.16Å; A34-V36 PolarHBondContact O-N 2.95Å; A34-V36 VanDerWaalsContact O-N 3.08Å
35	F	71.9	Confident	75.4	Confident	50 Å²	50	56.9 Å²	56.9	22%	0.219	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	91.1	171.7	-72.9	-94.8	0	0	0	108.8	A43 Q44 I46 A155 Q156	F35-A43 WeakPolarHBondContact O-CA 3.44Å; F35-Q44 HydrophobicContact CB-CG 3.85Å; F35-Q44 HydrophobicContact CD2-CG 3.97Å; F35-Q44 HydrophobicContact CG-CG 4.16Å; F35-Q44 PolarHBondContact N-O 2.84Å; F35-Q44 PolarHBondContact O-N 3.07Å; F35-I46 HydrophobicContact CD2-CD1 3.91Å; F35-I46 HydrophobicContact CD2-CG1 4.06Å; F35-I46 HydrophobicContact CE2-CD1 3.43Å; F35-I46 VanDerWaalsContact CE2-CD1 3.43Å; F35-I46 HydrophobicContact CE2-CG1 3.96Å; F35-I46 HydrophobicContact CZ-CD1 4.34Å; F35-A155 WeakPolarHBondContact CD1-O 3.46Å; F35-Q156 HydrophobicContact CE1-CG 4.03Å
36	V	62.8	Low	75.2	Confident	110 Å²	110	57.2 Å²	57.2	67%	0.667	35%	0.354	S	S	*	.			trans	-103.3	83.2	173.9	-169.3	0	0	0	0	108.3	A34	A34-V36 HydrophobicContact CB-CG2 4.16Å; A34-V36 PolarHBondContact O-N 2.95Å; A34-V36 VanDerWaalsContact O-N 3.08Å
37	G	59.7	Low	75.1	Confident	37 Å²	37	58.1 Å²	58.1	38%	0.381	35%	0.345	S	S	.	.			trans	-84.9	169.2	170.4	0	0	0	0	0	112.2	N39	G37-N39 PolarHBondContact O-N 2.86Å
38	A	56.8	Low	75	Confident	110 Å²	110	58.2 Å²	58.2	91%	0.909	35%	0.345	S	S	*	.	S	Bend	trans	-61.1	-13.2	178.4	0	0	0	0	0	114.7
39	N	53.6	Low	75.1	Confident	117 Å²	117	56.9 Å²	56.9	63%	0.626	34%	0.336	S	S	*	.			trans	-104.8	112.5	173.3	-76.9	-38	0	0	0	110.5	G37 V41 T42	G37-N39 PolarHBondContact O-N 2.86Å; N39-V41 PolarHBondContact O-N 3.4Å; N39-V41 VanDerWaalsContact O-N 3.17Å; N39-T42 PolarHBondContact O-N 3.03Å; N39-T42 PolarHBondContact O-OG1 3.39Å
40	I	54.7	Low	75	Confident	142 Å²	142	54.5 Å²	54.5	73%	0.728	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-58.9	-27.5	178.3	-60	173.3	0	0	0	111.7	T42 A43 S58	I40-T42 PolarHBondContact O-N 3Å; I40-A43 WeakPolarHBondContact O-CB 3.28Å; I40-A43 PolarHBondContact O-N 3.46Å; I40-S58 PolarHBondContact O-OG 3.1Å
41	V	57.1	Low	74.9	Confident	138 Å²	138	58.7 Å²	58.7	84%	0.836	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.5	-177.3	-175.3	0	0	0	0	113.4	N39	N39-V41 PolarHBondContact O-N 3.4Å; N39-V41 VanDerWaalsContact O-N 3.17Å
42	T	61.2	Low	75	Confident	90 Å²	90	61.4 Å²	61.4	55%	0.552	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-112.5	12.4	177.2	55.8	0	0	0	0	113.4	N39 I40 Q44	N39-T42 PolarHBondContact O-N 3.03Å; N39-T42 PolarHBondContact O-OG1 3.39Å; I40-T42 PolarHBondContact O-N 3Å; T42-Q44 PolarHBondContact O-N 2.92Å
43	A	65.8	Low	75.1	Confident	30 Å²	30	62.7 Å²	62.7	25%	0.248	36%	0.361	C	S	.	.			trans	-69.2	116.5	179.3	0	0	0	0	0	110.1	F35 I40 S58	F35-A43 WeakPolarHBondContact O-CA 3.44Å; I40-A43 WeakPolarHBondContact O-CB 3.28Å; I40-A43 PolarHBondContact O-N 3.46Å; A43-S58 PolarHBondContact O-N 2.91Å; A43-S58 PolarHBondContact O-OG 3.37Å
44	Q	78.3	Confident	75.4	Confident	67 Å²	67	62.4 Å²	62.4	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.3	-178.1	60.9	-172.9	-52.7	0	0	110.6	F35 T42 I46 V55 V56	F35-Q44 HydrophobicContact CB-CG 3.85Å; F35-Q44 HydrophobicContact CD2-CG 3.97Å; F35-Q44 HydrophobicContact CG-CG 4.16Å; F35-Q44 PolarHBondContact N-O 2.84Å; F35-Q44 PolarHBondContact O-N 3.07Å; T42-Q44 PolarHBondContact O-N 2.92Å; Q44-I46 HydrophobicContact CG-CG1 4.38Å; Q44-V55 HydrophobicContact CB-CG1 4.06Å; Q44-V56 WeakPolarHBondContact CA-O 3.21Å
45	V	84.9	Confident	75.8	Confident	52 Å²	52	62.1 Å²	62.1	32%	0.315	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.1	172	-176.1	0	0	0	0	107.8	V32 V55 V56	V32-V45 HydrophobicContact CG1-CG1 4.02Å; V45-V55 WeakPolarHBondContact O-CA 3.35Å; V45-V56 PolarHBondContact N-O 3.42Å; V45-V56 PolarHBondContact O-N 2.75Å
46	I	86.6	Confident	76.5	Confident	23 Å²	23	62 Å²	62	12%	0.118	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.6	179.1	-47.6	-171.4	0	0	0	108.7	V32 T33 F35 Q44 E48 C54 V55	V32-I46 WeakPolarHBondContact CA-O 3.33Å; T33-I46 PolarHBondContact N-O 3.1Å; T33-I46 PolarHBondContact O-N 2.87Å; T33-I46 WeakPolarHBondContact OG1-CB 3.5Å; F35-I46 HydrophobicContact CD2-CD1 3.91Å; F35-I46 HydrophobicContact CD2-CG1 4.06Å; F35-I46 HydrophobicContact CE2-CD1 3.43Å; F35-I46 VanDerWaalsContact CE2-CD1 3.43Å; F35-I46 HydrophobicContact CE2-CG1 3.96Å; F35-I46 HydrophobicContact CZ-CD1 4.34Å; Q44-I46 HydrophobicContact CG-CG1 4.38Å; I46-E48 HydrophobicContact CG2-CG 4.15Å; I46-C54 WeakPolarHBondContact CA-O 3.42Å; I46-V55 HydrophobicContact CB-CG2 4.47Å; I46-V55 HydrophobicContact CD1-CG2 4.33Å; I46-V55 HydrophobicContact CG1-CG1 4.24Å; I46-V55 HydrophobicContact CG1-CG2 4.07Å; I46-V55 HydrophobicContact CG2-CG2 4.09Å
47	W	88.6	Confident	77.5	Confident	78 Å²	78	60.5 Å²	60.5	30%	0.295	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.6	175	-54.6	72.7	0	0	0	107.1	P28 M29 V32 N53 C54	P28-W47 CarbonylContact O-C 3.54Å; M29-W47 HydrophobicContact CB-CE3 3.96Å; M29-W47 HydrophobicContact CB-CZ3 4.27Å; M29-W47 HydrophobicContact CG-CD2 4.48Å; M29-W47 HydrophobicContact CG-CE3 3.48Å; M29-W47 VanDerWaalsContact CG-CE3 3.48Å; M29-W47 HydrophobicContact CG-CZ3 3.81Å; M29-W47 HydrophobicContact SD-CE3 3.78Å; M29-W47 HydrophobicContact SD-CH2 4.36Å; M29-W47 HydrophobicContact SD-CZ3 3.46Å; M29-W47 WeakPolarHBondContact SD-CZ3 3.48Å; V32-W47 HydrophobicContact CG2-CD2 4.25Å; V32-W47 HydrophobicContact CG2-CE3 3.65Å; V32-W47 HydrophobicContact CG2-CZ3 3.96Å; W47-N53 CarbonylContact O-C 3.58Å; W47-N53 VanDerWaalsContact O-CA 3.29Å; W47-N53 WeakPolarHBondContact O-CA 3.47Å; W47-C54 HydrophobicContact CB-CB 4.29Å; W47-C54 PolarHBondContact N-O 2.71Å; W47-C54 PolarHBondContact O-N 3.4Å
48	E	88.5	Confident	78.4	Confident	41 Å²	41	62.2 Å²	62.2	19%	0.192	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.5	177.4	-58.9	-174.6	144.9	0	0	109.3	P28 W30 R31 I46	P28-E48 CarbonylContact O-C 3.59Å; P28-E48 VanDerWaalsContact O-C 3.24Å; W30-E48 WeakPolarHBondContact CA-O 3.23Å; W30-E48 WeakPolarHBondContact CB-O 3.45Å; W30-E48 PolarHBondContact N-O 2.91Å; R31-E48 HydrophobicContact CB-CB 4.18Å; R31-E48 PolarHBondContact N-O 3.36Å; R31-E48 PolarHBondContact O-N 3.47Å; I46-E48 HydrophobicContact CG2-CG 4.15Å
49	G	89.8	Confident	79.3	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.336	C	S	.	.			trans	-99.9	179.9	170.3	0	0	0	0	0	113.5	P28 M52 Y67 L77	P28-G49 VanDerWaalsContact CA-CA 3.45Å; P28-G49 PolarHBondContact O-N 3.05Å; G49-M52 WeakPolarHBondContact CA-O 3.38Å; G49-M52 PolarHBondContact N-O 3.3Å; G49-Y67 WeakPolarHBondContact O-CE2 3.24Å; G49-Y67 PolarHBondContact O-OH 2.75Å; G49-L77 WeakPolarHBondContact O-CD2 3.46Å
50	L	86.7	Confident	80.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-71.7	-31.4	169.7	-113.2	59.7	0	0	0	113.2	W30 L77 A80 R81 V84	W30-L50 HydrophobicContact CD2-CD1 3.53Å; W30-L50 HydrophobicContact CE3-CD1 3.89Å; W30-L50 HydrophobicContact CG-CD1 3.94Å; W30-L50 HydrophobicContact CH2-CD1 4.2Å; W30-L50 HydrophobicContact CZ2-CD1 3.85Å; W30-L50 HydrophobicContact CZ2-CD2 4.08Å; W30-L50 HydrophobicContact CZ3-CD1 4.22Å; L50-L77 HydrophobicContact CD1-CG 4.3Å; L50-A80 HydrophobicContact CD1-CB 4.43Å; L50-R81 HydrophobicContact CD2-CB 4.06Å; L50-R81 HydrophobicContact CD2-CG 4.09Å; L50-R81 HydrophobicContact CG-CB 4Å; L50-R81 HydrophobicContact CG-CG 4.13Å; L50-R81 PolarHBondContact O-NH1 3.04Å; L50-V84 HydrophobicContact CD2-CB 4.31Å; L50-V84 HydrophobicContact CD2-CG2 4.45Å
51	W	88.7	Confident	81.8	Confident	88 Å²	88	58.2 Å²	58.2	33%	0.333	33%	0.327	S	S	.	.	S	Bend	trans	-116.2	-31.1	-170.1	-55.9	90.7	0	0	0	113.5	C25 Y67 R81 I85	C25-W51 PolarHBondContact O-NE1 3.05Å; C25-W51 PolarHBondContact SG-NE1 3.48Å; C25-W51 VanDerWaalsContact SG-NE1 3.38Å; W51-Y67 WeakPolarHBondContact O-CD2 3.39Å; W51-Y67 PolarHBondContact O-N 3.32Å; W51-R81 HydrophobicContact CH2-CG 4.24Å; W51-R81 VanDerWaalsContact CH2-NE 3.28Å; W51-R81 HydrophobicContact CZ2-CG 3.93Å; W51-R81 VanDerWaalsContact CZ3-NE 3.29Å; W51-I85 HydrophobicContact CH2-CD1 3.64Å; W51-I85 HydrophobicContact CH2-CG1 4.23Å; W51-I85 HydrophobicContact CZ2-CD1 3.84Å; W51-I85 HydrophobicContact CZ2-CG1 4Å
52	M	88.9	Confident	83.2	Confident	62 Å²	62	57.4 Å²	57.4	31%	0.305	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157.1	-178.3	66.7	-175.6	76.3	0	0	109.6	P28 G49 K65 V66	P28-M52 HydrophobicContact CB-CG 3.63Å; P28-M52 HydrophobicContact CB-SD 4.31Å; P28-M52 HydrophobicContact CG-CG 4.35Å; P28-M52 HydrophobicContact CG-SD 4.41Å; G49-M52 WeakPolarHBondContact CA-O 3.38Å; G49-M52 PolarHBondContact N-O 3.3Å; M52-K65 CarbonylContact C-O 3.59Å; M52-K65 VanDerWaalsContact CA-O 3.27Å; M52-K65 WeakPolarHBondContact CA-O 3.46Å; M52-K65 VanDerWaalsContact CB-O 3.32Å; M52-K65 WeakPolarHBondContact CB-O 3.23Å; M52-V66 HydrophobicContact CB-CG2 4.36Å
53	N	88.9	Confident	84.4	Confident	42 Å²	42	58.9 Å²	58.9	23%	0.225	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.8	166.7	61.4	-16.4	0	0	0	109.8	W47 C64 K65 Y67	W47-N53 CarbonylContact O-C 3.58Å; W47-N53 VanDerWaalsContact O-CA 3.29Å; W47-N53 WeakPolarHBondContact O-CA 3.47Å; N53-C64 CarbonylContact O-C 3.48Å; N53-C64 VanDerWaalsContact O-CA 3.31Å; N53-C64 WeakPolarHBondContact O-CA 3.45Å; N53-K65 PolarHBondContact N-O 3.34Å; N53-K65 PolarHBondContact O-N 3.44Å; N53-K65 PolarHBondContact OD1-O 2.99Å; N53-Y67 HydrophobicContact CB-CE1 4.19Å
54	C	89.8	Confident	85.6	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.014	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.9	176.9	-62.7	0	0	0	0	109.6	I46 W47 M62 Q63 C64	I46-C54 WeakPolarHBondContact CA-O 3.42Å; W47-C54 HydrophobicContact CB-CB 4.29Å; W47-C54 PolarHBondContact N-O 2.71Å; W47-C54 PolarHBondContact O-N 3.4Å; C54-M62 HydrophobicContact CB-CE 3.95Å; C54-Q63 CarbonylContact C-O 3.56Å; C54-Q63 WeakPolarHBondContact CA-O 3.22Å; C54-C64 HydrophobicContact CB-CB 4.16Å; C54-C64 WeakPolarHBondContact CB-SG 3.43Å; C54-C64 WeakPolarHBondContact SG-CB 3.4Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 2.95Å
55	V	88.7	Confident	86.1	Confident	25 Å²	25	63.2 Å²	63.2	15%	0.152	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.7	177.7	-176.8	0	0	0	0	108.4	Q44 V45 I46 Q57 M62 Q63	Q44-V55 HydrophobicContact CB-CG1 4.06Å; V45-V55 WeakPolarHBondContact O-CA 3.35Å; I46-V55 HydrophobicContact CB-CG2 4.47Å; I46-V55 HydrophobicContact CD1-CG2 4.33Å; I46-V55 HydrophobicContact CG1-CG1 4.24Å; I46-V55 HydrophobicContact CG1-CG2 4.07Å; I46-V55 HydrophobicContact CG2-CG2 4.09Å; V55-Q57 HydrophobicContact CG1-CG 4.39Å; V55-M62 WeakPolarHBondContact O-CA 3.48Å; V55-Q63 PolarHBondContact N-O 3.5Å; V55-Q63 PolarHBondContact O-N 3.29Å
56	V	86.8	Confident	86.3	Confident	47 Å²	47	65.2 Å²	65.2	29%	0.285	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.1	172.1	-177.7	0	0	0	0	107.8	Q44 V45 M62	Q44-V56 WeakPolarHBondContact CA-O 3.21Å; V45-V56 PolarHBondContact N-O 3.42Å; V45-V56 PolarHBondContact O-N 2.75Å; V56-M62 HydrophobicContact CG2-CB 4.33Å; V56-M62 HydrophobicContact CG2-CG 4.15Å
57	Q	83.8	Confident	86.1	Confident	80 Å²	80	66.4 Å²	66.4	37%	0.374	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	159.5	177.2	-71.9	167.6	12	0	0	110.9	V55 T59 G60 Q61	V55-Q57 HydrophobicContact CG1-CG 4.39Å; Q57-T59 PolarHBondContact O-N 2.93Å; Q57-G60 PolarHBondContact O-N 3.03Å; Q57-Q61 PolarHBondContact N-O 3.45Å; Q57-Q61 VanDerWaalsContact N-O 3.12Å
58	S	77.4	Confident	85.5	Confident	72 Å²	72	68.6 Å²	68.6	50%	0.503	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.9	179.8	-12.3	0	0	0	0	113.4	I40 A43 G60	I40-S58 PolarHBondContact O-OG 3.1Å; A43-S58 PolarHBondContact O-N 2.91Å; A43-S58 PolarHBondContact O-OG 3.37Å; S58-G60 PolarHBondContact O-N 3.29Å
59	T	76.9	Confident	84.6	Confident	105 Å²	105	70.2 Å²	70.2	64%	0.644	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-1.4	172.5	54.7	0	0	0	0	113.7	Q57 Q61	Q57-T59 PolarHBondContact O-N 2.93Å; T59-Q61 PolarHBondContact O-N 2.74Å
60	G	77.5	Confident	83.2	Confident	58 Å²	58	75.1 Å²	75.1	60%	0.598	41%	0.409	S	S	*	.	S	Bend	trans	78.9	1.7	-178.9	0	0	0	0	0	114.3	Q57 S58	Q57-G60 PolarHBondContact O-N 3.03Å; S58-G60 PolarHBondContact O-N 3.29Å
61	Q	82.6	Confident	81.9	Confident	122 Å²	122	83 Å²	83	57%	0.57	45%	0.451	S	S	*	.			trans	-76.4	127.3	175.2	-63.9	-65.9	-63.7	0	0	110.1	Q57 T59	Q57-Q61 PolarHBondContact N-O 3.45Å; Q57-Q61 VanDerWaalsContact N-O 3.12Å; T59-Q61 PolarHBondContact O-N 2.74Å
62	M	86.6	Confident	80.4	Confident	122 Å²	122	83.1 Å²	83.1	60%	0.601	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	119	171.5	179.6	175.3	-176.6	0	0	109	C54 V55 V56 C64	C54-M62 HydrophobicContact CB-CE 3.95Å; V55-M62 WeakPolarHBondContact O-CA 3.48Å; V56-M62 HydrophobicContact CG2-CB 4.33Å; V56-M62 HydrophobicContact CG2-CG 4.15Å; M62-C64 VanDerWaalsContact CE-SG 3.59Å
63	Q	87.2	Confident	79.3	Confident	120 Å²	120	80.8 Å²	80.8	56%	0.561	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.4	176.9	-64.8	-174	-44.5	0	0	109.1	C54 V55	C54-Q63 CarbonylContact C-O 3.56Å; C54-Q63 WeakPolarHBondContact CA-O 3.22Å; V55-Q63 PolarHBondContact N-O 3.5Å; V55-Q63 PolarHBondContact O-N 3.29Å
64	C	90.8	Very high	78.7	Confident	67 Å²	67	81.4 Å²	81.4	45%	0.453	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.1	172.2	-64.1	0	0	0	0	109.9	N53 C54 M62	N53-C64 CarbonylContact O-C 3.48Å; N53-C64 VanDerWaalsContact O-CA 3.31Å; N53-C64 WeakPolarHBondContact O-CA 3.45Å; C54-C64 HydrophobicContact CB-CB 4.16Å; C54-C64 WeakPolarHBondContact CB-SG 3.43Å; C54-C64 WeakPolarHBondContact SG-CB 3.4Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 2.95Å; M62-C64 VanDerWaalsContact CE-SG 3.59Å
65	K	88.3	Confident	78.2	Confident	122 Å²	122	89.3 Å²	89.3	53%	0.53	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.5	176.7	-169.7	177.2	175.2	-173.6	0	109.7	M52 N53 D68	M52-K65 CarbonylContact C-O 3.59Å; M52-K65 VanDerWaalsContact CA-O 3.27Å; M52-K65 WeakPolarHBondContact CA-O 3.46Å; M52-K65 VanDerWaalsContact CB-O 3.32Å; M52-K65 WeakPolarHBondContact CB-O 3.23Å; N53-K65 PolarHBondContact N-O 3.34Å; N53-K65 PolarHBondContact O-N 3.44Å; N53-K65 PolarHBondContact OD1-O 2.99Å; K65-D68 WeakPolarHBondContact CE-OD2 3.46Å; K65-D68 IonicContact NZ-OD2 3.84Å; K65-D68 PolarHBondContact NZ-OD2 3.03Å
66	V	88.4	Confident	77.8	Confident	94 Å²	94	90.8 Å²	90.8	57%	0.57	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	142.1	171.7	179.7	0	0	0	0	108.2	M52 D68	M52-V66 HydrophobicContact CB-CG2 4.36Å; V66-D68 PolarHBondContact O-N 2.91Å; V66-D68 VanDerWaalsContact O-N 3.17Å
67	Y	83.8	Confident	77.5	Confident	48 Å²	48	88.7 Å²	88.7	19%	0.188	50%	0.496	C	S	.	.			trans	-64.3	118.2	177.7	-64.7	-71	0	0	0	110.9	G49 W51 N53 S69 L73	G49-Y67 WeakPolarHBondContact O-CE2 3.24Å; G49-Y67 PolarHBondContact O-OH 2.75Å; W51-Y67 WeakPolarHBondContact O-CD2 3.39Å; W51-Y67 PolarHBondContact O-N 3.32Å; N53-Y67 HydrophobicContact CB-CE1 4.19Å; Y67-S69 VanDerWaalsContact C-N 3.26Å; Y67-S69 PolarHBondContact O-N 2.69Å; Y67-L73 HydrophobicContact CD1-CD1 3.97Å; Y67-L73 HydrophobicContact CD2-CD1 3.98Å; Y67-L73 HydrophobicContact CE1-CD1 3.64Å; Y67-L73 HydrophobicContact CE2-CD1 3.65Å; Y67-L73 HydrophobicContact CG-CD1 4.13Å; Y67-L73 VanDerWaalsContact CZ-CD1 3.46Å
68	D	74.6	Confident	77.5	Confident	124 Å²	124	89.3 Å²	89.3	66%	0.663	50%	0.499	S	S	*	.	S	Bend	trans	-69	-21	-177.9	-67.9	-36.2	0	0	0	113.1	K65 V66	K65-D68 WeakPolarHBondContact CE-OD2 3.46Å; K65-D68 IonicContact NZ-OD2 3.84Å; K65-D68 PolarHBondContact NZ-OD2 3.03Å; V66-D68 PolarHBondContact O-N 2.91Å; V66-D68 VanDerWaalsContact O-N 3.17Å
69	S	69.8	Low	78	Confident	75 Å²	75	88.1 Å²	88.1	52%	0.524	49%	0.494	S	S	.	.			trans	-152.3	130.8	-179.6	-70.8	0	0	0	0	112	Y67 L71 A72	Y67-S69 VanDerWaalsContact C-N 3.26Å; Y67-S69 PolarHBondContact O-N 2.69Å; S69-L71 PolarHBondContact O-N 2.97Å; S69-A72 PolarHBondContact O-N 3.49Å
70	M	61.3	Low	78.5	Confident	102 Å²	102	83.2 Å²	83.2	50%	0.502	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-63.7	-22.4	-179.9	-58	-58.2	-174.5	0	0	113.4	A72 R81	M70-A72 VanDerWaalsContact C-N 3.33Å; M70-R81 PolarHBondContact SD-NH1 3.38Å
71	L	59	Low	79.1	Confident	166 Å²	166	81.6 Å²	81.6	87%	0.869	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-78.8	-14.7	-174.7	-156.1	67.4	0	0	0	113.6	S69	S69-L71 PolarHBondContact O-N 2.97Å
72	A	56.2	Low	79.5	Confident	91 Å²	91	78.5 Å²	78.5	75%	0.752	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-90.4	-3.2	178.3	0	0	0	0	0	113.3	S69 M70	S69-A72 PolarHBondContact O-N 3.49Å; M70-A72 VanDerWaalsContact C-N 3.33Å
73	L	67.3	Low	79.7	Confident	13 Å²	13	75.3 Å²	75.3	7%	0.068	42%	0.419	C	S	.	.	S	Bend	trans	-87	141.4	-176.5	-156.5	70	0	0	0	110.6	Y67 Q75 L77	Y67-L73 HydrophobicContact CD1-CD1 3.97Å; Y67-L73 HydrophobicContact CD2-CD1 3.98Å; Y67-L73 HydrophobicContact CE1-CD1 3.64Å; Y67-L73 HydrophobicContact CE2-CD1 3.65Å; Y67-L73 HydrophobicContact CG-CD1 4.13Å; Y67-L73 VanDerWaalsContact CZ-CD1 3.46Å; L73-Q75 PolarHBondContact O-N 3.27Å; L73-L77 HydrophobicContact CD1-CD2 3.98Å; L73-L77 HydrophobicContact CD2-CB 3.8Å; L73-L77 HydrophobicContact CD2-CD2 4.22Å; L73-L77 HydrophobicContact CG-CB 3.89Å; L73-L77 HydrophobicContact CG-CD2 4.17Å
74	P	75.2	Confident	80	Confident	54 Å²	54	69.6 Å²	69.6	35%	0.351	39%	0.393	S	S	.	.			trans	-57.3	140.3	174.3	18	-28.4	0	0	0	111.5	D76 L77 Q78	P74-D76 PolarHBondContact O-N 3.44Å; P74-D76 VanDerWaalsContact O-N 3.14Å; P74-L77 HydrophobicContact CG-CB 4.28Å; P74-L77 PolarHBondContact O-N 3.21Å; P74-Q78 PolarHBondContact O-N 2.91Å
75	Q	79.1	Confident	80.1	Confident	169 Å²	169	69.4 Å²	69.4	79%	0.79	39%	0.387	S	S	*	.	H	α-helix	trans	-54.3	-36.4	-173.6	-70.2	177.6	-19.1	0	0	113	L73 L77 Q78 A79	L73-Q75 PolarHBondContact O-N 3.27Å; Q75-L77 PolarHBondContact O-N 3.22Å; Q75-Q78 PolarHBondContact O-N 3.37Å; Q75-A79 PolarHBondContact O-N 3.16Å
76	D	80.3	Confident	80.4	Confident	55 Å²	55	67 Å²	67	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-42.5	176.8	-65.5	-51	0	0	0	112.5	P74 A80 W138	P74-D76 PolarHBondContact O-N 3.44Å; P74-D76 VanDerWaalsContact O-N 3.14Å; D76-A80 VanDerWaalsContact O-CB 3.32Å; D76-A80 WeakPolarHBondContact O-CB 3.37Å; D76-A80 PolarHBondContact O-N 2.93Å; D76-W138 PolarHBondContact OD1-NE1 3.21Å
77	L	80.8	Confident	80.7	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-71.9	-35.2	179.2	-116.1	73.4	0	0	0	111.6	R31 G49 L50 L73 P74 Q75 A80 R81	R31-L77 HydrophobicContact CG-CD1 4.35Å; G49-L77 WeakPolarHBondContact O-CD2 3.46Å; L50-L77 HydrophobicContact CD1-CG 4.3Å; L73-L77 HydrophobicContact CD1-CD2 3.98Å; L73-L77 HydrophobicContact CD2-CB 3.8Å; L73-L77 HydrophobicContact CD2-CD2 4.22Å; L73-L77 HydrophobicContact CG-CB 3.89Å; L73-L77 HydrophobicContact CG-CD2 4.17Å; P74-L77 HydrophobicContact CG-CB 4.28Å; P74-L77 PolarHBondContact O-N 3.21Å; Q75-L77 PolarHBondContact O-N 3.22Å; L77-A80 PolarHBondContact O-N 3.03Å; L77-R81 WeakPolarHBondContact O-CB 3.25Å; L77-R81 PolarHBondContact O-N 2.91Å
78	Q	85.5	Confident	81.2	Confident	93 Å²	93	61.8 Å²	61.8	44%	0.435	36%	0.355	S	S	.	.	H	α-helix	trans	-65.7	-44.2	176.2	-170.5	177.3	6.5	0	0	111.2	P74 Q75 R81 A82	P74-Q78 PolarHBondContact O-N 2.91Å; Q75-Q78 PolarHBondContact O-N 3.37Å; Q78-R81 PolarHBondContact O-N 3.16Å; Q78-A82 PolarHBondContact O-N 3.37Å
79	A	86.1	Confident	82.2	Confident	48 Å²	48	60.7 Å²	60.7	40%	0.397	35%	0.348	S	S	.	.	H	α-helix	trans	-63.8	-43.8	174.6	0	0	0	0	0	111.5	Q75 R81 A82 M83	Q75-A79 PolarHBondContact O-N 3.16Å; A79-R81 VanDerWaalsContact C-N 3.31Å; A79-R81 PolarHBondContact O-N 3.29Å; A79-A82 PolarHBondContact O-N 3.45Å; A79-M83 HydrophobicContact CB-CE 4.17Å; A79-M83 WeakPolarHBondContact O-CG 3.41Å; A79-M83 PolarHBondContact O-N 2.94Å
80	A	88.3	Confident	83.4	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-58.5	-42.5	175.9	0	0	0	0	0	112	W30 L50 D76 L77 A82 M83 V84 P135	W30-A80 HydrophobicContact CH2-CB 4.23Å; W30-A80 HydrophobicContact CZ3-CB 3.95Å; L50-A80 HydrophobicContact CD1-CB 4.43Å; D76-A80 VanDerWaalsContact O-CB 3.32Å; D76-A80 WeakPolarHBondContact O-CB 3.37Å; D76-A80 PolarHBondContact O-N 2.93Å; L77-A80 PolarHBondContact O-N 3.03Å; A80-A82 PolarHBondContact O-N 3.18Å; A80-M83 PolarHBondContact O-N 3.41Å; A80-V84 WeakPolarHBondContact O-CB 3.27Å; A80-V84 WeakPolarHBondContact O-CG2 3.38Å; A80-V84 PolarHBondContact O-N 3.28Å; A80-P135 HydrophobicContact CB-CB 3.88Å
81	R	90.1	Very high	85	Confident	25 Å²	25	54 Å²	54	9%	0.094	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-48.2	177	-163	-170.1	-157.7	151.4	-8.2	112.4	L50 W51 M70 L77 Q78 A79 V84 I85	L50-R81 HydrophobicContact CD2-CB 4.06Å; L50-R81 HydrophobicContact CD2-CG 4.09Å; L50-R81 HydrophobicContact CG-CB 4Å; L50-R81 HydrophobicContact CG-CG 4.13Å; L50-R81 PolarHBondContact O-NH1 3.04Å; W51-R81 HydrophobicContact CH2-CG 4.24Å; W51-R81 VanDerWaalsContact CH2-NE 3.28Å; W51-R81 HydrophobicContact CZ2-CG 3.93Å; W51-R81 VanDerWaalsContact CZ3-NE 3.29Å; M70-R81 PolarHBondContact SD-NH1 3.38Å; L77-R81 WeakPolarHBondContact O-CB 3.25Å; L77-R81 PolarHBondContact O-N 2.91Å; Q78-R81 PolarHBondContact O-N 3.16Å; A79-R81 VanDerWaalsContact C-N 3.31Å; A79-R81 PolarHBondContact O-N 3.29Å; R81-V84 PolarHBondContact O-N 3.44Å; R81-I85 HydrophobicContact CG-CD1 3.97Å; R81-I85 WeakPolarHBondContact O-CD1 3.19Å; R81-I85 WeakPolarHBondContact O-CG1 2.93Å; R81-I85 PolarHBondContact O-N 3.45Å
82	A	90.6	Very high	86.7	Confident	57 Å²	57	48.6 Å²	48.6	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-61.1	-47.7	178.8	0	0	0	0	0	111.1	Q78 A79 A80 V84 I85 V86	Q78-A82 PolarHBondContact O-N 3.37Å; A79-A82 PolarHBondContact O-N 3.45Å; A80-A82 PolarHBondContact O-N 3.18Å; A82-V84 PolarHBondContact O-N 2.94Å; A82-I85 PolarHBondContact O-N 3.32Å; A82-V86 VanDerWaalsContact O-CG2 3.28Å; A82-V86 WeakPolarHBondContact O-CG2 3.23Å; A82-V86 PolarHBondContact O-N 2.99Å
83	M	91.1	Very high	88.5	Confident	54 Å²	54	47 Å²	47	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-43.4	179.4	-72.4	-172.1	-87.7	0	0	112.7	A79 A80 V86 A87 I134 P135	A79-M83 HydrophobicContact CB-CE 4.17Å; A79-M83 WeakPolarHBondContact O-CG 3.41Å; A79-M83 PolarHBondContact O-N 2.94Å; A80-M83 PolarHBondContact O-N 3.41Å; M83-V86 PolarHBondContact O-N 3.27Å; M83-A87 WeakPolarHBondContact O-CB 3.18Å; M83-A87 PolarHBondContact O-N 3.37Å; M83-I134 HydrophobicContact SD-CG2 4.08Å; M83-P135 HydrophobicContact CB-CB 4.21Å; M83-P135 HydrophobicContact CB-CG 3.87Å; M83-P135 HydrophobicContact CE-CB 3.69Å; M83-P135 HydrophobicContact CE-CG 4.41Å; M83-P135 HydrophobicContact SD-CB 4.21Å; M83-P135 HydrophobicContact SD-CG 4.31Å
84	V	92.8	Very high	89.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-39.7	179.6	174.4	0	0	0	0	111.5	C25 W30 L50 A80 R81 A82 A87 V88 P135	C25-V84 HydrophobicContact CB-CG1 3.55Å; W30-V84 HydrophobicContact CH2-CG2 3.89Å; W30-V84 HydrophobicContact CZ2-CG2 4.02Å; L50-V84 HydrophobicContact CD2-CB 4.31Å; L50-V84 HydrophobicContact CD2-CG2 4.45Å; A80-V84 WeakPolarHBondContact O-CB 3.27Å; A80-V84 WeakPolarHBondContact O-CG2 3.38Å; A80-V84 PolarHBondContact O-N 3.28Å; R81-V84 PolarHBondContact O-N 3.44Å; A82-V84 PolarHBondContact O-N 2.94Å; V84-A87 WeakPolarHBondContact O-CB 3.16Å; V84-A87 PolarHBondContact O-N 2.8Å; V84-V88 WeakPolarHBondContact O-CG2 3.4Å; V84-V88 PolarHBondContact O-N 2.91Å; V84-P135 HydrophobicContact CG2-CG 4.13Å
85	I	93.8	Very high	90.5	Very high	63 Å²	63	44.6 Å²	44.6	32%	0.323	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-46.3	175.3	-68.1	164.7	0	0	0	110.6	W51 R81 A82 A87 V88 I89	W51-I85 HydrophobicContact CH2-CD1 3.64Å; W51-I85 HydrophobicContact CH2-CG1 4.23Å; W51-I85 HydrophobicContact CZ2-CD1 3.84Å; W51-I85 HydrophobicContact CZ2-CG1 4Å; R81-I85 HydrophobicContact CG-CD1 3.97Å; R81-I85 WeakPolarHBondContact O-CD1 3.19Å; R81-I85 WeakPolarHBondContact O-CG1 2.93Å; R81-I85 PolarHBondContact O-N 3.45Å; A82-I85 PolarHBondContact O-N 3.32Å; I85-A87 VanDerWaalsContact C-N 3.28Å; I85-A87 PolarHBondContact O-N 2.62Å; I85-V88 PolarHBondContact O-N 3.37Å; I85-I89 HydrophobicContact CG2-CD1 3.94Å; I85-I89 WeakPolarHBondContact O-CG1 3.33Å; I85-I89 PolarHBondContact O-N 3.1Å
86	V	94.6	Very high	91	Very high	72 Å²	72	42.3 Å²	42.3	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-59.8	-42.8	176.8	175	0	0	0	0	110.1	A82 M83 V88 I89 V90 L131	A82-V86 VanDerWaalsContact O-CG2 3.28Å; A82-V86 WeakPolarHBondContact O-CG2 3.23Å; A82-V86 PolarHBondContact O-N 2.99Å; M83-V86 PolarHBondContact O-N 3.27Å; V86-V88 PolarHBondContact O-N 3.23Å; V86-I89 PolarHBondContact O-N 3.24Å; V86-V90 HydrophobicContact CG1-CG2 4.19Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.3Å; V86-V90 PolarHBondContact O-N 3.39Å; V86-L131 HydrophobicContact CG1-CD1 4.07Å
87	A	94.7	Very high	91.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-43.8	175.4	0	0	0	0	0	112.6	M83 V84 I85 I89 V90 G91 C128 L131 I132	M83-A87 WeakPolarHBondContact O-CB 3.18Å; M83-A87 PolarHBondContact O-N 3.37Å; V84-A87 WeakPolarHBondContact O-CB 3.16Å; V84-A87 PolarHBondContact O-N 2.8Å; I85-A87 VanDerWaalsContact C-N 3.28Å; I85-A87 PolarHBondContact O-N 2.62Å; A87-I89 VanDerWaalsContact C-N 3.35Å; A87-I89 PolarHBondContact O-N 3.41Å; A87-V90 PolarHBondContact O-N 3.41Å; A87-G91 PolarHBondContact O-N 2.74Å; A87-C128 PolarHBondContact O-SG 3.25Å; A87-L131 HydrophobicContact CB-CB 3.77Å; A87-I132 HydrophobicContact CB-CD1 4.1Å; A87-I132 HydrophobicContact CB-CG1 3.5Å; A87-I132 VanDerWaalsContact CB-CG1 3.5Å
88	V	94.9	Very high	91.7	Very high	32 Å²	32	42.7 Å²	42.7	19%	0.194	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-44.6	177.4	172.3	0	0	0	0	111.2	W18 T21 I22 V84 I85 V86 G91 V92	W18-V88 PolarHBondContact NE1-O 3.23Å; T21-V88 HydrophobicContact CG2-CG2 3.87Å; I22-V88 HydrophobicContact CG1-CG1 4.23Å; I22-V88 HydrophobicContact CG1-CG2 4.33Å; V84-V88 WeakPolarHBondContact O-CG2 3.4Å; V84-V88 PolarHBondContact O-N 2.91Å; I85-V88 PolarHBondContact O-N 3.37Å; V86-V88 PolarHBondContact O-N 3.23Å; V88-G91 PolarHBondContact O-N 2.96Å; V88-V92 WeakPolarHBondContact O-CG2 3.19Å; V88-V92 PolarHBondContact O-N 3.49Å
89	I	95.6	Very high	91.7	Very high	100 Å²	100	43.1 Å²	43.1	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-47.5	178.3	-64.3	167.9	0	0	0	110.8	I85 V86 A87 G91 V92 C93	I85-I89 HydrophobicContact CG2-CD1 3.94Å; I85-I89 WeakPolarHBondContact O-CG1 3.33Å; I85-I89 PolarHBondContact O-N 3.1Å; V86-I89 PolarHBondContact O-N 3.24Å; A87-I89 VanDerWaalsContact C-N 3.35Å; A87-I89 PolarHBondContact O-N 3.41Å; I89-G91 PolarHBondContact O-N 3.23Å; I89-V92 WeakPolarHBondContact O-CB 3.29Å; I89-V92 PolarHBondContact O-N 3.09Å; I89-V92 VanDerWaalsContact O-N 3.16Å; I89-C93 PolarHBondContact O-N 2.85Å; I89-C93 VanDerWaalsContact O-N 3.16Å
90	V	94.9	Very high	91.6	Very high	36 Å²	36	43.6 Å²	43.6	22%	0.218	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-38.7	176.1	173.1	0	0	0	0	110.6	V86 A87 C93 G94 V124 I127 C128 L131	V86-V90 HydrophobicContact CG1-CG2 4.19Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.3Å; V86-V90 PolarHBondContact O-N 3.39Å; A87-V90 PolarHBondContact O-N 3.41Å; V90-C93 WeakPolarHBondContact O-CB 3.38Å; V90-C93 PolarHBondContact O-N 3.48Å; V90-G94 PolarHBondContact O-N 3.47Å; V90-V124 HydrophobicContact CG1-CG1 3.74Å; V90-V124 WeakPolarHBondContact O-CG1 3.48Å; V90-I127 HydrophobicContact CG1-CG2 4.43Å; V90-C128 HydrophobicContact CG1-CB 4.19Å; V90-L131 HydrophobicContact CG2-CD1 4.24Å
91	G	94.1	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-43.6	173.9	0	0	0	0	0	113	A87 V88 I89 C93 G94 V95	A87-G91 PolarHBondContact O-N 2.74Å; V88-G91 PolarHBondContact O-N 2.96Å; I89-G91 PolarHBondContact O-N 3.23Å; G91-C93 VanDerWaalsContact C-N 3.32Å; G91-C93 PolarHBondContact O-N 2.99Å; G91-G94 WeakPolarHBondContact O-CA 3.32Å; G91-G94 PolarHBondContact O-N 3.33Å; G91-G94 VanDerWaalsContact O-N 3.11Å; G91-V95 WeakPolarHBondContact O-CG2 3.49Å; G91-V95 PolarHBondContact O-N 2.93Å
92	V	94.6	Very high	90.5	Very high	53 Å²	53	43 Å²	43	32%	0.321	25%	0.248	S	C	.	.	H	α-helix	trans	-57.5	-46.7	174	173.7	0	0	0	0	110.7	W18 V88 I89 G94 V95 M96	W18-V92 HydrophobicContact CH2-CG2 4.4Å; W18-V92 HydrophobicContact CZ2-CG2 3.49Å; W18-V92 VanDerWaalsContact CZ2-CG2 3.49Å; V88-V92 WeakPolarHBondContact O-CG2 3.19Å; V88-V92 PolarHBondContact O-N 3.49Å; I89-V92 WeakPolarHBondContact O-CB 3.29Å; I89-V92 PolarHBondContact O-N 3.09Å; I89-V92 VanDerWaalsContact O-N 3.16Å; V92-G94 VanDerWaalsContact C-N 3.3Å; V92-G94 PolarHBondContact O-N 3.17Å; V92-V95 PolarHBondContact O-N 2.94Å; V92-M96 HydrophobicContact CG1-CE 3.83Å; V92-M96 HydrophobicContact CG1-SD 4.43Å; V92-M96 WeakPolarHBondContact O-CG 3.43Å; V92-M96 PolarHBondContact O-N 2.93Å
93	C	93.6	Very high	89.4	Confident	58 Å²	58	45.2 Å²	45.2	39%	0.392	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-41.9	176.1	-63.7	0	0	0	0	111.5	I89 V90 G91 M96 M97	I89-C93 PolarHBondContact O-N 2.85Å; I89-C93 VanDerWaalsContact O-N 3.16Å; V90-C93 WeakPolarHBondContact O-CB 3.38Å; V90-C93 PolarHBondContact O-N 3.48Å; G91-C93 VanDerWaalsContact C-N 3.32Å; G91-C93 PolarHBondContact O-N 2.99Å; C93-M96 PolarHBondContact O-N 3.42Å; C93-M97 HydrophobicContact CB-CE 4.07Å; C93-M97 WeakPolarHBondContact O-CE 3.42Å; C93-M97 WeakPolarHBondContact O-CG 3.44Å; C93-M97 PolarHBondContact O-N 2.89Å
94	G	92.3	Very high	88.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-43.9	175	0	0	0	0	0	112.9	V90 G91 V92 M97 A98	V90-G94 PolarHBondContact O-N 3.47Å; G91-G94 WeakPolarHBondContact O-CA 3.32Å; G91-G94 PolarHBondContact O-N 3.33Å; G91-G94 VanDerWaalsContact O-N 3.11Å; V92-G94 VanDerWaalsContact C-N 3.3Å; V92-G94 PolarHBondContact O-N 3.17Å; G94-M97 PolarHBondContact O-N 3.27Å; G94-A98 WeakPolarHBondContact O-CB 3.49Å; G94-A98 PolarHBondContact O-N 3.33Å
95	V	92.2	Very high	86.9	Confident	17 Å²	17	50.5 Å²	50.5	10%	0.103	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-45.4	176.5	174	0	0	0	0	111.3	M15 W18 G91 V92 M97 A98 I99 F125	M15-V95 HydrophobicContact CE-CG1 4.08Å; M15-V95 HydrophobicContact CE-CG2 4.42Å; M15-V95 HydrophobicContact SD-CB 4.21Å; M15-V95 HydrophobicContact SD-CG1 3.67Å; M15-V95 HydrophobicContact SD-CG2 3.54Å; M15-V95 VanDerWaalsContact SD-CG2 3.54Å; W18-V95 HydrophobicContact CD2-CG2 3.99Å; W18-V95 HydrophobicContact CE3-CG2 3.96Å; W18-V95 HydrophobicContact CG-CG2 4.34Å; W18-V95 HydrophobicContact CZ3-CG2 4.44Å; G91-V95 WeakPolarHBondContact O-CG2 3.49Å; G91-V95 PolarHBondContact O-N 2.93Å; V92-V95 PolarHBondContact O-N 2.94Å; V95-M97 VanDerWaalsContact C-N 3.33Å; V95-M97 PolarHBondContact O-N 3.36Å; V95-A98 PolarHBondContact O-N 3.41Å; V95-I99 HydrophobicContact CG1-CD1 3.96Å; V95-I99 WeakPolarHBondContact O-CG1 3.25Å; V95-I99 PolarHBondContact O-N 3.11Å; V95-F125 HydrophobicContact CG2-CE1 3.95Å; V95-F125 HydrophobicContact CG2-CZ 3.92Å
96	M	90.3	Very high	85.4	Confident	121 Å²	121	53.7 Å²	53.7	60%	0.596	30%	0.304	S	S	*	.	H	α-helix	trans	-58.6	-45.1	176.3	-70.6	-177.6	176.6	0	0	111.6	V92 C93 A98 I99 V100	V92-M96 HydrophobicContact CG1-CE 3.83Å; V92-M96 HydrophobicContact CG1-SD 4.43Å; V92-M96 WeakPolarHBondContact O-CG 3.43Å; V92-M96 PolarHBondContact O-N 2.93Å; C93-M96 PolarHBondContact O-N 3.42Å; M96-A98 PolarHBondContact O-N 3.27Å; M96-I99 PolarHBondContact O-N 3.23Å; M96-V100 WeakPolarHBondContact O-CG2 3.44Å; M96-V100 PolarHBondContact O-N 2.97Å; M96-V100 VanDerWaalsContact O-N 3.13Å
97	M	87.6	Confident	83.9	Confident	57 Å²	57	54.5 Å²	54.5	28%	0.281	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-36.1	177	-73.3	-178.1	-86.4	0	0	112.7	C93 G94 V95 V100 G101 I120 A121 V124	C93-M97 HydrophobicContact CB-CE 4.07Å; C93-M97 WeakPolarHBondContact O-CE 3.42Å; C93-M97 WeakPolarHBondContact O-CG 3.44Å; C93-M97 PolarHBondContact O-N 2.89Å; G94-M97 PolarHBondContact O-N 3.27Å; V95-M97 VanDerWaalsContact C-N 3.33Å; V95-M97 PolarHBondContact O-N 3.36Å; M97-V100 PolarHBondContact O-N 2.88Å; M97-G101 PolarHBondContact O-N 3.16Å; M97-I120 HydrophobicContact SD-CG2 3.63Å; M97-A121 HydrophobicContact CB-CB 3.8Å; M97-V124 HydrophobicContact CE-CB 4.03Å; M97-V124 HydrophobicContact CE-CG1 3.92Å; M97-V124 HydrophobicContact CE-CG2 3.46Å; M97-V124 VanDerWaalsContact CE-CG2 3.46Å; M97-V124 HydrophobicContact SD-CG2 4.37Å
98	A	87.4	Confident	82.5	Confident	8 Å²	8	57.5 Å²	57.5	7%	0.066	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-37.2	175.5	0	0	0	0	0	112.5	V11 G94 V95 M96 G102 A121 F125	V11-A98 HydrophobicContact CG2-CB 4.47Å; G94-A98 WeakPolarHBondContact O-CB 3.49Å; G94-A98 PolarHBondContact O-N 3.33Å; V95-A98 PolarHBondContact O-N 3.41Å; M96-A98 PolarHBondContact O-N 3.27Å; A98-G102 PolarHBondContact O-N 2.79Å; A98-A121 HydrophobicContact CB-CB 4.25Å; A98-F125 HydrophobicContact CB-CE2 4Å; A98-F125 HydrophobicContact CB-CZ 4.35Å
99	I	86.7	Confident	81.3	Confident	102 Å²	102	64.4 Å²	64.4	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-44.2	175.6	-66.4	164.2	0	0	0	110.6	V95 M96 G102 T105	V95-I99 HydrophobicContact CG1-CD1 3.96Å; V95-I99 WeakPolarHBondContact O-CG1 3.25Å; V95-I99 PolarHBondContact O-N 3.11Å; M96-I99 PolarHBondContact O-N 3.23Å; I99-G102 PolarHBondContact O-N 3.31Å; I99-T105 VanDerWaalsContact O-CB 3.29Å; I99-T105 WeakPolarHBondContact O-CB 3.44Å; I99-T105 PolarHBondContact O-OG1 3.15Å
100	V	84.4	Confident	80.4	Confident	58 Å²	58	64.2 Å²	64.2	35%	0.352	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-38.9	178.5	175.4	0	0	0	0	111.7	M96 M97 G102 M108	M96-V100 WeakPolarHBondContact O-CG2 3.44Å; M96-V100 PolarHBondContact O-N 2.97Å; M96-V100 VanDerWaalsContact O-N 3.13Å; M97-V100 PolarHBondContact O-N 2.88Å; V100-G102 VanDerWaalsContact C-N 3.31Å; V100-G102 PolarHBondContact O-N 3.45Å; V100-M108 HydrophobicContact CG1-CG 4.4Å; V100-M108 HydrophobicContact CG1-SD 4.07Å
101	G	77.1	Confident	79.5	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-77.7	-11.4	177.8	0	0	0	0	0	114.7	Q7 M97 C118	Q7-G101 PolarHBondContact NE2-O 3.1Å; M97-G101 PolarHBondContact O-N 3.16Å; G101-C118 VanDerWaalsContact C-SG 3.55Å; G101-C118 PolarHBondContact O-SG 3.32Å
102	G	77.6	Confident	78.7	Confident	14 Å²	14	72.6 Å²	72.6	14%	0.144	40%	0.402	C	S	.	.			trans	-63.6	135.4	-177.9	0	0	0	0	0	112.6	A98 I99 V100 C104 T105	A98-G102 PolarHBondContact O-N 2.79Å; I99-G102 PolarHBondContact O-N 3.31Å; V100-G102 VanDerWaalsContact C-N 3.31Å; V100-G102 PolarHBondContact O-N 3.45Å; G102-C104 PolarHBondContact O-N 2.95Å; G102-T105 PolarHBondContact O-N 3.22Å; G102-T105 VanDerWaalsContact O-N 3.07Å
103	K	67.3	Low	78	Confident	103 Å²	103	71.2 Å²	71.2	45%	0.448	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.9	176.2	-69.2	-177.5	178.3	-175.5	0	113.3	Q4 T105	Q4-K103 HydrophobicContact CG-CD 3.94Å; K103-T105 VanDerWaalsContact C-N 3.29Å
104	C	63.1	Low	77.3	Confident	129 Å²	129	70 Å²	70	87%	0.872	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.6	177.4	-54.8	0	0	0	0	113.5	G102	G102-C104 PolarHBondContact O-N 2.95Å
105	T	68.6	Low	76.8	Confident	38 Å²	38	71.1 Å²	71.1	23%	0.233	39%	0.393	C	S	.	.			trans	-106.8	121.9	-177.1	-48.2	0	0	0	0	109.8	I99 G102 K103 C107	I99-T105 VanDerWaalsContact O-CB 3.29Å; I99-T105 WeakPolarHBondContact O-CB 3.44Å; I99-T105 PolarHBondContact O-OG1 3.15Å; G102-T105 PolarHBondContact O-N 3.22Å; G102-T105 VanDerWaalsContact O-N 3.07Å; K103-T105 VanDerWaalsContact C-N 3.29Å; T105-C107 HydrophobicContact CG2-CB 4.01Å; T105-C107 WeakPolarHBondContact CG2-SG 3.45Å; T105-C107 PolarHBondContact O-N 2.88Å; T105-C107 VanDerWaalsContact O-N 3.17Å
106	N	61.3	Low	76.4	Confident	130 Å²	130	76.8 Å²	76.8	70%	0.695	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	37.4	177.9	-159.2	9.4	0	0	0	113	M108	N106-M108 VanDerWaalsContact C-N 3.33Å
107	C	64.3	Low	76.2	Confident	88 Å²	88	71.9 Å²	71.9	60%	0.595	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-19.2	177.2	-76.2	0	0	0	0	112.9	T105	T105-C107 HydrophobicContact CG2-CB 4.01Å; T105-C107 WeakPolarHBondContact CG2-SG 3.45Å; T105-C107 PolarHBondContact O-N 2.88Å; T105-C107 VanDerWaalsContact O-N 3.17Å
108	M	65.6	Low	76.2	Confident	64 Å²	64	69.4 Å²	69.4	32%	0.315	38%	0.383	S	S	.	.			trans	-138.7	134.5	179	-56.4	-174.4	80.1	0	0	108.7	V100 N106 A113 K114	V100-M108 HydrophobicContact CG1-CG 4.4Å; V100-M108 HydrophobicContact CG1-SD 4.07Å; N106-M108 VanDerWaalsContact C-N 3.33Å; M108-A113 HydrophobicContact CE-CB 3.39Å; M108-A113 HydrophobicContact SD-CB 4.38Å; M108-K114 HydrophobicContact CB-CG 4.16Å; M108-K114 WeakPolarHBondContact O-CE 3.36Å; M108-K114 PolarHBondContact O-NZ 3.39Å
109	E	69	Low	76.3	Confident	176 Å²	176	70.9 Å²	70.9	82%	0.822	39%	0.39	S	S	*	.			trans	-87.2	-25.6	176.9	-67.6	179.9	158.8	0	0	111.8	E111	E109-E111 PolarHBondContact O-N 3.24Å
110	D	77	Confident	76.5	Confident	97 Å²	97	70.3 Å²	70.3	52%	0.519	39%	0.387	S	S	.	.			trans	-79	118.8	-178.3	-174.6	2.5	0	0	0	112.8	A112 A113 K114	D110-A112 VanDerWaalsContact C-N 3.33Å; D110-A112 PolarHBondContact O-N 2.83Å; D110-A112 PolarHBondContact OD1-N 3.14Å; D110-A113 HydrophobicContact CB-CB 3.97Å; D110-A113 PolarHBondContact O-N 3.38Å; D110-K114 PolarHBondContact O-N 3.11Å; D110-K114 VanDerWaalsContact O-N 3.11Å
111	E	75.2	Confident	76.8	Confident	163 Å²	163	67.5 Å²	67.5	76%	0.762	37%	0.37	S	S	*	.	H	α-helix	trans	-64.7	-34	177.9	-67.3	-165	161.5	0	0	113	E109 K114 A115	E109-E111 PolarHBondContact O-N 3.24Å; E111-K114 PolarHBondContact O-N 3.45Å; E111-A115 PolarHBondContact O-N 3.31Å
112	A	78	Confident	77.6	Confident	48 Å²	48	67.5 Å²	67.5	40%	0.397	37%	0.37	S	S	.	.	H	α-helix	trans	-69.4	-38.1	179.2	0	0	0	0	0	111	D110 A115 K116	D110-A112 VanDerWaalsContact C-N 3.33Å; D110-A112 PolarHBondContact O-N 2.83Å; D110-A112 PolarHBondContact OD1-N 3.14Å; A112-A115 PolarHBondContact O-N 3.32Å; A112-K116 WeakPolarHBondContact O-CG 3.37Å; A112-K116 PolarHBondContact O-N 3.21Å; A112-K116 VanDerWaalsContact O-N 3.1Å
113	A	79.9	Confident	78.4	Confident	24 Å²	24	70.9 Å²	70.9	20%	0.198	38%	0.384	C	S	.	.	H	α-helix	trans	-69.2	-39.3	176.4	0	0	0	0	0	111.9	M108 D110 A115 K116 A117	M108-A113 HydrophobicContact CE-CB 3.39Å; M108-A113 HydrophobicContact SD-CB 4.38Å; D110-A113 HydrophobicContact CB-CB 3.97Å; D110-A113 PolarHBondContact O-N 3.38Å; A113-A115 PolarHBondContact O-N 3.35Å; A113-K116 PolarHBondContact O-N 2.9Å; A113-A117 WeakPolarHBondContact O-CB 3.44Å; A113-A117 PolarHBondContact O-N 3.38Å
114	K	79.4	Confident	79.7	Confident	33 Å²	33	67 Å²	67	14%	0.143	37%	0.369	C	S	.	.	H	α-helix	trans	-59.5	-44.1	171.8	-77.1	178.7	169.9	155.7	0	112.7	M108 D110 E111 A117 C118	M108-K114 HydrophobicContact CB-CG 4.16Å; M108-K114 WeakPolarHBondContact O-CE 3.36Å; M108-K114 PolarHBondContact O-NZ 3.39Å; D110-K114 PolarHBondContact O-N 3.11Å; D110-K114 VanDerWaalsContact O-N 3.11Å; E111-K114 PolarHBondContact O-N 3.45Å; K114-A117 PolarHBondContact O-N 3.46Å; K114-C118 PolarHBondContact O-N 3.41Å; K114-C118 PolarHBondContact O-SG 2.93Å; K114-C118 VanDerWaalsContact O-SG 3.38Å
115	A	81.5	Confident	81.3	Confident	24 Å²	24	60.9 Å²	60.9	20%	0.198	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-44.3	177.5	0	0	0	0	0	111.6	E111 A112 A113 C118 I119 P186	E111-A115 PolarHBondContact O-N 3.31Å; A112-A115 PolarHBondContact O-N 3.32Å; A113-A115 PolarHBondContact O-N 3.35Å; A115-C118 PolarHBondContact O-N 2.88Å; A115-I119 WeakPolarHBondContact O-CG1 3.47Å; A115-I119 PolarHBondContact O-N 3.32Å; A115-I119 VanDerWaalsContact O-N 3.1Å; A115-P186 HydrophobicContact CB-CB 4.06Å; A115-P186 HydrophobicContact CB-CG 4.04Å
116	K	83.9	Confident	82.6	Confident	135 Å²	135	61.3 Å²	61.3	59%	0.587	33%	0.328	S	S	*	.	H	α-helix	trans	-62.5	-43.7	175.3	-71.2	176.2	-176.8	178.5	0	112.1	A112 A113 C118 I119 I120	A112-K116 WeakPolarHBondContact O-CG 3.37Å; A112-K116 PolarHBondContact O-N 3.21Å; A112-K116 VanDerWaalsContact O-N 3.1Å; A113-K116 PolarHBondContact O-N 2.9Å; K116-C118 VanDerWaalsContact C-N 3.3Å; K116-C118 PolarHBondContact O-N 2.96Å; K116-I119 PolarHBondContact O-N 3.13Å; K116-I120 VanDerWaalsContact O-CG1 3.29Å; K116-I120 WeakPolarHBondContact O-CG1 3.33Å; K116-I120 PolarHBondContact O-N 2.86Å
117	A	86.1	Confident	84.2	Confident	18 Å²	18	59 Å²	59	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-40.2	176.6	0	0	0	0	0	112.1	A113 K114 I120 A121	A113-A117 WeakPolarHBondContact O-CB 3.44Å; A113-A117 PolarHBondContact O-N 3.38Å; K114-A117 PolarHBondContact O-N 3.46Å; A117-I120 PolarHBondContact O-N 3.23Å; A117-A121 WeakPolarHBondContact O-CB 3.01Å; A117-A121 PolarHBondContact O-N 2.97Å
118	C	87	Confident	85.8	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.034	29%	0.286	C	S	.	.	H	α-helix	trans	-64.3	-41	174.9	-73.5	0	0	0	0	113.2	Q7 G101 K114 A115 K116 A121 G122	Q7-C118 PolarHBondContact NE2-SG 3.05Å; G101-C118 VanDerWaalsContact C-SG 3.55Å; G101-C118 PolarHBondContact O-SG 3.32Å; K114-C118 PolarHBondContact O-N 3.41Å; K114-C118 PolarHBondContact O-SG 2.93Å; K114-C118 VanDerWaalsContact O-SG 3.38Å; A115-C118 PolarHBondContact O-N 2.88Å; K116-C118 VanDerWaalsContact C-N 3.3Å; K116-C118 PolarHBondContact O-N 2.96Å; C118-A121 PolarHBondContact O-N 3.29Å; C118-G122 PolarHBondContact O-N 2.95Å
119	I	88.4	Confident	87.2	Confident	40 Å²	40	51.7 Å²	51.7	21%	0.205	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-44.3	177	-67	163.7	0	0	0	110.1	A115 K116 A121 G122 I123	A115-I119 WeakPolarHBondContact O-CG1 3.47Å; A115-I119 PolarHBondContact O-N 3.32Å; A115-I119 VanDerWaalsContact O-N 3.1Å; K116-I119 PolarHBondContact O-N 3.13Å; I119-A121 VanDerWaalsContact C-N 3.34Å; I119-A121 PolarHBondContact O-N 2.94Å; I119-G122 PolarHBondContact O-N 3.06Å; I119-G122 VanDerWaalsContact O-N 3.15Å; I119-I123 HydrophobicContact CG2-CD1 4.13Å; I119-I123 WeakPolarHBondContact O-CG1 3.47Å; I119-I123 PolarHBondContact O-N 3.13Å
120	I	90.9	Very high	88.5	Confident	89 Å²	89	47.2 Å²	47.2	46%	0.456	25%	0.252	S	S	.	.	H	α-helix	trans	-61.9	-44.2	177.1	-63.7	164.9	0	0	0	110.4	M97 K116 A117 G122 I123 V124	M97-I120 HydrophobicContact SD-CG2 3.63Å; K116-I120 VanDerWaalsContact O-CG1 3.29Å; K116-I120 WeakPolarHBondContact O-CG1 3.33Å; K116-I120 PolarHBondContact O-N 2.86Å; A117-I120 PolarHBondContact O-N 3.23Å; I120-G122 VanDerWaalsContact C-N 3.3Å; I120-G122 PolarHBondContact O-N 3.45Å; I120-I123 PolarHBondContact O-N 3.49Å; I120-V124 HydrophobicContact CG2-CG2 4.41Å; I120-V124 WeakPolarHBondContact O-CG2 3.43Å; I120-V124 PolarHBondContact O-N 3.32Å
121	A	92.2	Very high	89.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58	-42.8	174.2	0	0	0	0	0	111.6	M97 A98 A117 C118 I119 V124 F125	M97-A121 HydrophobicContact CB-CB 3.8Å; A98-A121 HydrophobicContact CB-CB 4.25Å; A117-A121 WeakPolarHBondContact O-CB 3.01Å; A117-A121 PolarHBondContact O-N 2.97Å; C118-A121 PolarHBondContact O-N 3.29Å; I119-A121 VanDerWaalsContact C-N 3.34Å; I119-A121 PolarHBondContact O-N 2.94Å; A121-V124 PolarHBondContact O-N 3.49Å; A121-F125 WeakPolarHBondContact O-CD2 3.19Å; A121-F125 PolarHBondContact O-N 2.97Å
122	G	92.6	Very high	90.3	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-46.3	175.6	0	0	0	0	0	113.3	C118 I119 I120 V124 F125 I126 G178 C182	C118-G122 PolarHBondContact O-N 2.95Å; I119-G122 PolarHBondContact O-N 3.06Å; I119-G122 VanDerWaalsContact O-N 3.15Å; I120-G122 VanDerWaalsContact C-N 3.3Å; I120-G122 PolarHBondContact O-N 3.45Å; G122-V124 VanDerWaalsContact C-N 3.3Å; G122-V124 PolarHBondContact O-N 3.38Å; G122-F125 PolarHBondContact O-N 2.99Å; G122-I126 WeakPolarHBondContact O-CG1 3.17Å; G122-I126 PolarHBondContact O-N 3.41Å; G122-G178 WeakPolarHBondContact O-CA 3.46Å; G122-C182 VanDerWaalsContact C-SG 3.59Å
123	I	94.6	Very high	91.1	Very high	84 Å²	84	39.1 Å²	39.1	43%	0.431	20%	0.203	S	C	.	.	H	α-helix	trans	-60.1	-42.9	176.3	-65.6	167.1	0	0	0	110.5	I119 I120 F125 I126 I127	I119-I123 HydrophobicContact CG2-CD1 4.13Å; I119-I123 WeakPolarHBondContact O-CG1 3.47Å; I119-I123 PolarHBondContact O-N 3.13Å; I120-I123 PolarHBondContact O-N 3.49Å; I123-F125 PolarHBondContact O-N 3.19Å; I123-I126 PolarHBondContact O-N 2.94Å; I123-I127 HydrophobicContact CG2-CD1 3.94Å; I123-I127 WeakPolarHBondContact O-CG1 3.36Å; I123-I127 PolarHBondContact O-N 3.38Å
124	V	95.6	Very high	91.8	Very high	22 Å²	22	42.3 Å²	42.3	13%	0.133	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-39.6	179.5	174.2	0	0	0	0	111.2	V90 M97 I120 A121 G122 I127 C128	V90-V124 HydrophobicContact CG1-CG1 3.74Å; V90-V124 WeakPolarHBondContact O-CG1 3.48Å; M97-V124 HydrophobicContact CE-CB 4.03Å; M97-V124 HydrophobicContact CE-CG1 3.92Å; M97-V124 HydrophobicContact CE-CG2 3.46Å; M97-V124 VanDerWaalsContact CE-CG2 3.46Å; M97-V124 HydrophobicContact SD-CG2 4.37Å; I120-V124 HydrophobicContact CG2-CG2 4.41Å; I120-V124 WeakPolarHBondContact O-CG2 3.43Å; I120-V124 PolarHBondContact O-N 3.32Å; A121-V124 PolarHBondContact O-N 3.49Å; G122-V124 VanDerWaalsContact C-N 3.3Å; G122-V124 PolarHBondContact O-N 3.38Å; V124-I127 PolarHBondContact O-N 2.96Å; V124-C128 WeakPolarHBondContact O-CB 3.44Å; V124-C128 PolarHBondContact O-N 3.04Å
125	F	95.6	Very high	92.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.8	-35.6	173.2	-73.8	-55.7	0	0	0	113.2	A14 V95 A98 A121 G122 I123 C128 G129 L174 L181	A14-F125 HydrophobicContact CB-CD1 4.02Å; A14-F125 HydrophobicContact CB-CD2 3.72Å; A14-F125 HydrophobicContact CB-CE1 4.04Å; A14-F125 HydrophobicContact CB-CE2 3.73Å; A14-F125 HydrophobicContact CB-CG 3.86Å; A14-F125 HydrophobicContact CB-CZ 3.89Å; V95-F125 HydrophobicContact CG2-CE1 3.95Å; V95-F125 HydrophobicContact CG2-CZ 3.92Å; A98-F125 HydrophobicContact CB-CE2 4Å; A98-F125 HydrophobicContact CB-CZ 4.35Å; A121-F125 WeakPolarHBondContact O-CD2 3.19Å; A121-F125 PolarHBondContact O-N 2.97Å; G122-F125 PolarHBondContact O-N 2.99Å; I123-F125 PolarHBondContact O-N 3.19Å; F125-C128 WeakPolarHBondContact O-CB 3.36Å; F125-C128 PolarHBondContact O-N 2.89Å; F125-G129 PolarHBondContact O-N 3.29Å; F125-L174 HydrophobicContact CB-CD2 4.44Å; F125-L174 HydrophobicContact CD1-CD2 3.77Å; F125-L174 HydrophobicContact CE1-CD2 4.49Å; F125-L174 HydrophobicContact CG-CD2 4.46Å; F125-L181 HydrophobicContact CD2-CD1 3.85Å; F125-L181 HydrophobicContact CE2-CD1 4.09Å
126	I	96.3	Very high	93	Very high	48 Å²	48	39.7 Å²	39.7	25%	0.246	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-46.6	173.5	-69	167.7	0	0	0	110.3	G122 I123 C128 G129 L130 L175	G122-I126 WeakPolarHBondContact O-CG1 3.17Å; G122-I126 PolarHBondContact O-N 3.41Å; I123-I126 PolarHBondContact O-N 2.94Å; I126-C128 VanDerWaalsContact C-N 3.32Å; I126-C128 PolarHBondContact O-N 2.86Å; I126-G129 PolarHBondContact O-N 2.86Å; I126-L130 HydrophobicContact CG2-CD1 4.33Å; I126-L130 WeakPolarHBondContact O-CG 3.42Å; I126-L130 PolarHBondContact O-N 2.82Å; I126-L175 HydrophobicContact CB-CD2 4.45Å; I126-L175 HydrophobicContact CG2-CD2 3.93Å
127	I	96.1	Very high	93.5	Very high	80 Å²	80	34.8 Å²	34.8	41%	0.41	18%	0.183	S	C	.	.	H	α-helix	trans	-59.7	-45.2	176.4	-66.6	166.8	0	0	0	110.2	V90 I123 V124 G129 L130 L131	V90-I127 HydrophobicContact CG1-CG2 4.43Å; I123-I127 HydrophobicContact CG2-CD1 3.94Å; I123-I127 WeakPolarHBondContact O-CG1 3.36Å; I123-I127 PolarHBondContact O-N 3.38Å; V124-I127 PolarHBondContact O-N 2.96Å; I127-G129 PolarHBondContact O-N 2.88Å; I127-L130 PolarHBondContact O-N 3.35Å; I127-L131 HydrophobicContact CG2-CD1 4.01Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 VanDerWaalsContact O-CG 3.32Å; I127-L131 WeakPolarHBondContact O-CG 3.43Å; I127-L131 PolarHBondContact O-N 3.35Å
128	C	96.1	Very high	93.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.5	-48.1	174.6	-177.2	0	0	0	0	111.9	A87 V90 V124 F125 I126 L130 L131 I132	A87-C128 PolarHBondContact O-SG 3.25Å; V90-C128 HydrophobicContact CG1-CB 4.19Å; V124-C128 WeakPolarHBondContact O-CB 3.44Å; V124-C128 PolarHBondContact O-N 3.04Å; F125-C128 WeakPolarHBondContact O-CB 3.36Å; F125-C128 PolarHBondContact O-N 2.89Å; I126-C128 VanDerWaalsContact C-N 3.32Å; I126-C128 PolarHBondContact O-N 2.86Å; C128-L130 PolarHBondContact O-N 3.49Å; C128-L131 PolarHBondContact O-N 3.45Å; C128-I132 WeakPolarHBondContact O-CD1 3.37Å; C128-I132 WeakPolarHBondContact O-CG1 3.32Å; C128-I132 PolarHBondContact O-N 3.01Å
129	G	95.6	Very high	94	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-42.6	177.4	0	0	0	0	0	113	F125 I126 I127 I132 F133	F125-G129 PolarHBondContact O-N 3.29Å; I126-G129 PolarHBondContact O-N 2.86Å; I127-G129 PolarHBondContact O-N 2.88Å; G129-I132 PolarHBondContact O-N 3.41Å; G129-F133 WeakPolarHBondContact O-CB 3.45Å; G129-F133 PolarHBondContact O-N 3.42Å
130	L	96	Very high	94.1	Very high	82 Å²	82	38.9 Å²	38.9	43%	0.429	19%	0.192	S	C	.	.	H	α-helix	trans	-65.7	-41	176.1	-68.5	176	0	0	0	112.4	I126 I127 C128 I132 F133 I134 L175	I126-L130 HydrophobicContact CG2-CD1 4.33Å; I126-L130 WeakPolarHBondContact O-CG 3.42Å; I126-L130 PolarHBondContact O-N 2.82Å; I127-L130 PolarHBondContact O-N 3.35Å; C128-L130 PolarHBondContact O-N 3.49Å; L130-I132 PolarHBondContact O-N 2.95Å; L130-F133 PolarHBondContact O-N 2.78Å; L130-I134 WeakPolarHBondContact O-CD1 3.31Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.31Å; L130-I134 PolarHBondContact O-N 3.28Å; L130-I134 VanDerWaalsContact O-N 3.09Å; L130-L175 HydrophobicContact CD2-CD2 4.21Å; L130-L175 HydrophobicContact CG-CD2 4.18Å
131	L	94.4	Very high	94.2	Very high	45 Å²	45	37.7 Å²	37.7	24%	0.236	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-24.2	178.4	-74.1	171.7	0	0	0	113.3	V86 A87 V90 I127 C128 P135	V86-L131 HydrophobicContact CG1-CD1 4.07Å; A87-L131 HydrophobicContact CB-CB 3.77Å; V90-L131 HydrophobicContact CG2-CD1 4.24Å; I127-L131 HydrophobicContact CG2-CD1 4.01Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 VanDerWaalsContact O-CG 3.32Å; I127-L131 WeakPolarHBondContact O-CG 3.43Å; I127-L131 PolarHBondContact O-N 3.35Å; C128-L131 PolarHBondContact O-N 3.45Å; L131-P135 WeakPolarHBondContact O-CD 3.34Å; L131-P135 WeakPolarHBondContact O-CG 3.32Å
132	I	95.2	Very high	94	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-89.6	-39.5	174.3	-60.1	151.8	0	0	0	110.7	T21 A87 C128 G129 L130 I134 P135 V136 L174	T21-I132 HydrophobicContact CG2-CD1 3.22Å; T21-I132 HydrophobicContact CG2-CG1 3.59Å; T21-I132 WeakPolarHBondContact OG1-CD1 3.49Å; A87-I132 HydrophobicContact CB-CD1 4.1Å; A87-I132 HydrophobicContact CB-CG1 3.5Å; A87-I132 VanDerWaalsContact CB-CG1 3.5Å; C128-I132 WeakPolarHBondContact O-CD1 3.37Å; C128-I132 WeakPolarHBondContact O-CG1 3.32Å; C128-I132 PolarHBondContact O-N 3.01Å; G129-I132 PolarHBondContact O-N 3.41Å; L130-I132 PolarHBondContact O-N 2.95Å; I132-I134 VanDerWaalsContact C-N 3.31Å; I132-I134 PolarHBondContact O-N 3.39Å; I132-P135 VanDerWaalsContact O-CD 3.23Å; I132-P135 WeakPolarHBondContact O-CD 3.33Å; I132-P135 VanDerWaalsContact O-CG 3.3Å; I132-P135 WeakPolarHBondContact O-CG 3.41Å; I132-V136 HydrophobicContact CG2-CG2 4.02Å; I132-V136 WeakPolarHBondContact O-CB 3.48Å; I132-V136 WeakPolarHBondContact O-CG2 3.41Å; I132-V136 PolarHBondContact O-N 3.47Å; I132-L174 HydrophobicContact CD1-CD1 3.46Å; I132-L174 VanDerWaalsContact CD1-CD1 3.46Å
133	F	95.7	Very high	93.8	Very high	92 Å²	92	38.8 Å²	38.8	40%	0.404	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-40.9	-178.1	-173.5	-100	0	0	0	112.2	G129 L130 S137 W168 A171	G129-F133 WeakPolarHBondContact O-CB 3.45Å; G129-F133 PolarHBondContact O-N 3.42Å; L130-F133 PolarHBondContact O-N 2.78Å; F133-S137 WeakPolarHBondContact CZ-OG 3.45Å; F133-S137 WeakPolarHBondContact O-CB 3.48Å; F133-S137 PolarHBondContact O-N 2.91Å; F133-S137 PolarHBondContact O-OG 3.39Å; F133-W168 AromaticContact CD2-CD1 3.9Å; F133-W168 AromaticContact CE2-CD1 3.77Å; F133-A171 HydrophobicContact CB-CB 4.02Å; F133-A171 HydrophobicContact CD2-CB 4.18Å
134	I	94.5	Very high	93.5	Very high	92 Å²	92	38.4 Å²	38.4	47%	0.472	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-59.5	-180	-65.6	163.4	0	0	0	112.2	M83 L130 I132 V136 S137 W138	M83-I134 HydrophobicContact SD-CG2 4.08Å; L130-I134 WeakPolarHBondContact O-CD1 3.31Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.31Å; L130-I134 PolarHBondContact O-N 3.28Å; L130-I134 VanDerWaalsContact O-N 3.09Å; I132-I134 VanDerWaalsContact C-N 3.31Å; I132-I134 PolarHBondContact O-N 3.39Å; I134-V136 VanDerWaalsContact C-N 3.35Å; I134-V136 PolarHBondContact O-N 3.26Å; I134-S137 PolarHBondContact O-N 3.48Å; I134-W138 VanDerWaalsContact O-CB 3.23Å; I134-W138 WeakPolarHBondContact O-CB 3.24Å; I134-W138 PolarHBondContact O-N 3.25Å
135	P	92.9	Very high	93.1	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-35	-177.9	24.3	-34.7	0	0	0	113.3	A80 M83 V84 L131 I132 S139	A80-P135 HydrophobicContact CB-CB 3.88Å; M83-P135 HydrophobicContact CB-CB 4.21Å; M83-P135 HydrophobicContact CB-CG 3.87Å; M83-P135 HydrophobicContact CE-CB 3.69Å; M83-P135 HydrophobicContact CE-CG 4.41Å; M83-P135 HydrophobicContact SD-CB 4.21Å; M83-P135 HydrophobicContact SD-CG 4.31Å; V84-P135 HydrophobicContact CG2-CG 4.13Å; L131-P135 WeakPolarHBondContact O-CD 3.34Å; L131-P135 WeakPolarHBondContact O-CG 3.32Å; I132-P135 VanDerWaalsContact O-CD 3.23Å; I132-P135 WeakPolarHBondContact O-CD 3.33Å; I132-P135 VanDerWaalsContact O-CG 3.3Å; I132-P135 WeakPolarHBondContact O-CG 3.41Å; P135-S139 VanDerWaalsContact O-CB 3.23Å; P135-S139 WeakPolarHBondContact O-CB 3.09Å; P135-S139 PolarHBondContact O-N 3.43Å; P135-S139 PolarHBondContact O-OG 2.96Å
136	V	93.9	Very high	92.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-48.8	177.2	172.4	0	0	0	0	110.2	W30 I132 I134 S139 A140 L164 W168	W30-V136 HydrophobicContact CH2-CG2 4.04Å; I132-V136 HydrophobicContact CG2-CG2 4.02Å; I132-V136 WeakPolarHBondContact O-CB 3.48Å; I132-V136 WeakPolarHBondContact O-CG2 3.41Å; I132-V136 PolarHBondContact O-N 3.47Å; I134-V136 VanDerWaalsContact C-N 3.35Å; I134-V136 PolarHBondContact O-N 3.26Å; V136-S139 PolarHBondContact O-N 3.32Å; V136-A140 WeakPolarHBondContact O-CB 3.18Å; V136-A140 PolarHBondContact O-N 2.83Å; V136-L164 HydrophobicContact CB-CD2 4.45Å; V136-L164 HydrophobicContact CG1-CB 4.21Å; V136-L164 HydrophobicContact CG1-CD2 3.94Å; V136-L164 WeakPolarHBondContact CG1-O 3.38Å; V136-W168 HydrophobicContact CG1-CD2 4.28Å; V136-W168 HydrophobicContact CG1-CG 4.08Å
137	S	94.1	Very high	92	Very high	33 Å²	33	48.8 Å²	48.8	23%	0.231	23%	0.23	C	C	.	.	H	α-helix	trans	-69.7	-36.4	-179.6	-54.8	0	0	0	0	112.3	F133 I134 A140 N141 W168	F133-S137 WeakPolarHBondContact CZ-OG 3.45Å; F133-S137 WeakPolarHBondContact O-CB 3.48Å; F133-S137 PolarHBondContact O-N 2.91Å; F133-S137 PolarHBondContact O-OG 3.39Å; I134-S137 PolarHBondContact O-N 3.48Å; S137-A140 PolarHBondContact O-N 3.32Å; S137-N141 WeakPolarHBondContact O-CB 3.33Å; S137-N141 PolarHBondContact O-N 2.9Å; S137-W168 PolarHBondContact OG-NE1 3.31Å
138	W	93.2	Very high	91.4	Very high	143 Å²	143	53.7 Å²	53.7	54%	0.542	25%	0.245	S	C	.	.	H	α-helix	trans	-62.9	-50	173.5	-173.2	-92.5	0	0	0	111	D76 I134 A140 N141 T142	D76-W138 PolarHBondContact OD1-NE1 3.21Å; I134-W138 VanDerWaalsContact O-CB 3.23Å; I134-W138 WeakPolarHBondContact O-CB 3.24Å; I134-W138 PolarHBondContact O-N 3.25Å; W138-A140 VanDerWaalsContact C-N 3.32Å; W138-A140 PolarHBondContact O-N 3.47Å; W138-N141 PolarHBondContact O-N 3.33Å; W138-N141 VanDerWaalsContact O-N 3.1Å; W138-T142 WeakPolarHBondContact O-CG2 3.3Å; W138-T142 PolarHBondContact O-N 2.91Å
139	S	90.4	Very high	90.8	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-57.5	-45.7	177.2	-60.2	0	0	0	0	111.2	P135 V136 N141 T142 L143	P135-S139 VanDerWaalsContact O-CB 3.23Å; P135-S139 WeakPolarHBondContact O-CB 3.09Å; P135-S139 PolarHBondContact O-N 3.43Å; P135-S139 PolarHBondContact O-OG 2.96Å; V136-S139 PolarHBondContact O-N 3.32Å; S139-N141 PolarHBondContact O-N 2.96Å; S139-T142 PolarHBondContact O-N 2.93Å; S139-T142 PolarHBondContact O-OG1 3.39Å; S139-L143 WeakPolarHBondContact O-CD1 3.26Å; S139-L143 WeakPolarHBondContact O-CG 3.37Å; S139-L143 PolarHBondContact O-N 2.8Å
140	A	91	Very high	90.1	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-44.5	174.9	0	0	0	0	0	112.5	V136 S137 W138 T142 L143 I144 L160 W168	V136-A140 WeakPolarHBondContact O-CB 3.18Å; V136-A140 PolarHBondContact O-N 2.83Å; S137-A140 PolarHBondContact O-N 3.32Å; W138-A140 VanDerWaalsContact C-N 3.32Å; W138-A140 PolarHBondContact O-N 3.47Å; A140-T142 PolarHBondContact O-N 3.21Å; A140-L143 WeakPolarHBondContact O-CB 3.4Å; A140-L143 PolarHBondContact O-N 3.39Å; A140-I144 WeakPolarHBondContact O-CD1 3.43Å; A140-I144 VanDerWaalsContact O-CG1 3.25Å; A140-I144 WeakPolarHBondContact O-CG1 3.37Å; A140-I144 PolarHBondContact O-N 3.04Å; A140-L160 HydrophobicContact CB-CD2 3.82Å; A140-W168 HydrophobicContact CB-CH2 3.94Å; A140-W168 HydrophobicContact CB-CZ2 3.74Å
141	N	91.7	Very high	89.4	Confident	64 Å²	64	65.7 Å²	65.7	34%	0.342	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-39.7	177.7	177.7	60.3	0	0	0	112.4	S137 W138 S139 I144 R145	S137-N141 WeakPolarHBondContact O-CB 3.33Å; S137-N141 PolarHBondContact O-N 2.9Å; W138-N141 PolarHBondContact O-N 3.33Å; W138-N141 VanDerWaalsContact O-N 3.1Å; S139-N141 PolarHBondContact O-N 2.96Å; N141-I144 PolarHBondContact O-N 2.86Å; N141-R145 WeakPolarHBondContact O-CB 3.28Å; N141-R145 WeakPolarHBondContact O-CG 3.43Å; N141-R145 PolarHBondContact O-N 2.96Å
142	T	89	Confident	88.6	Confident	19 Å²	19	65.9 Å²	65.9	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-42.3	174.6	64.2	0	0	0	0	112	W138 S139 A140 I144 R145 D146	W138-T142 WeakPolarHBondContact O-CG2 3.3Å; W138-T142 PolarHBondContact O-N 2.91Å; S139-T142 PolarHBondContact O-N 2.93Å; S139-T142 PolarHBondContact O-OG1 3.39Å; A140-T142 PolarHBondContact O-N 3.21Å; T142-I144 PolarHBondContact O-N 3.26Å; T142-R145 PolarHBondContact O-N 3.4Å; T142-D146 WeakPolarHBondContact O-CB 3.29Å; T142-D146 PolarHBondContact O-N 2.92Å
143	L	87	Confident	87.5	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-45.5	175.9	-76.2	154.3	0	0	0	112	R31 S139 A140 D146 F147 R158 L160 L164	R31-L143 HydrophobicContact CB-CD2 4.08Å; R31-L143 HydrophobicContact CG-CD1 4.2Å; R31-L143 HydrophobicContact CG-CD2 4.06Å; R31-L143 VanDerWaalsContact NE-CD2 3.33Å; S139-L143 WeakPolarHBondContact O-CD1 3.26Å; S139-L143 WeakPolarHBondContact O-CG 3.37Å; S139-L143 PolarHBondContact O-N 2.8Å; A140-L143 WeakPolarHBondContact O-CB 3.4Å; A140-L143 PolarHBondContact O-N 3.39Å; L143-D146 PolarHBondContact O-N 2.9Å; L143-F147 PolarHBondContact O-N 3.49Å; L143-R158 HydrophobicContact CD2-CB 3.38Å; L143-R158 HydrophobicContact CD2-CG 4.37Å; L143-L160 HydrophobicContact CB-CD2 4.19Å; L143-L160 HydrophobicContact CD1-CD2 3.95Å; L143-L164 HydrophobicContact CD1-CD1 3.69Å
144	I	88.9	Confident	86.2	Confident	77 Å²	77	73.3 Å²	73.3	40%	0.395	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-43	178.4	-67.3	164.3	0	0	0	110.5	A140 N141 T142 D146 F147 Y148	A140-I144 WeakPolarHBondContact O-CD1 3.43Å; A140-I144 VanDerWaalsContact O-CG1 3.25Å; A140-I144 WeakPolarHBondContact O-CG1 3.37Å; A140-I144 PolarHBondContact O-N 3.04Å; N141-I144 PolarHBondContact O-N 2.86Å; T142-I144 PolarHBondContact O-N 3.26Å; I144-D146 VanDerWaalsContact C-N 3.35Å; I144-D146 PolarHBondContact O-N 3.36Å; I144-F147 WeakPolarHBondContact O-CB 3.25Å; I144-F147 PolarHBondContact O-N 3.45Å; I144-Y148 HydrophobicContact CG2-CD2 3.92Å; I144-Y148 HydrophobicContact CG2-CE2 3.77Å; I144-Y148 WeakPolarHBondContact O-CD2 3.45Å; I144-Y148 PolarHBondContact O-N 3.43Å
145	R	87.8	Confident	84.8	Confident	171 Å²	171	70.3 Å²	70.3	65%	0.645	35%	0.346	S	S	*	.	H	α-helix	trans	-62.3	-41.9	176.3	-76	-176	177.9	-144.3	-0.6	112.3	N141 T142 F147 Y148 N149	N141-R145 WeakPolarHBondContact O-CB 3.28Å; N141-R145 WeakPolarHBondContact O-CG 3.43Å; N141-R145 PolarHBondContact O-N 2.96Å; T142-R145 PolarHBondContact O-N 3.4Å; R145-F147 VanDerWaalsContact C-N 3.28Å; R145-F147 PolarHBondContact O-N 3Å; R145-Y148 PolarHBondContact O-N 3.49Å; R145-N149 PolarHBondContact O-N 2.95Å
146	D	84.3	Confident	83.7	Confident	40 Å²	40	74.5 Å²	74.5	21%	0.214	37%	0.366	C	S	.	.	H	α-helix	trans	-61.7	-38.1	175.6	-75.4	-13	0	0	0	111.3	R31 T142 L143 I144 Y148 N149 R158	R31-D146 IonicContact NH2-OD2 3.78Å; R31-D146 PolarHBondContact NH2-OD2 2.77Å; T142-D146 WeakPolarHBondContact O-CB 3.29Å; T142-D146 PolarHBondContact O-N 2.92Å; L143-D146 PolarHBondContact O-N 2.9Å; I144-D146 VanDerWaalsContact C-N 3.35Å; I144-D146 PolarHBondContact O-N 3.36Å; D146-Y148 PolarHBondContact O-N 2.99Å; D146-N149 PolarHBondContact O-N 3.49Å; D146-R158 IonicContact OD2-CZ 2.7Å; D146-R158 IonicContact OD2-NH1 3.29Å; D146-R158 PolarHBondContact OD2-NH1 2.92Å
147	F	83.2	Confident	82.8	Confident	76 Å²	76	78.6 Å²	78.6	33%	0.333	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-38.2	179.6	-168.4	-87.4	0	0	0	113.3	L143 I144 R145 R157	L143-F147 PolarHBondContact O-N 3.49Å; I144-F147 WeakPolarHBondContact O-CB 3.25Å; I144-F147 PolarHBondContact O-N 3.45Å; R145-F147 VanDerWaalsContact C-N 3.28Å; R145-F147 PolarHBondContact O-N 3Å; F147-R157 HydrophobicContact CD2-CB 4.2Å; F147-R157 HydrophobicContact CD2-CG 4.06Å; F147-R157 HydrophobicContact CE2-CB 4.26Å; F147-R157 HydrophobicContact CE2-CG 4.18Å
148	Y	84.7	Confident	82.2	Confident	183 Å²	183	80.8 Å²	80.8	72%	0.718	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.5	178.8	-69.8	-69.7	0	0	0	114.1	I144 R145 D146 P150	I144-Y148 HydrophobicContact CG2-CD2 3.92Å; I144-Y148 HydrophobicContact CG2-CE2 3.77Å; I144-Y148 WeakPolarHBondContact O-CD2 3.45Å; I144-Y148 PolarHBondContact O-N 3.43Å; R145-Y148 PolarHBondContact O-N 3.49Å; D146-Y148 PolarHBondContact O-N 2.99Å; Y148-P150 WeakPolarHBondContact O-CD 3.45Å
149	N	84.4	Confident	81.9	Confident	59 Å²	59	79.2 Å²	79.2	32%	0.316	38%	0.383	S	S	.	.			trans	-79	117.8	-178.2	-173.5	-13.4	0	0	0	110.6	R145 D146 L151 V152	R145-N149 PolarHBondContact O-N 2.95Å; D146-N149 PolarHBondContact O-N 3.49Å; N149-L151 PolarHBondContact O-N 2.91Å; N149-L151 VanDerWaalsContact O-N 3.11Å; N149-L151 WeakPolarHBondContact OD1-CB 3.29Å; N149-L151 PolarHBondContact OD1-N 3.33Å; N149-V152 HydrophobicContact CB-CG2 3.93Å; N149-V152 PolarHBondContact O-N 3.2Å; N149-V152 VanDerWaalsContact O-N 3.1Å
150	P	80.8	Confident	81.8	Confident	124 Å²	124	81.6 Å²	81.6	81%	0.805	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-11.9	-177.6	29.5	-36.9	0	0	0	113.7	Y148 V152	Y148-P150 WeakPolarHBondContact O-CD 3.45Å; P150-V152 VanDerWaalsContact C-N 3.31Å
151	L	81.1	Confident	81.7	Confident	152 Å²	152	81.5 Å²	81.5	80%	0.796	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.3	176.3	-58.6	172.7	0	0	0	112.7	N149	N149-L151 PolarHBondContact O-N 2.91Å; N149-L151 VanDerWaalsContact O-N 3.11Å; N149-L151 WeakPolarHBondContact OD1-CB 3.29Å; N149-L151 PolarHBondContact OD1-N 3.33Å
152	V	75.9	Confident	81.7	Confident	49 Å²	49	80.5 Å²	80.5	30%	0.297	40%	0.395	S	S	.	.	S	Bend	trans	-89.2	126.3	179.7	-179.1	0	0	0	0	109.2	N149 P150 Q156	N149-V152 HydrophobicContact CB-CG2 3.93Å; N149-V152 PolarHBondContact O-N 3.2Å; N149-V152 VanDerWaalsContact O-N 3.1Å; P150-V152 VanDerWaalsContact C-N 3.31Å; V152-Q156 HydrophobicContact CG1-CB 4.04Å
153	I	74	Confident	81.8	Confident	124 Å²	124	79.6 Å²	79.6	64%	0.636	39%	0.389	S	S	*	.			trans	-63.9	137.2	176	-50.9	170.1	0	0	0	108.2	A155 Q156	I153-A155 HydrophobicContact CG2-CB 4.34Å; I153-A155 PolarHBondContact O-N 3.4Å; I153-Q156 WeakPolarHBondContact O-CA 3.34Å; I153-Q156 PolarHBondContact O-N 3.32Å
154	E	67.1	Low	82.1	Confident	124 Å²	124	79.5 Å²	79.5	58%	0.579	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-46.8	-39.2	177.6	-76.9	-80.3	161.1	0	0	112.8	Q156 R157	E154-Q156 PolarHBondContact O-N 3.02Å; E154-Q156 VanDerWaalsContact O-N 3.17Å; E154-R157 VanDerWaalsContact CD-CZ 3.41Å; E154-R157 PolarHBondContact O-N 3.36Å; E154-R157 IonicContact OE1-CZ 3.26Å; E154-R157 IonicContact OE1-NH1 2.75Å; E154-R157 PolarHBondContact OE1-NH1 2.96Å; E154-R157 IonicContact OE1-NH2 2.69Å; E154-R157 PolarHBondContact OE1-NH2 3.1Å; E154-R157 IonicContact OE2-CZ 2.73Å; E154-R157 VanDerWaalsContact OE2-CZ 3.26Å; E154-R157 IonicContact OE2-NE 3.03Å; E154-R157 IonicContact OE2-NH1 3.06Å; E154-R157 PolarHBondContact OE2-NH1 3.1Å; E154-R157 IonicContact OE2-NH2 3.74Å
155	A	65.3	Low	82.4	Confident	29 Å²	29	81.8 Å²	81.8	24%	0.24	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-69.5	-6.5	178.5	0	0	0	0	0	115.2	F35 I153	F35-A155 WeakPolarHBondContact CD1-O 3.46Å; I153-A155 HydrophobicContact CG2-CB 4.34Å; I153-A155 PolarHBondContact O-N 3.4Å
156	Q	69.3	Low	82.7	Confident	89 Å²	89	76.7 Å²	76.7	42%	0.416	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-114.1	10.4	178	-74.3	-118.4	-62.5	0	0	112.7	F35 V152 I153 E154 R158	F35-Q156 HydrophobicContact CE1-CG 4.03Å; V152-Q156 HydrophobicContact CG1-CB 4.04Å; I153-Q156 WeakPolarHBondContact O-CA 3.34Å; I153-Q156 PolarHBondContact O-N 3.32Å; E154-Q156 PolarHBondContact O-N 3.02Å; E154-Q156 VanDerWaalsContact O-N 3.17Å; Q156-R158 PolarHBondContact O-N 3.4Å
157	R	75.4	Confident	83.3	Confident	86 Å²	86	74.8 Å²	74.8	33%	0.325	37%	0.368	S	S	.	.			trans	-59.3	130.4	175.6	-85.9	-177.7	168.9	152.6	17.2	110.5	F147 E154	F147-R157 HydrophobicContact CD2-CB 4.2Å; F147-R157 HydrophobicContact CD2-CG 4.06Å; F147-R157 HydrophobicContact CE2-CB 4.26Å; F147-R157 HydrophobicContact CE2-CG 4.18Å; E154-R157 VanDerWaalsContact CD-CZ 3.41Å; E154-R157 PolarHBondContact O-N 3.36Å; E154-R157 IonicContact OE1-CZ 3.26Å; E154-R157 IonicContact OE1-NH1 2.75Å; E154-R157 PolarHBondContact OE1-NH1 2.96Å; E154-R157 IonicContact OE1-NH2 2.69Å; E154-R157 PolarHBondContact OE1-NH2 3.1Å; E154-R157 IonicContact OE2-CZ 2.73Å; E154-R157 VanDerWaalsContact OE2-CZ 3.26Å; E154-R157 IonicContact OE2-NE 3.03Å; E154-R157 IonicContact OE2-NH1 3.06Å; E154-R157 PolarHBondContact OE2-NH1 3.1Å; E154-R157 IonicContact OE2-NH2 3.74Å
158	R	81.1	Confident	83.9	Confident	78 Å²	78	75.2 Å²	75.2	29%	0.294	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.2	179.7	-49.1	-172.4	162.6	139.9	-4.2	109.2	R31 V32 T33 L143 D146 Q156	R31-R158 VanDerWaalsContact NH2-NH1 3.18Å; V32-R158 CarbonylContact O-C 3.24Å; V32-R158 WeakPolarHBondContact O-CA 3.34Å; T33-R158 HydrophobicContact CG2-CB 4.04Å; T33-R158 HydrophobicContact CG2-CG 3.64Å; L143-R158 HydrophobicContact CD2-CB 3.38Å; L143-R158 HydrophobicContact CD2-CG 4.37Å; D146-R158 IonicContact OD2-CZ 2.7Å; D146-R158 IonicContact OD2-NH1 3.29Å; D146-R158 PolarHBondContact OD2-NH1 2.92Å; Q156-R158 PolarHBondContact O-N 3.4Å
159	E	87.1	Confident	84.5	Confident	110 Å²	110	68.3 Å²	68.3	51%	0.514	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	158.2	176.3	-63.1	-176.3	172.9	0	0	110.9	V32 G161	V32-E159 HydrophobicContact CB-CB 4.33Å; V32-E159 PolarHBondContact N-O 2.84Å; V32-E159 VanDerWaalsContact N-O 3.1Å; V32-E159 PolarHBondContact O-N 3.15Å; E159-G161 PolarHBondContact O-N 3.49Å
160	L	88	Confident	85	Confident	54 Å²	54	65.7 Å²	65.7	28%	0.283	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	121.8	177.6	-64.9	165.6	0	0	0	109.6	A140 L143 L164 Y165	A140-L160 HydrophobicContact CB-CD2 3.82Å; L143-L160 HydrophobicContact CB-CD2 4.19Å; L143-L160 HydrophobicContact CD1-CD2 3.95Å; L160-L164 HydrophobicContact CB-CD1 4.41Å; L160-L164 HydrophobicContact CD2-CD1 3.76Å; L160-Y165 HydrophobicContact CB-CE2 4.23Å
161	G	89.6	Confident	85.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.3	C	S	.	.			trans	-76.5	154.1	177.1	0	0	0	0	0	113.4	M29 W30 E159 S163 L164	M29-G161 CarbonylContact O-C 3.14Å; M29-G161 WeakPolarHBondContact O-CA 3.43Å; W30-G161 PolarHBondContact O-N 3.05Å; E159-G161 PolarHBondContact O-N 3.49Å; G161-S163 PolarHBondContact O-N 3.17Å; G161-S163 VanDerWaalsContact O-N 3.14Å; G161-L164 WeakPolarHBondContact O-CB 3.29Å; G161-L164 PolarHBondContact O-N 3.09Å; G161-L164 VanDerWaalsContact O-N 3.1Å
162	A	91.6	Very high	86.5	Confident	43 Å²	43	54 Å²	54	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-55	-33.1	-178.8	0	0	0	0	0	113.8	M29 L164 Y165 I166	M29-A162 HydrophobicContact CB-CB 4.35Å; M29-A162 HydrophobicContact CE-CB 4.27Å; M29-A162 PolarHBondContact O-N 3.35Å; M29-A162 HydrophobicContact SD-CB 4.24Å; A162-L164 VanDerWaalsContact C-N 3.26Å; A162-L164 PolarHBondContact O-N 3.45Å; A162-Y165 PolarHBondContact O-N 2.82Å; A162-I166 PolarHBondContact O-N 3.25Å
163	S	92.3	Very high	87.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-26.2	-178.6	69.7	0	0	0	0	113.4	T24 M29 W30 G161 I166 G167	T24-S163 WeakPolarHBondContact CG2-O 3.09Å; T24-S163 PolarHBondContact OG1-O 2.95Å; M29-S163 VanDerWaalsContact O-CB 3.27Å; M29-S163 WeakPolarHBondContact O-CB 3.46Å; M29-S163 PolarHBondContact O-N 3.38Å; M29-S163 PolarHBondContact O-OG 3.25Å; W30-S163 VanDerWaalsContact CA-OG 3.25Å; W30-S163 WeakPolarHBondContact CA-OG 3.42Å; W30-S163 PolarHBondContact N-OG 2.92Å; W30-S163 PolarHBondContact NE1-OG 3.27Å; G161-S163 PolarHBondContact O-N 3.17Å; G161-S163 VanDerWaalsContact O-N 3.14Å; S163-I166 PolarHBondContact O-N 3.31Å; S163-G167 PolarHBondContact O-N 2.86Å
164	L	92.7	Very high	88.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-41.1	177.3	-65.9	175.6	0	0	0	111	W30 V136 L143 L160 G161 A162 I166 G167 W168	W30-L164 HydrophobicContact CD2-CD2 4.24Å; W30-L164 HydrophobicContact CE3-CD2 3.66Å; W30-L164 HydrophobicContact CZ3-CD2 3.94Å; W30-L164 WeakPolarHBondContact O-CD1 3.29Å; V136-L164 HydrophobicContact CB-CD2 4.45Å; V136-L164 HydrophobicContact CG1-CB 4.21Å; V136-L164 HydrophobicContact CG1-CD2 3.94Å; V136-L164 WeakPolarHBondContact CG1-O 3.38Å; L143-L164 HydrophobicContact CD1-CD1 3.69Å; L160-L164 HydrophobicContact CB-CD1 4.41Å; L160-L164 HydrophobicContact CD2-CD1 3.76Å; G161-L164 WeakPolarHBondContact O-CB 3.29Å; G161-L164 PolarHBondContact O-N 3.09Å; G161-L164 VanDerWaalsContact O-N 3.1Å; A162-L164 VanDerWaalsContact C-N 3.26Å; A162-L164 PolarHBondContact O-N 3.45Å; L164-I166 VanDerWaalsContact C-N 3.34Å; L164-I166 PolarHBondContact O-N 2.94Å; L164-G167 WeakPolarHBondContact O-CA 3.44Å; L164-G167 PolarHBondContact O-N 2.74Å; L164-G167 VanDerWaalsContact O-N 3.13Å; L164-W168 PolarHBondContact O-N 3.47Å
165	Y	94.9	Very high	89.9	Confident	125 Å²	125	45.3 Å²	45.3	49%	0.49	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-41	175.3	-61.8	-73	0	0	0	111.8	L160 A162 G167 W168 G169	L160-Y165 HydrophobicContact CB-CE2 4.23Å; A162-Y165 PolarHBondContact O-N 2.82Å; Y165-G167 VanDerWaalsContact C-N 3.26Å; Y165-G167 PolarHBondContact O-N 3.11Å; Y165-W168 HydrophobicContact CD1-CE3 4.1Å; Y165-W168 HydrophobicContact CD1-CZ3 4.08Å; Y165-W168 HydrophobicContact CE1-CZ3 4.1Å; Y165-W168 PolarHBondContact O-N 3.11Å; Y165-G169 PolarHBondContact O-N 3.12Å
166	I	95.1	Very high	91.3	Very high	64 Å²	64	49.3 Å²	49.3	33%	0.328	25%	0.251	S	S	.	.	H	α-helix	trans	-66.4	-33.6	174.7	-61	172	0	0	0	110.3	T24 M27 A162 S163 L164 G169 S170	T24-I166 WeakPolarHBondContact OG1-CG2 3.46Å; M27-I166 HydrophobicContact CE-CD1 3.31Å; M27-I166 HydrophobicContact CE-CG1 4.48Å; M27-I166 HydrophobicContact CE-CG2 4.38Å; M27-I166 HydrophobicContact SD-CD1 4.17Å; A162-I166 PolarHBondContact O-N 3.25Å; S163-I166 PolarHBondContact O-N 3.31Å; L164-I166 VanDerWaalsContact C-N 3.34Å; L164-I166 PolarHBondContact O-N 2.94Å; I166-G169 PolarHBondContact O-N 3.17Å; I166-S170 VanDerWaalsContact O-CB 3.3Å; I166-S170 WeakPolarHBondContact O-CB 3.4Å; I166-S170 PolarHBondContact O-N 3.07Å; I166-S170 PolarHBondContact O-OG 3.19Å
167	G	95.3	Very high	92.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-45.2	172.7	0	0	0	0	0	112.9	T24 S163 L164 Y165 S170 A171	T24-G167 WeakPolarHBondContact OG1-CA 3.1Å; T24-G167 PolarHBondContact OG1-N 2.9Å; T24-G167 VanDerWaalsContact OG1-N 3.11Å; S163-G167 PolarHBondContact O-N 2.86Å; L164-G167 WeakPolarHBondContact O-CA 3.44Å; L164-G167 PolarHBondContact O-N 2.74Å; L164-G167 VanDerWaalsContact O-N 3.13Å; Y165-G167 VanDerWaalsContact C-N 3.26Å; Y165-G167 PolarHBondContact O-N 3.11Å; G167-S170 VanDerWaalsContact CA-OG 3.31Å; G167-S170 WeakPolarHBondContact CA-OG 3.28Å; G167-S170 PolarHBondContact O-OG 3.47Å; G167-A171 VanDerWaalsContact O-CB 3.31Å; G167-A171 WeakPolarHBondContact O-CB 2.85Å; G167-A171 PolarHBondContact O-N 3.38Å
168	W	96.9	Very high	93.3	Very high	85 Å²	85	41 Å²	41	32%	0.322	22%	0.215	S	C	.	.	H	α-helix	trans	-66.9	-42	173.8	-75.6	-35.1	0	0	0	112.7	F133 V136 S137 A140 L164 Y165 A171 G172	F133-W168 AromaticContact CD2-CD1 3.9Å; F133-W168 AromaticContact CE2-CD1 3.77Å; V136-W168 HydrophobicContact CG1-CD2 4.28Å; V136-W168 HydrophobicContact CG1-CG 4.08Å; S137-W168 PolarHBondContact OG-NE1 3.31Å; A140-W168 HydrophobicContact CB-CH2 3.94Å; A140-W168 HydrophobicContact CB-CZ2 3.74Å; L164-W168 PolarHBondContact O-N 3.47Å; Y165-W168 HydrophobicContact CD1-CE3 4.1Å; Y165-W168 HydrophobicContact CD1-CZ3 4.08Å; Y165-W168 HydrophobicContact CE1-CZ3 4.1Å; Y165-W168 PolarHBondContact O-N 3.11Å; W168-A171 PolarHBondContact O-N 2.93Å; W168-G172 PolarHBondContact O-N 3.5Å
169	G	96.4	Very high	93.8	Very high	39 Å²	39	38.4 Å²	38.4	40%	0.402	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-47.5	175.6	0	0	0	0	0	112	Y165 I166 G172 L173	Y165-G169 PolarHBondContact O-N 3.12Å; I166-G169 PolarHBondContact O-N 3.17Å; G169-G172 PolarHBondContact O-N 3.31Å; G169-L173 VanDerWaalsContact O-CG 3.28Å; G169-L173 WeakPolarHBondContact O-CG 3.28Å; G169-L173 PolarHBondContact O-N 3.36Å
170	S	95.9	Very high	94	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.028	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-44	177.3	51.5	0	0	0	0	112.6	G17 I166 G167 G172 L173 L174	G17-S170 VanDerWaalsContact O-CB 3.24Å; G17-S170 WeakPolarHBondContact O-CB 3.49Å; I166-S170 VanDerWaalsContact O-CB 3.3Å; I166-S170 WeakPolarHBondContact O-CB 3.4Å; I166-S170 PolarHBondContact O-N 3.07Å; I166-S170 PolarHBondContact O-OG 3.19Å; G167-S170 VanDerWaalsContact CA-OG 3.31Å; G167-S170 WeakPolarHBondContact CA-OG 3.28Å; G167-S170 PolarHBondContact O-OG 3.47Å; S170-G172 PolarHBondContact O-N 3.32Å; S170-L173 PolarHBondContact O-N 2.97Å; S170-L174 WeakPolarHBondContact O-CB 3.4Å; S170-L174 WeakPolarHBondContact O-CG 3.27Å; S170-L174 PolarHBondContact O-N 2.99Å
171	A	96.4	Very high	94	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-44.4	174.5	0	0	0	0	0	111.9	F133 G167 W168 L174 L175	F133-A171 HydrophobicContact CB-CB 4.02Å; F133-A171 HydrophobicContact CD2-CB 4.18Å; G167-A171 VanDerWaalsContact O-CB 3.31Å; G167-A171 WeakPolarHBondContact O-CB 2.85Å; G167-A171 PolarHBondContact O-N 3.38Å; W168-A171 PolarHBondContact O-N 2.93Å; A171-L174 PolarHBondContact O-N 3.45Å; A171-L175 WeakPolarHBondContact O-CB 3.46Å; A171-L175 VanDerWaalsContact O-CG 3.26Å; A171-L175 WeakPolarHBondContact O-CG 3.31Å; A171-L175 PolarHBondContact O-N 3.04Å
172	G	96.4	Very high	93.9	Very high	30 Å²	30	34.4 Å²	34.4	31%	0.309	20%	0.197	S	C	.	.	H	α-helix	trans	-60.5	-45.5	176	0	0	0	0	0	112.5	W168 G169 S170 L175 L176	W168-G172 PolarHBondContact O-N 3.5Å; G169-G172 PolarHBondContact O-N 3.31Å; S170-G172 PolarHBondContact O-N 3.32Å; G172-L175 PolarHBondContact O-N 3.38Å; G172-L176 WeakPolarHBondContact O-CB 3.44Å; G172-L176 VanDerWaalsContact O-CG 3.28Å; G172-L176 WeakPolarHBondContact O-CG 3.5Å; G172-L176 PolarHBondContact O-N 3.41Å
173	L	96.3	Very high	93.4	Very high	55 Å²	55	36.7 Å²	36.7	29%	0.288	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-39.5	176.7	-69.2	172.3	0	0	0	112.5	L13 I16 G169 S170 G177	L13-L173 HydrophobicContact CD2-CD2 3.57Å; I16-L173 HydrophobicContact CG2-CD1 3.83Å; G169-L173 VanDerWaalsContact O-CG 3.28Å; G169-L173 WeakPolarHBondContact O-CG 3.28Å; G169-L173 PolarHBondContact O-N 3.36Å; S170-L173 PolarHBondContact O-N 2.97Å; L173-G177 PolarHBondContact O-N 2.88Å
174	L	96.1	Very high	92.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-42.8	176	-78.2	168.4	0	0	0	112.3	A14 W18 F125 I132 S170 A171 G178	A14-L174 WeakPolarHBondContact O-CD2 3.36Å; W18-L174 HydrophobicContact CB-CD2 4.29Å; F125-L174 HydrophobicContact CB-CD2 4.44Å; F125-L174 HydrophobicContact CD1-CD2 3.77Å; F125-L174 HydrophobicContact CE1-CD2 4.49Å; F125-L174 HydrophobicContact CG-CD2 4.46Å; I132-L174 HydrophobicContact CD1-CD1 3.46Å; I132-L174 VanDerWaalsContact CD1-CD1 3.46Å; S170-L174 WeakPolarHBondContact O-CB 3.4Å; S170-L174 WeakPolarHBondContact O-CG 3.27Å; S170-L174 PolarHBondContact O-N 2.99Å; A171-L174 PolarHBondContact O-N 3.45Å; L174-G178 PolarHBondContact O-N 3.46Å
175	L	95.9	Very high	90.7	Very high	60 Å²	60	42.1 Å²	42.1	31%	0.314	25%	0.246	S	C	.	.	H	α-helix	trans	-66.2	-43.7	177.6	-70.6	174.1	0	0	0	111.6	I126 L130 A171 G172 G179	I126-L175 HydrophobicContact CB-CD2 4.45Å; I126-L175 HydrophobicContact CG2-CD2 3.93Å; L130-L175 HydrophobicContact CD2-CD2 4.21Å; L130-L175 HydrophobicContact CG-CD2 4.18Å; A171-L175 WeakPolarHBondContact O-CB 3.46Å; A171-L175 VanDerWaalsContact O-CG 3.26Å; A171-L175 WeakPolarHBondContact O-CG 3.31Å; A171-L175 PolarHBondContact O-N 3.04Å; G172-L175 PolarHBondContact O-N 3.38Å; L175-G179 PolarHBondContact O-N 3.22Å
176	L	95.2	Very high	88.9	Confident	113 Å²	113	38.7 Å²	38.7	59%	0.592	24%	0.238	S	C	*	.	H	α-helix	trans	-66.6	-48.2	176.1	-69.9	175.2	0	0	0	111.3	G172 G178 G179 L180	G172-L176 WeakPolarHBondContact O-CB 3.44Å; G172-L176 VanDerWaalsContact O-CG 3.28Å; G172-L176 WeakPolarHBondContact O-CG 3.5Å; G172-L176 PolarHBondContact O-N 3.41Å; L176-G178 PolarHBondContact O-N 2.96Å; L176-G179 PolarHBondContact O-N 3.49Å; L176-L180 WeakPolarHBondContact O-CB 3.38Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.33Å; L176-L180 PolarHBondContact O-N 2.9Å
177	G	93.1	Very high	86.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-46.3	178	0	0	0	0	0	112.2	G10 L173 L180 L181	G10-G177 WeakPolarHBondContact O-CA 3.29Å; L173-G177 PolarHBondContact O-N 2.88Å; G177-L180 PolarHBondContact O-N 3.22Å; G177-L181 VanDerWaalsContact O-CG 3.29Å; G177-L181 WeakPolarHBondContact O-CG 3.27Å; G177-L181 PolarHBondContact O-N 3.44Å; G177-L181 VanDerWaalsContact O-N 3.09Å
178	G	92.6	Very high	84.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-41.1	175.8	0	0	0	0	0	113	G122 L174 L176 L181 C182	G122-G178 WeakPolarHBondContact O-CA 3.46Å; L174-G178 PolarHBondContact O-N 3.46Å; L176-G178 PolarHBondContact O-N 2.96Å; G178-L181 PolarHBondContact O-N 3.37Å; G178-C182 PolarHBondContact O-N 3.49Å; G178-C182 PolarHBondContact O-SG 3.03Å
179	G	92.1	Very high	82.3	Confident	24 Å²	24	56.2 Å²	56.2	25%	0.247	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-46.9	174.6	0	0	0	0	0	112.5	L175 L176 L181 C182 C183	L175-G179 PolarHBondContact O-N 3.22Å; L176-G179 PolarHBondContact O-N 3.49Å; G179-L181 VanDerWaalsContact C-N 3.29Å; G179-L181 PolarHBondContact O-N 3.08Å; G179-C182 PolarHBondContact O-N 3.21Å; G179-C182 VanDerWaalsContact O-N 3.17Å; G179-C183 PolarHBondContact O-N 3.43Å; G179-C183 PolarHBondContact O-SG 2.92Å
180	L	91.2	Very high	79.7	Confident	46 Å²	46	56.9 Å²	56.9	24%	0.241	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-36.9	176.2	-70.2	-179.5	0	0	0	112.5	L6 M9 L13 L176 G177 N184	L6-L180 HydrophobicContact CD1-CD1 4.44Å; L6-L180 HydrophobicContact CD1-CD2 3.75Å; L6-L180 HydrophobicContact CG-CD2 4.35Å; M9-L180 HydrophobicContact CG-CD1 4.43Å; L13-L180 HydrophobicContact CD1-CD1 3.72Å; L176-L180 WeakPolarHBondContact O-CB 3.38Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.33Å; L176-L180 PolarHBondContact O-N 2.9Å; G177-L180 PolarHBondContact O-N 3.22Å; L180-N184 PolarHBondContact O-ND2 3.4Å
181	L	88.1	Confident	77.3	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-68.1	-38.6	175.2	-70.8	171	0	0	0	112.2	Q7 V11 F125 G177 G178 G179 N184	Q7-L181 HydrophobicContact CG-CD2 4.27Å; V11-L181 HydrophobicContact CG2-CD2 3.92Å; F125-L181 HydrophobicContact CD2-CD1 3.85Å; F125-L181 HydrophobicContact CE2-CD1 4.09Å; G177-L181 VanDerWaalsContact O-CG 3.29Å; G177-L181 WeakPolarHBondContact O-CG 3.27Å; G177-L181 PolarHBondContact O-N 3.44Å; G177-L181 VanDerWaalsContact O-N 3.09Å; G178-L181 PolarHBondContact O-N 3.37Å; G179-L181 VanDerWaalsContact C-N 3.29Å; G179-L181 PolarHBondContact O-N 3.08Å; L181-N184 WeakPolarHBondContact O-CB 3.5Å; L181-N184 PolarHBondContact O-N 3.43Å
182	C	86.6	Confident	74.7	Confident	31 Å²	31	74.1 Å²	74.1	21%	0.209	42%	0.424	C	S	.	.	H	α-helix	trans	-69.1	-32.7	175.9	-69.5	0	0	0	0	113.3	G122 G178 G179 N184	G122-C182 VanDerWaalsContact C-SG 3.59Å; G178-C182 PolarHBondContact O-N 3.49Å; G178-C182 PolarHBondContact O-SG 3.03Å; G179-C182 PolarHBondContact O-N 3.21Å; G179-C182 VanDerWaalsContact O-N 3.17Å; C182-N184 PolarHBondContact O-N 2.9Å
183	C	81.8	Confident	72	Confident	92 Å²	92	76 Å²	76	62%	0.622	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.5	178.2	-68.8	0	0	0	0	113.8	G179 C185	G179-C183 PolarHBondContact O-N 3.43Å; G179-C183 PolarHBondContact O-SG 2.92Å; C183-C185 PolarHBondContact O-N 3.04Å
184	N	69.9	Low	69.2	Low	17 Å²	17	84.5 Å²	84.5	9%	0.091	47%	0.473	C	S	.	.			trans	-75.5	60.9	171.6	-67.8	-44.5	0	0	0	111	A2 L180 L181 C182 P186	A2-N184 HydrophobicContact CB-CB 4.29Å; A2-N184 WeakPolarHBondContact CB-OD1 3.26Å; L180-N184 PolarHBondContact O-ND2 3.4Å; L181-N184 WeakPolarHBondContact O-CB 3.5Å; L181-N184 PolarHBondContact O-N 3.43Å; C182-N184 PolarHBondContact O-N 2.9Å; N184-P186 WeakPolarHBondContact O-CD 2.96Å
185	C	58.5	Low	66.5	Low	98 Å²	98	89.9 Å²	89.9	66%	0.662	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-67	122.1	174.6	-76.7	0	0	0	0	110.1	C183	C183-C185 PolarHBondContact O-N 3.04Å
186	P	56.5	Low	63.9	Low	52 Å²	52	98 Å²	98	34%	0.338	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-62.8	145.7	164.1	26.3	-31	0	0	0	108.9	A115 N184 K188	A115-P186 HydrophobicContact CB-CB 4.06Å; A115-P186 HydrophobicContact CB-CG 4.04Å; N184-P186 WeakPolarHBondContact O-CD 2.96Å; P186-K188 PolarHBondContact O-N 3.22Å
187	P	49.1	Very low	61.5	Low	117 Å²	117	98.8 Å²	98.8	76%	0.76	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-53.9	127.1	168.8	-18	29.8	0	0	0	108.6	E189	P187-E189 PolarHBondContact O-N 3.41Å
188	K	48.4	Very low	59.3	Low	198 Å²	198	102.9 Å²	102.9	86%	0.861	58%	0.579	S	S	*	*			trans	-65.6	103.7	179.1	-139.5	178.8	-176.8	177.8	0	108.2	P186 G190	P186-K188 PolarHBondContact O-N 3.22Å; K188-G190 PolarHBondContact O-N 3.19Å
189	E	51.7	Low	57.3	Low	202 Å²	202	106 Å²	106	94%	0.944	61%	0.605	S	S	*	*			trans	-74.9	104.4	163.3	-82.3	-171	143.2	0	0	108.6	P187	P187-E189 PolarHBondContact O-N 3.41Å
190	G	42.4	Very low	55.2	Low	54 Å²	54	114.7 Å²	114.7	56%	0.557	64%	0.636	S	S	*	*	S	Bend	trans	96	121.8	173.1	0	0	0	0	0	114.3	K188	K188-G190 PolarHBondContact O-N 3.19Å
191	N	45.4	Very low	53.4	Low	166 Å²	166	121.5 Å²	121.5	89%	0.888	66%	0.664	S	S	*	*	S	Bend	cis	-170.8	108.5	14.5	-158.3	10.9	0	0	0	107.8
192	M	42.4	Very low	52	Low	199 Å²	199	125.2 Å²	125.2	98%	0.98	70%	0.695	S	S	*	*	S	Bend	trans	173.3	91.4	146.4	-152.2	147	-162.6	0	0	110.2
193	G	38.9	Very low	50.7	Low	71 Å²	71	129.5 Å²	129.5	73%	0.732	72%	0.722	S	S	*	*	S	Bend	trans	151.1	73.9	176.4	0	0	0	0	0	111.7
194	R	36.4	Very low	49.3	Very low	232 Å²	232	131.2 Å²	131.2	88%	0.875	73%	0.729	S	S	*	*			trans	-34.8	123.1	176.8	-62.5	172	-179.8	176.7	-1	112.5
195	P	39.9	Very low	48.5	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	77%	0.768	S	S	*	*			trans	-69.5	130	147.8	17.9	-6	0	0	0	106.2	V197	P195-V197 PolarHBondContact O-N 2.94Å
196	Y	42.7	Very low	48.2	Very low	229 Å²	229	143.1 Å²	143.1	90%	0.898	77%	0.773	S	S	*	*			trans	-51.1	105.9	166.8	-83.4	-111.5	0	0	0	107.9	A198	Y196-A198 PolarHBondContact O-N 2.85Å
197	V	43.9	Very low	48.1	Very low	131 Å²	131	146.9 Å²	146.9	79%	0.794	80%	0.795	S	S	*	*			trans	-65.4	99.7	158.5	-179.4	0	0	0	0	103.5	P195 A199	P195-V197 PolarHBondContact O-N 2.94Å; V197-A199 VanDerWaalsContact C-N 3.31Å; V197-A199 PolarHBondContact O-N 2.89Å
198	A	47.5	Very low	48.5	Very low	85 Å²	85	146.3 Å²	146.3	70%	0.702	80%	0.795	S	S	*	*			trans	-54.3	107	164	0	0	0	0	0	105.4	Y196 K200	Y196-A198 PolarHBondContact O-N 2.85Å; A198-K200 PolarHBondContact O-N 2.86Å
199	A	49.6	Very low	48.5	Very low	67 Å²	67	142.5 Å²	142.5	55%	0.554	79%	0.79	S	S	*	*			trans	-54	110.1	176.4	0	0	0	0	0	106.5	V197 F201	V197-A199 VanDerWaalsContact C-N 3.31Å; V197-A199 PolarHBondContact O-N 2.89Å; A199-F201 HydrophobicContact CB-CE2 4.25Å; A199-F201 WeakPolarHBondContact O-CD2 3.42Å; A199-F201 PolarHBondContact O-N 3.26Å
200	K	48.9	Very low	48.6	Very low	205 Å²	205	137.8 Å²	137.8	89%	0.891	78%	0.779	S	S	*	*			trans	-66.5	95.8	165.1	-77.3	-173.3	177.3	-177.9	0	105.3	A198 A202	A198-K200 PolarHBondContact O-N 2.86Å; K200-A202 VanDerWaalsContact C-N 3.33Å; K200-A202 PolarHBondContact O-N 2.95Å
201	F	52.8	Low	49.1	Very low	189 Å²	189	141.8 Å²	141.8	83%	0.829	79%	0.785	S	S	*	*			trans	-60.7	102.8	163.9	-71.3	-84.7	0	0	0	106.5	A199	A199-F201 HydrophobicContact CB-CE2 4.25Å; A199-F201 WeakPolarHBondContact O-CD2 3.42Å; A199-F201 PolarHBondContact O-N 3.26Å
202	A	59.5	Low	49.3	Very low	80 Å²	80	140.8 Å²	140.8	66%	0.661	78%	0.78	S	S	*	*			trans	-63.6	129.2	161.4	0	0	0	0	0	106.6	K200 V204	K200-A202 VanDerWaalsContact C-N 3.33Å; K200-A202 PolarHBondContact O-N 2.95Å; A202-V204 PolarHBondContact O-N 2.88Å
203	P	57.8	Low	49.7	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	77%	0.768	S	S	*	*			trans	-58.9	130.8	172.8	24.5	-31.7	0	0	0	108.2	R205	P203-R205 PolarHBondContact O-N 3.13Å
204	V	52.3	Low	50.1	Low	128 Å²	128	147 Å²	147	78%	0.776	80%	0.795	S	S	*	*			trans	-55.7	112.4	172.9	174.7	0	0	0	0	107.3	A202 T206	A202-V204 PolarHBondContact O-N 2.88Å; V204-T206 HydrophobicContact CG1-CG2 4.37Å; V204-T206 PolarHBondContact O-N 3.03Å
205	R	53.5	Low	50.7	Low	240 Å²	240	142.8 Å²	142.8	91%	0.906	79%	0.791	S	S	*	*			trans	-70	97.6	167.2	-112.4	-178.4	175.8	179.3	-1.4	106.7	P203 T207	P203-R205 PolarHBondContact O-N 3.13Å; R205-T207 PolarHBondContact O-N 3Å; R205-T207 VanDerWaalsContact O-N 3.13Å
206	T	51.9	Low	51.3	Low	125 Å²	125	144.3 Å²	144.3	77%	0.767	79%	0.793	S	S	*	*			trans	-68.7	103.8	165	40.5	0	0	0	0	107.8	V204 S208	V204-T206 HydrophobicContact CG1-CG2 4.37Å; V204-T206 PolarHBondContact O-N 3.03Å; T206-S208 PolarHBondContact O-N 3.07Å
207	T	54.8	Low	51.8	Low	131 Å²	131	139.6 Å²	139.6	80%	0.804	79%	0.787	S	S	*	*			trans	-71.9	100.7	162.8	43.7	0	0	0	0	107.4	R205	R205-T207 PolarHBondContact O-N 3Å; R205-T207 VanDerWaalsContact O-N 3.13Å
208	S	56.7	Low	52.2	Low	106 Å²	106	140.1 Å²	140.1	74%	0.741	79%	0.787	S	S	*	*			trans	-70.9	128.1	161.5	57.4	0	0	0	0	108	T206 S210	T206-S208 PolarHBondContact O-N 3.07Å; S208-S210 PolarHBondContact O-N 2.97Å
209	P	49.6	Very low	52.5	Low	118 Å²	118	143.5 Å²	143.5	77%	0.766	79%	0.792	S	S	*	*			trans	-70.2	121.9	166.5	25.8	-27.6	0	0	0	108.1	M211	P209-M211 VanDerWaalsContact C-N 3.33Å; P209-M211 PolarHBondContact O-N 3.35Å
210	S	53	Low	52.7	Low	102 Å²	102	148.6 Å²	148.6	71%	0.713	81%	0.808	S	S	*	*			trans	-68.8	93.2	167.2	57.2	0	0	0	0	108.2	S208 N212	S208-S210 PolarHBondContact O-N 2.97Å; S210-N212 PolarHBondContact O-N 3.18Å; S210-N212 VanDerWaalsContact O-N 3.07Å
211	M	53.7	Low	53	Low	139 Å²	139	144.6 Å²	144.6	69%	0.685	80%	0.802	S	S	*	*			trans	-69.8	99.6	163.3	-99	-172.2	160.3	0	0	108	P209 Y213	P209-M211 VanDerWaalsContact C-N 3.33Å; P209-M211 PolarHBondContact O-N 3.35Å; M211-Y213 HydrophobicContact CB-CD2 4.2Å; M211-Y213 HydrophobicContact CB-CE2 3.8Å; M211-Y213 HydrophobicContact CG-CE2 4.21Å; M211-Y213 PolarHBondContact O-N 3.4Å; M211-Y213 HydrophobicContact SD-CE2 3.61Å; M211-Y213 PolarHBondContact SD-OH 3.01Å
212	N	48.4	Very low	53	Low	144 Å²	144	141.2 Å²	141.2	77%	0.77	80%	0.8	S	S	*	*			trans	-73.3	110.2	159.1	-74.1	-61.9	0	0	0	107	S210	S210-N212 PolarHBondContact O-N 3.18Å; S210-N212 VanDerWaalsContact O-N 3.07Å
213	Y	52.8	Low	52.5	Low	188 Å²	188	146.3 Å²	146.3	74%	0.737	81%	0.812	S	S	*	*			trans	-90.1	123.1	158.6	-69.9	-81.8	0	0	0	107.1	M211	M211-Y213 HydrophobicContact CB-CD2 4.2Å; M211-Y213 HydrophobicContact CB-CE2 3.8Å; M211-Y213 HydrophobicContact CG-CE2 4.21Å; M211-Y213 PolarHBondContact O-N 3.4Å; M211-Y213 HydrophobicContact SD-CE2 3.61Å; M211-Y213 PolarHBondContact SD-OH 3.01Å
214	V	45.3	Very low	52	Low	213 Å²	213	148.5 Å²	148.5	100%	1.291	81%	0.814	S	S	*	*			trans	-64.9	0	171.4	178.2	0	0	0	0	109.9

Retrieved 214 of 214 residues in 271.7 ms (Link to these results)

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