A0A2K5KY80_CERAT Loading...

Claudin

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

AlphaFold DB , UniProt , Accession A0A2K5KY80, Species CERAT (Cercocebus atys, Sooty mangabey), Gene CLDN4, Length 209 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	50.6	Low	80.3	Confident	157 Å²	157	60.5 Å²	60.5	77%	0.773	36%	0.359	S	S	*	.				0	128.5	0	-76.6	-173.6	-84.5	0	0	108
2	A	57.8	Low	81.5	Confident	22 Å²	22	59.5 Å²	59.5	18%	0.182	36%	0.363	C	S	.	.			trans	-65.7	156	174.4	0	0	0	0	0	111.4	L6 K103 N184	A2-L6 HydrophobicContact CB-CB 4.41Å; A2-L6 HydrophobicContact CB-CD2 3.86Å; A2-K103 PolarHBondContact O-NZ 2.99Å; A2-N184 WeakPolarHBondContact CB-OD1 3.48Å
3	S	72.6	Confident	82.6	Confident	81 Å²	81	58.2 Å²	58.2	57%	0.566	35%	0.352	S	S	*	.			trans	-58.7	145.3	177.4	69.6	0	0	0	0	110.5	G5 L6 Q7	S3-G5 PolarHBondContact O-N 2.99Å; S3-L6 PolarHBondContact O-N 3.15Å; S3-L6 VanDerWaalsContact O-N 3.09Å; S3-L6 PolarHBondContact OG-N 2.88Å; S3-Q7 PolarHBondContact O-N 3.07Å
4	M	78.5	Confident	83.5	Confident	105 Å²	105	54 Å²	54	52%	0.517	33%	0.326	S	S	.	.	H	α-helix	trans	-53.4	-34.9	174.1	-175	176.5	-177	0	0	111.5	Q7 V8 K103	M4-Q7 PolarHBondContact O-N 3.38Å; M4-V8 HydrophobicContact CG-CG2 4.39Å; M4-V8 VanDerWaalsContact O-CG2 3.31Å; M4-V8 WeakPolarHBondContact O-CG2 3.3Å; M4-V8 PolarHBondContact O-N 3.12Å; M4-K103 HydrophobicContact CG-CD 4.47Å
5	G	82.9	Confident	84.3	Confident	43 Å²	43	53.5 Å²	53.5	44%	0.443	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-44	175.4	0	0	0	0	0	113.7	S3 Q7 V8 T9	S3-G5 PolarHBondContact O-N 2.99Å; G5-Q7 VanDerWaalsContact C-N 3.34Å; G5-Q7 PolarHBondContact O-N 3.24Å; G5-V8 PolarHBondContact O-N 3.21Å; G5-T9 WeakPolarHBondContact O-CB 3.46Å; G5-T9 PolarHBondContact O-N 2.87Å; G5-T9 PolarHBondContact O-OG1 3.12Å
6	L	85.9	Confident	85.2	Confident	54 Å²	54	56.2 Å²	56.2	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-42.4	-180	-169.1	68.9	0	0	0	111.9	A2 S3 G10 L180	A2-L6 HydrophobicContact CB-CB 4.41Å; A2-L6 HydrophobicContact CB-CD2 3.86Å; S3-L6 PolarHBondContact O-N 3.15Å; S3-L6 VanDerWaalsContact O-N 3.09Å; S3-L6 PolarHBondContact OG-N 2.88Å; L6-G10 PolarHBondContact O-N 3.31Å; L6-L180 HydrophobicContact CD1-CB 4.41Å; L6-L180 HydrophobicContact CD1-CD2 3.63Å; L6-L180 HydrophobicContact CD1-CG 4.45Å
7	Q	87.2	Confident	85.8	Confident	9 Å²	9	52.9 Å²	52.9	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-44.9	179.1	-173.9	178.1	-0.2	0	0	111.6	S3 M4 G5 G10 I11 G101 K103 M118 L181	S3-Q7 PolarHBondContact O-N 3.07Å; M4-Q7 PolarHBondContact O-N 3.38Å; G5-Q7 VanDerWaalsContact C-N 3.34Å; G5-Q7 PolarHBondContact O-N 3.24Å; Q7-G10 PolarHBondContact O-N 3.36Å; Q7-I11 HydrophobicContact CG-CD1 4.11Å; Q7-I11 VanDerWaalsContact O-CG1 3.3Å; Q7-I11 WeakPolarHBondContact O-CG1 3.42Å; Q7-I11 PolarHBondContact O-N 3.32Å; Q7-G101 PolarHBondContact NE2-O 3.17Å; Q7-K103 VanDerWaalsContact OE1-CD 3.31Å; Q7-M118 HydrophobicContact CG-CE 4.14Å; Q7-L181 HydrophobicContact CG-CD2 4.22Å
8	V	90	Very high	86.5	Confident	78 Å²	78	53.1 Å²	53.1	47%	0.473	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-44.9	178.4	172.3	0	0	0	0	110.8	M4 G5 G10 I11 A12	M4-V8 HydrophobicContact CG-CG2 4.39Å; M4-V8 VanDerWaalsContact O-CG2 3.31Å; M4-V8 WeakPolarHBondContact O-CG2 3.3Å; M4-V8 PolarHBondContact O-N 3.12Å; G5-V8 PolarHBondContact O-N 3.21Å; V8-G10 PolarHBondContact O-N 3.25Å; V8-I11 PolarHBondContact O-N 3Å; V8-A12 WeakPolarHBondContact O-CB 3.49Å; V8-A12 PolarHBondContact O-N 3.1Å
9	T	91.8	Very high	87.1	Confident	74 Å²	74	54.9 Å²	54.9	45%	0.454	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.2	-56.9	0	0	0	0	111.5	G5 I11 A12 L13	G5-T9 WeakPolarHBondContact O-CB 3.46Å; G5-T9 PolarHBondContact O-N 2.87Å; G5-T9 PolarHBondContact O-OG1 3.12Å; T9-I11 PolarHBondContact O-N 3.5Å; T9-A12 PolarHBondContact O-N 2.93Å; T9-L13 HydrophobicContact CG2-CD1 4Å; T9-L13 HydrophobicContact CG2-CG 4.37Å; T9-L13 WeakPolarHBondContact O-CB 3.14Å; T9-L13 VanDerWaalsContact O-CG 3.3Å; T9-L13 WeakPolarHBondContact O-CG 3.45Å; T9-L13 PolarHBondContact O-N 3.09Å
10	G	92.8	Very high	87.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-45.6	176.3	0	0	0	0	0	112.8	L6 Q7 V8 A14 G177	L6-G10 PolarHBondContact O-N 3.31Å; Q7-G10 PolarHBondContact O-N 3.36Å; V8-G10 PolarHBondContact O-N 3.25Å; G10-A14 WeakPolarHBondContact O-CB 3.38Å; G10-A14 PolarHBondContact O-N 3.24Å; G10-G177 WeakPolarHBondContact O-CA 3.41Å
11	I	92.8	Very high	88	Confident	43 Å²	43	50.6 Å²	50.6	22%	0.221	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-46.1	175.7	-65	170.1	0	0	0	110.6	Q7 V8 T9 L13 A14 V15 M118 L181	Q7-I11 HydrophobicContact CG-CD1 4.11Å; Q7-I11 VanDerWaalsContact O-CG1 3.3Å; Q7-I11 WeakPolarHBondContact O-CG1 3.42Å; Q7-I11 PolarHBondContact O-N 3.32Å; V8-I11 PolarHBondContact O-N 3Å; T9-I11 PolarHBondContact O-N 3.5Å; I11-L13 PolarHBondContact O-N 3.27Å; I11-A14 PolarHBondContact O-N 2.81Å; I11-V15 HydrophobicContact CG2-CG2 4.2Å; I11-V15 WeakPolarHBondContact O-CG2 3.04Å; I11-V15 PolarHBondContact O-N 2.71Å; I11-M118 HydrophobicContact CD1-CE 3.96Å; I11-M118 HydrophobicContact CG1-CE 4.02Å; I11-L181 HydrophobicContact CG1-CD1 4.44Å; I11-L181 HydrophobicContact CG1-CD2 4.11Å
12	A	94.8	Very high	90.1	Very high	48 Å²	48	46.2 Å²	46.2	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-60.2	-45.7	-179.6	0	0	0	0	0	111.8	V8 T9 V15 L16	V8-A12 WeakPolarHBondContact O-CB 3.49Å; V8-A12 PolarHBondContact O-N 3.1Å; T9-A12 PolarHBondContact O-N 2.93Å; A12-V15 PolarHBondContact O-N 3.19Å; A12-L16 WeakPolarHBondContact O-CB 3.31Å; A12-L16 VanDerWaalsContact O-CG 3.32Å; A12-L16 WeakPolarHBondContact O-CG 3.41Å; A12-L16 PolarHBondContact O-N 3.22Å
13	L	96	Very high	92	Very high	42 Å²	42	49.4 Å²	49.4	22%	0.22	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-42.4	176	-70	171.9	0	0	0	111.9	T9 I11 L16 G17 L173 L180	T9-L13 HydrophobicContact CG2-CD1 4Å; T9-L13 HydrophobicContact CG2-CG 4.37Å; T9-L13 WeakPolarHBondContact O-CB 3.14Å; T9-L13 VanDerWaalsContact O-CG 3.3Å; T9-L13 WeakPolarHBondContact O-CG 3.45Å; T9-L13 PolarHBondContact O-N 3.09Å; I11-L13 PolarHBondContact O-N 3.27Å; L13-L16 PolarHBondContact O-N 3.12Å; L13-G17 PolarHBondContact O-N 3.26Å; L13-L173 HydrophobicContact CD2-CD2 3.68Å; L13-L180 HydrophobicContact CD1-CD1 3.72Å
14	A	95.4	Very high	93	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-40.1	178.8	0	0	0	0	0	112.4	G10 I11 G17 W18 F125 L174	G10-A14 WeakPolarHBondContact O-CB 3.38Å; G10-A14 PolarHBondContact O-N 3.24Å; I11-A14 PolarHBondContact O-N 2.81Å; A14-G17 PolarHBondContact O-N 3.31Å; A14-W18 WeakPolarHBondContact O-CB 3.45Å; A14-W18 PolarHBondContact O-N 2.65Å; A14-F125 HydrophobicContact CB-CD1 4.01Å; A14-F125 HydrophobicContact CB-CD2 3.72Å; A14-F125 HydrophobicContact CB-CE1 3.88Å; A14-F125 HydrophobicContact CB-CE2 3.56Å; A14-F125 HydrophobicContact CB-CG 3.93Å; A14-F125 HydrophobicContact CB-CZ 3.64Å; A14-L174 WeakPolarHBondContact O-CD2 3.24Å
15	V	96.1	Very high	93.8	Very high	46 Å²	46	41 Å²	41	28%	0.279	24%	0.239	S	C	.	.	H	α-helix	trans	-67	-45.2	175.8	172.6	0	0	0	0	111	I11 A12 G17 W18 L19 V95	I11-V15 HydrophobicContact CG2-CG2 4.2Å; I11-V15 WeakPolarHBondContact O-CG2 3.04Å; I11-V15 PolarHBondContact O-N 2.71Å; A12-V15 PolarHBondContact O-N 3.19Å; V15-G17 VanDerWaalsContact C-N 3.31Å; V15-G17 PolarHBondContact O-N 3.29Å; V15-W18 PolarHBondContact O-N 3.41Å; V15-L19 HydrophobicContact CG1-CD1 4.44Å; V15-L19 WeakPolarHBondContact O-CG 3.45Å; V15-L19 PolarHBondContact O-N 3.46Å; V15-V95 HydrophobicContact CG2-CG2 4.28Å
16	L	97.4	Very high	94.2	Very high	97 Å²	97	42 Å²	42	51%	0.508	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-42.4	174.7	-73.7	173.3	0	0	0	111.6	A12 L13 L19 A20 L173	A12-L16 WeakPolarHBondContact O-CB 3.31Å; A12-L16 VanDerWaalsContact O-CG 3.32Å; A12-L16 WeakPolarHBondContact O-CG 3.41Å; A12-L16 PolarHBondContact O-N 3.22Å; L13-L16 PolarHBondContact O-N 3.12Å; L16-L19 PolarHBondContact O-N 2.88Å; L16-A20 WeakPolarHBondContact O-CB 3.26Å; L16-A20 PolarHBondContact O-N 3.49Å; L16-L173 HydrophobicContact CB-CD1 4.43Å
17	G	96.9	Very high	94.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.8	-48.5	173.3	0	0	0	0	0	111.6	L13 A14 V15 L19 A20 V21	L13-G17 PolarHBondContact O-N 3.26Å; A14-G17 PolarHBondContact O-N 3.31Å; V15-G17 VanDerWaalsContact C-N 3.31Å; V15-G17 PolarHBondContact O-N 3.29Å; G17-L19 PolarHBondContact O-N 3.07Å; G17-A20 WeakPolarHBondContact O-CB 3.37Å; G17-A20 PolarHBondContact O-N 3.36Å; G17-A20 VanDerWaalsContact O-N 3.16Å; G17-V21 WeakPolarHBondContact O-CG2 3.38Å; G17-V21 PolarHBondContact O-N 3.18Å
18	W	97.6	Very high	94.7	Very high	56 Å²	56	42.5 Å²	42.5	21%	0.212	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-44.8	177.6	178.4	55.9	0	0	0	113.2	A14 V15 A20 V21 M22 I88 A91 A92 V95	A14-W18 WeakPolarHBondContact O-CB 3.45Å; A14-W18 PolarHBondContact O-N 2.65Å; V15-W18 PolarHBondContact O-N 3.41Å; W18-A20 VanDerWaalsContact C-N 3.32Å; W18-A20 PolarHBondContact O-N 3.37Å; W18-V21 PolarHBondContact O-N 3.04Å; W18-M22 HydrophobicContact CD2-CE 3.9Å; W18-M22 HydrophobicContact CE3-CE 3.95Å; W18-M22 HydrophobicContact CH2-CE 3.96Å; W18-M22 HydrophobicContact CZ2-CE 3.9Å; W18-M22 HydrophobicContact CZ2-SD 4.09Å; W18-M22 HydrophobicContact CZ3-CE 3.98Å; W18-M22 PolarHBondContact O-N 2.95Å; W18-M22 VanDerWaalsContact O-N 3.12Å; W18-I88 PolarHBondContact NE1-O 3.35Å; W18-I88 VanDerWaalsContact NE1-O 3.17Å; W18-A91 HydrophobicContact CB-CB 4.34Å; W18-A91 HydrophobicContact CG-CB 4.06Å; W18-A92 HydrophobicContact CZ2-CB 3.89Å; W18-V95 HydrophobicContact CD2-CG2 4.23Å; W18-V95 HydrophobicContact CE3-CG2 4.09Å
19	L	97.3	Very high	94.8	Very high	88 Å²	88	41 Å²	41	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-41.5	174	-66.7	179.3	0	0	0	111.6	V15 L16 G17 V21 M22 L23	V15-L19 HydrophobicContact CG1-CD1 4.44Å; V15-L19 WeakPolarHBondContact O-CG 3.45Å; V15-L19 PolarHBondContact O-N 3.46Å; L16-L19 PolarHBondContact O-N 2.88Å; G17-L19 PolarHBondContact O-N 3.07Å; L19-V21 PolarHBondContact O-N 3.35Å; L19-M22 HydrophobicContact CD2-CE 3.44Å; L19-M22 VanDerWaalsContact CD2-CE 3.44Å; L19-M22 HydrophobicContact CG-CE 4.47Å; L19-M22 PolarHBondContact O-N 3.09Å; L19-L23 PolarHBondContact O-N 3.44Å
20	A	96.8	Very high	94.8	Very high	19 Å²	19	37.7 Å²	37.7	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-33.8	177.6	0	0	0	0	0	112.5	L16 G17 W18 L23 C24 V166 A170	L16-A20 WeakPolarHBondContact O-CB 3.26Å; L16-A20 PolarHBondContact O-N 3.49Å; G17-A20 WeakPolarHBondContact O-CB 3.37Å; G17-A20 PolarHBondContact O-N 3.36Å; G17-A20 VanDerWaalsContact O-N 3.16Å; W18-A20 VanDerWaalsContact C-N 3.32Å; W18-A20 PolarHBondContact O-N 3.37Å; A20-L23 PolarHBondContact O-N 3.43Å; A20-C24 WeakPolarHBondContact O-CB 3.32Å; A20-C24 PolarHBondContact O-N 3.25Å; A20-V166 HydrophobicContact CB-CG1 4.42Å; A20-A170 HydrophobicContact CB-CB 3.56Å
21	V	96.5	Very high	94.7	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-43	171.6	-180	0	0	0	0	110.9	G17 W18 L19 L23 C24 C25 V84 I88 V132 A170 L174	G17-V21 WeakPolarHBondContact O-CG2 3.38Å; G17-V21 PolarHBondContact O-N 3.18Å; W18-V21 PolarHBondContact O-N 3.04Å; L19-V21 PolarHBondContact O-N 3.35Å; V21-L23 VanDerWaalsContact C-N 3.31Å; V21-L23 PolarHBondContact O-N 3.26Å; V21-C24 PolarHBondContact O-N 3.14Å; V21-C25 WeakPolarHBondContact O-CB 3.3Å; V21-C25 PolarHBondContact O-N 3.26Å; V21-V84 HydrophobicContact CG1-CG1 4.09Å; V21-I88 HydrophobicContact CB-CG1 4.47Å; V21-I88 HydrophobicContact CG1-CD1 4.26Å; V21-I88 HydrophobicContact CG1-CG1 3.63Å; V21-V132 HydrophobicContact CB-CG2 4.47Å; V21-V132 HydrophobicContact CG1-CG2 3.79Å; V21-V132 HydrophobicContact CG2-CG1 4.35Å; V21-V132 HydrophobicContact CG2-CG2 3.7Å; V21-A170 HydrophobicContact CG2-CB 3.71Å; V21-L174 HydrophobicContact CG2-CD1 3.59Å
22	M	96	Very high	94.5	Very high	64 Å²	64	37 Å²	37	32%	0.315	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-41.7	175.6	-71	-169.4	-73.2	0	0	111.6	W18 L19 C25 A26 I88	W18-M22 HydrophobicContact CD2-CE 3.9Å; W18-M22 HydrophobicContact CE3-CE 3.95Å; W18-M22 HydrophobicContact CH2-CE 3.96Å; W18-M22 HydrophobicContact CZ2-CE 3.9Å; W18-M22 HydrophobicContact CZ2-SD 4.09Å; W18-M22 HydrophobicContact CZ3-CE 3.98Å; W18-M22 PolarHBondContact O-N 2.95Å; W18-M22 VanDerWaalsContact O-N 3.12Å; L19-M22 HydrophobicContact CD2-CE 3.44Å; L19-M22 VanDerWaalsContact CD2-CE 3.44Å; L19-M22 HydrophobicContact CG-CE 4.47Å; L19-M22 PolarHBondContact O-N 3.09Å; M22-C25 PolarHBondContact O-N 2.74Å; M22-A26 WeakPolarHBondContact O-CB 3.45Å; M22-A26 PolarHBondContact O-N 2.97Å; M22-I88 HydrophobicContact CG-CD1 4.23Å; M22-I88 HydrophobicContact CG-CG1 4.27Å; M22-I88 HydrophobicContact CG-CG2 4.09Å; M22-I88 HydrophobicContact SD-CG2 4.49Å
23	L	95.9	Very high	94.1	Very high	90 Å²	90	35.2 Å²	35.2	47%	0.471	20%	0.195	S	C	.	.	H	α-helix	trans	-62.5	-47.2	174.7	-177.4	64.2	0	0	0	111.8	L19 A20 V21 C25 A26 L27 V166	L19-L23 PolarHBondContact O-N 3.44Å; A20-L23 PolarHBondContact O-N 3.43Å; V21-L23 VanDerWaalsContact C-N 3.31Å; V21-L23 PolarHBondContact O-N 3.26Å; L23-C25 VanDerWaalsContact C-N 3.27Å; L23-C25 PolarHBondContact O-N 2.62Å; L23-A26 PolarHBondContact O-N 3.29Å; L23-L27 HydrophobicContact CD1-CD1 3.97Å; L23-L27 HydrophobicContact CD1-CD2 4.28Å; L23-L27 HydrophobicContact CD1-CG 3.92Å; L23-L27 HydrophobicContact CD2-CD1 4.47Å; L23-L27 HydrophobicContact CG-CD1 3.83Å; L23-L27 HydrophobicContact CG-CG 4.2Å; L23-L27 WeakPolarHBondContact O-CB 3.47Å; L23-L27 VanDerWaalsContact O-CG 3.29Å; L23-L27 WeakPolarHBondContact O-CG 3.47Å; L23-L27 PolarHBondContact O-N 3.19Å; L23-V166 HydrophobicContact CD2-CG1 4.36Å
24	C	94.9	Very high	93.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.3	-41.5	175.5	176.4	0	0	0	0	111.9	A20 V21 W30 S163 V166	A20-C24 WeakPolarHBondContact O-CB 3.32Å; A20-C24 PolarHBondContact O-N 3.25Å; V21-C24 PolarHBondContact O-N 3.14Å; C24-W30 PolarHBondContact O-NE1 3.23Å; C24-S163 PolarHBondContact SG-O 3.14Å; C24-V166 HydrophobicContact CB-CB 4.43Å; C24-V166 HydrophobicContact CB-CG1 4.09Å
25	C	94.1	Very high	92.4	Very high	10 Å²	10	36.9 Å²	36.9	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-40.3	177.5	-170.7	0	0	0	0	112.8	V21 M22 L23 W51 V84 I88	V21-C25 WeakPolarHBondContact O-CB 3.3Å; V21-C25 PolarHBondContact O-N 3.26Å; M22-C25 PolarHBondContact O-N 2.74Å; L23-C25 VanDerWaalsContact C-N 3.27Å; L23-C25 PolarHBondContact O-N 2.62Å; C25-W51 PolarHBondContact O-NE1 3.47Å; C25-W51 PolarHBondContact SG-NE1 3.41Å; C25-W51 VanDerWaalsContact SG-NE1 3.37Å; C25-V84 HydrophobicContact CB-CG1 3.68Å; C25-I88 HydrophobicContact CB-CD1 3.91Å
26	A	92.5	Very high	90.9	Very high	64 Å²	64	41 Å²	41	53%	0.529	22%	0.223	S	C	.	.	H	α-helix	trans	-77.7	-32.8	-176.4	0	0	0	0	0	113.4	M22 L23	M22-A26 WeakPolarHBondContact O-CB 3.45Å; M22-A26 PolarHBondContact O-N 2.97Å; L23-A26 PolarHBondContact O-N 3.29Å
27	L	92.1	Very high	89.2	Confident	44 Å²	44	38.4 Å²	38.4	23%	0.23	22%	0.22	C	C	.	.			trans	-69.4	132	-176	-74.5	175.8	0	0	0	112.1	L23 M29	L23-L27 HydrophobicContact CD1-CD1 3.97Å; L23-L27 HydrophobicContact CD1-CD2 4.28Å; L23-L27 HydrophobicContact CD1-CG 3.92Å; L23-L27 HydrophobicContact CD2-CD1 4.47Å; L23-L27 HydrophobicContact CG-CD1 3.83Å; L23-L27 HydrophobicContact CG-CG 4.2Å; L23-L27 WeakPolarHBondContact O-CB 3.47Å; L23-L27 VanDerWaalsContact O-CG 3.29Å; L23-L27 WeakPolarHBondContact O-CG 3.47Å; L23-L27 PolarHBondContact O-N 3.19Å; L27-M29 HydrophobicContact CB-CE 4.39Å; L27-M29 HydrophobicContact CD1-CE 3.92Å; L27-M29 HydrophobicContact CD2-CE 4.02Å; L27-M29 HydrophobicContact CG-CE 4.33Å; L27-M29 PolarHBondContact O-N 3.47Å
28	P	91.3	Very high	87.3	Confident	29 Å²	29	44.4 Å²	44.4	19%	0.188	26%	0.262	C	S	.	.	S	Bend	trans	-83.3	34.1	-179	36	-37.1	0	0	0	113.4	W47 E48 G49 M52	P28-W47 CarbonylContact O-C 3.58Å; P28-W47 WeakPolarHBondContact O-CB 3.21Å; P28-E48 CarbonylContact O-C 3.02Å; P28-G49 VanDerWaalsContact CA-CA 3.41Å; P28-G49 PolarHBondContact O-N 3.38Å; P28-M52 HydrophobicContact CB-CG 3.62Å; P28-M52 HydrophobicContact CB-SD 4.29Å; P28-M52 HydrophobicContact CG-CG 4.35Å; P28-M52 HydrophobicContact CG-SD 4.4Å
29	M	91.6	Very high	85.4	Confident	47 Å²	47	47 Å²	47	23%	0.232	28%	0.28	C	S	.	.			trans	-124.3	47.8	-169.6	-54.2	-168.2	-76.4	0	0	111.5	L27 W47 G161 A162 S163	L27-M29 HydrophobicContact CB-CE 4.39Å; L27-M29 HydrophobicContact CD1-CE 3.92Å; L27-M29 HydrophobicContact CD2-CE 4.02Å; L27-M29 HydrophobicContact CG-CE 4.33Å; L27-M29 PolarHBondContact O-N 3.47Å; M29-W47 HydrophobicContact CB-CE3 3.98Å; M29-W47 HydrophobicContact CB-CZ3 4.3Å; M29-W47 HydrophobicContact CG-CE3 3.53Å; M29-W47 HydrophobicContact CG-CZ3 3.86Å; M29-W47 HydrophobicContact SD-CE3 3.76Å; M29-W47 HydrophobicContact SD-CH2 4.37Å; M29-W47 HydrophobicContact SD-CZ3 3.43Å; M29-W47 WeakPolarHBondContact SD-CZ3 3.43Å; M29-G161 CarbonylContact O-C 3.53Å; M29-G161 WeakPolarHBondContact O-CA 3.27Å; M29-A162 HydrophobicContact CB-CB 4.3Å; M29-A162 HydrophobicContact CE-CB 3.87Å; M29-A162 PolarHBondContact O-N 3.04Å; M29-A162 VanDerWaalsContact O-N 3.12Å; M29-A162 HydrophobicContact SD-CB 4.13Å; M29-S163 VanDerWaalsContact C-OG 3.22Å; M29-S163 WeakPolarHBondContact O-CB 3.39Å; M29-S163 PolarHBondContact O-N 3.41Å; M29-S163 PolarHBondContact O-OG 3.33Å
30	W	92.5	Very high	83.4	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.015	29%	0.293	C	S	.	.	S	Bend	trans	-83.7	-42	177.7	-83.6	67.3	0	0	0	111.9	C24 E48 L50 A80 V84 V136 T139 G161 S163 L164	C24-W30 PolarHBondContact O-NE1 3.23Å; W30-E48 WeakPolarHBondContact CA-O 3.27Å; W30-E48 WeakPolarHBondContact CB-O 3.44Å; W30-E48 PolarHBondContact N-O 2.88Å; W30-L50 HydrophobicContact CD2-CD1 3.86Å; W30-L50 HydrophobicContact CE3-CD1 4.11Å; W30-L50 HydrophobicContact CG-CD1 4.35Å; W30-L50 HydrophobicContact CH2-CD1 4.34Å; W30-L50 HydrophobicContact CZ2-CD1 4.1Å; W30-L50 HydrophobicContact CZ2-CD2 4.04Å; W30-L50 HydrophobicContact CZ3-CD1 4.34Å; W30-A80 HydrophobicContact CH2-CB 4.38Å; W30-A80 HydrophobicContact CZ3-CB 4Å; W30-V84 HydrophobicContact CH2-CG2 3.78Å; W30-V84 HydrophobicContact CZ2-CG2 4.08Å; W30-V136 HydrophobicContact CH2-CG2 4.03Å; W30-V136 HydrophobicContact CZ3-CG2 4.38Å; W30-T139 HydrophobicContact CE3-CG2 4.28Å; W30-T139 HydrophobicContact CZ3-CG2 4.22Å; W30-G161 PolarHBondContact O-N 2.98Å; W30-S163 WeakPolarHBondContact CA-OG 3.48Å; W30-S163 PolarHBondContact N-OG 3.49Å; W30-S163 PolarHBondContact NE1-OG 2.86Å; W30-L164 HydrophobicContact CD2-CD2 4.36Å; W30-L164 HydrophobicContact CE3-CD2 3.73Å; W30-L164 HydrophobicContact CZ3-CD2 4.07Å; W30-L164 WeakPolarHBondContact O-CD1 3.39Å; W30-L164 WeakPolarHBondContact O-CG 3.47Å
31	R	89.2	Confident	81.6	Confident	15 Å²	15	55.1 Å²	55.1	6%	0.057	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.2	176.3	-169.6	167.7	71.7	-167.5	-1.6	109.3	E48 I143 R158	R31-E48 HydrophobicContact CB-CB 4.29Å; R31-E48 IonicContact CZ-OE2 3.08Å; R31-E48 PolarHBondContact N-O 2.95Å; R31-E48 IonicContact NE-OE2 2.85Å; R31-E48 PolarHBondContact NE-OE2 2.98Å; R31-E48 IonicContact NH2-OE1 2.66Å; R31-E48 PolarHBondContact NH2-OE1 3.16Å; R31-E48 IonicContact NH2-OE2 2.71Å; R31-E48 PolarHBondContact NH2-OE2 2.84Å; R31-E48 PolarHBondContact O-N 2.95Å; R31-I143 HydrophobicContact CB-CD1 4.25Å; R31-I143 HydrophobicContact CG-CD1 3.92Å; R31-I143 HydrophobicContact CG-CG1 4.08Å; R31-R158 HydrophobicContact CG-CB 4.17Å; R31-R158 HydrophobicContact CG-CG 4.11Å; R31-R158 VanDerWaalsContact CZ-CZ 3.43Å; R31-R158 VanDerWaalsContact NH1-NH1 3.15Å
32	V	89.7	Confident	80.1	Confident	13 Å²	13	59.2 Å²	59.2	8%	0.079	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134.6	176.7	-179.2	0	0	0	0	107.8	T45 I46 W47 R158 E159	V32-T45 HydrophobicContact CG1-CG2 3.97Å; V32-I46 WeakPolarHBondContact CA-O 3.28Å; V32-W47 HydrophobicContact CG2-CD2 4.23Å; V32-W47 HydrophobicContact CG2-CE3 3.69Å; V32-W47 HydrophobicContact CG2-CZ3 4.02Å; V32-R158 CarbonylContact O-C 3.41Å; V32-R158 WeakPolarHBondContact O-CA 3.5Å; V32-E159 HydrophobicContact CB-CB 4.33Å; V32-E159 PolarHBondContact N-O 2.97Å; V32-E159 PolarHBondContact O-N 3.44Å
33	T	85.4	Confident	78.8	Confident	10 Å²	10	57.8 Å²	57.8	6%	0.061	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124	172.2	49.8	0	0	0	0	108.4	T45 I46 R158	T33-T45 WeakPolarHBondContact O-CA 3.36Å; T33-I46 PolarHBondContact N-O 3.06Å; T33-I46 PolarHBondContact O-N 3.46Å; T33-I46 WeakPolarHBondContact OG1-CB 3.25Å; T33-I46 PolarHBondContact OG1-O 3.49Å; T33-R158 HydrophobicContact CG2-CB 4.24Å; T33-R158 HydrophobicContact CG2-CG 3.39Å
34	A	80.9	Confident	78.1	Confident	21 Å²	21	56.9 Å²	56.9	17%	0.174	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107.9	176.4	0	0	0	0	0	108.6	I36	A34-I36 HydrophobicContact CB-CD1 3.64Å; A34-I36 HydrophobicContact CB-CG1 4.18Å; A34-I36 PolarHBondContact O-N 2.66Å
35	F	74.6	Confident	77.7	Confident	57 Å²	57	59.3 Å²	59.3	25%	0.25	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	90	174.3	-71.4	-94.1	0	0	0	109	S43 Q44 I46 G155 Q156	F35-S43 WeakPolarHBondContact O-CA 3.41Å; F35-Q44 HydrophobicContact CB-CG 3.9Å; F35-Q44 HydrophobicContact CD2-CG 3.96Å; F35-Q44 HydrophobicContact CG-CG 4.17Å; F35-Q44 PolarHBondContact N-O 2.88Å; F35-Q44 PolarHBondContact O-N 3.44Å; F35-I46 HydrophobicContact CD2-CD1 3.98Å; F35-I46 HydrophobicContact CD2-CG1 4.16Å; F35-I46 HydrophobicContact CE2-CD1 3.48Å; F35-I46 VanDerWaalsContact CE2-CD1 3.48Å; F35-I46 HydrophobicContact CE2-CG1 4.03Å; F35-I46 HydrophobicContact CZ-CD1 4.41Å; F35-G155 WeakPolarHBondContact CA-O 3.32Å; F35-Q156 HydrophobicContact CD1-CG 4.21Å; F35-Q156 HydrophobicContact CE1-CG 3.68Å; F35-Q156 HydrophobicContact CZ-CG 4.47Å
36	I	64.6	Low	77.4	Confident	132 Å²	132	60.4 Å²	60.4	68%	0.677	36%	0.359	S	S	*	.			trans	-103.2	79.1	176	-52.7	133.1	0	0	0	107.6	A34	A34-I36 HydrophobicContact CB-CD1 3.64Å; A34-I36 HydrophobicContact CB-CG1 4.18Å; A34-I36 PolarHBondContact O-N 2.66Å
37	G	62.3	Low	77.3	Confident	43 Å²	43	61.2 Å²	61.2	44%	0.443	35%	0.348	S	S	.	.			trans	-81.6	167.6	169.8	0	0	0	0	0	111.9	N39	G37-N39 PolarHBondContact O-N 3.47Å; G37-N39 VanDerWaalsContact O-N 3.12Å
38	S	57	Low	77.2	Confident	125 Å²	125	60.7 Å²	60.7	87%	0.874	35%	0.345	S	S	*	.	S	Bend	trans	-63.1	-12.5	174.7	48.9	0	0	0	0	114.2
39	N	57.2	Low	77.2	Confident	111 Å²	111	59.3 Å²	59.3	59%	0.594	34%	0.336	S	S	*	.			trans	-101.8	113.1	173.1	-75.3	-45.6	0	0	0	110.8	G37 V41 T42	G37-N39 PolarHBondContact O-N 3.47Å; G37-N39 VanDerWaalsContact O-N 3.12Å; N39-V41 PolarHBondContact O-N 2.85Å; N39-T42 PolarHBondContact O-N 2.81Å; N39-T42 PolarHBondContact O-OG1 2.79Å
40	I	56.2	Low	77	Confident	141 Å²	141	57.1 Å²	57.1	72%	0.723	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-59.8	-31.2	180	-53.2	165.4	0	0	0	111.2	T42 S43 S58	I40-T42 VanDerWaalsContact C-N 3.25Å; I40-T42 PolarHBondContact O-N 2.88Å; I40-S43 WeakPolarHBondContact O-CB 3.2Å; I40-S43 PolarHBondContact O-N 3.18Å; I40-S43 PolarHBondContact O-OG 3.39Å; I40-S58 PolarHBondContact O-OG 2.96Å
41	V	59.3	Low	76.9	Confident	137 Å²	137	61.4 Å²	61.4	83%	0.83	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.1	-177.4	-178	0	0	0	0	113.3	N39	N39-V41 PolarHBondContact O-N 2.85Å
42	T	64	Low	76.9	Confident	87 Å²	87	63.7 Å²	63.7	53%	0.534	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-108.6	11.3	177.4	55.6	0	0	0	0	113.2	N39 I40 Q44	N39-T42 PolarHBondContact O-N 2.81Å; N39-T42 PolarHBondContact O-OG1 2.79Å; I40-T42 VanDerWaalsContact C-N 3.25Å; I40-T42 PolarHBondContact O-N 2.88Å; T42-Q44 PolarHBondContact O-N 3.46Å
43	S	69.1	Low	76.9	Confident	34 Å²	34	65.4 Å²	65.4	24%	0.238	36%	0.362	C	S	.	.			trans	-71.5	118.9	179.1	63.5	0	0	0	0	110.5	F35 I40 S58	F35-S43 WeakPolarHBondContact O-CA 3.41Å; I40-S43 WeakPolarHBondContact O-CB 3.2Å; I40-S43 PolarHBondContact O-N 3.18Å; I40-S43 PolarHBondContact O-OG 3.39Å; S43-S58 PolarHBondContact O-N 2.91Å; S43-S58 PolarHBondContact O-OG 3.46Å; S43-S58 WeakPolarHBondContact OG-CB 3.17Å; S43-S58 PolarHBondContact OG-OG 3.48Å
44	Q	80.8	Confident	77.2	Confident	71 Å²	71	65.6 Å²	65.6	33%	0.332	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	138.5	-178.4	59.3	-174.6	-39.7	0	0	110.6	F35 T42 I46 V55 V56	F35-Q44 HydrophobicContact CB-CG 3.9Å; F35-Q44 HydrophobicContact CD2-CG 3.96Å; F35-Q44 HydrophobicContact CG-CG 4.17Å; F35-Q44 PolarHBondContact N-O 2.88Å; F35-Q44 PolarHBondContact O-N 3.44Å; T42-Q44 PolarHBondContact O-N 3.46Å; Q44-I46 HydrophobicContact CG-CG1 4.46Å; Q44-V55 HydrophobicContact CB-CG2 4.01Å; Q44-V56 WeakPolarHBondContact CA-O 3.48Å
45	T	86.5	Confident	77.6	Confident	50 Å²	50	65.9 Å²	65.9	31%	0.307	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.9	172.9	-54.2	0	0	0	0	108.5	V32 T33 V55 V56	V32-T45 HydrophobicContact CG1-CG2 3.97Å; T33-T45 WeakPolarHBondContact O-CA 3.36Å; T45-V55 WeakPolarHBondContact O-CA 3.21Å; T45-V56 PolarHBondContact N-O 2.93Å; T45-V56 PolarHBondContact O-N 2.97Å
46	I	88.2	Confident	78.3	Confident	33 Å²	33	65.8 Å²	65.8	17%	0.169	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.6	-179.9	-47.4	-175.4	0	0	0	108.9	V32 T33 F35 Q44 E48 C54 V55	V32-I46 WeakPolarHBondContact CA-O 3.28Å; T33-I46 PolarHBondContact N-O 3.06Å; T33-I46 PolarHBondContact O-N 3.46Å; T33-I46 WeakPolarHBondContact OG1-CB 3.25Å; T33-I46 PolarHBondContact OG1-O 3.49Å; F35-I46 HydrophobicContact CD2-CD1 3.98Å; F35-I46 HydrophobicContact CD2-CG1 4.16Å; F35-I46 HydrophobicContact CE2-CD1 3.48Å; F35-I46 VanDerWaalsContact CE2-CD1 3.48Å; F35-I46 HydrophobicContact CE2-CG1 4.03Å; F35-I46 HydrophobicContact CZ-CD1 4.41Å; Q44-I46 HydrophobicContact CG-CG1 4.46Å; I46-E48 HydrophobicContact CG2-CG 4.08Å; I46-C54 CarbonylContact C-O 3.51Å; I46-C54 WeakPolarHBondContact CA-O 3.29Å; I46-V55 HydrophobicContact CG1-CG2 4.11Å
47	W	90.3	Very high	79.2	Confident	82 Å²	82	62.9 Å²	62.9	31%	0.311	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	111.7	174.6	-54.8	72	0	0	0	107.3	P28 M29 V32 N53 C54	P28-W47 CarbonylContact O-C 3.58Å; P28-W47 WeakPolarHBondContact O-CB 3.21Å; M29-W47 HydrophobicContact CB-CE3 3.98Å; M29-W47 HydrophobicContact CB-CZ3 4.3Å; M29-W47 HydrophobicContact CG-CE3 3.53Å; M29-W47 HydrophobicContact CG-CZ3 3.86Å; M29-W47 HydrophobicContact SD-CE3 3.76Å; M29-W47 HydrophobicContact SD-CH2 4.37Å; M29-W47 HydrophobicContact SD-CZ3 3.43Å; M29-W47 WeakPolarHBondContact SD-CZ3 3.43Å; V32-W47 HydrophobicContact CG2-CD2 4.23Å; V32-W47 HydrophobicContact CG2-CE3 3.69Å; V32-W47 HydrophobicContact CG2-CZ3 4.02Å; W47-N53 CarbonylContact O-C 3.5Å; W47-N53 VanDerWaalsContact O-CA 3.26Å; W47-N53 WeakPolarHBondContact O-CA 3.46Å; W47-C54 HydrophobicContact CB-CB 4.28Å; W47-C54 PolarHBondContact N-O 2.89Å; W47-C54 PolarHBondContact O-N 2.77Å
48	E	90	Very high	80	Confident	32 Å²	32	64.1 Å²	64.1	15%	0.15	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.3	177.9	-67.3	172.9	118	0	0	108.9	P28 W30 R31 I46 N53	P28-E48 CarbonylContact O-C 3.02Å; W30-E48 WeakPolarHBondContact CA-O 3.27Å; W30-E48 WeakPolarHBondContact CB-O 3.44Å; W30-E48 PolarHBondContact N-O 2.88Å; R31-E48 HydrophobicContact CB-CB 4.29Å; R31-E48 IonicContact CZ-OE2 3.08Å; R31-E48 PolarHBondContact N-O 2.95Å; R31-E48 IonicContact NE-OE2 2.85Å; R31-E48 PolarHBondContact NE-OE2 2.98Å; R31-E48 IonicContact NH2-OE1 2.66Å; R31-E48 PolarHBondContact NH2-OE1 3.16Å; R31-E48 IonicContact NH2-OE2 2.71Å; R31-E48 PolarHBondContact NH2-OE2 2.84Å; R31-E48 PolarHBondContact O-N 2.95Å; I46-E48 HydrophobicContact CG2-CG 4.08Å; E48-N53 HydrophobicContact CG-CB 4.48Å
49	G	91.1	Very high	81	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.342	C	S	.	.			trans	-96.8	179.5	172.1	0	0	0	0	0	113.3	P28 M52	P28-G49 VanDerWaalsContact CA-CA 3.41Å; P28-G49 PolarHBondContact O-N 3.38Å; G49-M52 WeakPolarHBondContact CA-O 3.37Å; G49-M52 PolarHBondContact N-O 2.78Å
50	L	88.4	Confident	82	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	34%	0.344	C	S	.	.	S	Bend	trans	-72.7	-32	171.7	-133.5	62.8	0	0	0	112	W30 A80 R81 V84	W30-L50 HydrophobicContact CD2-CD1 3.86Å; W30-L50 HydrophobicContact CE3-CD1 4.11Å; W30-L50 HydrophobicContact CG-CD1 4.35Å; W30-L50 HydrophobicContact CH2-CD1 4.34Å; W30-L50 HydrophobicContact CZ2-CD1 4.1Å; W30-L50 HydrophobicContact CZ2-CD2 4.04Å; W30-L50 HydrophobicContact CZ3-CD1 4.34Å; L50-A80 HydrophobicContact CD1-CB 4.17Å; L50-R81 HydrophobicContact CD1-CB 4.48Å; L50-R81 HydrophobicContact CD2-CB 4.04Å; L50-R81 HydrophobicContact CD2-CG 4.11Å; L50-R81 HydrophobicContact CG-CB 3.89Å; L50-R81 HydrophobicContact CG-CG 4.08Å; L50-R81 PolarHBondContact O-NE 3.05Å; L50-R81 PolarHBondContact O-NH2 2.99Å; L50-V84 HydrophobicContact CD2-CB 4.44Å
51	W	90	Very high	83.3	Confident	95 Å²	95	59.8 Å²	59.8	36%	0.36	34%	0.336	S	S	.	.	S	Bend	trans	-117.2	-28.6	-172.6	-59.1	100.2	0	0	0	115	C25 Y67 R81 I85	C25-W51 PolarHBondContact O-NE1 3.47Å; C25-W51 PolarHBondContact SG-NE1 3.41Å; C25-W51 VanDerWaalsContact SG-NE1 3.37Å; W51-Y67 VanDerWaalsContact C-CD2 3.5Å; W51-Y67 VanDerWaalsContact O-CD2 3.31Å; W51-Y67 WeakPolarHBondContact O-CD2 3.24Å; W51-Y67 PolarHBondContact O-N 2.77Å; W51-R81 HydrophobicContact CH2-CG 4.13Å; W51-R81 HydrophobicContact CZ2-CG 4.02Å; W51-I85 HydrophobicContact CH2-CD1 3.64Å; W51-I85 HydrophobicContact CZ2-CD1 3.7Å; W51-I85 HydrophobicContact CZ2-CG1 4.15Å
52	M	90.1	Very high	84.6	Confident	63 Å²	63	60.6 Å²	60.6	31%	0.31	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.9	-179.7	67.4	-177.6	75.8	0	0	109.3	P28 G49 C64 K65 V66	P28-M52 HydrophobicContact CB-CG 3.62Å; P28-M52 HydrophobicContact CB-SD 4.29Å; P28-M52 HydrophobicContact CG-CG 4.35Å; P28-M52 HydrophobicContact CG-SD 4.4Å; G49-M52 WeakPolarHBondContact CA-O 3.37Å; G49-M52 PolarHBondContact N-O 2.78Å; M52-C64 HydrophobicContact SD-CB 4.44Å; M52-K65 CarbonylContact C-O 3.6Å; M52-K65 VanDerWaalsContact CA-O 3.25Å; M52-K65 WeakPolarHBondContact CA-O 3.34Å; M52-K65 VanDerWaalsContact CB-O 3.29Å; M52-K65 WeakPolarHBondContact CB-O 3.45Å; M52-V66 HydrophobicContact CB-CG2 4.34Å
53	N	89.9	Confident	85.8	Confident	49 Å²	49	61.4 Å²	61.4	26%	0.262	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.2	166.3	62.5	-14.2	0	0	0	109.9	W47 E48 C64 K65 Y67	W47-N53 CarbonylContact O-C 3.5Å; W47-N53 VanDerWaalsContact O-CA 3.26Å; W47-N53 WeakPolarHBondContact O-CA 3.46Å; E48-N53 HydrophobicContact CG-CB 4.48Å; N53-C64 CarbonylContact O-C 3.59Å; N53-C64 VanDerWaalsContact O-CA 3.28Å; N53-C64 WeakPolarHBondContact O-CA 3.36Å; N53-K65 PolarHBondContact N-O 2.81Å; N53-K65 PolarHBondContact O-N 2.81Å; N53-K65 PolarHBondContact OD1-O 3.07Å; N53-Y67 HydrophobicContact CB-CE1 4.45Å
54	C	90.7	Very high	86.8	Confident	14 Å²	14	63.4 Å²	63.4	10%	0.095	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.4	176.7	-62.6	0	0	0	0	109.3	I46 W47 Q63 C64	I46-C54 CarbonylContact C-O 3.51Å; I46-C54 WeakPolarHBondContact CA-O 3.29Å; W47-C54 HydrophobicContact CB-CB 4.28Å; W47-C54 PolarHBondContact N-O 2.89Å; W47-C54 PolarHBondContact O-N 2.77Å; C54-Q63 CarbonylContact C-O 3.57Å; C54-Q63 WeakPolarHBondContact CA-O 3.46Å; C54-C64 HydrophobicContact CB-CB 4.15Å; C54-C64 WeakPolarHBondContact CB-SG 3.45Å; C54-C64 WeakPolarHBondContact SG-CB 3.49Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.39Å
55	V	89.8	Confident	87.2	Confident	27 Å²	27	65.9 Å²	65.9	16%	0.164	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.7	174.1	61.2	0	0	0	0	109.3	Q44 T45 I46 Q57 M62 Q63	Q44-V55 HydrophobicContact CB-CG2 4.01Å; T45-V55 WeakPolarHBondContact O-CA 3.21Å; I46-V55 HydrophobicContact CG1-CG2 4.11Å; V55-Q57 HydrophobicContact CG2-CG 4.42Å; V55-M62 WeakPolarHBondContact O-CA 3.26Å; V55-Q63 HydrophobicContact CG1-CB 3.98Å; V55-Q63 PolarHBondContact N-O 2.91Å; V55-Q63 PolarHBondContact O-N 3.38Å
56	V	88.3	Confident	87.3	Confident	54 Å²	54	67.9 Å²	67.9	33%	0.327	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.6	172.3	-176.8	0	0	0	0	107.6	Q44 T45 M62	Q44-V56 WeakPolarHBondContact CA-O 3.48Å; T45-V56 PolarHBondContact N-O 2.93Å; T45-V56 PolarHBondContact O-N 2.97Å; V56-M62 HydrophobicContact CG2-CB 4.23Å
57	Q	84.8	Confident	87.2	Confident	72 Å²	72	68.3 Å²	68.3	34%	0.336	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	158.9	178.2	-66.2	170.1	27.4	0	0	110.7	V55 T59 G60 Q61	V55-Q57 HydrophobicContact CG2-CG 4.42Å; Q57-T59 PolarHBondContact O-N 2.83Å; Q57-G60 PolarHBondContact O-N 2.85Å; Q57-Q61 PolarHBondContact N-O 3.08Å; Q57-Q61 VanDerWaalsContact N-O 3.09Å
58	S	78	Confident	86.4	Confident	69 Å²	69	70.3 Å²	70.3	48%	0.483	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.9	179.1	-3.3	0	0	0	0	113.8	I40 S43 G60	I40-S58 PolarHBondContact O-OG 2.96Å; S43-S58 PolarHBondContact O-N 2.91Å; S43-S58 PolarHBondContact O-OG 3.46Å; S43-S58 WeakPolarHBondContact OG-CB 3.17Å; S43-S58 PolarHBondContact OG-OG 3.48Å; S58-G60 PolarHBondContact O-N 3.09Å
59	T	77.6	Confident	85.4	Confident	106 Å²	106	72.2 Å²	72.2	65%	0.65	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-3	172.8	54.9	0	0	0	0	113.6	Q57 Q61	Q57-T59 PolarHBondContact O-N 2.83Å; T59-Q61 VanDerWaalsContact C-N 3.28Å; T59-Q61 PolarHBondContact O-N 3.37Å
60	G	78.4	Confident	84	Confident	61 Å²	61	77.5 Å²	77.5	63%	0.629	43%	0.426	S	S	*	.	S	Bend	trans	81.5	0.9	-178.3	0	0	0	0	0	114.2	Q57 S58	Q57-G60 PolarHBondContact O-N 2.85Å; S58-G60 PolarHBondContact O-N 3.09Å
61	Q	83.3	Confident	82.7	Confident	119 Å²	119	85.1 Å²	85.1	56%	0.556	47%	0.466	S	S	*	.			trans	-77.5	126.1	175.4	-62.5	-149.6	-36.4	0	0	110.7	Q57 T59	Q57-Q61 PolarHBondContact N-O 3.08Å; Q57-Q61 VanDerWaalsContact N-O 3.09Å; T59-Q61 VanDerWaalsContact C-N 3.28Å; T59-Q61 PolarHBondContact O-N 3.37Å
62	M	87.3	Confident	81.2	Confident	154 Å²	154	84 Å²	84	76%	0.759	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.2	168.1	65.7	177	159.1	0	0	109.9	V55 V56	V55-M62 WeakPolarHBondContact O-CA 3.26Å; V56-M62 HydrophobicContact CG2-CB 4.23Å
63	Q	88.9	Confident	80.3	Confident	104 Å²	104	81.6 Å²	81.6	49%	0.486	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.8	175.6	-65.3	-176.8	-33.4	0	0	108.6	C54 V55	C54-Q63 CarbonylContact C-O 3.57Å; C54-Q63 WeakPolarHBondContact CA-O 3.46Å; V55-Q63 HydrophobicContact CG1-CB 3.98Å; V55-Q63 PolarHBondContact N-O 2.91Å; V55-Q63 PolarHBondContact O-N 3.38Å
64	C	91.5	Very high	79.6	Confident	76 Å²	76	81.4 Å²	81.4	51%	0.514	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.8	173.8	-64.1	0	0	0	0	109.7	M52 N53 C54	M52-C64 HydrophobicContact SD-CB 4.44Å; N53-C64 CarbonylContact O-C 3.59Å; N53-C64 VanDerWaalsContact O-CA 3.28Å; N53-C64 WeakPolarHBondContact O-CA 3.36Å; C54-C64 HydrophobicContact CB-CB 4.15Å; C54-C64 WeakPolarHBondContact CB-SG 3.45Å; C54-C64 WeakPolarHBondContact SG-CB 3.49Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.39Å
65	K	88.9	Confident	79.1	Confident	122 Å²	122	88.7 Å²	88.7	53%	0.53	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.5	177.5	-173	176.5	177	-173.2	0	110	M52 N53 D68	M52-K65 CarbonylContact C-O 3.6Å; M52-K65 VanDerWaalsContact CA-O 3.25Å; M52-K65 WeakPolarHBondContact CA-O 3.34Å; M52-K65 VanDerWaalsContact CB-O 3.29Å; M52-K65 WeakPolarHBondContact CB-O 3.45Å; N53-K65 PolarHBondContact N-O 2.81Å; N53-K65 PolarHBondContact O-N 2.81Å; N53-K65 PolarHBondContact OD1-O 3.07Å; K65-D68 WeakPolarHBondContact CE-OD2 3.34Å; K65-D68 IonicContact NZ-OD2 2.98Å; K65-D68 PolarHBondContact NZ-OD2 2.86Å
66	V	89.1	Confident	78.6	Confident	93 Å²	93	90.2 Å²	90.2	56%	0.564	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	142.5	172.3	-178.7	0	0	0	0	108.7	M52 D68	M52-V66 HydrophobicContact CB-CG2 4.34Å; V66-D68 PolarHBondContact O-N 2.94Å; V66-D68 VanDerWaalsContact O-N 3.14Å
67	Y	84.3	Confident	78.3	Confident	41 Å²	41	87.9 Å²	87.9	16%	0.161	49%	0.492	C	S	.	.			trans	-66.1	114.7	176	-66.3	-72.6	0	0	0	110.5	W51 N53 S69 L73	W51-Y67 VanDerWaalsContact C-CD2 3.5Å; W51-Y67 VanDerWaalsContact O-CD2 3.31Å; W51-Y67 WeakPolarHBondContact O-CD2 3.24Å; W51-Y67 PolarHBondContact O-N 2.77Å; N53-Y67 HydrophobicContact CB-CE1 4.45Å; Y67-S69 PolarHBondContact O-N 3.35Å; Y67-L73 HydrophobicContact CD1-CD1 4.23Å; Y67-L73 HydrophobicContact CD2-CD1 3.76Å; Y67-L73 HydrophobicContact CE1-CD1 3.91Å; Y67-L73 HydrophobicContact CE2-CD1 3.4Å; Y67-L73 VanDerWaalsContact CE2-CD1 3.4Å; Y67-L73 HydrophobicContact CG-CD1 4.17Å; Y67-L73 VanDerWaalsContact CZ-CD1 3.47Å
68	D	74.2	Confident	78.4	Confident	125 Å²	125	88.7 Å²	88.7	67%	0.668	50%	0.496	S	S	*	.	S	Bend	trans	-66.9	-18.4	-177.7	-65.3	-40.4	0	0	0	113.2	K65 V66	K65-D68 WeakPolarHBondContact CE-OD2 3.34Å; K65-D68 IonicContact NZ-OD2 2.98Å; K65-D68 PolarHBondContact NZ-OD2 2.86Å; V66-D68 PolarHBondContact O-N 2.94Å; V66-D68 VanDerWaalsContact O-N 3.14Å
69	S	70.1	Confident	78.8	Confident	72 Å²	72	87.9 Å²	87.9	50%	0.503	49%	0.494	S	S	.	.			trans	-149.3	139.5	-179.4	-69.6	0	0	0	0	111.8	Y67 L71 A72	Y67-S69 PolarHBondContact O-N 3.35Å; S69-L71 PolarHBondContact O-N 2.9Å; S69-A72 PolarHBondContact O-N 3.06Å
70	L	61.3	Low	79.4	Confident	111 Å²	111	83 Å²	83	58%	0.581	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-61.8	-27.2	178.2	-63.8	176	0	0	0	112.8	A72	L70-A72 VanDerWaalsContact C-N 3.32Å
71	L	60	Low	80	Confident	160 Å²	160	81.2 Å²	81.2	84%	0.838	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-80.8	-10.4	-178.4	-150.6	71.7	0	0	0	113.7	S69 L73	S69-L71 PolarHBondContact O-N 2.9Å; L71-L73 VanDerWaalsContact C-N 3.31Å
72	A	59.8	Low	80.3	Confident	73 Å²	73	78 Å²	78	60%	0.603	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-84.8	-7.7	177	0	0	0	0	0	112.8	S69 L70	S69-A72 PolarHBondContact O-N 3.06Å; L70-A72 VanDerWaalsContact C-N 3.32Å
73	L	69.6	Low	80.6	Confident	12 Å²	12	73.1 Å²	73.1	6%	0.063	41%	0.409	C	S	.	.	S	Bend	trans	-88.1	139.4	-178.5	-160.8	71	0	0	0	110.1	Y67 L71 Q75 L77 Q78	Y67-L73 HydrophobicContact CD1-CD1 4.23Å; Y67-L73 HydrophobicContact CD2-CD1 3.76Å; Y67-L73 HydrophobicContact CE1-CD1 3.91Å; Y67-L73 HydrophobicContact CE2-CD1 3.4Å; Y67-L73 VanDerWaalsContact CE2-CD1 3.4Å; Y67-L73 HydrophobicContact CG-CD1 4.17Å; Y67-L73 VanDerWaalsContact CZ-CD1 3.47Å; L71-L73 VanDerWaalsContact C-N 3.31Å; L73-Q75 PolarHBondContact O-N 2.85Å; L73-L77 HydrophobicContact CD1-CB 4.22Å; L73-L77 HydrophobicContact CD1-CD2 4.14Å; L73-L77 HydrophobicContact CD2-CB 3.79Å; L73-L77 HydrophobicContact CG-CB 3.76Å; L73-Q78 HydrophobicContact CD2-CB 4.42Å
74	P	75.9	Confident	80.9	Confident	45 Å²	45	68.2 Å²	68.2	29%	0.292	39%	0.386	S	S	.	.			trans	-58.6	141.4	173.4	21.4	-30.7	0	0	0	110.8	D76 L77 Q78	P74-D76 PolarHBondContact O-N 3.31Å; P74-D76 VanDerWaalsContact O-N 3.09Å; P74-L77 HydrophobicContact CG-CB 4.19Å; P74-L77 HydrophobicContact CG-CD1 4.13Å; P74-L77 HydrophobicContact CG-CD2 4.26Å; P74-L77 HydrophobicContact CG-CG 4.41Å; P74-L77 PolarHBondContact O-N 2.94Å; P74-Q78 PolarHBondContact O-N 3.29Å; P74-Q78 VanDerWaalsContact O-N 3.1Å
75	Q	80.1	Confident	81	Confident	166 Å²	166	67.4 Å²	67.4	78%	0.776	38%	0.375	S	S	*	.	H	α-helix	trans	-52.9	-36.2	-172.8	-171.9	174.9	-13.1	0	0	113.1	L73 Q78 A79	L73-Q75 PolarHBondContact O-N 2.85Å; Q75-Q78 PolarHBondContact O-N 3.32Å; Q75-A79 PolarHBondContact O-N 2.93Å
76	D	80.2	Confident	81.4	Confident	59 Å²	59	65.5 Å²	65.5	32%	0.316	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-45	175.8	-65.5	-31.9	0	0	0	112.8	P74 Q78 A80 N142	P74-D76 PolarHBondContact O-N 3.31Å; P74-D76 VanDerWaalsContact O-N 3.09Å; D76-Q78 VanDerWaalsContact C-N 3.34Å; D76-A80 WeakPolarHBondContact O-CB 3.23Å; D76-A80 PolarHBondContact O-N 3.31Å; D76-N142 PolarHBondContact OD1-ND2 3.05Å; D76-N142 PolarHBondContact OD2-ND2 3.03Å
77	L	81.7	Confident	81.7	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-73.8	-29.5	179.7	-89.6	66.2	0	0	0	111.2	L73 P74 A80 R81	L73-L77 HydrophobicContact CD1-CB 4.22Å; L73-L77 HydrophobicContact CD1-CD2 4.14Å; L73-L77 HydrophobicContact CD2-CB 3.79Å; L73-L77 HydrophobicContact CG-CB 3.76Å; P74-L77 HydrophobicContact CG-CB 4.19Å; P74-L77 HydrophobicContact CG-CD1 4.13Å; P74-L77 HydrophobicContact CG-CD2 4.26Å; P74-L77 HydrophobicContact CG-CG 4.41Å; P74-L77 PolarHBondContact O-N 2.94Å; L77-A80 PolarHBondContact O-N 3.12Å; L77-R81 WeakPolarHBondContact O-CB 3.4Å; L77-R81 PolarHBondContact O-N 3.14Å
78	Q	86.5	Confident	82.3	Confident	88 Å²	88	60.7 Å²	60.7	41%	0.411	34%	0.344	S	S	.	.	H	α-helix	trans	-67.2	-44.9	174.3	-171.7	178	-1.2	0	0	111.4	L73 P74 Q75 D76 R81 A82	L73-Q78 HydrophobicContact CD2-CB 4.42Å; P74-Q78 PolarHBondContact O-N 3.29Å; P74-Q78 VanDerWaalsContact O-N 3.1Å; Q75-Q78 PolarHBondContact O-N 3.32Å; D76-Q78 VanDerWaalsContact C-N 3.34Å; Q78-R81 PolarHBondContact O-N 2.87Å; Q78-A82 PolarHBondContact O-N 3.29Å
79	A	86.2	Confident	83.4	Confident	53 Å²	53	59.5 Å²	59.5	44%	0.438	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-43.5	173.8	0	0	0	0	0	111.4	Q75 R81 A82 L83	Q75-A79 PolarHBondContact O-N 2.93Å; A79-R81 VanDerWaalsContact C-N 3.33Å; A79-R81 PolarHBondContact O-N 2.93Å; A79-A82 PolarHBondContact O-N 3.42Å; A79-L83 WeakPolarHBondContact O-CG 2.98Å; A79-L83 PolarHBondContact O-N 3.29Å
80	A	89.6	Confident	84.7	Confident	2 Å²	2	57.7 Å²	57.7	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-41.9	175.3	0	0	0	0	0	112.3	W30 L50 D76 L77 A82 L83 V84 P135 T139	W30-A80 HydrophobicContact CH2-CB 4.38Å; W30-A80 HydrophobicContact CZ3-CB 4Å; L50-A80 HydrophobicContact CD1-CB 4.17Å; D76-A80 WeakPolarHBondContact O-CB 3.23Å; D76-A80 PolarHBondContact O-N 3.31Å; L77-A80 PolarHBondContact O-N 3.12Å; A80-A82 PolarHBondContact O-N 3.33Å; A80-L83 PolarHBondContact O-N 3.02Å; A80-V84 WeakPolarHBondContact O-CB 3.19Å; A80-V84 VanDerWaalsContact O-CG2 3.23Å; A80-V84 WeakPolarHBondContact O-CG2 3.06Å; A80-V84 PolarHBondContact O-N 3.26Å; A80-P135 HydrophobicContact CB-CB 3.73Å; A80-T139 HydrophobicContact CB-CG2 4.27Å
81	R	90.8	Very high	86.3	Confident	24 Å²	24	52.4 Å²	52.4	9%	0.091	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-49.2	176	-167	-170.5	-80.6	-171.1	2.6	111.8	L50 W51 L77 Q78 A79 I85	L50-R81 HydrophobicContact CD1-CB 4.48Å; L50-R81 HydrophobicContact CD2-CB 4.04Å; L50-R81 HydrophobicContact CD2-CG 4.11Å; L50-R81 HydrophobicContact CG-CB 3.89Å; L50-R81 HydrophobicContact CG-CG 4.08Å; L50-R81 PolarHBondContact O-NE 3.05Å; L50-R81 PolarHBondContact O-NH2 2.99Å; W51-R81 HydrophobicContact CH2-CG 4.13Å; W51-R81 HydrophobicContact CZ2-CG 4.02Å; L77-R81 WeakPolarHBondContact O-CB 3.4Å; L77-R81 PolarHBondContact O-N 3.14Å; Q78-R81 PolarHBondContact O-N 2.87Å; A79-R81 VanDerWaalsContact C-N 3.33Å; A79-R81 PolarHBondContact O-N 2.93Å; R81-I85 HydrophobicContact CG-CD1 3.87Å; R81-I85 WeakPolarHBondContact O-CB 3.39Å; R81-I85 WeakPolarHBondContact O-CD1 3.22Å; R81-I85 WeakPolarHBondContact O-CG1 3.47Å; R81-I85 PolarHBondContact O-N 3.24Å; R81-I85 VanDerWaalsContact O-N 3.08Å
82	A	91.2	Very high	88.1	Confident	51 Å²	51	46.2 Å²	46.2	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-48.3	179.3	0	0	0	0	0	111.7	Q78 A79 A80 V84 I85 I86	Q78-A82 PolarHBondContact O-N 3.29Å; A79-A82 PolarHBondContact O-N 3.42Å; A80-A82 PolarHBondContact O-N 3.33Å; A82-V84 PolarHBondContact O-N 2.7Å; A82-I85 PolarHBondContact O-N 2.93Å; A82-I86 WeakPolarHBondContact O-CD1 3.22Å; A82-I86 WeakPolarHBondContact O-CG1 3.16Å; A82-I86 PolarHBondContact O-N 3.12Å
83	L	92.8	Very high	89.8	Confident	53 Å²	53	47.3 Å²	47.3	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-42.7	-178.3	-70.8	170.2	0	0	0	112.7	A79 A80 I86 S87 L131 P135	A79-L83 WeakPolarHBondContact O-CG 2.98Å; A79-L83 PolarHBondContact O-N 3.29Å; A80-L83 PolarHBondContact O-N 3.02Å; L83-I86 PolarHBondContact O-N 3.37Å; L83-S87 WeakPolarHBondContact O-CB 3.36Å; L83-S87 PolarHBondContact O-N 3.33Å; L83-L131 HydrophobicContact CD2-CD2 4.05Å; L83-P135 HydrophobicContact CB-CB 4.31Å; L83-P135 HydrophobicContact CB-CG 3.89Å; L83-P135 HydrophobicContact CD1-CB 4.09Å; L83-P135 HydrophobicContact CD1-CG 4.24Å
84	V	94.4	Very high	91	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-41.6	178.3	174	0	0	0	0	111.3	V21 C25 W30 L50 A80 A82 S87 I88 P135	V21-V84 HydrophobicContact CG1-CG1 4.09Å; C25-V84 HydrophobicContact CB-CG1 3.68Å; W30-V84 HydrophobicContact CH2-CG2 3.78Å; W30-V84 HydrophobicContact CZ2-CG2 4.08Å; L50-V84 HydrophobicContact CD2-CB 4.44Å; A80-V84 WeakPolarHBondContact O-CB 3.19Å; A80-V84 VanDerWaalsContact O-CG2 3.23Å; A80-V84 WeakPolarHBondContact O-CG2 3.06Å; A80-V84 PolarHBondContact O-N 3.26Å; A82-V84 PolarHBondContact O-N 2.7Å; V84-S87 WeakPolarHBondContact O-CB 3.47Å; V84-S87 PolarHBondContact O-N 2.05Å; V84-I88 HydrophobicContact CG1-CD1 4.12Å; V84-I88 WeakPolarHBondContact O-CG1 3.37Å; V84-I88 PolarHBondContact O-N 3.19Å; V84-P135 HydrophobicContact CG2-CG 4.1Å
85	I	95.2	Very high	91.9	Very high	58 Å²	58	45.7 Å²	45.7	30%	0.297	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-47.1	176.2	-68.2	166.9	0	0	0	110.8	W51 R81 A82 S87 I88 I89	W51-I85 HydrophobicContact CH2-CD1 3.64Å; W51-I85 HydrophobicContact CZ2-CD1 3.7Å; W51-I85 HydrophobicContact CZ2-CG1 4.15Å; R81-I85 HydrophobicContact CG-CD1 3.87Å; R81-I85 WeakPolarHBondContact O-CB 3.39Å; R81-I85 WeakPolarHBondContact O-CD1 3.22Å; R81-I85 WeakPolarHBondContact O-CG1 3.47Å; R81-I85 PolarHBondContact O-N 3.24Å; R81-I85 VanDerWaalsContact O-N 3.08Å; A82-I85 PolarHBondContact O-N 2.93Å; I85-S87 VanDerWaalsContact C-N 3.26Å; I85-S87 PolarHBondContact O-N 3.46Å; I85-I88 PolarHBondContact O-N 3.08Å; I85-I88 VanDerWaalsContact O-N 3.1Å; I85-I89 HydrophobicContact CG2-CD1 4.02Å; I85-I89 WeakPolarHBondContact O-CG1 3.5Å; I85-I89 PolarHBondContact O-N 3.1Å; I85-I89 VanDerWaalsContact O-N 3.08Å
86	I	95.8	Very high	92.5	Very high	83 Å²	83	43.1 Å²	43.1	43%	0.426	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-45.4	176.9	-66.8	164.9	0	0	0	109.2	A82 L83 I88 I89 V90 L131	A82-I86 WeakPolarHBondContact O-CD1 3.22Å; A82-I86 WeakPolarHBondContact O-CG1 3.16Å; A82-I86 PolarHBondContact O-N 3.12Å; L83-I86 PolarHBondContact O-N 3.37Å; I86-I88 VanDerWaalsContact C-N 3.32Å; I86-I88 PolarHBondContact O-N 3.5Å; I86-I89 PolarHBondContact O-N 2.94Å; I86-V90 HydrophobicContact CG2-CG2 4.16Å; I86-V90 WeakPolarHBondContact O-CG2 3.47Å; I86-V90 PolarHBondContact O-N 2.98Å; I86-L131 HydrophobicContact CG2-CD1 4.03Å
87	S	96.2	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.5	-40.4	175.8	-178	0	0	0	0	113.4	L83 V84 I85 I89 V90 A91 A128 V132	L83-S87 WeakPolarHBondContact O-CB 3.36Å; L83-S87 PolarHBondContact O-N 3.33Å; V84-S87 WeakPolarHBondContact O-CB 3.47Å; V84-S87 PolarHBondContact O-N 2.05Å; I85-S87 VanDerWaalsContact C-N 3.26Å; I85-S87 PolarHBondContact O-N 3.46Å; S87-I89 VanDerWaalsContact C-N 3.31Å; S87-I89 PolarHBondContact O-N 3.38Å; S87-V90 PolarHBondContact O-N 3.2Å; S87-A91 VanDerWaalsContact O-CB 3.24Å; S87-A91 WeakPolarHBondContact O-CB 3.45Å; S87-A91 PolarHBondContact O-N 3.45Å; S87-A128 PolarHBondContact OG-O 2.89Å; S87-V132 WeakPolarHBondContact OG-CG2 3.31Å
88	I	96.6	Very high	93.5	Very high	32 Å²	32	43 Å²	43	16%	0.164	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-42.3	178.6	-70.6	165.4	0	0	0	110.1	W18 V21 M22 C25 V84 I85 I86 A92	W18-I88 PolarHBondContact NE1-O 3.35Å; W18-I88 VanDerWaalsContact NE1-O 3.17Å; V21-I88 HydrophobicContact CB-CG1 4.47Å; V21-I88 HydrophobicContact CG1-CD1 4.26Å; V21-I88 HydrophobicContact CG1-CG1 3.63Å; M22-I88 HydrophobicContact CG-CD1 4.23Å; M22-I88 HydrophobicContact CG-CG1 4.27Å; M22-I88 HydrophobicContact CG-CG2 4.09Å; M22-I88 HydrophobicContact SD-CG2 4.49Å; C25-I88 HydrophobicContact CB-CD1 3.91Å; V84-I88 HydrophobicContact CG1-CD1 4.12Å; V84-I88 WeakPolarHBondContact O-CG1 3.37Å; V84-I88 PolarHBondContact O-N 3.19Å; I85-I88 PolarHBondContact O-N 3.08Å; I85-I88 VanDerWaalsContact O-N 3.1Å; I86-I88 VanDerWaalsContact C-N 3.32Å; I86-I88 PolarHBondContact O-N 3.5Å; I88-A92 WeakPolarHBondContact O-CB 3.1Å; I88-A92 PolarHBondContact O-N 2.92Å
89	I	97.3	Very high	93.6	Very high	100 Å²	100	42.6 Å²	42.6	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-66.4	-47.5	178.3	-62.4	166.6	0	0	0	110.3	I85 I86 S87 A91 A92 L93	I85-I89 HydrophobicContact CG2-CD1 4.02Å; I85-I89 WeakPolarHBondContact O-CG1 3.5Å; I85-I89 PolarHBondContact O-N 3.1Å; I85-I89 VanDerWaalsContact O-N 3.08Å; I86-I89 PolarHBondContact O-N 2.94Å; S87-I89 VanDerWaalsContact C-N 3.31Å; S87-I89 PolarHBondContact O-N 3.38Å; I89-A91 PolarHBondContact O-N 2.89Å; I89-A92 WeakPolarHBondContact O-CB 3.36Å; I89-A92 PolarHBondContact O-N 3.29Å; I89-L93 WeakPolarHBondContact O-CG 3.33Å; I89-L93 PolarHBondContact O-N 2.97Å
90	V	96.8	Very high	93.6	Very high	35 Å²	35	43 Å²	43	21%	0.212	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-45.3	178.1	175.5	0	0	0	0	110.9	I86 S87 A92 L93 G94 V124 A128 L131	I86-V90 HydrophobicContact CG2-CG2 4.16Å; I86-V90 WeakPolarHBondContact O-CG2 3.47Å; I86-V90 PolarHBondContact O-N 2.98Å; S87-V90 PolarHBondContact O-N 3.2Å; V90-A92 VanDerWaalsContact C-N 3.35Å; V90-A92 PolarHBondContact O-N 3.34Å; V90-L93 WeakPolarHBondContact O-CB 3.41Å; V90-L93 PolarHBondContact O-N 2.94Å; V90-G94 PolarHBondContact O-N 2.85Å; V90-V124 HydrophobicContact CG1-CG1 3.67Å; V90-V124 WeakPolarHBondContact O-CG1 3.36Å; V90-A128 HydrophobicContact CB-CB 4.41Å; V90-A128 HydrophobicContact CG1-CB 4.13Å; V90-L131 HydrophobicContact CG2-CD1 4.4Å
91	A	96.3	Very high	93.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-37.5	175.8	0	0	0	0	0	112.4	W18 S87 I89 L93 G94 V95 F125 A128	W18-A91 HydrophobicContact CB-CB 4.34Å; W18-A91 HydrophobicContact CG-CB 4.06Å; S87-A91 VanDerWaalsContact O-CB 3.24Å; S87-A91 WeakPolarHBondContact O-CB 3.45Å; S87-A91 PolarHBondContact O-N 3.45Å; I89-A91 PolarHBondContact O-N 2.89Å; A91-L93 VanDerWaalsContact C-N 3.33Å; A91-L93 PolarHBondContact O-N 3.41Å; A91-G94 CarbonylContact O-C 3.58Å; A91-G94 WeakPolarHBondContact O-CA 3.32Å; A91-G94 PolarHBondContact O-N 3.16Å; A91-G94 VanDerWaalsContact O-N 3.09Å; A91-V95 WeakPolarHBondContact O-CG2 3.43Å; A91-V95 PolarHBondContact O-N 3.33Å; A91-F125 HydrophobicContact CB-CD1 4.43Å; A91-F125 HydrophobicContact CB-CE1 4.45Å; A91-F125 WeakPolarHBondContact O-CE1 3.08Å; A91-A128 HydrophobicContact CB-CB 3.84Å
92	A	96.6	Very high	92.9	Very high	29 Å²	29	42 Å²	42	24%	0.24	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-41.4	174.4	0	0	0	0	0	111.7	W18 I88 I89 V90 G94 V95 L96	W18-A92 HydrophobicContact CZ2-CB 3.89Å; I88-A92 WeakPolarHBondContact O-CB 3.1Å; I88-A92 PolarHBondContact O-N 2.92Å; I89-A92 WeakPolarHBondContact O-CB 3.36Å; I89-A92 PolarHBondContact O-N 3.29Å; V90-A92 VanDerWaalsContact C-N 3.35Å; V90-A92 PolarHBondContact O-N 3.34Å; A92-G94 VanDerWaalsContact C-N 3.32Å; A92-G94 PolarHBondContact O-N 3.31Å; A92-V95 PolarHBondContact O-N 2.98Å; A92-L96 WeakPolarHBondContact O-CG 3.24Å; A92-L96 PolarHBondContact O-N 2.95Å
93	L	95.8	Very high	91.9	Very high	96 Å²	96	43.3 Å²	43.3	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-40.7	171.6	-64.7	174.8	0	0	0	111.5	I89 V90 A91 V95 L96 L97	I89-L93 WeakPolarHBondContact O-CG 3.33Å; I89-L93 PolarHBondContact O-N 2.97Å; V90-L93 WeakPolarHBondContact O-CB 3.41Å; V90-L93 PolarHBondContact O-N 2.94Å; A91-L93 VanDerWaalsContact C-N 3.33Å; A91-L93 PolarHBondContact O-N 3.41Å; L93-V95 VanDerWaalsContact C-N 3.33Å; L93-V95 PolarHBondContact O-N 2.92Å; L93-L96 HydrophobicContact CD2-CD1 4.47Å; L93-L96 PolarHBondContact O-N 3Å; L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 3.29Å
94	G	94.8	Very high	90.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-39.3	173.7	0	0	0	0	0	113.3	V90 A91 A92 L97 S98	V90-G94 PolarHBondContact O-N 2.85Å; A91-G94 CarbonylContact O-C 3.58Å; A91-G94 WeakPolarHBondContact O-CA 3.32Å; A91-G94 PolarHBondContact O-N 3.16Å; A91-G94 VanDerWaalsContact O-N 3.09Å; A92-G94 VanDerWaalsContact C-N 3.32Å; A92-G94 PolarHBondContact O-N 3.31Å; G94-L97 PolarHBondContact O-N 2.86Å; G94-S98 WeakPolarHBondContact O-CB 3.44Å; G94-S98 PolarHBondContact O-N 3.43Å; G94-S98 PolarHBondContact O-OG 2.89Å
95	V	94.6	Very high	89.8	Confident	24 Å²	24	47.5 Å²	47.5	15%	0.145	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-47.1	174.7	174.1	0	0	0	0	110.4	V15 W18 A91 A92 L93 L97 S98 V99 F125	V15-V95 HydrophobicContact CG2-CG2 4.28Å; W18-V95 HydrophobicContact CD2-CG2 4.23Å; W18-V95 HydrophobicContact CE3-CG2 4.09Å; A91-V95 WeakPolarHBondContact O-CG2 3.43Å; A91-V95 PolarHBondContact O-N 3.33Å; A92-V95 PolarHBondContact O-N 2.98Å; L93-V95 VanDerWaalsContact C-N 3.33Å; L93-V95 PolarHBondContact O-N 2.92Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.37Å; V95-S98 WeakPolarHBondContact O-CB 3.41Å; V95-S98 PolarHBondContact O-N 3.36Å; V95-S98 VanDerWaalsContact O-N 3.09Å; V95-V99 WeakPolarHBondContact O-CG2 3.49Å; V95-V99 PolarHBondContact O-N 3.35Å; V95-F125 HydrophobicContact CB-CZ 4.42Å; V95-F125 HydrophobicContact CG2-CE1 3.89Å; V95-F125 HydrophobicContact CG2-CZ 3.77Å; V95-F125 VanDerWaalsContact N-CZ 3.33Å
96	L	93.3	Very high	88.6	Confident	111 Å²	111	50.9 Å²	50.9	58%	0.581	29%	0.286	S	S	*	.	H	α-helix	trans	-59.1	-45	177.2	-67.4	175	0	0	0	111.8	A92 L93 S98 V99 V100	A92-L96 WeakPolarHBondContact O-CG 3.24Å; A92-L96 PolarHBondContact O-N 2.95Å; L93-L96 HydrophobicContact CD2-CD1 4.47Å; L93-L96 PolarHBondContact O-N 3Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.3Å; L96-V99 PolarHBondContact O-N 3.22Å; L96-V100 WeakPolarHBondContact O-CG2 3.11Å; L96-V100 PolarHBondContact O-N 3.45Å; L96-V100 VanDerWaalsContact O-N 3.12Å
97	L	91.7	Very high	87.6	Confident	58 Å²	58	51.2 Å²	51.2	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-36.1	175.6	-69	172.8	0	0	0	112.2	L93 G94 V95 V100 G101 V120 A121 V124	L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.36Å; L93-L97 PolarHBondContact O-N 3.29Å; G94-L97 PolarHBondContact O-N 2.86Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.37Å; L97-V100 PolarHBondContact O-N 3.46Å; L97-G101 PolarHBondContact O-N 2.94Å; L97-V120 HydrophobicContact CD1-CG1 4.1Å; L97-A121 HydrophobicContact CB-CB 3.77Å; L97-V124 HydrophobicContact CD1-CG2 4.23Å
98	S	90.1	Very high	86.7	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.028	31%	0.305	C	S	.	.	H	α-helix	trans	-69.6	-33.7	177.1	-60.5	0	0	0	0	113	G94 V95 L96 G102 F125	G94-S98 WeakPolarHBondContact O-CB 3.44Å; G94-S98 PolarHBondContact O-N 3.43Å; G94-S98 PolarHBondContact O-OG 2.89Å; V95-S98 WeakPolarHBondContact O-CB 3.41Å; V95-S98 PolarHBondContact O-N 3.36Å; V95-S98 VanDerWaalsContact O-N 3.09Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.3Å; S98-G102 WeakPolarHBondContact O-CA 3.43Å; S98-G102 PolarHBondContact O-N 2.81Å; S98-F125 VanDerWaalsContact OG-CE2 3.31Å; S98-F125 WeakPolarHBondContact OG-CE2 3.34Å
99	V	89.1	Confident	85.7	Confident	81 Å²	81	59.6 Å²	59.6	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-66.1	-43.9	174.1	172.6	0	0	0	0	110.2	V95 L96 T105	V95-V99 WeakPolarHBondContact O-CG2 3.49Å; V95-V99 PolarHBondContact O-N 3.35Å; L96-V99 PolarHBondContact O-N 3.22Å; V99-T105 WeakPolarHBondContact O-CB 3.38Å; V99-T105 WeakPolarHBondContact O-CG2 3.37Å; V99-T105 PolarHBondContact O-OG1 3.4Å
100	V	87.3	Confident	84.9	Confident	61 Å²	61	60 Å²	60	37%	0.37	34%	0.338	S	S	.	.	H	α-helix	trans	-70.3	-40.7	179.6	175.8	0	0	0	0	112.1	L96 L97 C107 L108	L96-V100 WeakPolarHBondContact O-CG2 3.11Å; L96-V100 PolarHBondContact O-N 3.45Å; L96-V100 VanDerWaalsContact O-N 3.12Å; L97-V100 PolarHBondContact O-N 3.46Å; V100-C107 HydrophobicContact CG1-CB 4.26Å; V100-L108 HydrophobicContact CG1-CD1 3.73Å; V100-L108 HydrophobicContact CG1-CG 4.27Å
101	G	82.3	Confident	84.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-85.3	-3	-179.8	0	0	0	0	0	115.3	Q7 L97 T117 M118	Q7-G101 PolarHBondContact NE2-O 3.17Å; L97-G101 PolarHBondContact O-N 2.94Å; G101-T117 WeakPolarHBondContact CA-OG1 3.43Å; G101-M118 VanDerWaalsContact O-CG 3.31Å; G101-M118 WeakPolarHBondContact O-CG 3.48Å; G101-M118 VanDerWaalsContact O-SD 3.36Å
102	G	81.9	Confident	83.4	Confident	6 Å²	6	65.8 Å²	65.8	6%	0.062	37%	0.37	C	S	.	.			trans	-66.3	139.6	-178.4	0	0	0	0	0	112.5	S98 C104 T105	S98-G102 WeakPolarHBondContact O-CA 3.43Å; S98-G102 PolarHBondContact O-N 2.81Å; G102-C104 PolarHBondContact O-N 3.33Å; G102-C104 VanDerWaalsContact O-N 3.16Å; G102-T105 PolarHBondContact O-N 3.33Å; G102-T105 VanDerWaalsContact O-N 3.08Å
103	K	71.3	Confident	82.7	Confident	77 Å²	77	65.7 Å²	65.7	34%	0.335	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.3	175.2	-73.5	176.8	-177.3	172	0	113.5	A2 M4 Q7 T105	A2-K103 PolarHBondContact O-NZ 2.99Å; M4-K103 HydrophobicContact CG-CD 4.47Å; Q7-K103 VanDerWaalsContact OE1-CD 3.31Å; K103-T105 VanDerWaalsContact C-N 3.31Å
104	C	68.7	Low	82.2	Confident	105 Å²	105	62.2 Å²	62.2	71%	0.709	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.7	179.4	-53.2	0	0	0	0	113.4	G102	G102-C104 PolarHBondContact O-N 3.33Å; G102-C104 VanDerWaalsContact O-N 3.16Å
105	T	74.3	Confident	81.6	Confident	38 Å²	38	63 Å²	63	23%	0.233	36%	0.357	C	S	.	.			trans	-113.4	129.5	-174.9	-55.3	0	0	0	0	110.3	V99 G102 K103 C107	V99-T105 WeakPolarHBondContact O-CB 3.38Å; V99-T105 WeakPolarHBondContact O-CG2 3.37Å; V99-T105 PolarHBondContact O-OG1 3.4Å; G102-T105 PolarHBondContact O-N 3.33Å; G102-T105 VanDerWaalsContact O-N 3.08Å; K103-T105 VanDerWaalsContact C-N 3.31Å; T105-C107 VanDerWaalsContact C-N 3.31Å; T105-C107 HydrophobicContact CG2-CB 3.88Å; T105-C107 WeakPolarHBondContact CG2-SG 3.42Å; T105-C107 PolarHBondContact O-N 3.32Å
106	N	70.5	Confident	81.3	Confident	128 Å²	128	68.4 Å²	68.4	68%	0.684	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	32.3	178.5	-160	22.9	0	0	0	113.6	L108	N106-L108 VanDerWaalsContact C-N 3.34Å
107	C	75.1	Confident	81.1	Confident	91 Å²	91	64.8 Å²	64.8	62%	0.615	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-21.8	177.6	-70	0	0	0	0	112.9	V100 T105	V100-C107 HydrophobicContact CG1-CB 4.26Å; T105-C107 VanDerWaalsContact C-N 3.31Å; T105-C107 HydrophobicContact CG2-CB 3.88Å; T105-C107 WeakPolarHBondContact CG2-SG 3.42Å; T105-C107 PolarHBondContact O-N 3.32Å
108	L	76.6	Confident	81	Confident	43 Å²	43	62.1 Å²	62.1	23%	0.225	35%	0.346	C	S	.	.			trans	-127.2	127.6	177.1	-77.9	159	0	0	0	107.6	V100 N106 A113 K114 T117	V100-L108 HydrophobicContact CG1-CD1 3.73Å; V100-L108 HydrophobicContact CG1-CG 4.27Å; N106-L108 VanDerWaalsContact C-N 3.34Å; L108-A113 HydrophobicContact CD2-CB 4.05Å; L108-K114 HydrophobicContact CB-CG 3.84Å; L108-K114 HydrophobicContact CD1-CG 4.33Å; L108-K114 WeakPolarHBondContact O-CE 3.46Å; L108-K114 PolarHBondContact O-NZ 3Å; L108-T117 HydrophobicContact CD1-CG2 4.08Å
109	E	75	Confident	81.1	Confident	165 Å²	165	64.1 Å²	64.1	77%	0.771	36%	0.356	S	S	*	.			trans	-86.7	-28.1	174.2	-66.7	-179.7	158.9	0	0	111	E111	E109-E111 PolarHBondContact O-N 3.18Å
110	D	81.4	Confident	81.3	Confident	109 Å²	109	64 Å²	64	58%	0.583	36%	0.356	S	S	*	.			trans	-77.3	112	-179.4	-76.6	-38.4	0	0	0	113.2	S112 A113 K114	D110-S112 VanDerWaalsContact C-N 3.25Å; D110-S112 PolarHBondContact O-N 3.32Å; D110-A113 HydrophobicContact CB-CB 3.76Å; D110-A113 WeakPolarHBondContact O-CB 3.49Å; D110-A113 PolarHBondContact O-N 2.92Å; D110-A113 VanDerWaalsContact O-N 3.09Å; D110-K114 PolarHBondContact O-N 3.12Å
111	E	78.9	Confident	81.6	Confident	89 Å²	89	61.1 Å²	61.1	42%	0.416	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-32.2	176	-73.4	-62.5	128	0	0	113.3	E109 K114 A115	E109-E111 PolarHBondContact O-N 3.18Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.01Å; E111-A115 PolarHBondContact O-N 2.77Å
112	S	81.1	Confident	82.2	Confident	67 Å²	67	61.1 Å²	61.1	47%	0.469	34%	0.338	S	S	.	.	H	α-helix	trans	-70.6	-34.9	176.4	74.5	0	0	0	0	112.4	D110 K116	D110-S112 VanDerWaalsContact C-N 3.25Å; D110-S112 PolarHBondContact O-N 3.32Å; S112-K116 WeakPolarHBondContact O-CG 3.46Å; S112-K116 PolarHBondContact O-N 3.46Å
113	A	83.6	Confident	82.8	Confident	27 Å²	27	64 Å²	64	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-69.7	-44.8	175	0	0	0	0	0	110.2	L108 D110 A115 K116 T117	L108-A113 HydrophobicContact CD2-CB 4.05Å; D110-A113 HydrophobicContact CB-CB 3.76Å; D110-A113 WeakPolarHBondContact O-CB 3.49Å; D110-A113 PolarHBondContact O-N 2.92Å; D110-A113 VanDerWaalsContact O-N 3.09Å; A113-A115 VanDerWaalsContact C-N 3.34Å; A113-A115 PolarHBondContact O-N 3.47Å; A113-K116 PolarHBondContact O-N 3.09Å; A113-T117 WeakPolarHBondContact O-CG2 3.32Å; A113-T117 PolarHBondContact O-N 3.47Å; A113-T117 PolarHBondContact O-OG1 3.46Å; A113-T117 VanDerWaalsContact O-OG1 3.12Å
114	K	83.6	Confident	84.1	Confident	22 Å²	22	61.7 Å²	61.7	10%	0.096	35%	0.347	C	S	.	.	H	α-helix	trans	-54.9	-46.8	173.9	-69.5	-178.1	-168.4	164.7	0	112.5	L108 D110 E111 K116 T117 M118	L108-K114 HydrophobicContact CB-CG 3.84Å; L108-K114 HydrophobicContact CD1-CG 4.33Å; L108-K114 WeakPolarHBondContact O-CE 3.46Å; L108-K114 PolarHBondContact O-NZ 3Å; D110-K114 PolarHBondContact O-N 3.12Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.01Å; K114-K116 PolarHBondContact O-N 3.25Å; K114-T117 WeakPolarHBondContact CA-OG1 3.29Å; K114-T117 PolarHBondContact O-N 3.21Å; K114-T117 PolarHBondContact O-OG1 3.17Å; K114-M118 VanDerWaalsContact O-CG 3.28Å; K114-M118 WeakPolarHBondContact O-CG 3.22Å; K114-M118 PolarHBondContact O-N 3.37Å
115	A	83.9	Confident	85.4	Confident	18 Å²	18	56.8 Å²	56.8	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-45.4	178.5	0	0	0	0	0	111.5	E111 A113 M118 I119	E111-A115 PolarHBondContact O-N 2.77Å; A113-A115 VanDerWaalsContact C-N 3.34Å; A113-A115 PolarHBondContact O-N 3.47Å; A115-M118 PolarHBondContact O-N 2.97Å; A115-I119 WeakPolarHBondContact O-CG1 3.46Å; A115-I119 PolarHBondContact O-N 2.89Å; A115-I119 VanDerWaalsContact O-N 3.13Å
116	K	87	Confident	86.5	Confident	137 Å²	137	57.4 Å²	57.4	60%	0.596	32%	0.315	S	S	*	.	H	α-helix	trans	-64.7	-44.3	177.5	-71.7	177.2	-178.9	-177.6	0	112.3	S112 A113 K114 M118 I119 V120	S112-K116 WeakPolarHBondContact O-CG 3.46Å; S112-K116 PolarHBondContact O-N 3.46Å; A113-K116 PolarHBondContact O-N 3.09Å; K114-K116 PolarHBondContact O-N 3.25Å; K116-M118 VanDerWaalsContact C-N 3.28Å; K116-M118 PolarHBondContact O-N 3.45Å; K116-I119 PolarHBondContact O-N 3.26Å; K116-V120 WeakPolarHBondContact O-CG2 3.49Å; K116-V120 PolarHBondContact O-N 3.49Å
117	T	90.1	Very high	87.8	Confident	34 Å²	34	55.8 Å²	55.8	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-36.8	178.4	51.7	0	0	0	0	111.7	G101 L108 A113 K114 V120 A121	G101-T117 WeakPolarHBondContact CA-OG1 3.43Å; L108-T117 HydrophobicContact CD1-CG2 4.08Å; A113-T117 WeakPolarHBondContact O-CG2 3.32Å; A113-T117 PolarHBondContact O-N 3.47Å; A113-T117 PolarHBondContact O-OG1 3.46Å; A113-T117 VanDerWaalsContact O-OG1 3.12Å; K114-T117 WeakPolarHBondContact CA-OG1 3.29Å; K114-T117 PolarHBondContact O-N 3.21Å; K114-T117 PolarHBondContact O-OG1 3.17Å; T117-V120 PolarHBondContact O-N 2.91Å; T117-A121 WeakPolarHBondContact O-CB 3.37Å; T117-A121 PolarHBondContact O-N 3.12Å
118	M	90	Very high	88.8	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-36.5	175.8	-70.1	-51.7	-54.2	0	0	113	Q7 I11 G101 K114 A115 K116 A121 G122 L181	Q7-M118 HydrophobicContact CG-CE 4.14Å; I11-M118 HydrophobicContact CD1-CE 3.96Å; I11-M118 HydrophobicContact CG1-CE 4.02Å; G101-M118 VanDerWaalsContact O-CG 3.31Å; G101-M118 WeakPolarHBondContact O-CG 3.48Å; G101-M118 VanDerWaalsContact O-SD 3.36Å; K114-M118 VanDerWaalsContact O-CG 3.28Å; K114-M118 WeakPolarHBondContact O-CG 3.22Å; K114-M118 PolarHBondContact O-N 3.37Å; A115-M118 PolarHBondContact O-N 2.97Å; K116-M118 VanDerWaalsContact C-N 3.28Å; K116-M118 PolarHBondContact O-N 3.45Å; M118-A121 PolarHBondContact O-N 3.47Å; M118-G122 PolarHBondContact O-N 2.86Å; M118-L181 HydrophobicContact CE-CD1 3.98Å; M118-L181 HydrophobicContact CE-CD2 3.47Å; M118-L181 VanDerWaalsContact CE-CD2 3.47Å; M118-L181 HydrophobicContact CE-CG 4.24Å
119	I	90.8	Very high	89.8	Confident	47 Å²	47	49.4 Å²	49.4	24%	0.241	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-44.7	173.3	-65.1	163	0	0	0	109.8	A115 K116 A121 G122 V123 N184 P186	A115-I119 WeakPolarHBondContact O-CG1 3.46Å; A115-I119 PolarHBondContact O-N 2.89Å; A115-I119 VanDerWaalsContact O-N 3.13Å; K116-I119 PolarHBondContact O-N 3.26Å; I119-A121 VanDerWaalsContact C-N 3.35Å; I119-A121 PolarHBondContact O-N 3.16Å; I119-G122 PolarHBondContact O-N 2.91Å; I119-V123 WeakPolarHBondContact O-CG2 3.36Å; I119-V123 PolarHBondContact O-N 3.24Å; I119-N184 WeakPolarHBondContact CD1-O 3.07Å; I119-P186 HydrophobicContact CD1-CG 4.48Å
120	V	93.4	Very high	90.8	Very high	79 Å²	79	45.8 Å²	45.8	48%	0.479	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-44.7	176.2	175.8	0	0	0	0	110.7	L97 K116 T117 G122 V123 V124	L97-V120 HydrophobicContact CD1-CG1 4.1Å; K116-V120 WeakPolarHBondContact O-CG2 3.49Å; K116-V120 PolarHBondContact O-N 3.49Å; T117-V120 PolarHBondContact O-N 2.91Å; V120-G122 VanDerWaalsContact C-N 3.3Å; V120-G122 PolarHBondContact O-N 3.46Å; V120-V123 PolarHBondContact O-N 2.98Å; V120-V124 HydrophobicContact CG1-CG2 4.42Å; V120-V124 VanDerWaalsContact O-CG2 3.27Å; V120-V124 WeakPolarHBondContact O-CG2 3.5Å; V120-V124 PolarHBondContact O-N 3.25Å
121	A	94	Very high	91.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-42.5	174.6	0	0	0	0	0	111.9	L97 T117 M118 I119 V124 F125	L97-A121 HydrophobicContact CB-CB 3.77Å; T117-A121 WeakPolarHBondContact O-CB 3.37Å; T117-A121 PolarHBondContact O-N 3.12Å; M118-A121 PolarHBondContact O-N 3.47Å; I119-A121 VanDerWaalsContact C-N 3.35Å; I119-A121 PolarHBondContact O-N 3.16Å; A121-V124 PolarHBondContact O-N 2.95Å; A121-F125 WeakPolarHBondContact O-CD2 3.27Å; A121-F125 PolarHBondContact O-N 2.93Å
122	G	94.1	Very high	92.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-46.7	175.2	0	0	0	0	0	113	M118 I119 V120 V124 F125 L126 G178	M118-G122 PolarHBondContact O-N 2.86Å; I119-G122 PolarHBondContact O-N 2.91Å; V120-G122 VanDerWaalsContact C-N 3.3Å; V120-G122 PolarHBondContact O-N 3.46Å; G122-V124 VanDerWaalsContact C-N 3.33Å; G122-V124 PolarHBondContact O-N 3.45Å; G122-F125 PolarHBondContact O-N 3.23Å; G122-L126 WeakPolarHBondContact O-CG 3.43Å; G122-L126 PolarHBondContact O-N 2.96Å; G122-G178 WeakPolarHBondContact CA-O 3.11Å; G122-G178 WeakPolarHBondContact O-CA 3.32Å
123	V	96.1	Very high	93	Very high	67 Å²	67	38 Å²	38	41%	0.406	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-42	176	174.4	0	0	0	0	111.2	I119 V120 F125 L126 L127 C182	I119-V123 WeakPolarHBondContact O-CG2 3.36Å; I119-V123 PolarHBondContact O-N 3.24Å; V120-V123 PolarHBondContact O-N 2.98Å; V123-F125 VanDerWaalsContact C-N 3.33Å; V123-F125 PolarHBondContact O-N 3.45Å; V123-L126 WeakPolarHBondContact O-CB 3.45Å; V123-L126 PolarHBondContact O-N 3.3Å; V123-L127 HydrophobicContact CG1-CD1 4.25Å; V123-L127 HydrophobicContact CG1-CG 4.49Å; V123-L127 WeakPolarHBondContact O-CG 3.38Å; V123-L127 PolarHBondContact O-N 2.95Å; V123-C182 PolarHBondContact N-SG 2.94Å
124	V	97.1	Very high	93.5	Very high	28 Å²	28	40.8 Å²	40.8	17%	0.17	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-42	176.5	170.4	0	0	0	0	111.2	V90 L97 V120 A121 G122 L127 A128	V90-V124 HydrophobicContact CG1-CG1 3.67Å; V90-V124 WeakPolarHBondContact O-CG1 3.36Å; L97-V124 HydrophobicContact CD1-CG2 4.23Å; V120-V124 HydrophobicContact CG1-CG2 4.42Å; V120-V124 VanDerWaalsContact O-CG2 3.27Å; V120-V124 WeakPolarHBondContact O-CG2 3.5Å; V120-V124 PolarHBondContact O-N 3.25Å; A121-V124 PolarHBondContact O-N 2.95Å; G122-V124 VanDerWaalsContact C-N 3.33Å; G122-V124 PolarHBondContact O-N 3.45Å; V124-L127 PolarHBondContact O-N 3.39Å; V124-A128 WeakPolarHBondContact O-CB 3.43Å; V124-A128 PolarHBondContact O-N 3.17Å
125	F	97.2	Very high	94	Very high	1 Å²	1	40 Å²	40	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-36.4	174.4	-73.6	-54.5	0	0	0	113.6	A14 A91 V95 S98 A121 G122 V123 A128 G129 L174 L181	A14-F125 HydrophobicContact CB-CD1 4.01Å; A14-F125 HydrophobicContact CB-CD2 3.72Å; A14-F125 HydrophobicContact CB-CE1 3.88Å; A14-F125 HydrophobicContact CB-CE2 3.56Å; A14-F125 HydrophobicContact CB-CG 3.93Å; A14-F125 HydrophobicContact CB-CZ 3.64Å; A91-F125 HydrophobicContact CB-CD1 4.43Å; A91-F125 HydrophobicContact CB-CE1 4.45Å; A91-F125 WeakPolarHBondContact O-CE1 3.08Å; V95-F125 HydrophobicContact CB-CZ 4.42Å; V95-F125 HydrophobicContact CG2-CE1 3.89Å; V95-F125 HydrophobicContact CG2-CZ 3.77Å; V95-F125 VanDerWaalsContact N-CZ 3.33Å; S98-F125 VanDerWaalsContact OG-CE2 3.31Å; S98-F125 WeakPolarHBondContact OG-CE2 3.34Å; A121-F125 WeakPolarHBondContact O-CD2 3.27Å; A121-F125 PolarHBondContact O-N 2.93Å; G122-F125 PolarHBondContact O-N 3.23Å; V123-F125 VanDerWaalsContact C-N 3.33Å; V123-F125 PolarHBondContact O-N 3.45Å; F125-A128 PolarHBondContact O-N 3.28Å; F125-G129 PolarHBondContact O-N 3.36Å; F125-L174 HydrophobicContact CD1-CD2 3.79Å; F125-L174 HydrophobicContact CE1-CD2 4.38Å; F125-L181 HydrophobicContact CD2-CD1 3.91Å; F125-L181 HydrophobicContact CE2-CD1 3.99Å
126	L	97.3	Very high	94.5	Very high	52 Å²	52	39.1 Å²	39.1	27%	0.272	21%	0.21	S	C	.	.	H	α-helix	trans	-61.5	-46	173.7	-71.1	173.4	0	0	0	111	G122 V123 G129 L130 L175	G122-L126 WeakPolarHBondContact O-CG 3.43Å; G122-L126 PolarHBondContact O-N 2.96Å; V123-L126 WeakPolarHBondContact O-CB 3.45Å; V123-L126 PolarHBondContact O-N 3.3Å; L126-G129 PolarHBondContact O-N 2.84Å; L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 3.36Å; L126-L175 HydrophobicContact CD2-CB 4.48Å; L126-L175 HydrophobicContact CD2-CD2 3.84Å; L126-L175 VanDerWaalsContact CD2-O 3.29Å; L126-L175 WeakPolarHBondContact CD2-O 3.44Å
127	L	96.9	Very high	94.9	Very high	93 Å²	93	34.9 Å²	34.9	49%	0.487	20%	0.198	S	C	.	.	H	α-helix	trans	-62.5	-42.1	176.2	-69.3	174.5	0	0	0	111.8	V123 V124 L130 L131	V123-L127 HydrophobicContact CG1-CD1 4.25Å; V123-L127 HydrophobicContact CG1-CG 4.49Å; V123-L127 WeakPolarHBondContact O-CG 3.38Å; V123-L127 PolarHBondContact O-N 2.95Å; V124-L127 PolarHBondContact O-N 3.39Å; L127-L130 PolarHBondContact O-N 3.5Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.38Å
128	A	97	Very high	95.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-47.7	174	0	0	0	0	0	111.6	S87 V90 A91 V124 F125 L130 L131 V132 L174	S87-A128 PolarHBondContact OG-O 2.89Å; V90-A128 HydrophobicContact CB-CB 4.41Å; V90-A128 HydrophobicContact CG1-CB 4.13Å; A91-A128 HydrophobicContact CB-CB 3.84Å; V124-A128 WeakPolarHBondContact O-CB 3.43Å; V124-A128 PolarHBondContact O-N 3.17Å; F125-A128 PolarHBondContact O-N 3.28Å; A128-L130 VanDerWaalsContact C-N 3.28Å; A128-L130 PolarHBondContact O-N 3.49Å; A128-L131 PolarHBondContact O-N 3.27Å; A128-V132 PolarHBondContact O-N 3.49Å; A128-V132 VanDerWaalsContact O-N 3.14Å; A128-L174 HydrophobicContact CB-CD1 4.46Å
129	G	96.4	Very high	95.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.7	-40.6	176.5	0	0	0	0	0	113	F125 L126 V132 I133	F125-G129 PolarHBondContact O-N 3.36Å; L126-G129 PolarHBondContact O-N 2.84Å; G129-V132 PolarHBondContact O-N 3.33Å; G129-I133 PolarHBondContact O-N 3.38Å
130	L	96.5	Very high	95.3	Very high	89 Å²	89	38.5 Å²	38.5	47%	0.466	21%	0.207	S	C	.	.	H	α-helix	trans	-65.1	-40.2	174.4	-71	171	0	0	0	112.7	L126 L127 A128 V132 I133 V134 L175	L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 3.36Å; L127-L130 PolarHBondContact O-N 3.5Å; A128-L130 VanDerWaalsContact C-N 3.28Å; A128-L130 PolarHBondContact O-N 3.49Å; L130-V132 PolarHBondContact O-N 2.87Å; L130-I133 HydrophobicContact CD2-CG2 4.44Å; L130-I133 WeakPolarHBondContact O-CG2 3.14Å; L130-I133 PolarHBondContact O-N 2.8Å; L130-V134 VanDerWaalsContact O-CG2 3.3Å; L130-V134 WeakPolarHBondContact O-CG2 3.34Å; L130-V134 PolarHBondContact O-N 3.42Å; L130-L175 HydrophobicContact CG-CD2 4.29Å
131	L	94.9	Very high	95.3	Very high	50 Å²	50	38.9 Å²	38.9	26%	0.262	20%	0.203	S	C	.	.	H	α-helix	trans	-66.4	-21.7	177.2	-72.7	169	0	0	0	113.3	L83 I86 V90 L127 A128 P135	L83-L131 HydrophobicContact CD2-CD2 4.05Å; I86-L131 HydrophobicContact CG2-CD1 4.03Å; V90-L131 HydrophobicContact CG2-CD1 4.4Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.38Å; A128-L131 PolarHBondContact O-N 3.27Å; L131-P135 WeakPolarHBondContact O-CD 3.45Å; L131-P135 VanDerWaalsContact O-CG 3.24Å; L131-P135 WeakPolarHBondContact O-CG 3.25Å
132	V	96.1	Very high	95.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-86.9	-43.4	173.6	-179	0	0	0	0	112	V21 S87 A128 G129 L130 V134 P135 V136	V21-V132 HydrophobicContact CB-CG2 4.47Å; V21-V132 HydrophobicContact CG1-CG2 3.79Å; V21-V132 HydrophobicContact CG2-CG1 4.35Å; V21-V132 HydrophobicContact CG2-CG2 3.7Å; S87-V132 WeakPolarHBondContact OG-CG2 3.31Å; A128-V132 PolarHBondContact O-N 3.49Å; A128-V132 VanDerWaalsContact O-N 3.14Å; G129-V132 PolarHBondContact O-N 3.33Å; L130-V132 PolarHBondContact O-N 2.87Å; V132-V134 VanDerWaalsContact C-N 3.28Å; V132-V134 PolarHBondContact O-N 3.27Å; V132-P135 VanDerWaalsContact O-CD 3.22Å; V132-P135 WeakPolarHBondContact O-CD 3.31Å; V132-P135 WeakPolarHBondContact O-CG 3.31Å; V132-V136 HydrophobicContact CG1-CG2 4.04Å; V132-V136 WeakPolarHBondContact O-CB 3.19Å; V132-V136 WeakPolarHBondContact O-CG2 3.29Å; V132-V136 PolarHBondContact O-N 2.89Å
133	I	96.3	Very high	95	Very high	53 Å²	53	40.6 Å²	40.6	27%	0.272	21%	0.212	S	C	.	.	H	α-helix	trans	-66.2	-32.8	-173.9	-157.7	167.2	0	0	0	112.1	G129 L130 S137	G129-I133 PolarHBondContact O-N 3.38Å; L130-I133 HydrophobicContact CD2-CG2 4.44Å; L130-I133 WeakPolarHBondContact O-CG2 3.14Å; L130-I133 PolarHBondContact O-N 2.8Å; I133-S137 WeakPolarHBondContact O-CB 3.37Å; I133-S137 PolarHBondContact O-N 2.87Å; I133-S137 PolarHBondContact O-OG 2.93Å
134	V	95.2	Very high	94.8	Very high	85 Å²	85	40.7 Å²	40.7	52%	0.515	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-60.7	178.4	171.6	0	0	0	0	112.1	L130 V132 V136 S137 W138	L130-V134 VanDerWaalsContact O-CG2 3.3Å; L130-V134 WeakPolarHBondContact O-CG2 3.34Å; L130-V134 PolarHBondContact O-N 3.42Å; V132-V134 VanDerWaalsContact C-N 3.28Å; V132-V134 PolarHBondContact O-N 3.27Å; V134-V136 PolarHBondContact O-N 3.48Å; V134-S137 PolarHBondContact O-N 3.42Å; V134-W138 WeakPolarHBondContact O-CB 3.41Å; V134-W138 PolarHBondContact O-N 2.95Å
135	P	93.9	Very high	94.5	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-66.2	-35.1	-179.1	26	-35.6	0	0	0	113.2	A80 L83 V84 L131 V132 T139	A80-P135 HydrophobicContact CB-CB 3.73Å; L83-P135 HydrophobicContact CB-CB 4.31Å; L83-P135 HydrophobicContact CB-CG 3.89Å; L83-P135 HydrophobicContact CD1-CB 4.09Å; L83-P135 HydrophobicContact CD1-CG 4.24Å; V84-P135 HydrophobicContact CG2-CG 4.1Å; L131-P135 WeakPolarHBondContact O-CD 3.45Å; L131-P135 VanDerWaalsContact O-CG 3.24Å; L131-P135 WeakPolarHBondContact O-CG 3.25Å; V132-P135 VanDerWaalsContact O-CD 3.22Å; V132-P135 WeakPolarHBondContact O-CD 3.31Å; V132-P135 WeakPolarHBondContact O-CG 3.31Å; P135-T139 WeakPolarHBondContact O-CB 3.4Å; P135-T139 VanDerWaalsContact O-CG2 3.26Å; P135-T139 WeakPolarHBondContact O-CG2 3.42Å; P135-T139 PolarHBondContact O-N 3.28Å; P135-T139 PolarHBondContact O-OG1 3.09Å
136	V	95	Very high	94	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-45.1	177.3	173.6	0	0	0	0	110.8	W30 V132 V134 T139 A140 L164 W168	W30-V136 HydrophobicContact CH2-CG2 4.03Å; W30-V136 HydrophobicContact CZ3-CG2 4.38Å; V132-V136 HydrophobicContact CG1-CG2 4.04Å; V132-V136 WeakPolarHBondContact O-CB 3.19Å; V132-V136 WeakPolarHBondContact O-CG2 3.29Å; V132-V136 PolarHBondContact O-N 2.89Å; V134-V136 PolarHBondContact O-N 3.48Å; V136-T139 PolarHBondContact O-OG1 3.44Å; V136-A140 WeakPolarHBondContact O-CB 3.44Å; V136-A140 PolarHBondContact O-N 3.23Å; V136-L164 HydrophobicContact CG1-CB 4.22Å; V136-L164 HydrophobicContact CG1-CD2 4.03Å; V136-L164 VanDerWaalsContact CG1-O 3.31Å; V136-L164 WeakPolarHBondContact CG1-O 3.44Å; V136-W168 HydrophobicContact CG1-CD2 4.31Å; V136-W168 HydrophobicContact CG1-CG 4.08Å
137	S	95	Very high	93.5	Very high	47 Å²	47	47.7 Å²	47.7	33%	0.329	24%	0.239	S	C	.	.	H	α-helix	trans	-74.3	-34.4	-179.7	-52.2	0	0	0	0	112.1	I133 V134 A140 H141 W168	I133-S137 WeakPolarHBondContact O-CB 3.37Å; I133-S137 PolarHBondContact O-N 2.87Å; I133-S137 PolarHBondContact O-OG 2.93Å; V134-S137 PolarHBondContact O-N 3.42Å; S137-A140 PolarHBondContact O-N 2.85Å; S137-H141 WeakPolarHBondContact O-CB 3.42Å; S137-H141 PolarHBondContact O-N 2.85Å; S137-W168 PolarHBondContact OG-NE1 3.12Å; S137-W168 VanDerWaalsContact OG-NE1 3.12Å
138	W	94.3	Very high	93	Very high	146 Å²	146	52 Å²	52	55%	0.553	25%	0.25	S	C	*	.	H	α-helix	trans	-64.2	-47.9	174.7	-173.2	-94.7	0	0	0	111.8	V134 A140 H141 N142	V134-W138 WeakPolarHBondContact O-CB 3.41Å; V134-W138 PolarHBondContact O-N 2.95Å; W138-A140 VanDerWaalsContact C-N 3.35Å; W138-A140 PolarHBondContact O-N 3.4Å; W138-H141 WeakPolarHBondContact O-CB 3.4Å; W138-H141 PolarHBondContact O-N 3.38Å; W138-H141 VanDerWaalsContact O-N 3.16Å; W138-N142 PolarHBondContact NE1-ND2 3.36Å; W138-N142 PolarHBondContact O-N 3.23Å; W138-N142 PolarHBondContact O-OD1 2.96Å
139	T	91.9	Very high	92.6	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.067	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-41.4	176.4	50.5	0	0	0	0	111.8	W30 A80 P135 V136 H141 N142 I143 L164	W30-T139 HydrophobicContact CE3-CG2 4.28Å; W30-T139 HydrophobicContact CZ3-CG2 4.22Å; A80-T139 HydrophobicContact CB-CG2 4.27Å; P135-T139 WeakPolarHBondContact O-CB 3.4Å; P135-T139 VanDerWaalsContact O-CG2 3.26Å; P135-T139 WeakPolarHBondContact O-CG2 3.42Å; P135-T139 PolarHBondContact O-N 3.28Å; P135-T139 PolarHBondContact O-OG1 3.09Å; V136-T139 PolarHBondContact O-OG1 3.44Å; T139-H141 VanDerWaalsContact C-N 3.34Å; T139-H141 PolarHBondContact O-N 3.02Å; T139-N142 PolarHBondContact O-N 2.95Å; T139-I143 VanDerWaalsContact O-CG1 3.27Å; T139-I143 WeakPolarHBondContact O-CG1 3.39Å; T139-I143 PolarHBondContact O-N 2.89Å; T139-I143 VanDerWaalsContact O-N 3.07Å; T139-L164 VanDerWaalsContact OG1-CD2 3.27Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.31Å
140	A	93.1	Very high	92.2	Very high	3 Å²	3	60.7 Å²	60.7	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-42.2	172.7	0	0	0	0	0	112.3	V136 S137 W138 I143 I144 M160 L164 W168	V136-A140 WeakPolarHBondContact O-CB 3.44Å; V136-A140 PolarHBondContact O-N 3.23Å; S137-A140 PolarHBondContact O-N 2.85Å; W138-A140 VanDerWaalsContact C-N 3.35Å; W138-A140 PolarHBondContact O-N 3.4Å; A140-I143 PolarHBondContact O-N 2.79Å; A140-I144 VanDerWaalsContact O-CG1 3.32Å; A140-I144 WeakPolarHBondContact O-CG1 3.33Å; A140-I144 PolarHBondContact O-N 3.44Å; A140-M160 HydrophobicContact CB-CE 4.11Å; A140-M160 HydrophobicContact CB-SD 4.49Å; A140-L164 HydrophobicContact CB-CD1 4.31Å; A140-W168 HydrophobicContact CB-CH2 4.1Å; A140-W168 HydrophobicContact CB-CZ2 3.85Å
141	H	93.5	Very high	91.8	Very high	87 Å²	87	63.9 Å²	63.9	40%	0.403	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-46.1	177.4	-175	65.9	0	0	0	112.1	S137 W138 T139 I143 I144 Q145	S137-H141 WeakPolarHBondContact O-CB 3.42Å; S137-H141 PolarHBondContact O-N 2.85Å; W138-H141 WeakPolarHBondContact O-CB 3.4Å; W138-H141 PolarHBondContact O-N 3.38Å; W138-H141 VanDerWaalsContact O-N 3.16Å; T139-H141 VanDerWaalsContact C-N 3.34Å; T139-H141 PolarHBondContact O-N 3.02Å; H141-I143 VanDerWaalsContact C-N 3.31Å; H141-I143 PolarHBondContact O-N 2.89Å; H141-I144 PolarHBondContact O-N 3.43Å; H141-Q145 PolarHBondContact NE2-NE2 3.22Å; H141-Q145 WeakPolarHBondContact O-CG 3.31Å; H141-Q145 PolarHBondContact O-N 2.88Å
142	N	91.2	Very high	91.1	Very high	26 Å²	26	63.3 Å²	63.3	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-37.4	178.8	-67.8	-0.7	0	0	0	111.9	D76 W138 T139 Q145 D146	D76-N142 PolarHBondContact OD1-ND2 3.05Å; D76-N142 PolarHBondContact OD2-ND2 3.03Å; W138-N142 PolarHBondContact NE1-ND2 3.36Å; W138-N142 PolarHBondContact O-N 3.23Å; W138-N142 PolarHBondContact O-OD1 2.96Å; T139-N142 PolarHBondContact O-N 2.95Å; N142-Q145 PolarHBondContact O-N 3.42Å; N142-D146 WeakPolarHBondContact O-CB 3.44Å; N142-D146 PolarHBondContact O-N 3.47Å
143	I	90.3	Very high	90.4	Very high	10 Å²	10	65.9 Å²	65.9	5%	0.051	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-44.6	174	-68.9	166.2	0	0	0	110.9	R31 T139 A140 H141 D146 F147 R158 M160 L164	R31-I143 HydrophobicContact CB-CD1 4.25Å; R31-I143 HydrophobicContact CG-CD1 3.92Å; R31-I143 HydrophobicContact CG-CG1 4.08Å; T139-I143 VanDerWaalsContact O-CG1 3.27Å; T139-I143 WeakPolarHBondContact O-CG1 3.39Å; T139-I143 PolarHBondContact O-N 2.89Å; T139-I143 VanDerWaalsContact O-N 3.07Å; A140-I143 PolarHBondContact O-N 2.79Å; H141-I143 VanDerWaalsContact C-N 3.31Å; H141-I143 PolarHBondContact O-N 2.89Å; I143-D146 PolarHBondContact O-N 2.92Å; I143-F147 PolarHBondContact O-N 3.45Å; I143-F147 VanDerWaalsContact O-N 3.09Å; I143-R158 HydrophobicContact CG1-CB 4.46Å; I143-R158 HydrophobicContact CG2-CB 4.01Å; I143-R158 WeakPolarHBondContact CG2-O 3.38Å; I143-M160 HydrophobicContact CG2-CG 4.26Å; I143-L164 HydrophobicContact CD1-CD1 3.88Å
144	I	91.4	Very high	89.2	Confident	69 Å²	69	68.4 Å²	68.4	35%	0.354	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-45.1	177.1	-65.6	161.7	0	0	0	110.5	A140 H141 D146 F147 Y148 M160	A140-I144 VanDerWaalsContact O-CG1 3.32Å; A140-I144 WeakPolarHBondContact O-CG1 3.33Å; A140-I144 PolarHBondContact O-N 3.44Å; H141-I144 PolarHBondContact O-N 3.43Å; I144-D146 VanDerWaalsContact C-N 3.33Å; I144-D146 PolarHBondContact O-N 2.96Å; I144-F147 WeakPolarHBondContact O-CB 3.36Å; I144-F147 PolarHBondContact O-N 3.22Å; I144-F147 VanDerWaalsContact O-N 3.14Å; I144-Y148 HydrophobicContact CG2-CD2 3.89Å; I144-Y148 HydrophobicContact CG2-CE2 3.71Å; I144-Y148 VanDerWaalsContact O-CD2 3.24Å; I144-Y148 WeakPolarHBondContact O-CD2 3.37Å; I144-Y148 PolarHBondContact O-N 3.13Å; I144-M160 HydrophobicContact CD1-CE 3.39Å; I144-M160 HydrophobicContact CG1-CE 3.42Å; I144-M160 VanDerWaalsContact CG1-CE 3.42Å
145	Q	90.4	Very high	88	Confident	106 Å²	106	65.2 Å²	65.2	50%	0.495	35%	0.346	S	S	.	.	H	α-helix	trans	-59.1	-44.8	178.1	-75.1	-170	-19.1	0	0	111.7	H141 N142 F147 Y148 N149	H141-Q145 PolarHBondContact NE2-NE2 3.22Å; H141-Q145 WeakPolarHBondContact O-CG 3.31Å; H141-Q145 PolarHBondContact O-N 2.88Å; N142-Q145 PolarHBondContact O-N 3.42Å; Q145-F147 VanDerWaalsContact C-N 3.27Å; Q145-F147 PolarHBondContact O-N 3.41Å; Q145-Y148 PolarHBondContact O-N 2.94Å; Q145-N149 PolarHBondContact O-N 3.39Å; Q145-N149 VanDerWaalsContact O-N 3.07Å
146	D	87.3	Confident	87.1	Confident	37 Å²	37	70 Å²	70	20%	0.198	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-35.3	176.2	-82.4	-15	0	0	0	112.3	N142 I143 I144 Y148 N149 R158	N142-D146 WeakPolarHBondContact O-CB 3.44Å; N142-D146 PolarHBondContact O-N 3.47Å; I143-D146 PolarHBondContact O-N 2.92Å; I144-D146 VanDerWaalsContact C-N 3.33Å; I144-D146 PolarHBondContact O-N 2.96Å; D146-Y148 VanDerWaalsContact C-N 3.28Å; D146-Y148 PolarHBondContact O-N 3.46Å; D146-N149 PolarHBondContact O-N 3.4Å; D146-R158 WeakPolarHBondContact OD2-CD 3.4Å; D146-R158 IonicContact OD2-CZ 3.47Å; D146-R158 IonicContact OD2-NE 3.67Å; D146-R158 IonicContact OD2-NH1 2.65Å; D146-R158 PolarHBondContact OD2-NH1 3.09Å
147	F	86.1	Confident	86.4	Confident	84 Å²	84	73.3 Å²	73.3	37%	0.368	38%	0.383	S	S	.	.	H	α-helix	trans	-64.3	-33.1	179.3	-169.3	-87.4	0	0	0	113.2	I143 I144 Q145 K157	I143-F147 PolarHBondContact O-N 3.45Å; I143-F147 VanDerWaalsContact O-N 3.09Å; I144-F147 WeakPolarHBondContact O-CB 3.36Å; I144-F147 PolarHBondContact O-N 3.22Å; I144-F147 VanDerWaalsContact O-N 3.14Å; Q145-F147 VanDerWaalsContact C-N 3.27Å; Q145-F147 PolarHBondContact O-N 3.41Å; F147-K157 HydrophobicContact CD2-CB 4.08Å; F147-K157 HydrophobicContact CD2-CD 3.8Å; F147-K157 HydrophobicContact CD2-CG 4.34Å; F147-K157 HydrophobicContact CE2-CB 4.29Å; F147-K157 HydrophobicContact CE2-CD 3.64Å; F147-K157 HydrophobicContact CG-CD 4.39Å; F147-K157 HydrophobicContact CZ-CD 4.11Å; F147-K157 PolarHBondContact O-NZ 3.24Å
148	Y	87.9	Confident	86	Confident	183 Å²	183	74.9 Å²	74.9	72%	0.718	38%	0.381	S	S	*	.	H	α-helix	trans	-94.9	-5.5	178.7	-68.3	-69.8	0	0	0	113.8	I144 Q145 D146 P150	I144-Y148 HydrophobicContact CG2-CD2 3.89Å; I144-Y148 HydrophobicContact CG2-CE2 3.71Å; I144-Y148 VanDerWaalsContact O-CD2 3.24Å; I144-Y148 WeakPolarHBondContact O-CD2 3.37Å; I144-Y148 PolarHBondContact O-N 3.13Å; Q145-Y148 PolarHBondContact O-N 2.94Å; D146-Y148 VanDerWaalsContact C-N 3.28Å; D146-Y148 PolarHBondContact O-N 3.46Å; Y148-P150 WeakPolarHBondContact O-CD 3.46Å
149	N	88.4	Confident	85.8	Confident	58 Å²	58	73.1 Å²	73.1	31%	0.31	38%	0.379	S	S	.	.			trans	-74.9	118.5	-179	-173.9	-13.4	0	0	0	110.8	Q145 D146 L151 V152	Q145-N149 PolarHBondContact O-N 3.39Å; Q145-N149 VanDerWaalsContact O-N 3.07Å; D146-N149 PolarHBondContact O-N 3.4Å; N149-L151 PolarHBondContact O-N 3.46Å; N149-L151 VanDerWaalsContact O-N 3.15Å; N149-L151 VanDerWaalsContact OD1-CB 3.3Å; N149-L151 WeakPolarHBondContact OD1-CB 3.44Å; N149-L151 WeakPolarHBondContact OD1-CG 3.42Å; N149-L151 PolarHBondContact OD1-N 2.99Å; N149-V152 HydrophobicContact CB-CG2 3.95Å; N149-V152 PolarHBondContact O-N 3.19Å; N149-V152 VanDerWaalsContact O-N 3.12Å
150	P	86.4	Confident	85.7	Confident	125 Å²	125	75.1 Å²	75.1	81%	0.812	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.6	-178.9	29	-36.4	0	0	0	113.7	Y148 V152	Y148-P150 WeakPolarHBondContact O-CD 3.46Å; P150-V152 VanDerWaalsContact C-N 3.3Å
151	L	88.1	Confident	85.6	Confident	157 Å²	157	75 Å²	75	82%	0.822	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.2	176.3	-58.3	172.7	0	0	0	112.7	N149	N149-L151 PolarHBondContact O-N 3.46Å; N149-L151 VanDerWaalsContact O-N 3.15Å; N149-L151 VanDerWaalsContact OD1-CB 3.3Å; N149-L151 WeakPolarHBondContact OD1-CB 3.44Å; N149-L151 WeakPolarHBondContact OD1-CG 3.42Å; N149-L151 PolarHBondContact OD1-N 2.99Å
152	V	82	Confident	85.7	Confident	38 Å²	38	72.8 Å²	72.8	23%	0.23	38%	0.384	C	S	.	.	S	Bend	trans	-91.3	124	-179.8	-179.4	0	0	0	0	109.4	N149 P150 Q156	N149-V152 HydrophobicContact CB-CG2 3.95Å; N149-V152 PolarHBondContact O-N 3.19Å; N149-V152 VanDerWaalsContact O-N 3.12Å; P150-V152 VanDerWaalsContact C-N 3.3Å; V152-Q156 HydrophobicContact CG1-CB 4.18Å
153	A	80	Confident	85.8	Confident	54 Å²	54	71.5 Å²	71.5	45%	0.446	38%	0.377	S	S	.	.			trans	-59.9	143.8	176.5	0	0	0	0	0	111	G155 Q156	A153-G155 PolarHBondContact O-N 2.91Å; A153-G155 VanDerWaalsContact O-N 3.12Å; A153-Q156 HydrophobicContact CB-CG 4.41Å; A153-Q156 PolarHBondContact O-N 3.01Å
154	S	71.1	Confident	86	Confident	106 Å²	106	71 Å²	71	74%	0.741	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-56	-32.3	-178.4	50.2	0	0	0	0	113.6	Q156	S154-Q156 VanDerWaalsContact C-N 3.33Å
155	G	70.4	Confident	86.2	Confident	17 Å²	17	74 Å²	74	18%	0.175	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-83.1	3.4	175.7	0	0	0	0	0	115.5	F35 A153	F35-G155 WeakPolarHBondContact CA-O 3.32Å; A153-G155 PolarHBondContact O-N 2.91Å; A153-G155 VanDerWaalsContact O-N 3.12Å
156	Q	75.3	Confident	86.5	Confident	105 Å²	105	70.7 Å²	70.7	49%	0.491	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-117.7	13.7	177.3	-69.1	-170.5	-59.6	0	0	112.9	F35 V152 A153 S154 R158	F35-Q156 HydrophobicContact CD1-CG 4.21Å; F35-Q156 HydrophobicContact CE1-CG 3.68Å; F35-Q156 HydrophobicContact CZ-CG 4.47Å; V152-Q156 HydrophobicContact CG1-CB 4.18Å; A153-Q156 HydrophobicContact CB-CG 4.41Å; A153-Q156 PolarHBondContact O-N 3.01Å; S154-Q156 VanDerWaalsContact C-N 3.33Å; Q156-R158 PolarHBondContact O-N 2.84Å
157	K	80.6	Confident	86.9	Confident	71 Å²	71	69 Å²	69	31%	0.309	36%	0.36	S	S	.	.			trans	-64.2	136.2	179.5	-70.4	-171	172.6	-157.8	0	110.7	F147	F147-K157 HydrophobicContact CD2-CB 4.08Å; F147-K157 HydrophobicContact CD2-CD 3.8Å; F147-K157 HydrophobicContact CD2-CG 4.34Å; F147-K157 HydrophobicContact CE2-CB 4.29Å; F147-K157 HydrophobicContact CE2-CD 3.64Å; F147-K157 HydrophobicContact CG-CD 4.39Å; F147-K157 HydrophobicContact CZ-CD 4.11Å; F147-K157 PolarHBondContact O-NZ 3.24Å
158	R	85.3	Confident	87.5	Confident	80 Å²	80	69 Å²	69	30%	0.302	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.1	178.5	-72.7	156.1	170.6	-175.7	6.5	109.2	R31 V32 T33 I143 D146 Q156	R31-R158 HydrophobicContact CG-CB 4.17Å; R31-R158 HydrophobicContact CG-CG 4.11Å; R31-R158 VanDerWaalsContact CZ-CZ 3.43Å; R31-R158 VanDerWaalsContact NH1-NH1 3.15Å; V32-R158 CarbonylContact O-C 3.41Å; V32-R158 WeakPolarHBondContact O-CA 3.5Å; T33-R158 HydrophobicContact CG2-CB 4.24Å; T33-R158 HydrophobicContact CG2-CG 3.39Å; I143-R158 HydrophobicContact CG1-CB 4.46Å; I143-R158 HydrophobicContact CG2-CB 4.01Å; I143-R158 WeakPolarHBondContact CG2-O 3.38Å; D146-R158 WeakPolarHBondContact OD2-CD 3.4Å; D146-R158 IonicContact OD2-CZ 3.47Å; D146-R158 IonicContact OD2-NE 3.67Å; D146-R158 IonicContact OD2-NH1 2.65Å; D146-R158 PolarHBondContact OD2-NH1 3.09Å; Q156-R158 PolarHBondContact O-N 2.84Å
159	E	89.9	Confident	87.9	Confident	109 Å²	109	63.1 Å²	63.1	51%	0.509	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	155.7	174.4	-63.3	-175.1	171.2	0	0	110.2	V32 G161	V32-E159 HydrophobicContact CB-CB 4.33Å; V32-E159 PolarHBondContact N-O 2.97Å; V32-E159 PolarHBondContact O-N 3.44Å; E159-G161 PolarHBondContact O-N 3.49Å
160	M	90.4	Very high	88.3	Confident	52 Å²	52	60.3 Å²	60.3	26%	0.256	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	125.1	177.3	-65.7	-175.4	-175.1	0	0	109.9	A140 I143 I144 L164 W168	A140-M160 HydrophobicContact CB-CE 4.11Å; A140-M160 HydrophobicContact CB-SD 4.49Å; I143-M160 HydrophobicContact CG2-CG 4.26Å; I144-M160 HydrophobicContact CD1-CE 3.39Å; I144-M160 HydrophobicContact CG1-CE 3.42Å; I144-M160 VanDerWaalsContact CG1-CE 3.42Å; M160-L164 HydrophobicContact CB-CD1 4.09Å; M160-L164 HydrophobicContact CG-CD1 4.29Å; M160-W168 HydrophobicContact SD-CH2 4.28Å
161	G	92.1	Very high	88.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.			trans	-79.2	157.8	175.9	0	0	0	0	0	112.9	M29 W30 E159 S163 L164	M29-G161 CarbonylContact O-C 3.53Å; M29-G161 WeakPolarHBondContact O-CA 3.27Å; W30-G161 PolarHBondContact O-N 2.98Å; E159-G161 PolarHBondContact O-N 3.49Å; G161-S163 PolarHBondContact O-N 3.04Å; G161-L164 WeakPolarHBondContact O-CB 3.23Å; G161-L164 PolarHBondContact O-N 3.2Å; G161-L164 VanDerWaalsContact O-N 3.12Å
162	A	93.9	Very high	89.3	Confident	41 Å²	41	48.3 Å²	48.3	34%	0.339	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-29.3	-177.2	0	0	0	0	0	113.9	M29 L164 Y165 V166	M29-A162 HydrophobicContact CB-CB 4.3Å; M29-A162 HydrophobicContact CE-CB 3.87Å; M29-A162 PolarHBondContact O-N 3.04Å; M29-A162 VanDerWaalsContact O-N 3.12Å; M29-A162 HydrophobicContact SD-CB 4.13Å; A162-L164 PolarHBondContact O-N 2.95Å; A162-Y165 PolarHBondContact O-N 3.31Å; A162-V166 PolarHBondContact O-N 3.25Å
163	S	94	Very high	90	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-24.9	-179.9	73.2	0	0	0	0	112.5	C24 M29 W30 G161 V166 G167	C24-S163 PolarHBondContact SG-O 3.14Å; M29-S163 VanDerWaalsContact C-OG 3.22Å; M29-S163 WeakPolarHBondContact O-CB 3.39Å; M29-S163 PolarHBondContact O-N 3.41Å; M29-S163 PolarHBondContact O-OG 3.33Å; W30-S163 WeakPolarHBondContact CA-OG 3.48Å; W30-S163 PolarHBondContact N-OG 3.49Å; W30-S163 PolarHBondContact NE1-OG 2.86Å; G161-S163 PolarHBondContact O-N 3.04Å; S163-V166 PolarHBondContact O-N 3.14Å; S163-G167 PolarHBondContact O-N 2.95Å
164	L	94.7	Very high	90.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-41.8	176.8	-63	178.5	0	0	0	111.2	W30 V136 T139 A140 I143 M160 G161 A162 G167 W168	W30-L164 HydrophobicContact CD2-CD2 4.36Å; W30-L164 HydrophobicContact CE3-CD2 3.73Å; W30-L164 HydrophobicContact CZ3-CD2 4.07Å; W30-L164 WeakPolarHBondContact O-CD1 3.39Å; W30-L164 WeakPolarHBondContact O-CG 3.47Å; V136-L164 HydrophobicContact CG1-CB 4.22Å; V136-L164 HydrophobicContact CG1-CD2 4.03Å; V136-L164 VanDerWaalsContact CG1-O 3.31Å; V136-L164 WeakPolarHBondContact CG1-O 3.44Å; T139-L164 VanDerWaalsContact OG1-CD2 3.27Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.31Å; A140-L164 HydrophobicContact CB-CD1 4.31Å; I143-L164 HydrophobicContact CD1-CD1 3.88Å; M160-L164 HydrophobicContact CB-CD1 4.09Å; M160-L164 HydrophobicContact CG-CD1 4.29Å; G161-L164 WeakPolarHBondContact O-CB 3.23Å; G161-L164 PolarHBondContact O-N 3.2Å; G161-L164 VanDerWaalsContact O-N 3.12Å; A162-L164 PolarHBondContact O-N 2.95Å; L164-G167 PolarHBondContact O-N 3.2Å; L164-G167 VanDerWaalsContact O-N 3.17Å; L164-W168 PolarHBondContact O-N 2.79Å
165	Y	96.1	Very high	92	Very high	130 Å²	130	43.6 Å²	43.6	51%	0.51	23%	0.226	S	C	.	.	H	α-helix	trans	-64.4	-41.2	174.7	-57.4	-64.1	0	0	0	111.9	A162 G167 W168 A169	A162-Y165 PolarHBondContact O-N 3.31Å; Y165-G167 VanDerWaalsContact C-N 3.29Å; Y165-G167 PolarHBondContact O-N 3.5Å; Y165-W168 AromaticContact CD1-CE3 3.92Å; Y165-W168 HydrophobicContact CD1-CE3 3.92Å; Y165-W168 AromaticContact CD1-CZ3 3.83Å; Y165-W168 HydrophobicContact CD1-CZ3 3.83Å; Y165-W168 HydrophobicContact CE1-CE3 4.44Å; Y165-W168 AromaticContact CE1-CZ3 3.89Å; Y165-W168 HydrophobicContact CE1-CZ3 3.89Å; Y165-W168 PolarHBondContact O-N 3.09Å; Y165-A169 WeakPolarHBondContact O-CB 3.17Å; Y165-A169 PolarHBondContact O-N 3.36Å
166	V	96.4	Very high	93.2	Very high	38 Å²	38	48 Å²	48	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-40.9	173.3	-179.8	0	0	0	0	110.4	A20 L23 C24 A162 S163 A169 A170	A20-V166 HydrophobicContact CB-CG1 4.42Å; L23-V166 HydrophobicContact CD2-CG1 4.36Å; C24-V166 HydrophobicContact CB-CB 4.43Å; C24-V166 HydrophobicContact CB-CG1 4.09Å; A162-V166 PolarHBondContact O-N 3.25Å; S163-V166 PolarHBondContact O-N 3.14Å; V166-A169 PolarHBondContact O-N 3.4Å; V166-A170 WeakPolarHBondContact O-CB 3.33Å; V166-A170 PolarHBondContact O-N 3.01Å
167	G	96.4	Very high	94.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-43.5	177.1	0	0	0	0	0	113.1	S163 L164 Y165 A170 S171	S163-G167 PolarHBondContact O-N 2.95Å; L164-G167 PolarHBondContact O-N 3.2Å; L164-G167 VanDerWaalsContact O-N 3.17Å; Y165-G167 VanDerWaalsContact C-N 3.29Å; Y165-G167 PolarHBondContact O-N 3.5Å; G167-A170 PolarHBondContact O-N 2.84Å; G167-S171 WeakPolarHBondContact O-CB 3.42Å; G167-S171 PolarHBondContact O-N 2.88Å; G167-S171 PolarHBondContact O-OG 3.42Å
168	W	97.7	Very high	94.8	Very high	86 Å²	86	39.7 Å²	39.7	33%	0.326	21%	0.207	S	C	.	.	H	α-helix	trans	-63.2	-47.7	173.4	-77.4	-34.6	0	0	0	112	V136 S137 A140 M160 L164 Y165 A170 S171 G172	V136-W168 HydrophobicContact CG1-CD2 4.31Å; V136-W168 HydrophobicContact CG1-CG 4.08Å; S137-W168 PolarHBondContact OG-NE1 3.12Å; S137-W168 VanDerWaalsContact OG-NE1 3.12Å; A140-W168 HydrophobicContact CB-CH2 4.1Å; A140-W168 HydrophobicContact CB-CZ2 3.85Å; M160-W168 HydrophobicContact SD-CH2 4.28Å; L164-W168 PolarHBondContact O-N 2.79Å; Y165-W168 AromaticContact CD1-CE3 3.92Å; Y165-W168 HydrophobicContact CD1-CE3 3.92Å; Y165-W168 AromaticContact CD1-CZ3 3.83Å; Y165-W168 HydrophobicContact CD1-CZ3 3.83Å; Y165-W168 HydrophobicContact CE1-CE3 4.44Å; Y165-W168 AromaticContact CE1-CZ3 3.89Å; Y165-W168 HydrophobicContact CE1-CZ3 3.89Å; Y165-W168 PolarHBondContact O-N 3.09Å; W168-A170 VanDerWaalsContact C-N 3.32Å; W168-A170 PolarHBondContact O-N 3.12Å; W168-S171 PolarHBondContact O-N 3.18Å; W168-S171 PolarHBondContact O-OG 3.3Å; W168-G172 PolarHBondContact O-N 3.26Å
169	A	97.4	Very high	95.2	Very high	58 Å²	58	37 Å²	37	48%	0.479	20%	0.204	S	C	.	.	H	α-helix	trans	-58.6	-45	176	0	0	0	0	0	111.6	Y165 V166 S171 G172 L173	Y165-A169 WeakPolarHBondContact O-CB 3.17Å; Y165-A169 PolarHBondContact O-N 3.36Å; V166-A169 PolarHBondContact O-N 3.4Å; A169-S171 PolarHBondContact O-N 3.01Å; A169-G172 PolarHBondContact O-N 3.05Å; A169-L173 VanDerWaalsContact O-CG 3.31Å; A169-L173 WeakPolarHBondContact O-CG 3.47Å; A169-L173 PolarHBondContact O-N 2.96Å
170	A	96.9	Very high	95.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-46	177.5	0	0	0	0	0	112	A20 V21 V166 G167 W168 G172 L173 L174	A20-A170 HydrophobicContact CB-CB 3.56Å; V21-A170 HydrophobicContact CG2-CB 3.71Å; V166-A170 WeakPolarHBondContact O-CB 3.33Å; V166-A170 PolarHBondContact O-N 3.01Å; G167-A170 PolarHBondContact O-N 2.84Å; W168-A170 VanDerWaalsContact C-N 3.32Å; W168-A170 PolarHBondContact O-N 3.12Å; A170-G172 PolarHBondContact O-N 2.85Å; A170-L173 PolarHBondContact O-N 3.38Å; A170-L174 WeakPolarHBondContact O-CB 3.32Å; A170-L174 WeakPolarHBondContact O-CG 3.28Å; A170-L174 PolarHBondContact O-N 3.5Å
171	S	96.9	Very high	95.3	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-41.3	176.5	72.8	0	0	0	0	111.9	G167 W168 A169 L174 L175	G167-S171 WeakPolarHBondContact O-CB 3.42Å; G167-S171 PolarHBondContact O-N 2.88Å; G167-S171 PolarHBondContact O-OG 3.42Å; W168-S171 PolarHBondContact O-N 3.18Å; W168-S171 PolarHBondContact O-OG 3.3Å; A169-S171 PolarHBondContact O-N 3.01Å; S171-L174 PolarHBondContact O-N 3.37Å; S171-L175 WeakPolarHBondContact O-CB 3.3Å; S171-L175 WeakPolarHBondContact O-CG 3.36Å; S171-L175 PolarHBondContact O-N 3.45Å
172	G	97.1	Very high	95.1	Very high	27 Å²	27	33.6 Å²	33.6	28%	0.278	19%	0.193	S	C	.	.	H	α-helix	trans	-63	-44.2	176.3	0	0	0	0	0	112.3	W168 A169 A170 L175 L176	W168-G172 PolarHBondContact O-N 3.26Å; A169-G172 PolarHBondContact O-N 3.05Å; A170-G172 PolarHBondContact O-N 2.85Å; G172-L175 PolarHBondContact O-N 2.93Å; G172-L176 WeakPolarHBondContact O-CB 3.31Å; G172-L176 VanDerWaalsContact O-CG 3.25Å; G172-L176 WeakPolarHBondContact O-CG 3.47Å; G172-L176 PolarHBondContact O-N 2.9Å
173	L	97	Very high	94.5	Very high	51 Å²	51	35.8 Å²	35.8	27%	0.267	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-42.7	175.9	-70.4	172.4	0	0	0	112.3	L13 L16 A169 A170 G177	L13-L173 HydrophobicContact CD2-CD2 3.68Å; L16-L173 HydrophobicContact CB-CD1 4.43Å; A169-L173 VanDerWaalsContact O-CG 3.31Å; A169-L173 WeakPolarHBondContact O-CG 3.47Å; A169-L173 PolarHBondContact O-N 2.96Å; A170-L173 PolarHBondContact O-N 3.38Å; L173-G177 PolarHBondContact O-N 3.32Å
174	L	96.8	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-42.5	175.7	-77.8	173.3	0	0	0	112.2	A14 V21 F125 A128 A170 S171 G178	A14-L174 WeakPolarHBondContact O-CD2 3.24Å; V21-L174 HydrophobicContact CG2-CD1 3.59Å; F125-L174 HydrophobicContact CD1-CD2 3.79Å; F125-L174 HydrophobicContact CE1-CD2 4.38Å; A128-L174 HydrophobicContact CB-CD1 4.46Å; A170-L174 WeakPolarHBondContact O-CB 3.32Å; A170-L174 WeakPolarHBondContact O-CG 3.28Å; A170-L174 PolarHBondContact O-N 3.5Å; S171-L174 PolarHBondContact O-N 3.37Å; L174-G178 PolarHBondContact O-N 3.32Å
175	L	97	Very high	91.6	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-44.9	179.2	-72.4	172.7	0	0	0	111.8	L126 L130 S171 G172 G179	L126-L175 HydrophobicContact CD2-CB 4.48Å; L126-L175 HydrophobicContact CD2-CD2 3.84Å; L126-L175 VanDerWaalsContact CD2-O 3.29Å; L126-L175 WeakPolarHBondContact CD2-O 3.44Å; L130-L175 HydrophobicContact CG-CD2 4.29Å; S171-L175 WeakPolarHBondContact O-CB 3.3Å; S171-L175 WeakPolarHBondContact O-CG 3.36Å; S171-L175 PolarHBondContact O-N 3.45Å; G172-L175 PolarHBondContact O-N 2.93Å; L175-G179 PolarHBondContact O-N 2.75Å
176	L	96.1	Very high	89.8	Confident	111 Å²	111	37.9 Å²	37.9	58%	0.581	24%	0.235	S	C	*	.	H	α-helix	trans	-65.7	-46.8	176.1	-70	173.9	0	0	0	111.1	G172 G178 G179 L180	G172-L176 WeakPolarHBondContact O-CB 3.31Å; G172-L176 VanDerWaalsContact O-CG 3.25Å; G172-L176 WeakPolarHBondContact O-CG 3.47Å; G172-L176 PolarHBondContact O-N 2.9Å; L176-G178 PolarHBondContact O-N 3.49Å; L176-G179 PolarHBondContact O-N 2.98Å; L176-L180 VanDerWaalsContact O-CG 3.23Å; L176-L180 WeakPolarHBondContact O-CG 2.9Å; L176-L180 PolarHBondContact O-N 3.41Å
177	G	94.5	Very high	87.8	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-49.8	176.3	0	0	0	0	0	112	G10 L173 G179 L180 L181	G10-G177 WeakPolarHBondContact O-CA 3.41Å; L173-G177 PolarHBondContact O-N 3.32Å; G177-G179 PolarHBondContact O-N 3.01Å; G177-L180 PolarHBondContact O-N 3.47Å; G177-L181 VanDerWaalsContact O-CG 3.31Å; G177-L181 WeakPolarHBondContact O-CG 3.43Å; G177-L181 PolarHBondContact O-N 2.91Å; G177-L181 VanDerWaalsContact O-N 3.14Å
178	G	94.3	Very high	85.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-42.9	176.6	0	0	0	0	0	113.1	G122 L174 L176 L181 C182	G122-G178 WeakPolarHBondContact CA-O 3.11Å; G122-G178 WeakPolarHBondContact O-CA 3.32Å; L174-G178 PolarHBondContact O-N 3.32Å; L176-G178 PolarHBondContact O-N 3.49Å; G178-L181 PolarHBondContact O-N 2.83Å; G178-C182 PolarHBondContact O-N 2.77Å; G178-C182 PolarHBondContact O-SG 2.82Å
179	G	93.6	Very high	83.3	Confident	24 Å²	24	51 Å²	51	25%	0.247	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-46.4	176.4	0	0	0	0	0	112.7	L175 L176 G177 L181 C182 C183	L175-G179 PolarHBondContact O-N 2.75Å; L176-G179 PolarHBondContact O-N 2.98Å; G177-G179 PolarHBondContact O-N 3.01Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.7Å; G179-C182 PolarHBondContact O-N 3.06Å; G179-C183 PolarHBondContact O-N 2.75Å; G179-C183 PolarHBondContact O-SG 3.43Å
180	L	92.2	Very high	80.9	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.267	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-35.7	177.4	-65.3	169.3	0	0	0	112	L6 L13 L176 G177 C183	L6-L180 HydrophobicContact CD1-CB 4.41Å; L6-L180 HydrophobicContact CD1-CD2 3.63Å; L6-L180 HydrophobicContact CD1-CG 4.45Å; L13-L180 HydrophobicContact CD1-CD1 3.72Å; L176-L180 VanDerWaalsContact O-CG 3.23Å; L176-L180 WeakPolarHBondContact O-CG 2.9Å; L176-L180 PolarHBondContact O-N 3.41Å; G177-L180 PolarHBondContact O-N 3.47Å; L180-C183 PolarHBondContact O-N 3.36Å
181	L	89.9	Confident	78.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71	-35.5	175.8	-67.3	-179.3	0	0	0	112.9	Q7 I11 M118 F125 G177 G178 G179 C183 N184	Q7-L181 HydrophobicContact CG-CD2 4.22Å; I11-L181 HydrophobicContact CG1-CD1 4.44Å; I11-L181 HydrophobicContact CG1-CD2 4.11Å; M118-L181 HydrophobicContact CE-CD1 3.98Å; M118-L181 HydrophobicContact CE-CD2 3.47Å; M118-L181 VanDerWaalsContact CE-CD2 3.47Å; M118-L181 HydrophobicContact CE-CG 4.24Å; F125-L181 HydrophobicContact CD2-CD1 3.91Å; F125-L181 HydrophobicContact CE2-CD1 3.99Å; G177-L181 VanDerWaalsContact O-CG 3.31Å; G177-L181 WeakPolarHBondContact O-CG 3.43Å; G177-L181 PolarHBondContact O-N 2.91Å; G177-L181 VanDerWaalsContact O-N 3.14Å; G178-L181 PolarHBondContact O-N 2.83Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.7Å; L181-C183 VanDerWaalsContact C-N 3.35Å; L181-N184 WeakPolarHBondContact O-CB 3.3Å; L181-N184 PolarHBondContact O-N 3.37Å; L181-N184 PolarHBondContact O-ND2 2.83Å
182	C	87.7	Confident	75.9	Confident	39 Å²	39	67.3 Å²	67.3	26%	0.264	38%	0.379	S	S	.	.	H	α-helix	trans	-68.7	-30.5	174.2	-71.2	0	0	0	0	113.1	V123 G178 G179 N184	V123-C182 PolarHBondContact N-SG 2.94Å; G178-C182 PolarHBondContact O-N 2.77Å; G178-C182 PolarHBondContact O-SG 2.82Å; G179-C182 PolarHBondContact O-N 3.06Å; C182-N184 PolarHBondContact O-N 3.29Å; C182-N184 VanDerWaalsContact O-N 3.09Å
183	C	81.5	Confident	73.7	Confident	86 Å²	86	76.9 Å²	76.9	58%	0.581	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-1.6	177.3	-69	0	0	0	0	114.1	G179 L180 L181 C185	G179-C183 PolarHBondContact O-N 2.75Å; G179-C183 PolarHBondContact O-SG 3.43Å; L180-C183 PolarHBondContact O-N 3.36Å; L181-C183 VanDerWaalsContact C-N 3.35Å; C183-C185 VanDerWaalsContact C-N 3.3Å; C183-C185 PolarHBondContact O-N 3.39Å
184	N	70.1	Confident	71.5	Confident	12 Å²	12	79 Å²	79	6%	0.064	43%	0.427	C	S	.	.			trans	-69.1	84.8	170.5	-73.4	-25.2	0	0	0	110.3	A2 I119 L181 C182 P186	A2-N184 WeakPolarHBondContact CB-OD1 3.48Å; I119-N184 WeakPolarHBondContact CD1-O 3.07Å; L181-N184 WeakPolarHBondContact O-CB 3.3Å; L181-N184 PolarHBondContact O-N 3.37Å; L181-N184 PolarHBondContact O-ND2 2.83Å; C182-N184 PolarHBondContact O-N 3.29Å; C182-N184 VanDerWaalsContact O-N 3.09Å; N184-P186 WeakPolarHBondContact O-CD 3.33Å; N184-P186 VanDerWaalsContact O-N 3.15Å
185	C	58.5	Low	69.7	Low	96 Å²	96	82.1 Å²	82.1	65%	0.649	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-57.4	122	172.3	-74.5	0	0	0	0	109.7	C183	C183-C185 VanDerWaalsContact C-N 3.3Å; C183-C185 PolarHBondContact O-N 3.39Å
186	P	58.4	Low	67.6	Low	67 Å²	67	88.7 Å²	88.7	44%	0.435	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-59.4	144.3	173.2	24	-29.8	0	0	0	108.3	I119 N184 R188	I119-P186 HydrophobicContact CD1-CG 4.48Å; N184-P186 WeakPolarHBondContact O-CD 3.33Å; N184-P186 VanDerWaalsContact O-N 3.15Å; P186-R188 PolarHBondContact O-N 2.85Å
187	P	54.1	Low	65.9	Low	61 Å²	61	93.9 Å²	93.9	40%	0.396	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-54.2	120.4	169.7	22	-28.8	0	0	0	107.3	T189	P187-T189 PolarHBondContact O-N 3.08Å
188	R	51.1	Low	64.4	Low	212 Å²	212	99.4 Å²	99.4	80%	0.8	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-50.7	116.4	173.6	-136.2	177.7	178.4	123.5	-0.7	105.1	P186 D190	P186-R188 PolarHBondContact O-N 2.85Å; R188-D190 WeakPolarHBondContact CD-OD1 3.31Å; R188-D190 PolarHBondContact O-N 3.4Å
189	T	49.4	Very low	63	Low	126 Å²	126	103.9 Å²	103.9	77%	0.773	57%	0.569	S	S	*	*			trans	-72.2	73.8	166.3	-33.5	0	0	0	0	104.9	P187 K191	P187-T189 PolarHBondContact O-N 3.08Å; T189-K191 PolarHBondContact O-N 3.16Å
190	D	45.1	Very low	61.6	Low	116 Å²	116	107.2 Å²	107.2	62%	0.62	59%	0.594	S	S	*	*			trans	-63.9	85	161.7	-70.6	-34.8	0	0	0	103.8	R188 P192	R188-D190 WeakPolarHBondContact CD-OD1 3.31Å; R188-D190 PolarHBondContact O-N 3.4Å; D190-P192 VanDerWaalsContact C-N 3.3Å; D190-P192 WeakPolarHBondContact O-CD 2.73Å; D190-P192 VanDerWaalsContact O-N 3.08Å
191	K	45.3	Very low	60.1	Low	176 Å²	176	116.7 Å²	116.7	77%	0.765	63%	0.626	S	S	*	*			trans	-56	110	147.7	-74	-177.5	178	178.9	0	102.2	T189 Y193	T189-K191 PolarHBondContact O-N 3.16Å; K191-Y193 VanDerWaalsContact C-N 3.33Å; K191-Y193 PolarHBondContact O-N 3.05Å
192	P	44.5	Very low	58.7	Low	112 Å²	112	122.4 Å²	122.4	73%	0.727	67%	0.666	S	S	*	*			trans	-56.7	114	169.4	24.2	-29.6	0	0	0	103.8	D190 S194	D190-P192 VanDerWaalsContact C-N 3.3Å; D190-P192 WeakPolarHBondContact O-CD 2.73Å; D190-P192 VanDerWaalsContact O-N 3.08Å; P192-S194 PolarHBondContact O-N 2.99Å
193	Y	50.8	Low	57.5	Low	228 Å²	228	125.1 Å²	125.1	89%	0.894	69%	0.692	S	S	*	*			trans	-63	89.7	166	-140.2	-89	0	0	0	103	K191 A195	K191-Y193 VanDerWaalsContact C-N 3.33Å; K191-Y193 PolarHBondContact O-N 3.05Å; Y193-A195 PolarHBondContact O-N 3.19Å
194	S	50.3	Low	56.6	Low	95 Å²	95	125.6 Å²	125.6	66%	0.664	70%	0.702	S	S	*	*			trans	-67.5	83.8	170.5	179.9	0	0	0	0	104.2	P192 K196	P192-S194 PolarHBondContact O-N 2.99Å; S194-K196 PolarHBondContact O-N 3.09Å
195	A	59	Low	56	Low	66 Å²	66	129.3 Å²	129.3	55%	0.545	73%	0.734	S	S	.	*			trans	-60.3	93.4	159.4	0	0	0	0	0	104.6	Y193 Y197	Y193-A195 PolarHBondContact O-N 3.19Å; A195-Y197 HydrophobicContact CB-CD2 4.46Å; A195-Y197 PolarHBondContact O-N 3.3Å
196	K	53.2	Low	55.6	Low	184 Å²	184	128.2 Å²	128.2	80%	0.8	73%	0.728	S	S	*	*			trans	-61.8	92.1	166.7	-76.6	-176.5	176.9	179.9	0	106	S194 S198	S194-K196 PolarHBondContact O-N 3.09Å; K196-S198 PolarHBondContact O-N 2.96Å
197	Y	61.7	Low	55.2	Low	220 Å²	220	132.6 Å²	132.6	86%	0.863	75%	0.747	S	S	*	*			trans	-64.3	106.3	164.1	-96.5	-91.3	0	0	0	106.5	A195 A199	A195-Y197 HydrophobicContact CB-CD2 4.46Å; A195-Y197 PolarHBondContact O-N 3.3Å; Y197-A199 PolarHBondContact O-N 2.96Å; Y197-A199 VanDerWaalsContact O-N 3.13Å
198	S	62.2	Low	54.9	Low	116 Å²	116	139.2 Å²	139.2	81%	0.811	77%	0.766	S	S	*	*			trans	-61.9	112.4	163.4	-72.8	0	0	0	0	107.2	K196 A200	K196-S198 PolarHBondContact O-N 2.96Å; S198-A200 PolarHBondContact O-N 3.13Å
199	A	65.3	Low	54.7	Low	94 Å²	94	139.5 Å²	139.5	78%	0.777	79%	0.791	S	S	*	*			trans	-56.4	132	171.9	0	0	0	0	0	109	Y197 R201	Y197-A199 PolarHBondContact O-N 2.96Å; Y197-A199 VanDerWaalsContact O-N 3.13Å; A199-R201 PolarHBondContact O-N 3.4Å
200	A	63.2	Low	55	Low	94 Å²	94	140.2 Å²	140.2	78%	0.777	79%	0.792	S	S	*	*			trans	-59.5	127.3	174.6	0	0	0	0	0	109	S198 S202	S198-A200 PolarHBondContact O-N 3.13Å; A200-S202 PolarHBondContact O-N 3.13Å; A200-S202 VanDerWaalsContact O-N 3.16Å
201	R	61.3	Low	55.5	Low	250 Å²	250	141.5 Å²	141.5	94%	0.943	80%	0.801	S	S	*	*			trans	-64.9	113.4	174.8	-124.6	178.8	-174.3	176.5	1.1	107.9	A199 A203	A199-R201 PolarHBondContact O-N 3.4Å; R201-A203 PolarHBondContact O-N 3.16Å; R201-A203 VanDerWaalsContact O-N 3.13Å
202	S	60.8	Low	56.1	Low	120 Å²	120	139.6 Å²	139.6	84%	0.839	80%	0.803	S	S	*	*			trans	-60.2	114.2	172.1	-41.2	0	0	0	0	108.7	A200 A204	A200-S202 PolarHBondContact O-N 3.13Å; A200-S202 VanDerWaalsContact O-N 3.16Å; S202-A204 PolarHBondContact O-N 3.29Å
203	A	62.8	Low	56.7	Low	97 Å²	97	141.2 Å²	141.2	80%	0.802	81%	0.807	S	S	*	*			trans	-69.2	123.9	170.1	0	0	0	0	0	108.2	R201 A205	R201-A203 PolarHBondContact O-N 3.16Å; R201-A203 VanDerWaalsContact O-N 3.13Å; A203-A205 PolarHBondContact O-N 3.35Å
204	A	61	Low	57.1	Low	96 Å²	96	135.8 Å²	135.8	79%	0.793	80%	0.801	S	S	*	*			trans	-63	125.6	173.2	0	0	0	0	0	109	S202 S206	S202-A204 PolarHBondContact O-N 3.29Å; A204-S206 PolarHBondContact O-N 3.1Å; A204-S206 VanDerWaalsContact O-N 3.1Å
205	A	58.2	Low	57.6	Low	90 Å²	90	138.5 Å²	138.5	74%	0.744	81%	0.811	S	S	*	*			trans	-63.2	112.3	172	0	0	0	0	0	108.6	A203 N207	A203-A205 PolarHBondContact O-N 3.35Å; A205-N207 PolarHBondContact O-N 3.23Å
206	S	49.3	Very low	57.5	Low	73 Å²	73	143.6 Å²	143.6	51%	0.51	83%	0.83	S	S	.	*			trans	-70.9	109.9	172.4	-173	0	0	0	0	108.2	A204 Y208	A204-S206 PolarHBondContact O-N 3.1Å; A204-S206 VanDerWaalsContact O-N 3.1Å; S206-Y208 WeakPolarHBondContact O-CD2 3.37Å; S206-Y208 PolarHBondContact O-N 3.33Å; S206-Y208 WeakPolarHBondContact OG-CE2 3.33Å; S206-Y208 PolarHBondContact OG-OH 3.33Å
207	N	50.6	Low	57.8	Low	158 Å²	158	140.5 Å²	140.5	85%	0.845	83%	0.832	S	S	*	*			trans	-64.7	120.1	167.3	-71.5	-73.1	0	0	0	108.2	A205	A205-N207 PolarHBondContact O-N 3.23Å
208	Y	48.4	Very low	57.5	Low	201 Å²	201	133.9 Å²	133.9	79%	0.788	83%	0.829	S	S	*	*			trans	-109.2	127.2	163.9	-62.4	-80.8	0	0	0	107.7	S206	S206-Y208 WeakPolarHBondContact O-CD2 3.37Å; S206-Y208 PolarHBondContact O-N 3.33Å; S206-Y208 WeakPolarHBondContact OG-CE2 3.33Å; S206-Y208 PolarHBondContact OG-OH 3.33Å
209	V	46.8	Very low	57	Low	218 Å²	218	135.5 Å²	135.5	100%	1.321	83%	0.831	S	S	*	*			trans	-23.3	0	178.6	-176.7	0	0	0	0	116.1

Retrieved 209 of 209 residues in 37.7 ms (Link to these results)

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