A0A077ZDV2_TRITR Loading...

Claudin 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDV2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 325 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	55.8	Low	82.8	Confident	199 Å²	199	65.5 Å²	65.5	98%	0.98	36%	0.36	S	S	*	.				0	-29.6	0	-75	-161.8	-172.4	0	0	114.2	S3 P4 E266	M1-S3 VanDerWaalsContact C-N 3.34Å; M1-P4 WeakPolarHBondContact O-CD 2.97Å; M1-E266 PolarHBondContact N-OE1 3.46Å
2	L	77.6	Confident	83.6	Confident	107 Å²	107	66.3 Å²	66.3	56%	0.56	37%	0.368	S	S	*	.	H	α-helix	trans	-72.8	-28.1	-179	-164.2	71.1	0	0	0	113	V5 I6	L2-V5 PolarHBondContact O-N 3.13Å; L2-I6 HydrophobicContact CD2-CD1 3.88Å; L2-I6 HydrophobicContact CG-CD1 3.8Å; L2-I6 HydrophobicContact CG-CG1 4.2Å; L2-I6 WeakPolarHBondContact O-CG1 2.93Å; L2-I6 PolarHBondContact O-N 2.99Å; L2-I6 VanDerWaalsContact O-N 3.16Å
3	S	76.8	Confident	84.3	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.014	36%	0.358	C	S	.	.	H	α-helix	trans	-52.2	-55.3	-177.3	174.8	0	0	0	0	115.2	M1 V5 I6 L7 M263 E266	M1-S3 VanDerWaalsContact C-N 3.34Å; S3-V5 VanDerWaalsContact C-N 3.27Å; S3-V5 PolarHBondContact O-N 3.36Å; S3-I6 PolarHBondContact O-N 3.04Å; S3-L7 WeakPolarHBondContact O-CG 3.12Å; S3-L7 PolarHBondContact O-N 3.04Å; S3-L7 VanDerWaalsContact O-N 3.09Å; S3-M263 WeakPolarHBondContact OG-CG 3.26Å; S3-E266 VanDerWaalsContact CB-OE2 3.3Å; S3-E266 WeakPolarHBondContact CB-OE2 3.42Å
4	P	82.5	Confident	84.7	Confident	76 Å²	76	61.2 Å²	61.2	49%	0.494	34%	0.335	S	S	.	.	H	α-helix	trans	-63.6	-30.6	-178.5	23.8	-35.3	0	0	0	113.7	M1 S8	M1-P4 WeakPolarHBondContact O-CD 2.97Å; P4-S8 PolarHBondContact O-N 3.31Å
5	V	86.9	Confident	85.2	Confident	70 Å²	70	63.6 Å²	63.6	42%	0.424	35%	0.347	S	S	.	.	H	α-helix	trans	-70.8	-41.8	178.1	179.8	0	0	0	0	110.6	L2 S3 L7 S8 F9	L2-V5 PolarHBondContact O-N 3.13Å; S3-V5 VanDerWaalsContact C-N 3.27Å; S3-V5 PolarHBondContact O-N 3.36Å; V5-L7 VanDerWaalsContact C-N 3.32Å; V5-L7 PolarHBondContact O-N 3.41Å; V5-S8 PolarHBondContact O-N 3.49Å; V5-S8 PolarHBondContact O-OG 3.12Å; V5-F9 HydrophobicContact CG1-CD2 3.83Å; V5-F9 HydrophobicContact CG1-CE2 3.63Å; V5-F9 WeakPolarHBondContact O-CD2 2.7Å; V5-F9 PolarHBondContact O-N 2.96Å
6	I	87.5	Confident	85.8	Confident	22 Å²	22	65 Å²	65	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-65	-40.4	176.7	-62.4	172	0	0	0	110.5	L2 S3 S8 F9 S10 L255 V258 A259	L2-I6 HydrophobicContact CD2-CD1 3.88Å; L2-I6 HydrophobicContact CG-CD1 3.8Å; L2-I6 HydrophobicContact CG-CG1 4.2Å; L2-I6 WeakPolarHBondContact O-CG1 2.93Å; L2-I6 PolarHBondContact O-N 2.99Å; L2-I6 VanDerWaalsContact O-N 3.16Å; S3-I6 PolarHBondContact O-N 3.04Å; I6-S8 VanDerWaalsContact C-N 3.34Å; I6-S8 PolarHBondContact O-N 3.41Å; I6-F9 PolarHBondContact O-N 3.45Å; I6-S10 WeakPolarHBondContact O-CB 3.3Å; I6-S10 PolarHBondContact O-N 3.17Å; I6-L255 HydrophobicContact CG2-CB 4.06Å; I6-L255 HydrophobicContact CG2-CD2 4.18Å; I6-L255 VanDerWaalsContact CG2-O 3.27Å; I6-L255 WeakPolarHBondContact CG2-O 2.79Å; I6-V258 HydrophobicContact CD1-CG1 4.09Å; I6-A259 HydrophobicContact CB-CB 4.23Å; I6-A259 HydrophobicContact CG2-CB 3.82Å
7	L	85	Confident	86.2	Confident	23 Å²	23	61.2 Å²	61.2	12%	0.12	33%	0.332	C	S	.	.	H	α-helix	trans	-62.6	-39.6	176.3	-70.7	171.6	0	0	0	112.4	S3 V5 S10 S11 I174 M256 A259 M263	S3-L7 WeakPolarHBondContact O-CG 3.12Å; S3-L7 PolarHBondContact O-N 3.04Å; S3-L7 VanDerWaalsContact O-N 3.09Å; V5-L7 VanDerWaalsContact C-N 3.32Å; V5-L7 PolarHBondContact O-N 3.41Å; L7-S10 PolarHBondContact O-N 3.17Å; L7-S11 PolarHBondContact O-N 3.18Å; L7-S11 PolarHBondContact O-OG 2.93Å; L7-I174 HydrophobicContact CD2-CD1 4.37Å; L7-I174 HydrophobicContact CD2-CG2 4.18Å; L7-M256 HydrophobicContact CD2-CE 4.47Å; L7-M256 HydrophobicContact CD2-SD 3.63Å; L7-A259 HydrophobicContact CD2-CB 3.47Å; L7-A259 VanDerWaalsContact CD2-CB 3.47Å; L7-A259 HydrophobicContact CG-CB 3.77Å; L7-M263 HydrophobicContact CD1-SD 3.83Å
8	S	89.7	Confident	86.5	Confident	60 Å²	60	58.3 Å²	58.3	42%	0.42	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-42	177.9	68.5	0	0	0	0	112.2	P4 V5 I6 S10 S11 V12	P4-S8 PolarHBondContact O-N 3.31Å; V5-S8 PolarHBondContact O-N 3.49Å; V5-S8 PolarHBondContact O-OG 3.12Å; I6-S8 VanDerWaalsContact C-N 3.34Å; I6-S8 PolarHBondContact O-N 3.41Å; S8-S10 VanDerWaalsContact C-N 3.33Å; S8-S10 PolarHBondContact O-N 3.36Å; S8-S11 PolarHBondContact O-N 3.38Å; S8-S11 PolarHBondContact O-OG 2.96Å; S8-V12 WeakPolarHBondContact O-CG2 3.44Å; S8-V12 PolarHBondContact O-N 3.43Å; S8-V12 VanDerWaalsContact O-N 3.15Å
9	F	90.4	Very high	87	Confident	116 Å²	116	59.3 Å²	59.3	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-44.3	172.7	-82.4	-67.6	0	0	0	111.5	V5 I6 S11 V12 F13 L255	V5-F9 HydrophobicContact CG1-CD2 3.83Å; V5-F9 HydrophobicContact CG1-CE2 3.63Å; V5-F9 WeakPolarHBondContact O-CD2 2.7Å; V5-F9 PolarHBondContact O-N 2.96Å; I6-F9 PolarHBondContact O-N 3.45Å; F9-S11 VanDerWaalsContact C-N 3.33Å; F9-S11 PolarHBondContact O-N 3.36Å; F9-V12 PolarHBondContact O-N 2.91Å; F9-F13 HydrophobicContact CB-CD2 4.46Å; F9-F13 HydrophobicContact CB-CE2 4.35Å; F9-F13 HydrophobicContact CD1-CE2 4.28Å; F9-F13 WeakPolarHBondContact O-CD2 3.18Å; F9-F13 PolarHBondContact O-N 2.9Å; F9-L255 HydrophobicContact CB-CD1 4.25Å
10	S	89.4	Confident	87.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-44.5	178.8	179.7	0	0	0	0	112.2	I6 L7 S8 F13 S14 S252 M256	I6-S10 WeakPolarHBondContact O-CB 3.3Å; I6-S10 PolarHBondContact O-N 3.17Å; L7-S10 PolarHBondContact O-N 3.17Å; S8-S10 VanDerWaalsContact C-N 3.33Å; S8-S10 PolarHBondContact O-N 3.36Å; S10-F13 PolarHBondContact O-N 3.22Å; S10-S14 WeakPolarHBondContact O-CB 3.04Å; S10-S14 PolarHBondContact O-N 3.43Å; S10-S252 WeakPolarHBondContact O-CB 3.04Å; S10-S252 PolarHBondContact O-OG 2.89Å; S10-S252 PolarHBondContact OG-O 3.46Å; S10-S252 PolarHBondContact OG-OG 2.76Å; S10-S252 VanDerWaalsContact OG-OG 3.12Å; S10-M256 WeakPolarHBondContact OG-CE 3.27Å; S10-M256 WeakPolarHBondContact OG-CG 3.15Å
11	S	89.3	Confident	87.7	Confident	46 Å²	46	55.4 Å²	55.4	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-66.2	-39.3	179.7	67.6	0	0	0	0	112.4	L7 S8 F9 S14 L15	L7-S11 PolarHBondContact O-N 3.18Å; L7-S11 PolarHBondContact O-OG 2.93Å; S8-S11 PolarHBondContact O-N 3.38Å; S8-S11 PolarHBondContact O-OG 2.96Å; F9-S11 VanDerWaalsContact C-N 3.33Å; F9-S11 PolarHBondContact O-N 3.36Å; S11-S14 WeakPolarHBondContact O-CB 3.16Å; S11-S14 PolarHBondContact O-N 2.88Å; S11-L15 WeakPolarHBondContact O-CG 3.38Å; S11-L15 PolarHBondContact O-N 3.4Å
12	V	92.6	Very high	89.5	Confident	75 Å²	75	50 Å²	50	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-49.6	174.8	172.3	0	0	0	0	111.2	S8 F9 S14 L15 L16	S8-V12 WeakPolarHBondContact O-CG2 3.44Å; S8-V12 PolarHBondContact O-N 3.43Å; S8-V12 VanDerWaalsContact O-N 3.15Å; F9-V12 PolarHBondContact O-N 2.91Å; V12-S14 VanDerWaalsContact C-N 3.3Å; V12-S14 PolarHBondContact O-N 3.38Å; V12-L15 PolarHBondContact O-N 2.85Å; V12-L16 HydrophobicContact CG1-CD1 3.83Å; V12-L16 HydrophobicContact CG1-CG 4.36Å; V12-L16 WeakPolarHBondContact O-CB 3.4Å; V12-L16 WeakPolarHBondContact O-CG 3.44Å; V12-L16 PolarHBondContact O-N 3.25Å
13	F	91.8	Very high	90.3	Very high	55 Å²	55	48.3 Å²	48.3	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-37.4	177.3	-75.4	-63.1	0	0	0	112.3	F9 S10 G17 F248 I251 L255	F9-F13 HydrophobicContact CB-CD2 4.46Å; F9-F13 HydrophobicContact CB-CE2 4.35Å; F9-F13 HydrophobicContact CD1-CE2 4.28Å; F9-F13 WeakPolarHBondContact O-CD2 3.18Å; F9-F13 PolarHBondContact O-N 2.9Å; S10-F13 PolarHBondContact O-N 3.22Å; F13-G17 PolarHBondContact O-N 3.16Å; F13-F248 HydrophobicContact CD1-CB 4.44Å; F13-F248 AromaticContact CD1-CD1 3.87Å; F13-F248 HydrophobicContact CD1-CD1 3.87Å; F13-F248 HydrophobicContact CD1-CE1 4.26Å; F13-F248 HydrophobicContact CD1-CG 4.1Å; F13-F248 HydrophobicContact CE1-CD1 4.21Å; F13-F248 HydrophobicContact CE1-CE1 4.19Å; F13-I251 HydrophobicContact CD2-CG2 4.23Å; F13-I251 HydrophobicContact CE2-CG2 4.47Å; F13-I251 HydrophobicContact CG-CG2 4.42Å; F13-L255 HydrophobicContact CD2-CD1 3.74Å; F13-L255 HydrophobicContact CE2-CD1 4.09Å
14	S	89.8	Confident	91.1	Very high	6 Å²	6	48.2 Å²	48.2	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-49.8	176.8	-144.5	0	0	0	0	111.2	S10 S11 V12 G17 T18 L159 S252	S10-S14 WeakPolarHBondContact O-CB 3.04Å; S10-S14 PolarHBondContact O-N 3.43Å; S11-S14 WeakPolarHBondContact O-CB 3.16Å; S11-S14 PolarHBondContact O-N 2.88Å; V12-S14 VanDerWaalsContact C-N 3.3Å; V12-S14 PolarHBondContact O-N 3.38Å; S14-G17 PolarHBondContact O-N 3.48Å; S14-T18 WeakPolarHBondContact O-CB 3.29Å; S14-T18 PolarHBondContact O-N 3.25Å; S14-T18 PolarHBondContact O-OG1 2.96Å; S14-L159 VanDerWaalsContact OG-CD2 3.27Å; S14-L159 WeakPolarHBondContact OG-CD2 3.46Å; S14-S252 WeakPolarHBondContact CB-OG 3.44Å; S14-S252 PolarHBondContact OG-OG 3.05Å
15	L	92.4	Very high	91.6	Very high	97 Å²	97	46.3 Å²	46.3	51%	0.508	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-46.8	-179.2	-70.6	172.2	0	0	0	111.7	S11 V12 G17 T18 V19	S11-L15 WeakPolarHBondContact O-CG 3.38Å; S11-L15 PolarHBondContact O-N 3.4Å; V12-L15 PolarHBondContact O-N 2.85Å; L15-G17 PolarHBondContact O-N 2.93Å; L15-T18 PolarHBondContact O-N 3.44Å; L15-V19 VanDerWaalsContact O-CG2 3.29Å; L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.87Å
16	L	94.9	Very high	91.8	Very high	86 Å²	86	45.5 Å²	45.5	45%	0.45	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-47.3	176.2	-71.7	175.5	0	0	0	110.9	V12 T18 V19 L20 F248	V12-L16 HydrophobicContact CG1-CD1 3.83Å; V12-L16 HydrophobicContact CG1-CG 4.36Å; V12-L16 WeakPolarHBondContact O-CB 3.4Å; V12-L16 WeakPolarHBondContact O-CG 3.44Å; V12-L16 PolarHBondContact O-N 3.25Å; L16-T18 PolarHBondContact O-N 3.29Å; L16-V19 PolarHBondContact O-N 3.35Å; L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.3Å; L16-L20 PolarHBondContact O-N 2.97Å; L16-F248 HydrophobicContact CB-CD2 4.15Å
17	G	92.5	Very high	92	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-46.6	177.9	0	0	0	0	0	112.6	F13 S14 L15 L20 V21 G245	F13-G17 PolarHBondContact O-N 3.16Å; S14-G17 PolarHBondContact O-N 3.48Å; L15-G17 PolarHBondContact O-N 2.93Å; G17-L20 PolarHBondContact O-N 3.07Å; G17-V21 WeakPolarHBondContact O-CG2 3.2Å; G17-V21 PolarHBondContact O-N 2.85Å; G17-G245 WeakPolarHBondContact CA-O 3.28Å
18	T	91.8	Very high	92.2	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-45.2	176.8	-60.9	0	0	0	0	112.6	S14 L15 L16 L20 V21 I22 L155 L159	S14-T18 WeakPolarHBondContact O-CB 3.29Å; S14-T18 PolarHBondContact O-N 3.25Å; S14-T18 PolarHBondContact O-OG1 2.96Å; L15-T18 PolarHBondContact O-N 3.44Å; L16-T18 PolarHBondContact O-N 3.29Å; T18-L20 VanDerWaalsContact C-N 3.33Å; T18-L20 PolarHBondContact O-N 3.43Å; T18-V21 PolarHBondContact O-N 3.32Å; T18-I22 HydrophobicContact CG2-CD1 3.71Å; T18-I22 HydrophobicContact CG2-CG1 4.39Å; T18-I22 VanDerWaalsContact O-CG1 3.28Å; T18-I22 WeakPolarHBondContact O-CG1 3.12Å; T18-I22 PolarHBondContact O-N 2.89Å; T18-L155 HydrophobicContact CG2-CD2 3.93Å; T18-L155 HydrophobicContact CG2-CG 4.4Å; T18-L155 WeakPolarHBondContact OG1-CD2 3.32Å; T18-L159 HydrophobicContact CG2-CD1 3.75Å; T18-L159 WeakPolarHBondContact OG1-CD1 3.45Å
19	V	95.4	Very high	92.3	Very high	78 Å²	78	44.1 Å²	44.1	47%	0.473	25%	0.247	S	C	.	.	H	α-helix	trans	-60.6	-44.4	178.1	169.5	0	0	0	0	110.8	L15 L16 V21 I22 I23	L15-V19 VanDerWaalsContact O-CG2 3.29Å; L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.87Å; L16-V19 PolarHBondContact O-N 3.35Å; V19-V21 PolarHBondContact O-N 3.04Å; V19-I22 PolarHBondContact O-N 3.33Å; V19-I23 HydrophobicContact CG1-CD1 3.67Å; V19-I23 HydrophobicContact CG1-CG1 4.36Å; V19-I23 VanDerWaalsContact O-CG1 3.26Å; V19-I23 WeakPolarHBondContact O-CG1 3.47Å; V19-I23 PolarHBondContact O-N 2.73Å
20	L	95.7	Very high	92.5	Very high	37 Å²	37	38.6 Å²	38.6	19%	0.194	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-44.1	178.9	-70.2	175.2	0	0	0	112.4	L16 G17 T18 I23 A24 I241 I244 F248	L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.3Å; L16-L20 PolarHBondContact O-N 2.97Å; G17-L20 PolarHBondContact O-N 3.07Å; T18-L20 VanDerWaalsContact C-N 3.33Å; T18-L20 PolarHBondContact O-N 3.43Å; L20-I23 PolarHBondContact O-N 2.87Å; L20-A24 WeakPolarHBondContact O-CB 3.21Å; L20-A24 PolarHBondContact O-N 3.36Å; L20-I241 HydrophobicContact CB-CG2 3.7Å; L20-I241 HydrophobicContact CD2-CG2 3.69Å; L20-I241 HydrophobicContact CG-CG2 4.2Å; L20-I241 WeakPolarHBondContact O-CG2 3.02Å; L20-I244 HydrophobicContact CD1-CG2 3.94Å; L20-F248 HydrophobicContact CD1-CD2 3.79Å; L20-F248 HydrophobicContact CD1-CE2 3.86Å
21	V	93.4	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-41.9	176.4	174.1	0	0	0	0	110.8	G17 T18 V19 I23 A24 F25 Y148 L152 L196 I246 I249	G17-V21 WeakPolarHBondContact O-CG2 3.2Å; G17-V21 PolarHBondContact O-N 2.85Å; T18-V21 PolarHBondContact O-N 3.32Å; V19-V21 PolarHBondContact O-N 3.04Å; V21-I23 PolarHBondContact O-N 3.46Å; V21-A24 PolarHBondContact O-N 2.93Å; V21-F25 PolarHBondContact O-N 3.48Å; V21-Y148 HydrophobicContact CG1-CE1 3.63Å; V21-Y148 WeakPolarHBondContact CG1-OH 3.48Å; V21-Y148 PolarHBondContact O-OH 3.47Å; V21-L152 HydrophobicContact CG1-CD2 3.68Å; V21-L196 HydrophobicContact CG1-CD1 3.86Å; V21-L196 HydrophobicContact CG1-CD2 3.87Å; V21-L196 HydrophobicContact CG1-CG 4.49Å; V21-L196 HydrophobicContact CG2-CD1 4.43Å; V21-I246 HydrophobicContact CG2-CG1 4.34Å; V21-I249 HydrophobicContact CG2-CD1 4.02Å
22	I	94.1	Very high	92.8	Very high	85 Å²	85	38.7 Å²	38.7	44%	0.436	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-42.9	175.8	-68.5	168.4	0	0	0	111.5	T18 V19 F25 G26 L152	T18-I22 HydrophobicContact CG2-CD1 3.71Å; T18-I22 HydrophobicContact CG2-CG1 4.39Å; T18-I22 VanDerWaalsContact O-CG1 3.28Å; T18-I22 WeakPolarHBondContact O-CG1 3.12Å; T18-I22 PolarHBondContact O-N 2.89Å; V19-I22 PolarHBondContact O-N 3.33Å; I22-F25 WeakPolarHBondContact O-CB 3.45Å; I22-F25 PolarHBondContact O-N 3.09Å; I22-G26 PolarHBondContact O-N 3.22Å; I22-G26 VanDerWaalsContact O-N 3.14Å; I22-L152 HydrophobicContact CG1-CD2 3.8Å
23	I	94.3	Very high	92.9	Very high	71 Å²	71	35.8 Å²	35.8	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-62.4	-46.9	176.3	-69.8	167.6	0	0	0	110.1	V19 L20 V21 F25 G26 T27 W237	V19-I23 HydrophobicContact CG1-CD1 3.67Å; V19-I23 HydrophobicContact CG1-CG1 4.36Å; V19-I23 VanDerWaalsContact O-CG1 3.26Å; V19-I23 WeakPolarHBondContact O-CG1 3.47Å; V19-I23 PolarHBondContact O-N 2.73Å; L20-I23 PolarHBondContact O-N 2.87Å; V21-I23 PolarHBondContact O-N 3.46Å; I23-F25 VanDerWaalsContact C-N 3.27Å; I23-F25 PolarHBondContact O-N 3.47Å; I23-G26 PolarHBondContact O-N 2.85Å; I23-T27 HydrophobicContact CG2-CG2 3.96Å; I23-T27 WeakPolarHBondContact O-CB 3.34Å; I23-T27 WeakPolarHBondContact O-CG2 3.32Å; I23-T27 PolarHBondContact O-N 3.39Å; I23-T27 VanDerWaalsContact O-N 3.16Å; I23-T27 PolarHBondContact O-OG1 3.49Å; I23-W237 HydrophobicContact CG2-CH2 4.19Å; I23-W237 HydrophobicContact CG2-CZ3 3.96Å
24	A	93.9	Very high	92.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-41.8	177.7	0	0	0	0	0	111.6	L20 V21 G26 T27 W30 S238 I241 A242	L20-A24 WeakPolarHBondContact O-CB 3.21Å; L20-A24 PolarHBondContact O-N 3.36Å; V21-A24 PolarHBondContact O-N 2.93Å; A24-G26 PolarHBondContact O-N 3.31Å; A24-T27 WeakPolarHBondContact CA-OG1 3.43Å; A24-T27 PolarHBondContact O-N 3.27Å; A24-T27 PolarHBondContact O-OG1 2.83Å; A24-W30 HydrophobicContact CB-CZ2 4.29Å; A24-W30 PolarHBondContact O-NE1 3.49Å; A24-S238 VanDerWaalsContact CB-O 3.28Å; A24-S238 WeakPolarHBondContact CB-O 3.48Å; A24-I241 HydrophobicContact CB-CG2 4.45Å; A24-A242 HydrophobicContact CB-CB 3.79Å
25	F	92.5	Very high	93	Very high	37 Å²	37	39.5 Å²	39.5	16%	0.162	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-43	177.6	-174.5	-110.8	0	0	0	113.9	V21 I22 I23 L70 F71 Y148 I149 L152	V21-F25 PolarHBondContact O-N 3.48Å; I22-F25 WeakPolarHBondContact O-CB 3.45Å; I22-F25 PolarHBondContact O-N 3.09Å; I23-F25 VanDerWaalsContact C-N 3.27Å; I23-F25 PolarHBondContact O-N 3.47Å; F25-L70 HydrophobicContact CD2-CD1 3.53Å; F25-L70 HydrophobicContact CE2-CD1 4.06Å; F25-L70 HydrophobicContact CG-CD1 4.4Å; F25-F71 HydrophobicContact CD1-CE2 4.34Å; F25-F71 HydrophobicContact CD2-CE2 4.34Å; F25-F71 HydrophobicContact CD2-CZ 4.47Å; F25-F71 AromaticContact CE1-CE2 3.96Å; F25-F71 HydrophobicContact CE1-CE2 3.96Å; F25-F71 AromaticContact CE1-CZ 3.95Å; F25-F71 HydrophobicContact CE1-CZ 3.95Å; F25-F71 AromaticContact CE2-CE2 3.96Å; F25-F71 HydrophobicContact CE2-CE2 3.96Å; F25-F71 AromaticContact CE2-CZ 3.67Å; F25-F71 HydrophobicContact CE2-CZ 3.67Å; F25-F71 AromaticContact CZ-CE2 3.78Å; F25-F71 HydrophobicContact CZ-CE2 3.78Å; F25-F71 AromaticContact CZ-CZ 3.37Å; F25-F71 HydrophobicContact CZ-CZ 3.37Å; F25-Y148 HydrophobicContact CB-CD1 4.1Å; F25-Y148 HydrophobicContact CB-CE1 3.5Å; F25-Y148 VanDerWaalsContact CB-CE1 3.5Å; F25-Y148 AromaticContact CD2-CD1 3.16Å; F25-Y148 HydrophobicContact CD2-CD1 3.16Å; F25-Y148 AromaticContact CD2-CE1 3.51Å; F25-Y148 HydrophobicContact CD2-CE1 3.51Å; F25-Y148 AromaticContact CD2-CG 3.74Å; F25-Y148 HydrophobicContact CD2-CG 3.74Å; F25-Y148 AromaticContact CE2-CD1 3.73Å; F25-Y148 HydrophobicContact CE2-CD1 3.73Å; F25-Y148 HydrophobicContact CE2-CE1 4.49Å; F25-Y148 HydrophobicContact CE2-CG 4.11Å; F25-Y148 AromaticContact CG-CD1 3.85Å; F25-Y148 HydrophobicContact CG-CD1 3.85Å; F25-Y148 AromaticContact CG-CE1 3.79Å; F25-Y148 HydrophobicContact CG-CE1 3.79Å; F25-I149 HydrophobicContact CE1-CG1 4.42Å; F25-I149 HydrophobicContact CE2-CG1 3.97Å; F25-I149 HydrophobicContact CZ-CD1 4.05Å; F25-I149 HydrophobicContact CZ-CG1 3.47Å; F25-I149 VanDerWaalsContact CZ-CG1 3.47Å; F25-L152 HydrophobicContact CB-CD1 4.31Å; F25-L152 HydrophobicContact CD1-CD1 4.01Å; F25-L152 HydrophobicContact CD2-CD1 4.4Å; F25-L152 HydrophobicContact CE1-CD1 4.39Å; F25-L152 HydrophobicContact CG-CD1 3.99Å
26	G	90.7	Very high	92.9	Very high	53 Å²	53	38.9 Å²	38.9	55%	0.546	21%	0.208	S	C	.	.	H	α-helix	trans	-83	-9.2	-175.7	0	0	0	0	0	114.9	I22 I23 A24	I22-G26 PolarHBondContact O-N 3.22Å; I22-G26 VanDerWaalsContact O-N 3.14Å; I23-G26 PolarHBondContact O-N 2.85Å; A24-G26 PolarHBondContact O-N 3.31Å
27	T	91.6	Very high	92.4	Very high	24 Å²	24	37.1 Å²	37.1	15%	0.147	20%	0.195	C	C	.	.			trans	-100.5	152.9	-171.2	48.9	0	0	0	0	112.7	I23 A24 W237 S238	I23-T27 HydrophobicContact CG2-CG2 3.96Å; I23-T27 WeakPolarHBondContact O-CB 3.34Å; I23-T27 WeakPolarHBondContact O-CG2 3.32Å; I23-T27 PolarHBondContact O-N 3.39Å; I23-T27 VanDerWaalsContact O-N 3.16Å; I23-T27 PolarHBondContact O-OG1 3.49Å; A24-T27 WeakPolarHBondContact CA-OG1 3.43Å; A24-T27 PolarHBondContact O-N 3.27Å; A24-T27 PolarHBondContact O-OG1 2.83Å; T27-W237 HydrophobicContact CG2-CH2 3.48Å; T27-W237 VanDerWaalsContact CG2-CH2 3.48Å; T27-W237 HydrophobicContact CG2-CZ2 4.05Å; T27-W237 HydrophobicContact CG2-CZ3 4.29Å; T27-S238 WeakPolarHBondContact CB-OG 3.29Å; T27-S238 VanDerWaalsContact OG1-CB 3.28Å; T27-S238 WeakPolarHBondContact OG1-CB 3.47Å; T27-S238 PolarHBondContact OG1-OG 3.41Å
28	N	89.6	Confident	92.1	Very high	25 Å²	25	42 Å²	42	13%	0.134	23%	0.225	C	C	.	.	S	Bend	trans	-100.4	25.6	-171.5	-57	-40.2	0	0	0	114	T67 L68 G69	N28-T67 CarbonylContact O-C 3.58Å; N28-T67 VanDerWaalsContact O-CB 3.28Å; N28-T67 WeakPolarHBondContact O-CB 3.34Å; N28-T67 PolarHBondContact O-OG1 3.38Å; N28-L68 CarbonylContact C-O 3.59Å; N28-L68 CarbonylContact O-C 3.51Å; N28-L68 VanDerWaalsContact O-C 3.24Å; N28-G69 PolarHBondContact O-N 3.23Å
29	N	92.8	Very high	91.8	Very high	27 Å²	27	42.8 Å²	42.8	14%	0.144	23%	0.233	C	C	.	.			trans	-130.4	56.2	-174.2	-160.2	-15.2	0	0	0	112.3	G236 W237 S238	N29-G236 CarbonylContact O-C 3.53Å; N29-G236 WeakPolarHBondContact O-CA 3.26Å; N29-G236 VanDerWaalsContact OD1-CA 3.23Å; N29-G236 WeakPolarHBondContact OD1-CA 3.36Å; N29-W237 HydrophobicContact CB-CG 4.48Å; N29-W237 VanDerWaalsContact CG-CD1 3.45Å; N29-W237 PolarHBondContact ND2-NE1 3.28Å; N29-W237 VanDerWaalsContact ND2-NE1 3.12Å; N29-W237 PolarHBondContact O-N 2.79Å; N29-S238 WeakPolarHBondContact O-CB 3.04Å; N29-S238 PolarHBondContact O-N 2.71Å; N29-S238 PolarHBondContact O-OG 2.8Å
30	W	93.5	Very high	91.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-82.2	-31.9	170.1	-77.4	65.9	0	0	0	111.9	A24 L68 L70 Y148 V200 W203 G236 Y239 A242	A24-W30 HydrophobicContact CB-CZ2 4.29Å; A24-W30 PolarHBondContact O-NE1 3.49Å; W30-L68 WeakPolarHBondContact CB-O 3.34Å; W30-L68 PolarHBondContact N-O 2.86Å; W30-L70 HydrophobicContact CD2-CD2 4.08Å; W30-L70 HydrophobicContact CD2-CG 4.29Å; W30-L70 HydrophobicContact CE3-CD2 4.34Å; W30-L70 HydrophobicContact CH2-CD2 4.34Å; W30-L70 HydrophobicContact CZ2-CD1 3.79Å; W30-L70 HydrophobicContact CZ2-CD2 4.1Å; W30-L70 HydrophobicContact CZ2-CG 4Å; W30-L70 HydrophobicContact CZ3-CD2 4.46Å; W30-Y148 AromaticContact CH2-CE2 3.94Å; W30-Y148 HydrophobicContact CH2-CE2 3.94Å; W30-Y148 HydrophobicContact CZ2-CE2 4.18Å; W30-V200 HydrophobicContact CH2-CG2 4.17Å; W30-V200 HydrophobicContact CZ3-CG2 4.35Å; W30-W203 HydrophobicContact CB-CH2 4.29Å; W30-W203 HydrophobicContact CB-CZ2 3.73Å; W30-W203 AromaticContact CE3-CD2 3.77Å; W30-W203 HydrophobicContact CE3-CD2 3.77Å; W30-W203 AromaticContact CE3-CE2 3.8Å; W30-W203 HydrophobicContact CE3-CE3 4.12Å; W30-W203 HydrophobicContact CE3-CG 4.13Å; W30-W203 HydrophobicContact CE3-CZ2 4.2Å; W30-W203 HydrophobicContact CE3-CZ3 4.47Å; W30-W203 HydrophobicContact CZ3-CD2 4.17Å; W30-W203 HydrophobicContact CZ3-CE3 4.46Å; W30-W203 HydrophobicContact CZ3-CG 4.2Å; W30-G236 PolarHBondContact O-N 2.92Å; W30-Y239 HydrophobicContact CE3-CD2 4.22Å; W30-Y239 HydrophobicContact CZ3-CD2 4.32Å; W30-A242 HydrophobicContact CH2-CB 4.06Å; W30-A242 HydrophobicContact CZ2-CB 4.42Å
31	Q	93.1	Very high	90.7	Very high	9 Å²	9	40.9 Å²	40.9	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.1	179.7	-175.5	179.9	2.6	0	0	109.4	F33 T67 L68 W203 D207 R211 I233	Q31-F33 HydrophobicContact CB-CE2 4.49Å; Q31-F33 VanDerWaalsContact CD-CE2 3.5Å; Q31-F33 HydrophobicContact CG-CD2 4.31Å; Q31-F33 HydrophobicContact CG-CE2 3.66Å; Q31-F33 HydrophobicContact CG-CZ 4.15Å; Q31-T67 CarbonylContact O-C 3.14Å; Q31-T67 WeakPolarHBondContact O-CA 3.37Å; Q31-L68 HydrophobicContact CB-CB 4.3Å; Q31-L68 PolarHBondContact N-O 2.94Å; Q31-L68 PolarHBondContact O-N 3.02Å; Q31-W203 HydrophobicContact CB-CH2 4.25Å; Q31-W203 HydrophobicContact CB-CZ2 4.22Å; Q31-D207 PolarHBondContact NE2-OD1 3.28Å; Q31-D207 VanDerWaalsContact NE2-OD1 3.11Å; Q31-D207 PolarHBondContact OE1-OD1 2.99Å; Q31-R211 VanDerWaalsContact NE2-CZ 3.35Å; Q31-I233 HydrophobicContact CG-CG2 4.13Å
32	E	93.6	Very high	90.3	Very high	38 Å²	38	49.1 Å²	49.1	18%	0.178	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.9	-177.9	-175.3	177.6	-174.8	0	0	109.7	R34 T67 I233 S234	E32-R34 VanDerWaalsContact CD-NE 3.27Å; E32-R34 VanDerWaalsContact CD-NH2 3.31Å; E32-R34 HydrophobicContact CG-CG 4.11Å; E32-R34 IonicContact OE1-CZ 3.83Å; E32-R34 VanDerWaalsContact OE1-CZ 3.26Å; E32-R34 IonicContact OE1-NE 2.94Å; E32-R34 PolarHBondContact OE1-NE 2.93Å; E32-R34 IonicContact OE1-NH2 3.26Å; E32-R34 PolarHBondContact OE1-NH2 3.49Å; E32-R34 IonicContact OE2-CZ 3.89Å; E32-R34 IonicContact OE2-NE 2.96Å; E32-R34 IonicContact OE2-NH2 3.69Å; E32-R34 PolarHBondContact OE2-NH2 3.29Å; E32-T67 HydrophobicContact CG-CG2 4.26Å; E32-I233 WeakPolarHBondContact O-CA 2.88Å; E32-S234 PolarHBondContact N-O 3.49Å; E32-S234 PolarHBondContact O-N 3.47Å
33	F	92.6	Very high	89.7	Confident	15 Å²	15	48.8 Å²	48.8	7%	0.066	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.9	172.3	-62	-104.1	0	0	0	108	Q31 D65 R66 L68 W223 T231 I233	Q31-F33 HydrophobicContact CB-CE2 4.49Å; Q31-F33 VanDerWaalsContact CD-CE2 3.5Å; Q31-F33 HydrophobicContact CG-CD2 4.31Å; Q31-F33 HydrophobicContact CG-CE2 3.66Å; Q31-F33 HydrophobicContact CG-CZ 4.15Å; F33-D65 WeakPolarHBondContact O-CA 3.44Å; F33-R66 HydrophobicContact CB-CG 3.69Å; F33-R66 HydrophobicContact CD2-CG 3.81Å; F33-R66 HydrophobicContact CG-CG 3.96Å; F33-R66 PolarHBondContact N-O 3.47Å; F33-R66 PolarHBondContact O-N 3.2Å; F33-L68 HydrophobicContact CD2-CD1 4.48Å; F33-L68 HydrophobicContact CD2-CG 4.42Å; F33-L68 HydrophobicContact CE2-CD1 3.51Å; F33-L68 HydrophobicContact CE2-CG 3.87Å; F33-L68 HydrophobicContact CZ-CD1 4.13Å; F33-W223 AromaticContact CD1-CH2 3.9Å; F33-W223 HydrophobicContact CD1-CH2 3.9Å; F33-W223 AromaticContact CE1-CH2 3.79Å; F33-W223 HydrophobicContact CE1-CH2 3.79Å; F33-T231 HydrophobicContact CB-CG2 4.47Å; F33-T231 HydrophobicContact CD1-CG2 4.32Å; F33-I233 HydrophobicContact CD1-CB 4.43Å; F33-I233 HydrophobicContact CD1-CD1 3.97Å; F33-I233 HydrophobicContact CD1-CG1 3.7Å; F33-I233 HydrophobicContact CD1-CG2 4.04Å; F33-I233 HydrophobicContact CE1-CD1 3.69Å; F33-I233 HydrophobicContact CE1-CG1 3.89Å; F33-I233 HydrophobicContact CE1-CG2 3.83Å; F33-I233 HydrophobicContact CZ-CG2 4.14Å
34	R	93.3	Very high	89	Confident	135 Å²	135	45.7 Å²	45.7	51%	0.509	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	109.4	174.4	-63.3	-173.5	179.7	171.8	7.9	109	E32 D65 T231 D232	E32-R34 VanDerWaalsContact CD-NE 3.27Å; E32-R34 VanDerWaalsContact CD-NH2 3.31Å; E32-R34 HydrophobicContact CG-CG 4.11Å; E32-R34 IonicContact OE1-CZ 3.83Å; E32-R34 VanDerWaalsContact OE1-CZ 3.26Å; E32-R34 IonicContact OE1-NE 2.94Å; E32-R34 PolarHBondContact OE1-NE 2.93Å; E32-R34 IonicContact OE1-NH2 3.26Å; E32-R34 PolarHBondContact OE1-NH2 3.49Å; E32-R34 IonicContact OE2-CZ 3.89Å; E32-R34 IonicContact OE2-NE 2.96Å; E32-R34 IonicContact OE2-NH2 3.69Å; E32-R34 PolarHBondContact OE2-NH2 3.29Å; R34-D65 WeakPolarHBondContact CA-OD1 3.38Å; R34-T231 CarbonylContact O-C 3.24Å; R34-T231 VanDerWaalsContact O-CA 3.27Å; R34-T231 WeakPolarHBondContact O-CA 3.41Å; R34-D232 HydrophobicContact CB-CB 4.46Å; R34-D232 PolarHBondContact N-O 2.95Å; R34-D232 PolarHBondContact O-N 3.09Å
35	V	91.3	Very high	88.3	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.024	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	112.7	179.9	-173.7	0	0	0	0	108.7	R37 F64 D65 L227 T231	V35-R37 VanDerWaalsContact C-N 3.31Å; V35-R37 HydrophobicContact CG1-CG 4.41Å; V35-R37 PolarHBondContact O-N 3Å; V35-F64 WeakPolarHBondContact CG2-O 3.49Å; V35-D65 PolarHBondContact N-OD1 3.29Å; V35-L227 HydrophobicContact CG1-CD1 3.93Å; V35-T231 HydrophobicContact CG2-CG2 3.93Å
36	N	89.6	Confident	87.8	Confident	83 Å²	83	54.7 Å²	54.7	44%	0.444	28%	0.277	S	S	.	.			trans	-75.7	86.4	174.1	-170.3	-20.5	0	0	0	110.6	T38 A39 L40 S230	N36-T38 PolarHBondContact O-N 3.12Å; N36-T38 PolarHBondContact OD1-N 3.47Å; N36-T38 PolarHBondContact OD1-OG1 3.14Å; N36-A39 HydrophobicContact CB-CB 4.09Å; N36-A39 PolarHBondContact O-N 3Å; N36-A39 PolarHBondContact OD1-N 3.43Å; N36-A39 VanDerWaalsContact OD1-N 3.15Å; N36-L40 WeakPolarHBondContact O-CB 3.31Å; N36-L40 PolarHBondContact O-N 3.4Å; N36-S230 PolarHBondContact N-O 2.96Å
37	R	86.1	Confident	87	Confident	49 Å²	49	54.9 Å²	54.9	19%	0.185	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-33.6	-178.3	-63	-175.4	72.5	-166.8	4.5	112.8	V35 L40 L41 N58 F63 F64 D78	V35-R37 VanDerWaalsContact C-N 3.31Å; V35-R37 HydrophobicContact CG1-CG 4.41Å; V35-R37 PolarHBondContact O-N 3Å; R37-L40 WeakPolarHBondContact O-CB 3.31Å; R37-L40 PolarHBondContact O-N 3.39Å; R37-L41 WeakPolarHBondContact O-CB 3.35Å; R37-L41 VanDerWaalsContact O-CG 3.28Å; R37-L41 WeakPolarHBondContact O-CG 3.47Å; R37-L41 PolarHBondContact O-N 2.94Å; R37-N58 PolarHBondContact NH2-OD1 3.49Å; R37-F63 WeakPolarHBondContact CG-O 3.22Å; R37-F64 VanDerWaalsContact CZ-CE1 3.4Å; R37-D78 IonicContact CZ-OD2 3.81Å; R37-D78 IonicContact NH1-OD2 2.71Å; R37-D78 PolarHBondContact NH1-OD2 2.82Å
38	T	85.3	Confident	85.8	Confident	102 Å²	102	58 Å²	58	63%	0.626	29%	0.288	S	S	*	.	H	α-helix	trans	-67.2	-43.5	178.9	68.2	0	0	0	0	111.8	N36 L40 R42	N36-T38 PolarHBondContact O-N 3.12Å; N36-T38 PolarHBondContact OD1-N 3.47Å; N36-T38 PolarHBondContact OD1-OG1 3.14Å; T38-L40 VanDerWaalsContact C-N 3.33Å; T38-R42 PolarHBondContact O-N 2.91Å; T38-R42 VanDerWaalsContact O-N 3.16Å
39	A	85	Confident	84.8	Confident	27 Å²	27	64.7 Å²	64.7	22%	0.223	32%	0.319	C	S	.	.	H	α-helix	trans	-67	-38.4	174.4	0	0	0	0	0	111.2	N36 R42 K43	N36-A39 HydrophobicContact CB-CB 4.09Å; N36-A39 PolarHBondContact O-N 3Å; N36-A39 PolarHBondContact OD1-N 3.43Å; N36-A39 VanDerWaalsContact OD1-N 3.15Å; A39-R42 PolarHBondContact O-N 3.3Å; A39-K43 WeakPolarHBondContact O-CG 3.46Å; A39-K43 PolarHBondContact O-N 3.15Å
40	L	84.8	Confident	83.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-52.9	177.9	-163.3	81.4	0	0	0	111.3	N36 R37 T38 R42 K43 Y44 L57 F63 I226 L227	N36-L40 WeakPolarHBondContact O-CB 3.31Å; N36-L40 PolarHBondContact O-N 3.4Å; R37-L40 WeakPolarHBondContact O-CB 3.31Å; R37-L40 PolarHBondContact O-N 3.39Å; T38-L40 VanDerWaalsContact C-N 3.33Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 3.43Å; L40-K43 PolarHBondContact O-N 3.01Å; L40-K43 VanDerWaalsContact O-N 3.07Å; L40-Y44 HydrophobicContact CD1-CD2 4.24Å; L40-Y44 HydrophobicContact CD1-CE2 3.83Å; L40-Y44 HydrophobicContact CD2-CE2 4.39Å; L40-Y44 HydrophobicContact CG-CD2 3.86Å; L40-Y44 HydrophobicContact CG-CE2 3.82Å; L40-Y44 WeakPolarHBondContact O-CD2 3.27Å; L40-Y44 PolarHBondContact O-N 2.7Å; L40-L57 HydrophobicContact CD2-CD2 3.42Å; L40-L57 VanDerWaalsContact CD2-CD2 3.42Å; L40-L57 HydrophobicContact CG-CD2 4.39Å; L40-F63 HydrophobicContact CD2-CB 4.38Å; L40-F63 HydrophobicContact CD2-CD1 3.47Å; L40-F63 VanDerWaalsContact CD2-CD1 3.47Å; L40-F63 HydrophobicContact CD2-CE1 4.11Å; L40-F63 HydrophobicContact CD2-CG 4.29Å; L40-I226 HydrophobicContact CD1-CG2 4.03Å; L40-L227 HydrophobicContact CD1-CB 4.37Å; L40-L227 HydrophobicContact CD1-CD1 3.97Å; L40-L227 HydrophobicContact CD2-CD1 4.32Å
41	L	83.4	Confident	82.3	Confident	73 Å²	73	71.4 Å²	71.4	38%	0.382	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-38.6	178.5	-72.6	169.6	0	0	0	111.9	R37 T45 L54	R37-L41 WeakPolarHBondContact O-CB 3.35Å; R37-L41 VanDerWaalsContact O-CG 3.28Å; R37-L41 WeakPolarHBondContact O-CG 3.47Å; R37-L41 PolarHBondContact O-N 2.94Å; L41-T45 WeakPolarHBondContact O-CB 3.33Å; L41-T45 VanDerWaalsContact O-CG2 3.28Å; L41-T45 WeakPolarHBondContact O-CG2 3.36Å; L41-T45 PolarHBondContact O-N 3.47Å; L41-T45 PolarHBondContact O-OG1 3.03Å; L41-L54 HydrophobicContact CD2-CD1 3.83Å
42	R	84.5	Confident	80.9	Confident	174 Å²	174	75.7 Å²	75.7	66%	0.657	37%	0.373	S	S	*	.	H	α-helix	trans	-61.8	-45.3	174	-170.6	-179.9	-73.2	151	-3.4	111.4	T38 A39 L40 T45 H46	T38-R42 PolarHBondContact O-N 2.91Å; T38-R42 VanDerWaalsContact O-N 3.16Å; A39-R42 PolarHBondContact O-N 3.3Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 3.43Å; R42-T45 WeakPolarHBondContact CA-OG1 3.39Å; R42-T45 PolarHBondContact O-N 2.91Å; R42-T45 PolarHBondContact O-OG1 3.4Å; R42-H46 PolarHBondContact O-CD2 3.19Å; R42-H46 PolarHBondContact O-N 3.02Å
43	K	82.6	Confident	79.6	Confident	78 Å²	78	75.4 Å²	75.4	34%	0.339	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-44.2	178.2	-70.4	178.4	-176.1	176.7	0	112.4	A39 L40 T45 H46 D47 I226 S230	A39-K43 WeakPolarHBondContact O-CG 3.46Å; A39-K43 PolarHBondContact O-N 3.15Å; L40-K43 PolarHBondContact O-N 3.01Å; L40-K43 VanDerWaalsContact O-N 3.07Å; K43-T45 VanDerWaalsContact C-N 3.34Å; K43-T45 PolarHBondContact O-N 3.17Å; K43-H46 PolarHBondContact O-N 3.26Å; K43-D47 WeakPolarHBondContact O-CB 3.44Å; K43-D47 PolarHBondContact O-N 2.86Å; K43-D47 VanDerWaalsContact O-N 3.12Å; K43-I226 HydrophobicContact CB-CG2 3.68Å; K43-I226 HydrophobicContact CD-CG2 3.78Å; K43-I226 HydrophobicContact CG-CG2 4.39Å; K43-S230 PolarHBondContact NZ-OG 2.97Å
44	Y	79.9	Confident	78.5	Confident	6 Å²	6	78 Å²	78	2%	0.024	39%	0.392	C	S	.	.	H	α-helix	trans	-69.5	-26	179.5	-88.1	-94.4	0	0	0	114	L40 D47 S50 A53 L57 I226	L40-Y44 HydrophobicContact CD1-CD2 4.24Å; L40-Y44 HydrophobicContact CD1-CE2 3.83Å; L40-Y44 HydrophobicContact CD2-CE2 4.39Å; L40-Y44 HydrophobicContact CG-CD2 3.86Å; L40-Y44 HydrophobicContact CG-CE2 3.82Å; L40-Y44 WeakPolarHBondContact O-CD2 3.27Å; L40-Y44 PolarHBondContact O-N 2.7Å; Y44-D47 VanDerWaalsContact O-O 3.12Å; Y44-S50 VanDerWaalsContact CD1-CB 3.48Å; Y44-S50 WeakPolarHBondContact CD1-O 3.31Å; Y44-S50 WeakPolarHBondContact CD1-OG 3.34Å; Y44-A53 HydrophobicContact CE1-CB 4.07Å; Y44-L57 HydrophobicContact CD1-CD1 3.8Å; Y44-L57 HydrophobicContact CD2-CD1 4.35Å; Y44-L57 HydrophobicContact CE1-CD1 3.93Å; Y44-L57 HydrophobicContact CE2-CD1 4.47Å; Y44-L57 HydrophobicContact CG-CD1 4.02Å; Y44-I226 HydrophobicContact CD2-CG2 3.86Å; Y44-I226 HydrophobicContact CE2-CB 4.13Å; Y44-I226 HydrophobicContact CE2-CG2 3.6Å
45	T	79.8	Confident	77.3	Confident	67 Å²	67	75.4 Å²	75.4	41%	0.411	40%	0.395	S	S	.	.	H	α-helix	trans	-77.1	-34	176.8	43.7	0	0	0	0	112.4	L41 R42 K43 R51	L41-T45 WeakPolarHBondContact O-CB 3.33Å; L41-T45 VanDerWaalsContact O-CG2 3.28Å; L41-T45 WeakPolarHBondContact O-CG2 3.36Å; L41-T45 PolarHBondContact O-N 3.47Å; L41-T45 PolarHBondContact O-OG1 3.03Å; R42-T45 WeakPolarHBondContact CA-OG1 3.39Å; R42-T45 PolarHBondContact O-N 2.91Å; R42-T45 PolarHBondContact O-OG1 3.4Å; K43-T45 VanDerWaalsContact C-N 3.34Å; K43-T45 PolarHBondContact O-N 3.17Å; T45-R51 PolarHBondContact O-NH2 2.7Å
46	H	80.6	Confident	76.4	Confident	158 Å²	158	79.1 Å²	79.1	73%	0.731	41%	0.414	S	S	*	.	H	α-helix	trans	-74.1	-33.2	174.6	-76.9	-64.5	0	0	0	113.1	R42 K43	R42-H46 PolarHBondContact O-CD2 3.19Å; R42-H46 PolarHBondContact O-N 3.02Å; K43-H46 PolarHBondContact O-N 3.26Å
47	D	74.7	Confident	75.8	Confident	57 Å²	57	75.4 Å²	75.4	31%	0.305	39%	0.394	S	S	.	.			trans	-88.9	110.5	-179.5	179.7	29.3	0	0	0	111.5	K43 Y44 E49 S50	K43-D47 WeakPolarHBondContact O-CB 3.44Å; K43-D47 PolarHBondContact O-N 2.86Å; K43-D47 VanDerWaalsContact O-N 3.12Å; Y44-D47 VanDerWaalsContact O-O 3.12Å; D47-E49 VanDerWaalsContact C-N 3.3Å; D47-E49 PolarHBondContact O-N 2.86Å; D47-S50 WeakPolarHBondContact CB-OG 3.43Å; D47-S50 VanDerWaalsContact CG-OG 3.31Å; D47-S50 PolarHBondContact O-N 3.42Å; D47-S50 PolarHBondContact O-OG 3.5Å; D47-S50 VanDerWaalsContact OD2-CB 3.26Å; D47-S50 WeakPolarHBondContact OD2-CB 3.49Å; D47-S50 PolarHBondContact OD2-OG 2.87Å
48	S	66.6	Low	75.4	Confident	89 Å²	89	76.5 Å²	76.5	62%	0.622	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-28.8	-175.5	51.9	0	0	0	0	113.5	S50	S48-S50 VanDerWaalsContact C-N 3.34Å
49	E	67.8	Low	75.1	Confident	167 Å²	167	77.6 Å²	77.6	78%	0.78	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-26.4	-176.7	-67.2	-166.3	162.7	0	0	112.8	D47 P52	D47-E49 VanDerWaalsContact C-N 3.3Å; D47-E49 PolarHBondContact O-N 2.86Å; E49-P52 WeakPolarHBondContact O-CD 3.32Å
50	S	67.8	Low	74.9	Confident	17 Å²	17	78.8 Å²	78.8	12%	0.119	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.5	-174.8	60.2	0	0	0	0	114.1	Y44 D47 S48 P52 A53	Y44-S50 VanDerWaalsContact CD1-CB 3.48Å; Y44-S50 WeakPolarHBondContact CD1-O 3.31Å; Y44-S50 WeakPolarHBondContact CD1-OG 3.34Å; D47-S50 WeakPolarHBondContact CB-OG 3.43Å; D47-S50 VanDerWaalsContact CG-OG 3.31Å; D47-S50 PolarHBondContact O-N 3.42Å; D47-S50 PolarHBondContact O-OG 3.5Å; D47-S50 VanDerWaalsContact OD2-CB 3.26Å; D47-S50 WeakPolarHBondContact OD2-CB 3.49Å; D47-S50 PolarHBondContact OD2-OG 2.87Å; S48-S50 VanDerWaalsContact C-N 3.34Å; S50-P52 VanDerWaalsContact C-CD 3.45Å; S50-A53 VanDerWaalsContact O-CB 3.31Å; S50-A53 WeakPolarHBondContact O-CB 3.31Å; S50-A53 PolarHBondContact O-N 3.27Å
51	R	65.6	Low	74.8	Confident	150 Å²	150	79.3 Å²	79.3	57%	0.566	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-50	-41.5	170.7	-70.2	-176.8	175.1	-151.3	-3.8	115.5	T45 A53 L54	T45-R51 PolarHBondContact O-NH2 2.7Å; R51-A53 PolarHBondContact O-N 3.45Å; R51-L54 WeakPolarHBondContact O-CB 3.09Å; R51-L54 PolarHBondContact O-N 3.2Å
52	P	64.2	Low	74.8	Confident	99 Å²	99	77.7 Å²	77.7	64%	0.643	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-65	-18.8	176.6	23.1	-33.3	0	0	0	113.4	E49 S50 L54 S55	E49-P52 WeakPolarHBondContact O-CD 3.32Å; S50-P52 VanDerWaalsContact C-CD 3.45Å; P52-L54 VanDerWaalsContact C-N 3.28Å; P52-S55 PolarHBondContact O-OG 3.44Å
53	A	67	Low	74.9	Confident	32 Å²	32	70 Å²	70	26%	0.264	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-79.2	-10.3	172.8	0	0	0	0	0	113.1	Y44 S50 R51 S55 N56 L57	Y44-A53 HydrophobicContact CE1-CB 4.07Å; S50-A53 VanDerWaalsContact O-CB 3.31Å; S50-A53 WeakPolarHBondContact O-CB 3.31Å; S50-A53 PolarHBondContact O-N 3.27Å; R51-A53 PolarHBondContact O-N 3.45Å; A53-S55 VanDerWaalsContact C-N 3.27Å; A53-S55 PolarHBondContact O-N 3.12Å; A53-N56 PolarHBondContact O-N 2.96Å; A53-N56 VanDerWaalsContact O-N 3.09Å; A53-L57 PolarHBondContact O-N 3.47Å; A53-L57 VanDerWaalsContact O-N 3.1Å
54	L	68.9	Low	75.2	Confident	69 Å²	69	66.4 Å²	66.4	36%	0.361	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-63.5	-29.1	-179.3	-165.6	63	0	0	0	113.1	L41 R51 P52 L57	L41-L54 HydrophobicContact CD2-CD1 3.83Å; R51-L54 WeakPolarHBondContact O-CB 3.09Å; R51-L54 PolarHBondContact O-N 3.2Å; P52-L54 VanDerWaalsContact C-N 3.28Å; L54-L57 HydrophobicContact CB-CD1 4.41Å; L54-L57 HydrophobicContact CD1-CD1 3.82Å; L54-L57 WeakPolarHBondContact O-CB 3.44Å
55	S	68.2	Low	75.8	Confident	82 Å²	82	67.8 Å²	67.8	57%	0.573	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-37.1	173.1	56	0	0	0	0	112.2	P52 A53 L57	P52-S55 PolarHBondContact O-OG 3.44Å; A53-S55 VanDerWaalsContact C-N 3.27Å; A53-S55 PolarHBondContact O-N 3.12Å; S55-L57 VanDerWaalsContact C-N 3.31Å
56	N	72.3	Confident	76.3	Confident	82 Å²	82	65.1 Å²	65.1	44%	0.439	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-78.7	-16.8	179.9	-67.4	-23.5	0	0	0	113	A53 N58 Q59 T60	A53-N56 PolarHBondContact O-N 2.96Å; A53-N56 VanDerWaalsContact O-N 3.09Å; N56-N58 VanDerWaalsContact C-N 3.27Å; N56-N58 PolarHBondContact O-N 3.24Å; N56-Q59 PolarHBondContact O-N 3.36Å; N56-T60 PolarHBondContact O-N 3.42Å; N56-T60 VanDerWaalsContact O-N 3.09Å; N56-T60 PolarHBondContact O-OG1 3.24Å
57	L	76.2	Confident	76.9	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-61	-32.1	-178.6	-101.9	137.6	0	0	0	113.1	L40 Y44 A53 L54 S55 F63 F64	L40-L57 HydrophobicContact CD2-CD2 3.42Å; L40-L57 VanDerWaalsContact CD2-CD2 3.42Å; L40-L57 HydrophobicContact CG-CD2 4.39Å; Y44-L57 HydrophobicContact CD1-CD1 3.8Å; Y44-L57 HydrophobicContact CD2-CD1 4.35Å; Y44-L57 HydrophobicContact CE1-CD1 3.93Å; Y44-L57 HydrophobicContact CE2-CD1 4.47Å; Y44-L57 HydrophobicContact CG-CD1 4.02Å; A53-L57 PolarHBondContact O-N 3.47Å; A53-L57 VanDerWaalsContact O-N 3.1Å; L54-L57 HydrophobicContact CB-CD1 4.41Å; L54-L57 HydrophobicContact CD1-CD1 3.82Å; L54-L57 WeakPolarHBondContact O-CB 3.44Å; S55-L57 VanDerWaalsContact C-N 3.31Å; L57-F63 HydrophobicContact CB-CD2 4.41Å; L57-F63 HydrophobicContact CD2-CB 4.08Å; L57-F63 HydrophobicContact CD2-CD1 3.62Å; L57-F63 HydrophobicContact CD2-CD2 4.06Å; L57-F63 HydrophobicContact CD2-CE1 3.94Å; L57-F63 HydrophobicContact CD2-CE2 4.39Å; L57-F63 HydrophobicContact CD2-CG 3.66Å; L57-F63 HydrophobicContact CD2-CZ 4.33Å; L57-F63 HydrophobicContact CG-CD1 4.24Å; L57-F63 HydrophobicContact CG-CD2 4.01Å; L57-F63 HydrophobicContact CG-CE1 4.2Å; L57-F63 HydrophobicContact CG-CE2 4.01Å; L57-F63 HydrophobicContact CG-CG 4.13Å; L57-F63 HydrophobicContact CG-CZ 4.09Å; L57-F64 WeakPolarHBondContact O-CE2 3.47Å
58	N	78.8	Confident	77.7	Confident	73 Å²	73	57 Å²	57	39%	0.39	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-89.3	-12.8	179.3	-75.5	-14.7	0	0	0	114.3	R37 N56 N81	R37-N58 PolarHBondContact NH2-OD1 3.49Å; N56-N58 VanDerWaalsContact C-N 3.27Å; N56-N58 PolarHBondContact O-N 3.24Å; N58-N81 PolarHBondContact O-N 2.95Å
59	Q	79.4	Confident	78.8	Confident	124 Å²	124	52.9 Å²	52.9	58%	0.579	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-30	-178	-65.9	-178.4	-4.4	0	0	112.3	N56	N56-Q59 PolarHBondContact O-N 3.36Å
60	T	79.7	Confident	79.7	Confident	53 Å²	53	45 Å²	45	33%	0.325	25%	0.245	S	C	.	.			trans	-93.6	124.6	-172.3	51.7	0	0	0	0	111.6	N56 I62 F63 F64	N56-T60 PolarHBondContact O-N 3.42Å; N56-T60 VanDerWaalsContact O-N 3.09Å; N56-T60 PolarHBondContact O-OG1 3.24Å; T60-I62 PolarHBondContact O-N 2.94Å; T60-F63 PolarHBondContact O-N 3.2Å; T60-F63 WeakPolarHBondContact OG1-CD2 3.38Å; T60-F63 WeakPolarHBondContact OG1-CE2 3.36Å; T60-F64 WeakPolarHBondContact O-CD2 3.19Å
61	A	82.9	Confident	80.6	Confident	12 Å²	12	47.7 Å²	47.7	10%	0.099	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-59.5	-21.1	-176.7	0	0	0	0	0	114.6	F63 F64 R66 F75 P80	A61-F63 PolarHBondContact O-N 3.01Å; A61-F63 VanDerWaalsContact O-N 3.17Å; A61-F64 PolarHBondContact O-N 3.45Å; A61-R66 PolarHBondContact O-NH1 3.02Å; A61-F75 HydrophobicContact CB-CE1 3.97Å; A61-F75 HydrophobicContact CB-CZ 3.78Å; A61-P80 HydrophobicContact CB-CG 4.07Å
62	I	83.9	Confident	81.6	Confident	39 Å²	39	44.3 Å²	44.3	20%	0.2	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.8	-25.6	-178	65.2	175.4	0	0	0	113.3	T60 R66 W223 L227	T60-I62 PolarHBondContact O-N 2.94Å; I62-R66 VanDerWaalsContact CA-NH1 3.31Å; I62-R66 PolarHBondContact O-NH1 3.5Å; I62-R66 VanDerWaalsContact O-NH1 3.11Å; I62-W223 HydrophobicContact CB-CZ2 4.42Å; I62-W223 HydrophobicContact CG2-CZ2 4.22Å; I62-L227 HydrophobicContact CB-CD2 4.18Å; I62-L227 HydrophobicContact CD1-CD2 3.83Å; I62-L227 HydrophobicContact CG1-CD2 3.98Å
63	F	85.8	Confident	82.8	Confident	11 Å²	11	40.3 Å²	40.3	5%	0.048	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-91.8	5.1	-177.8	-62.1	-67.4	0	0	0	114.5	R37 L40 L57 T60 A61 L227	R37-F63 WeakPolarHBondContact CG-O 3.22Å; L40-F63 HydrophobicContact CD2-CB 4.38Å; L40-F63 HydrophobicContact CD2-CD1 3.47Å; L40-F63 VanDerWaalsContact CD2-CD1 3.47Å; L40-F63 HydrophobicContact CD2-CE1 4.11Å; L40-F63 HydrophobicContact CD2-CG 4.29Å; L57-F63 HydrophobicContact CB-CD2 4.41Å; L57-F63 HydrophobicContact CD2-CB 4.08Å; L57-F63 HydrophobicContact CD2-CD1 3.62Å; L57-F63 HydrophobicContact CD2-CD2 4.06Å; L57-F63 HydrophobicContact CD2-CE1 3.94Å; L57-F63 HydrophobicContact CD2-CE2 4.39Å; L57-F63 HydrophobicContact CD2-CG 3.66Å; L57-F63 HydrophobicContact CD2-CZ 4.33Å; L57-F63 HydrophobicContact CG-CD1 4.24Å; L57-F63 HydrophobicContact CG-CD2 4.01Å; L57-F63 HydrophobicContact CG-CE1 4.2Å; L57-F63 HydrophobicContact CG-CE2 4.01Å; L57-F63 HydrophobicContact CG-CG 4.13Å; L57-F63 HydrophobicContact CG-CZ 4.09Å; T60-F63 PolarHBondContact O-N 3.2Å; T60-F63 WeakPolarHBondContact OG1-CD2 3.38Å; T60-F63 WeakPolarHBondContact OG1-CE2 3.36Å; A61-F63 PolarHBondContact O-N 3.01Å; A61-F63 VanDerWaalsContact O-N 3.17Å; F63-L227 HydrophobicContact CD1-CD1 3.64Å; F63-L227 HydrophobicContact CD1-CD2 3.92Å; F63-L227 HydrophobicContact CD1-CG 4.3Å; F63-L227 HydrophobicContact CE1-CB 4.32Å; F63-L227 HydrophobicContact CE1-CD1 4.05Å; F63-L227 HydrophobicContact CE1-CD2 3.77Å; F63-L227 HydrophobicContact CE1-CG 4.27Å; F63-L227 HydrophobicContact CZ-CD2 4.48Å
64	F	89.2	Confident	84	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.018	20%	0.203	C	C	.	.	S	Bend	trans	-113.8	151.2	-178.9	-69.1	-103.2	0	0	0	110.4	V35 R37 L57 T60 A61 R66 F75 D78 V79 P80	V35-F64 WeakPolarHBondContact CG2-O 3.49Å; R37-F64 VanDerWaalsContact CZ-CE1 3.4Å; L57-F64 WeakPolarHBondContact O-CE2 3.47Å; T60-F64 WeakPolarHBondContact O-CD2 3.19Å; A61-F64 PolarHBondContact O-N 3.45Å; F64-R66 PolarHBondContact O-NH1 2.83Å; F64-F75 HydrophobicContact CB-CD1 3.97Å; F64-F75 HydrophobicContact CB-CE1 4.14Å; F64-D78 HydrophobicContact CD1-CB 3.71Å; F64-D78 VanDerWaalsContact CD1-O 3.3Å; F64-D78 WeakPolarHBondContact CD1-O 3.24Å; F64-D78 HydrophobicContact CE1-CB 3.82Å; F64-V79 WeakPolarHBondContact CE1-O 3.39Å; F64-P80 HydrophobicContact CD2-CB 3.98Å; F64-P80 HydrophobicContact CD2-CG 4.34Å; F64-P80 HydrophobicContact CE2-CB 3.74Å; F64-P80 HydrophobicContact CZ-CB 4.11Å
65	D	91.8	Very high	85.1	Confident	34 Å²	34	35.8 Å²	35.8	18%	0.182	19%	0.187	C	C	.	.			trans	-61.8	136	168.4	-59.9	-37.2	0	0	0	109.1	F33 R34 V35 F75 P76 T77	F33-D65 WeakPolarHBondContact O-CA 3.44Å; R34-D65 WeakPolarHBondContact CA-OD1 3.38Å; V35-D65 PolarHBondContact N-OD1 3.29Å; D65-F75 WeakPolarHBondContact O-CD1 3.32Å; D65-P76 HydrophobicContact CB-CG 4.35Å; D65-T77 WeakPolarHBondContact CB-OG1 3.31Å; D65-T77 WeakPolarHBondContact OD2-CG2 3.22Å; D65-T77 PolarHBondContact OD2-OG1 3.16Å
66	R	91.1	Very high	86.1	Confident	12 Å²	12	35 Å²	35	5%	0.045	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	149.1	-178.2	57.1	174	179.4	-77.4	6.9	112.6	F33 A61 I62 F64 E73 C74 F75	F33-R66 HydrophobicContact CB-CG 3.69Å; F33-R66 HydrophobicContact CD2-CG 3.81Å; F33-R66 HydrophobicContact CG-CG 3.96Å; F33-R66 PolarHBondContact N-O 3.47Å; F33-R66 PolarHBondContact O-N 3.2Å; A61-R66 PolarHBondContact O-NH1 3.02Å; I62-R66 VanDerWaalsContact CA-NH1 3.31Å; I62-R66 PolarHBondContact O-NH1 3.5Å; I62-R66 VanDerWaalsContact O-NH1 3.11Å; F64-R66 PolarHBondContact O-NH1 2.83Å; R66-E73 HydrophobicContact CB-CG 4.3Å; R66-E73 WeakPolarHBondContact CD-OE1 3.43Å; R66-E73 IonicContact NE-OE1 2.96Å; R66-C74 CarbonylContact C-O 3.42Å; R66-C74 WeakPolarHBondContact CA-O 3.49Å; R66-F75 HydrophobicContact CB-CD1 4.1Å; R66-F75 HydrophobicContact CB-CE1 4.03Å
67	T	93.4	Very high	86.8	Confident	19 Å²	19	35 Å²	35	12%	0.117	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.3	172.1	62.4	0	0	0	0	109	N28 Q31 E32 E73 C74	N28-T67 CarbonylContact O-C 3.58Å; N28-T67 VanDerWaalsContact O-CB 3.28Å; N28-T67 WeakPolarHBondContact O-CB 3.34Å; N28-T67 PolarHBondContact O-OG1 3.38Å; Q31-T67 CarbonylContact O-C 3.14Å; Q31-T67 WeakPolarHBondContact O-CA 3.37Å; E32-T67 HydrophobicContact CG-CG2 4.26Å; T67-E73 WeakPolarHBondContact O-CA 3.25Å; T67-C74 PolarHBondContact N-O 3.4Å; T67-C74 PolarHBondContact O-N 3.31Å
68	L	90.3	Very high	87.3	Confident	25 Å²	25	38.7 Å²	38.7	13%	0.131	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.7	175.8	-59.5	-177.4	0	0	0	109.9	N28 W30 Q31 F33 E73 L97	N28-L68 CarbonylContact C-O 3.59Å; N28-L68 CarbonylContact O-C 3.51Å; N28-L68 VanDerWaalsContact O-C 3.24Å; W30-L68 WeakPolarHBondContact CB-O 3.34Å; W30-L68 PolarHBondContact N-O 2.86Å; Q31-L68 HydrophobicContact CB-CB 4.3Å; Q31-L68 PolarHBondContact N-O 2.94Å; Q31-L68 PolarHBondContact O-N 3.02Å; F33-L68 HydrophobicContact CD2-CD1 4.48Å; F33-L68 HydrophobicContact CD2-CG 4.42Å; F33-L68 HydrophobicContact CE2-CD1 3.51Å; F33-L68 HydrophobicContact CE2-CG 3.87Å; F33-L68 HydrophobicContact CZ-CD1 4.13Å; L68-E73 HydrophobicContact CD2-CB 3.6Å; L68-E73 HydrophobicContact CD2-CG 3.58Å; L68-L97 HydrophobicContact CD2-CD1 4.08Å
69	G	89.8	Confident	87.7	Confident	2 Å²	2	37.3 Å²	37.3	2%	0.021	20%	0.197	C	C	.	.			trans	-98.2	-169.7	162.3	0	0	0	0	0	112.4	N28 F71 R72	N28-G69 PolarHBondContact O-N 3.23Å; G69-F71 VanDerWaalsContact C-N 3.31Å; G69-R72 PolarHBondContact N-O 2.97Å
70	L	86.6	Confident	88	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.17	C	C	.	.	S	Bend	trans	-69.7	-31	169	-65.2	177.9	0	0	0	112.4	F25 W30 M141 I145	F25-L70 HydrophobicContact CD2-CD1 3.53Å; F25-L70 HydrophobicContact CE2-CD1 4.06Å; F25-L70 HydrophobicContact CG-CD1 4.4Å; W30-L70 HydrophobicContact CD2-CD2 4.08Å; W30-L70 HydrophobicContact CD2-CG 4.29Å; W30-L70 HydrophobicContact CE3-CD2 4.34Å; W30-L70 HydrophobicContact CH2-CD2 4.34Å; W30-L70 HydrophobicContact CZ2-CD1 3.79Å; W30-L70 HydrophobicContact CZ2-CD2 4.1Å; W30-L70 HydrophobicContact CZ2-CG 4Å; W30-L70 HydrophobicContact CZ3-CD2 4.46Å; L70-M141 HydrophobicContact CB-CE 4.36Å; L70-M141 HydrophobicContact CD2-CE 3.66Å; L70-I145 HydrophobicContact CB-CG1 4.42Å
71	F	86.9	Confident	88.1	Confident	75 Å²	75	34.1 Å²	34.1	33%	0.329	18%	0.182	S	C	.	.	S	Bend	trans	-117	-25.4	-170.1	-58.9	-71.2	0	0	0	114.6	F25 G69 L97 I145	F25-F71 HydrophobicContact CD1-CE2 4.34Å; F25-F71 HydrophobicContact CD2-CE2 4.34Å; F25-F71 HydrophobicContact CD2-CZ 4.47Å; F25-F71 AromaticContact CE1-CE2 3.96Å; F25-F71 HydrophobicContact CE1-CE2 3.96Å; F25-F71 AromaticContact CE1-CZ 3.95Å; F25-F71 HydrophobicContact CE1-CZ 3.95Å; F25-F71 AromaticContact CE2-CE2 3.96Å; F25-F71 HydrophobicContact CE2-CE2 3.96Å; F25-F71 AromaticContact CE2-CZ 3.67Å; F25-F71 HydrophobicContact CE2-CZ 3.67Å; F25-F71 AromaticContact CZ-CE2 3.78Å; F25-F71 HydrophobicContact CZ-CE2 3.78Å; F25-F71 AromaticContact CZ-CZ 3.37Å; F25-F71 HydrophobicContact CZ-CZ 3.37Å; G69-F71 VanDerWaalsContact C-N 3.31Å; F71-L97 PolarHBondContact O-N 3.35Å; F71-I145 HydrophobicContact CD1-CD1 4.19Å; F71-I145 HydrophobicContact CE1-CD1 3.91Å; F71-I145 HydrophobicContact CE1-CG1 4.19Å; F71-I145 HydrophobicContact CE1-CG2 3.64Å; F71-I145 HydrophobicContact CZ-CG1 4.49Å; F71-I145 HydrophobicContact CZ-CG2 3.87Å
72	R	87.9	Confident	87.8	Confident	78 Å²	78	37.8 Å²	37.8	29%	0.294	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.1	-165.7	-58.3	170.1	-176.8	-163.2	-3.2	110	G69 Y86 R95	G69-R72 PolarHBondContact N-O 2.97Å; R72-Y86 WeakPolarHBondContact CD-OH 3.37Å; R72-Y86 WeakPolarHBondContact CG-OH 3.44Å; R72-Y86 PolarHBondContact NE-OH 3.2Å; R72-R95 WeakPolarHBondContact CA-O 3.45Å
73	E	88.8	Confident	87.2	Confident	16 Å²	16	37 Å²	37	8%	0.075	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.9	166	171.3	178.2	-143.4	0	0	107.4	R66 T67 L68 F75 C94 R95 L97	R66-E73 HydrophobicContact CB-CG 4.3Å; R66-E73 WeakPolarHBondContact CD-OE1 3.43Å; R66-E73 IonicContact NE-OE1 2.96Å; T67-E73 WeakPolarHBondContact O-CA 3.25Å; L68-E73 HydrophobicContact CD2-CB 3.6Å; L68-E73 HydrophobicContact CD2-CG 3.58Å; E73-F75 HydrophobicContact CG-CE2 4.17Å; E73-F75 HydrophobicContact CG-CZ 4Å; E73-C94 CarbonylContact O-C 3.5Å; E73-C94 VanDerWaalsContact O-CA 3.24Å; E73-C94 WeakPolarHBondContact O-CA 3Å; E73-R95 HydrophobicContact CB-CG 4.32Å; E73-R95 PolarHBondContact N-O 3.35Å; E73-R95 PolarHBondContact O-N 3Å; E73-R95 IonicContact OE1-NH2 2.7Å; E73-R95 IonicContact OE2-CZ 3.64Å; E73-R95 IonicContact OE2-NE 2.72Å; E73-R95 PolarHBondContact OE2-NE 2.9Å; E73-R95 IonicContact OE2-NH2 3.11Å; E73-R95 PolarHBondContact OE2-NH2 3.4Å; E73-L97 HydrophobicContact CB-CD1 3.53Å
74	C	92.3	Very high	86.9	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.014	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.2	-179.1	-60.1	0	0	0	0	110.8	R66 T67 N92 Q93 C94	R66-C74 CarbonylContact C-O 3.42Å; R66-C74 WeakPolarHBondContact CA-O 3.49Å; T67-C74 PolarHBondContact N-O 3.4Å; T67-C74 PolarHBondContact O-N 3.31Å; C74-N92 HydrophobicContact CB-CB 4.44Å; C74-Q93 CarbonylContact C-O 3.44Å; C74-Q93 WeakPolarHBondContact CA-O 3.47Å; C74-C94 HydrophobicContact CB-CB 4.05Å; C74-C94 WeakPolarHBondContact CB-SG 3.5Å; C74-C94 WeakPolarHBondContact SG-CB 3.27Å; C74-C94 CovalentContact SG-SG 2.04Å; C74-C94 PolarHBondContact SG-SG 2.93Å
75	F	92.3	Very high	86.8	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	102.4	-179.4	-62.2	-83	0	0	0	108.5	A61 F64 D65 R66 E73 D78 V79 P80 T85 Q93 R95	A61-F75 HydrophobicContact CB-CE1 3.97Å; A61-F75 HydrophobicContact CB-CZ 3.78Å; F64-F75 HydrophobicContact CB-CD1 3.97Å; F64-F75 HydrophobicContact CB-CE1 4.14Å; D65-F75 WeakPolarHBondContact O-CD1 3.32Å; R66-F75 HydrophobicContact CB-CD1 4.1Å; R66-F75 HydrophobicContact CB-CE1 4.03Å; E73-F75 HydrophobicContact CG-CE2 4.17Å; E73-F75 HydrophobicContact CG-CZ 4Å; F75-D78 WeakPolarHBondContact CB-O 3.46Å; F75-V79 HydrophobicContact CB-CG2 4.15Å; F75-P80 HydrophobicContact CE1-CG 3.99Å; F75-P80 HydrophobicContact CE2-CG 4.36Å; F75-P80 HydrophobicContact CZ-CG 3.91Å; F75-T85 HydrophobicContact CD2-CG2 4.08Å; F75-T85 HydrophobicContact CE2-CG2 4.27Å; F75-Q93 PolarHBondContact N-O 3.27Å; F75-R95 HydrophobicContact CE2-CG 4.28Å
76	P	88.7	Confident	86.6	Confident	66 Å²	66	43.2 Å²	43.2	43%	0.429	27%	0.265	S	S	.	.	S	Bend	trans	-77.3	-26.9	-173.6	28.5	-34.3	0	0	0	113.9	D65	D65-P76 HydrophobicContact CB-CG 4.35Å
77	T	87.2	Confident	86.5	Confident	80 Å²	80	46.7 Å²	46.7	49%	0.491	29%	0.288	S	S	.	.	S	Bend	trans	-104.6	-65.6	-174.4	51.8	0	0	0	0	111.6	D65	D65-T77 WeakPolarHBondContact CB-OG1 3.31Å; D65-T77 WeakPolarHBondContact OD2-CG2 3.22Å; D65-T77 PolarHBondContact OD2-OG1 3.16Å
78	D	86.5	Confident	86.2	Confident	82 Å²	82	46.3 Å²	46.3	44%	0.439	29%	0.285	S	S	.	.			trans	-133.7	149.9	-176.7	-69.6	-35.1	0	0	0	111	R37 F64 F75	R37-D78 IonicContact CZ-OD2 3.81Å; R37-D78 IonicContact NH1-OD2 2.71Å; R37-D78 PolarHBondContact NH1-OD2 2.82Å; F64-D78 HydrophobicContact CD1-CB 3.71Å; F64-D78 VanDerWaalsContact CD1-O 3.3Å; F64-D78 WeakPolarHBondContact CD1-O 3.24Å; F64-D78 HydrophobicContact CE1-CB 3.82Å; F75-D78 WeakPolarHBondContact CB-O 3.46Å
79	V	86.9	Confident	85.8	Confident	45 Å²	45	51.4 Å²	51.4	27%	0.273	32%	0.319	S	S	.	.			trans	-105.7	138.5	180	179.9	0	0	0	0	110.8	F64 F75 S83 T85 Q93	F64-V79 WeakPolarHBondContact CE1-O 3.39Å; F75-V79 HydrophobicContact CB-CG2 4.15Å; V79-S83 WeakPolarHBondContact CG1-OG 3.49Å; V79-T85 HydrophobicContact CG1-CG2 3.67Å; V79-Q93 HydrophobicContact CG2-CB 3.34Å; V79-Q93 HydrophobicContact CG2-CG 3.64Å
80	P	85.5	Confident	85.4	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.019	35%	0.354	C	S	.	.			trans	-65.2	138.6	171.8	16.5	-22	0	0	0	112	A61 F64 F75 G82 S83	A61-P80 HydrophobicContact CB-CG 4.07Å; F64-P80 HydrophobicContact CD2-CB 3.98Å; F64-P80 HydrophobicContact CD2-CG 4.34Å; F64-P80 HydrophobicContact CE2-CB 3.74Å; F64-P80 HydrophobicContact CZ-CB 4.11Å; F75-P80 HydrophobicContact CE1-CG 3.99Å; F75-P80 HydrophobicContact CE2-CG 4.36Å; F75-P80 HydrophobicContact CZ-CG 3.91Å; P80-G82 PolarHBondContact O-N 2.82Å; P80-S83 VanDerWaalsContact O-CB 3.29Å; P80-S83 WeakPolarHBondContact O-CB 3.44Å; P80-S83 PolarHBondContact O-N 3.41Å; P80-S83 PolarHBondContact O-OG 3.45Å
81	N	82.1	Confident	85.3	Confident	107 Å²	107	60.9 Å²	60.9	57%	0.572	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	127.2	-180	-71.1	-8.7	0	0	0	110.8	N58	N58-N81 PolarHBondContact O-N 2.95Å
82	G	76.9	Confident	85.3	Confident	88 Å²	88	60.1 Å²	60.1	91%	0.907	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	13.9	177.5	0	0	0	0	0	115.3	P80 G84	P80-G82 PolarHBondContact O-N 2.82Å; G82-G84 VanDerWaalsContact C-N 3.32Å; G82-G84 PolarHBondContact O-N 3.31Å
83	S	71.3	Confident	85.5	Confident	24 Å²	24	59.2 Å²	59.2	17%	0.168	38%	0.377	C	S	.	.			trans	-81.4	0.6	-173.9	58.4	0	0	0	0	116.4	V79 P80 T85	V79-S83 WeakPolarHBondContact CG1-OG 3.49Å; P80-S83 VanDerWaalsContact O-CB 3.29Å; P80-S83 WeakPolarHBondContact O-CB 3.44Å; P80-S83 PolarHBondContact O-N 3.41Å; P80-S83 PolarHBondContact O-OG 3.45Å; S83-T85 PolarHBondContact O-N 3.22Å
84	G	80	Confident	85.6	Confident	68 Å²	68	58.5 Å²	58.5	70%	0.701	37%	0.373	S	S	*	.			trans	57.9	46.7	175.4	0	0	0	0	0	113.4	G82	G82-G84 VanDerWaalsContact C-N 3.32Å; G82-G84 PolarHBondContact O-N 3.31Å
85	T	86.4	Confident	85.3	Confident	39 Å²	39	61.4 Å²	61.4	24%	0.239	38%	0.384	C	S	.	.			trans	-80.5	151.2	177.7	56.9	0	0	0	0	112.2	F75 V79 S83 Q93 C94 R95	F75-T85 HydrophobicContact CD2-CG2 4.08Å; F75-T85 HydrophobicContact CE2-CG2 4.27Å; V79-T85 HydrophobicContact CG1-CG2 3.67Å; S83-T85 PolarHBondContact O-N 3.22Å; T85-Q93 PolarHBondContact OG1-OE1 3.23Å; T85-C94 CarbonylContact C-O 3.55Å; T85-C94 VanDerWaalsContact CA-O 3.25Å; T85-C94 WeakPolarHBondContact CA-O 3.23Å; T85-C94 WeakPolarHBondContact CB-O 3.49Å; T85-R95 HydrophobicContact CG2-CB 4.43Å
86	Y	88.2	Confident	85	Confident	72 Å²	72	64.9 Å²	64.9	28%	0.282	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	158.3	167	64.3	-92	0	0	0	109.4	R72 C94 N96	R72-Y86 WeakPolarHBondContact CD-OH 3.37Å; R72-Y86 WeakPolarHBondContact CG-OH 3.44Å; R72-Y86 PolarHBondContact NE-OH 3.2Å; Y86-C94 VanDerWaalsContact CD1-O 3.26Å; Y86-C94 WeakPolarHBondContact CD1-O 3.23Å; Y86-C94 HydrophobicContact CE2-CB 4.38Å; Y86-C94 PolarHBondContact N-O 3.23Å; Y86-C94 PolarHBondContact O-N 3.12Å; Y86-C94 VanDerWaalsContact O-O 3.13Å; Y86-N96 PolarHBondContact OH-OD1 3.06Å
87	T	89.3	Confident	84.3	Confident	85 Å²	85	64.3 Å²	64.3	52%	0.521	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	124.8	177	-50	0	0	0	0	109.4	N92 Q93	T87-N92 WeakPolarHBondContact CA-O 3.13Å; T87-Q93 PolarHBondContact OG1-NE2 2.78Å
88	D	85.5	Confident	83	Confident	10 Å²	10	65.8 Å²	65.8	5%	0.053	40%	0.4	C	S	.	.			trans	-76.6	168.8	174.8	82.9	-9.4	0	0	0	111.5	M90 G91 N92	D88-M90 PolarHBondContact O-N 3.45Å; D88-M90 VanDerWaalsContact OD1-C 3.29Å; D88-M90 WeakPolarHBondContact OD1-CA 3.21Å; D88-M90 WeakPolarHBondContact OD1-CB 3.47Å; D88-M90 PolarHBondContact OD1-N 2.98Å; D88-G91 PolarHBondContact O-N 3.26Å; D88-G91 PolarHBondContact OD1-N 3.32Å; D88-N92 PolarHBondContact N-O 3.4Å; D88-N92 PolarHBondContact OD1-N 3.24Å
89	P	83.8	Confident	81.4	Confident	132 Å²	132	67.2 Å²	67.2	86%	0.857	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15	177.8	-25.5	35.7	0	0	0	114.8
90	M	80.5	Confident	79.7	Confident	152 Å²	152	66.9 Å²	66.9	75%	0.749	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	1.6	177.7	-58.7	-169.2	75.7	0	0	112.7	D88	D88-M90 PolarHBondContact O-N 3.45Å; D88-M90 VanDerWaalsContact OD1-C 3.29Å; D88-M90 WeakPolarHBondContact OD1-CA 3.21Å; D88-M90 WeakPolarHBondContact OD1-CB 3.47Å; D88-M90 PolarHBondContact OD1-N 2.98Å
91	G	84.4	Confident	77.8	Confident	50 Å²	50	73.4 Å²	73.4	52%	0.515	43%	0.432	S	S	.	.	S	Bend	trans	85.9	2.7	179.3	0	0	0	0	0	114.9	D88	D88-G91 PolarHBondContact O-N 3.26Å; D88-G91 PolarHBondContact OD1-N 3.32Å
92	N	86.8	Confident	76.2	Confident	59 Å²	59	71.1 Å²	71.1	32%	0.316	42%	0.419	S	S	.	.			trans	-82.1	147.6	178.3	-59.9	-54.5	0	0	0	111	C74 T87 D88 C94	C74-N92 HydrophobicContact CB-CB 4.44Å; T87-N92 WeakPolarHBondContact CA-O 3.13Å; D88-N92 PolarHBondContact N-O 3.4Å; D88-N92 PolarHBondContact OD1-N 3.24Å; N92-C94 PolarHBondContact O-N 2.94Å
93	Q	91.3	Very high	75	Confident	60 Å²	60	68.9 Å²	68.9	28%	0.28	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	112.4	173.7	-64.6	-60.8	-39.1	0	0	109.3	C74 F75 V79 T85 T87	C74-Q93 CarbonylContact C-O 3.44Å; C74-Q93 WeakPolarHBondContact CA-O 3.47Å; F75-Q93 PolarHBondContact N-O 3.27Å; V79-Q93 HydrophobicContact CG2-CB 3.34Å; V79-Q93 HydrophobicContact CG2-CG 3.64Å; T85-Q93 PolarHBondContact OG1-OE1 3.23Å; T87-Q93 PolarHBondContact OG1-NE2 2.78Å
94	C	91	Very high	74.2	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	156	-175.1	-54.9	0	0	0	0	111.6	E73 C74 T85 Y86 N92	E73-C94 CarbonylContact O-C 3.5Å; E73-C94 VanDerWaalsContact O-CA 3.24Å; E73-C94 WeakPolarHBondContact O-CA 3Å; C74-C94 HydrophobicContact CB-CB 4.05Å; C74-C94 WeakPolarHBondContact CB-SG 3.5Å; C74-C94 WeakPolarHBondContact SG-CB 3.27Å; C74-C94 CovalentContact SG-SG 2.04Å; C74-C94 PolarHBondContact SG-SG 2.93Å; T85-C94 CarbonylContact C-O 3.55Å; T85-C94 VanDerWaalsContact CA-O 3.25Å; T85-C94 WeakPolarHBondContact CA-O 3.23Å; T85-C94 WeakPolarHBondContact CB-O 3.49Å; Y86-C94 VanDerWaalsContact CD1-O 3.26Å; Y86-C94 WeakPolarHBondContact CD1-O 3.23Å; Y86-C94 HydrophobicContact CE2-CB 4.38Å; Y86-C94 PolarHBondContact N-O 3.23Å; Y86-C94 PolarHBondContact O-N 3.12Å; Y86-C94 VanDerWaalsContact O-O 3.13Å; N92-C94 PolarHBondContact O-N 2.94Å
95	R	87.8	Confident	73.2	Confident	64 Å²	64	78.5 Å²	78.5	24%	0.242	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.7	165.4	63.2	-175.5	-175.7	163.4	5.9	109	R72 E73 F75 T85	R72-R95 WeakPolarHBondContact CA-O 3.45Å; E73-R95 HydrophobicContact CB-CG 4.32Å; E73-R95 PolarHBondContact N-O 3.35Å; E73-R95 PolarHBondContact O-N 3Å; E73-R95 IonicContact OE1-NH2 2.7Å; E73-R95 IonicContact OE2-CZ 3.64Å; E73-R95 IonicContact OE2-NE 2.72Å; E73-R95 PolarHBondContact OE2-NE 2.9Å; E73-R95 IonicContact OE2-NH2 3.11Å; E73-R95 PolarHBondContact OE2-NH2 3.4Å; F75-R95 HydrophobicContact CE2-CG 4.28Å; T85-R95 HydrophobicContact CG2-CB 4.43Å
96	N	83.9	Confident	72	Confident	77 Å²	77	81.1 Å²	81.1	41%	0.412	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	144	172.1	-67.3	-31	0	0	0	108.4	Y86 I98	Y86-N96 PolarHBondContact OH-OD1 3.06Å; N96-I98 HydrophobicContact CB-CD1 4.15Å; N96-I98 HydrophobicContact CB-CG1 3.87Å; N96-I98 WeakPolarHBondContact O-CG1 3.16Å; N96-I98 PolarHBondContact O-N 2.81Å
97	L	76.1	Confident	70.8	Confident	54 Å²	54	83.2 Å²	83.2	28%	0.283	46%	0.456	S	S	.	.			trans	-69.4	86.9	172.3	-128.3	70.9	0	0	0	108	L68 F71 E73	L68-L97 HydrophobicContact CD2-CD1 4.08Å; F71-L97 PolarHBondContact O-N 3.35Å; E73-L97 HydrophobicContact CB-CD1 3.53Å
98	I	58.6	Low	69.5	Low	111 Å²	111	81.7 Å²	81.7	57%	0.569	45%	0.446	S	S	*	.			trans	-88.9	-11.5	-173.2	-68.5	165.5	0	0	0	112	N96 Y100	N96-I98 HydrophobicContact CB-CD1 4.15Å; N96-I98 HydrophobicContact CB-CG1 3.87Å; N96-I98 WeakPolarHBondContact O-CG1 3.16Å; N96-I98 PolarHBondContact O-N 2.81Å; I98-Y100 VanDerWaalsContact C-N 3.29Å; I98-Y100 PolarHBondContact O-N 3.21Å
99	D	52.9	Low	68.3	Low	112 Å²	112	83.1 Å²	83.1	60%	0.599	46%	0.455	S	S	*	.			trans	-86	57.3	-172.7	-74.7	-24.4	0	0	0	115
100	Y	50.5	Low	67.2	Low	37 Å²	37	86.8 Å²	86.8	15%	0.145	45%	0.452	C	S	.	.			trans	-102.8	12.6	152.1	-59.6	-72.2	0	0	0	112.1	I98 I102 D139 M141 R142	I98-Y100 VanDerWaalsContact C-N 3.29Å; I98-Y100 PolarHBondContact O-N 3.21Å; Y100-I102 VanDerWaalsContact C-N 3.34Å; Y100-I102 PolarHBondContact O-N 3.48Å; Y100-D139 VanDerWaalsContact CB-OD2 3.26Å; Y100-D139 WeakPolarHBondContact CB-OD2 2.95Å; Y100-D139 HydrophobicContact CD1-CB 3.54Å; Y100-D139 VanDerWaalsContact CD1-CG 3.48Å; Y100-D139 WeakPolarHBondContact CD1-OD2 3.22Å; Y100-D139 HydrophobicContact CE1-CB 3.81Å; Y100-D139 HydrophobicContact CG-CB 4.28Å; Y100-D139 VanDerWaalsContact CG-OD2 3.27Å; Y100-M141 HydrophobicContact CE1-CB 3.82Å; Y100-M141 HydrophobicContact CE1-CG 4.41Å; Y100-M141 WeakPolarHBondContact OH-CB 3.24Å; Y100-M141 WeakPolarHBondContact OH-CG 3.46Å; Y100-R142 HydrophobicContact CE2-CG 4.33Å
101	Q	45.6	Very low	66.6	Low	141 Å²	141	82.4 Å²	82.4	66%	0.659	44%	0.437	S	S	*	.			trans	-69.3	99.8	175.6	-80.9	179.4	-50.2	0	0	108.4
102	I	49.5	Very low	65.7	Low	59 Å²	59	82.1 Å²	82.1	30%	0.303	42%	0.42	S	S	.	.			trans	-51.7	121.7	158.1	-53.1	170.5	0	0	0	105.3	Y100 E104 V109 M120	Y100-I102 VanDerWaalsContact C-N 3.34Å; Y100-I102 PolarHBondContact O-N 3.48Å; I102-E104 PolarHBondContact O-N 3.41Å; I102-V109 HydrophobicContact CG2-CG2 3.59Å; I102-M120 HydrophobicContact CB-CE 4.34Å; I102-M120 WeakPolarHBondContact CD1-O 3.4Å; I102-M120 HydrophobicContact CG1-CE 4.1Å
103	P	52.3	Low	64.7	Low	41 Å²	41	81.5 Å²	81.5	27%	0.266	42%	0.421	S	S	.	.			trans	-55.1	131.3	172.4	18	-25.4	0	0	0	108.1	D105 V108 V109 Y112	P103-D105 PolarHBondContact O-N 2.97Å; P103-V108 HydrophobicContact CB-CG1 4.4Å; P103-V108 HydrophobicContact CG-CB 4.34Å; P103-V108 HydrophobicContact CG-CG1 3.81Å; P103-V109 WeakPolarHBondContact O-CG2 3.35Å; P103-Y112 VanDerWaalsContact CD-OH 3.24Å; P103-Y112 WeakPolarHBondContact CD-OH 3.33Å; P103-Y112 HydrophobicContact CG-CE2 4.28Å; P103-Y112 WeakPolarHBondContact CG-OH 3.5Å
104	E	53.6	Low	63.6	Low	188 Å²	188	85.9 Å²	85.9	88%	0.879	44%	0.435	S	S	*	.	S	Bend	trans	-60.6	-22.4	-174.4	-62.1	-175.5	168.6	0	0	111.7	I102 S106	I102-E104 PolarHBondContact O-N 3.41Å; E104-S106 PolarHBondContact O-N 2.86Å
105	D	59.8	Low	62.4	Low	106 Å²	106	90.2 Å²	90.2	57%	0.567	45%	0.453	S	S	*	.			trans	-66.8	100.4	178.1	-66.4	-20.8	0	0	0	112.3	P103 V107 V108 V109	P103-D105 PolarHBondContact O-N 2.97Å; D105-V107 PolarHBondContact O-N 2.95Å; D105-V108 HydrophobicContact CB-CB 4.05Å; D105-V108 HydrophobicContact CB-CG2 3.63Å; D105-V108 WeakPolarHBondContact O-CB 3.29Å; D105-V108 PolarHBondContact O-N 3.31Å; D105-V109 PolarHBondContact O-N 2.7Å; D105-V109 VanDerWaalsContact O-N 3.14Å
106	S	60.6	Low	61.3	Low	93 Å²	93	87.7 Å²	87.7	65%	0.65	44%	0.443	S	S	*	.	H	α-helix	trans	-52.7	-28.2	174.3	62.8	0	0	0	0	114.3	E104 R110	E104-S106 PolarHBondContact O-N 2.86Å; S106-R110 PolarHBondContact O-N 3.08Å; S106-R110 VanDerWaalsContact O-N 3.15Å
107	V	63.3	Low	60.2	Low	117 Å²	117	85.3 Å²	85.3	71%	0.709	43%	0.43	S	S	*	.	H	α-helix	trans	-69	-41.7	175.5	-178.4	0	0	0	0	111.1	D105 R110	D105-V107 PolarHBondContact O-N 2.95Å; V107-R110 PolarHBondContact O-N 3.5Å
108	V	61.4	Low	59.6	Low	53 Å²	53	85.5 Å²	85.5	32%	0.321	43%	0.431	S	S	.	.	H	α-helix	trans	-65.7	-43.2	177.2	178.4	0	0	0	0	109.8	P103 D105 R110 S111 Y112	P103-V108 HydrophobicContact CB-CG1 4.4Å; P103-V108 HydrophobicContact CG-CB 4.34Å; P103-V108 HydrophobicContact CG-CG1 3.81Å; D105-V108 HydrophobicContact CB-CB 4.05Å; D105-V108 HydrophobicContact CB-CG2 3.63Å; D105-V108 WeakPolarHBondContact O-CB 3.29Å; D105-V108 PolarHBondContact O-N 3.31Å; V108-R110 VanDerWaalsContact C-N 3.31Å; V108-R110 PolarHBondContact O-N 3.06Å; V108-S111 WeakPolarHBondContact O-CB 3.35Å; V108-S111 PolarHBondContact O-N 2.98Å; V108-S111 VanDerWaalsContact O-N 3.11Å; V108-S111 PolarHBondContact O-OG 3.14Å; V108-Y112 HydrophobicContact CG1-CE1 3.85Å; V108-Y112 WeakPolarHBondContact O-CD1 3.24Å
109	V	61.1	Low	59.8	Low	40 Å²	40	81.9 Å²	81.9	24%	0.242	41%	0.411	C	S	.	.	H	α-helix	trans	-62.9	-35.2	179.1	-179.3	0	0	0	0	112.5	I102 P103 D105 S111 Y112 L117	I102-V109 HydrophobicContact CG2-CG2 3.59Å; P103-V109 WeakPolarHBondContact O-CG2 3.35Å; D105-V109 PolarHBondContact O-N 2.7Å; D105-V109 VanDerWaalsContact O-N 3.14Å; V109-S111 PolarHBondContact O-N 2.98Å; V109-Y112 HydrophobicContact CB-CD2 4.41Å; V109-Y112 HydrophobicContact CG1-CD2 4.28Å; V109-Y112 HydrophobicContact CG2-CE2 4.26Å; V109-Y112 WeakPolarHBondContact O-CB 3.38Å; V109-Y112 PolarHBondContact O-N 3.33Å; V109-L117 HydrophobicContact CG1-CD2 4.33Å
110	R	61	Low	60	Low	208 Å²	208	77.6 Å²	77.6	79%	0.785	39%	0.387	S	S	*	.	H	α-helix	trans	-68.7	-22.7	177.7	-163.2	-179.8	-76.4	-172.9	-3.2	112.7	S106 V107 V108 Y112	S106-R110 PolarHBondContact O-N 3.08Å; S106-R110 VanDerWaalsContact O-N 3.15Å; V107-R110 PolarHBondContact O-N 3.5Å; V108-R110 VanDerWaalsContact C-N 3.31Å; V108-R110 PolarHBondContact O-N 3.06Å; R110-Y112 VanDerWaalsContact C-N 3.28Å; R110-Y112 PolarHBondContact O-N 3.37Å
111	S	67	Low	60.3	Low	61 Å²	61	81.1 Å²	81.1	43%	0.427	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	1.4	177.3	79.7	0	0	0	0	114.1	V108 V109 R216	V108-S111 WeakPolarHBondContact O-CB 3.35Å; V108-S111 PolarHBondContact O-N 2.98Å; V108-S111 VanDerWaalsContact O-N 3.11Å; V108-S111 PolarHBondContact O-OG 3.14Å; V109-S111 PolarHBondContact O-N 2.98Å; S111-R216 PolarHBondContact O-NH2 3.26Å; S111-R216 PolarHBondContact OG-NH2 2.83Å
112	Y	65.7	Low	60.2	Low	44 Å²	44	82.3 Å²	82.3	17%	0.173	40%	0.403	C	S	.	.			trans	-78.4	135.2	-176	-72.4	-16.4	0	0	0	113.5	P103 V108 V109 R110 Q116 L117	P103-Y112 VanDerWaalsContact CD-OH 3.24Å; P103-Y112 WeakPolarHBondContact CD-OH 3.33Å; P103-Y112 HydrophobicContact CG-CE2 4.28Å; P103-Y112 WeakPolarHBondContact CG-OH 3.5Å; V108-Y112 HydrophobicContact CG1-CE1 3.85Å; V108-Y112 WeakPolarHBondContact O-CD1 3.24Å; V109-Y112 HydrophobicContact CB-CD2 4.41Å; V109-Y112 HydrophobicContact CG1-CD2 4.28Å; V109-Y112 HydrophobicContact CG2-CE2 4.26Å; V109-Y112 WeakPolarHBondContact O-CB 3.38Å; V109-Y112 PolarHBondContact O-N 3.33Å; R110-Y112 VanDerWaalsContact C-N 3.28Å; R110-Y112 PolarHBondContact O-N 3.37Å; Y112-Q116 VanDerWaalsContact CA-OE1 3.26Å; Y112-Q116 HydrophobicContact CG-CB 4.1Å; Y112-L117 HydrophobicContact CD2-CD2 4.5Å
113	S	66.4	Low	60	Low	46 Å²	46	85.8 Å²	85.8	32%	0.322	42%	0.422	S	S	.	.			trans	-59.9	155.3	171.8	174.5	0	0	0	0	110.5	Y115 Q116 L117	S113-Y115 PolarHBondContact O-N 3.36Å; S113-Y115 VanDerWaalsContact O-N 3.09Å; S113-Q116 WeakPolarHBondContact O-CB 3.43Å; S113-Q116 PolarHBondContact O-N 2.91Å; S113-L117 PolarHBondContact O-N 3.32Å
114	Y	67.9	Low	59.6	Low	151 Å²	151	91 Å²	91	59%	0.592	44%	0.44	S	S	*	.	H	α-helix	trans	-48.5	-40	177.4	177.7	-106.2	0	0	0	112.6	L117 I118	Y114-L117 WeakPolarHBondContact O-CB 3.43Å; Y114-L117 PolarHBondContact O-N 2.96Å; Y114-I118 HydrophobicContact CD1-CD1 3.65Å; Y114-I118 HydrophobicContact CD1-CG1 4.49Å; Y114-I118 HydrophobicContact CD2-CD1 4.46Å; Y114-I118 HydrophobicContact CE1-CD1 3.1Å; Y114-I118 HydrophobicContact CE1-CG1 4.21Å; Y114-I118 HydrophobicContact CE2-CD1 4Å; Y114-I118 HydrophobicContact CE2-CG1 4.4Å; Y114-I118 HydrophobicContact CG-CD1 4.31Å; Y114-I118 WeakPolarHBondContact O-CB 3.28Å; Y114-I118 WeakPolarHBondContact O-CG1 3.42Å; Y114-I118 PolarHBondContact O-N 3.45Å
115	Y	65.5	Low	59.1	Low	92 Å²	92	85.9 Å²	85.9	36%	0.361	43%	0.425	S	S	.	.	H	α-helix	trans	-72.3	-36.9	179	-60.3	-67.5	0	0	0	113.7	S113 L117 I118 R119 L213	S113-Y115 PolarHBondContact O-N 3.36Å; S113-Y115 VanDerWaalsContact O-N 3.09Å; Y115-L117 VanDerWaalsContact C-N 3.34Å; Y115-I118 PolarHBondContact O-N 2.98Å; Y115-R119 WeakPolarHBondContact O-CB 3.47Å; Y115-R119 PolarHBondContact O-N 3.45Å; Y115-L213 HydrophobicContact CD1-CB 4.09Å; Y115-L213 HydrophobicContact CD1-CD1 3.66Å; Y115-L213 HydrophobicContact CD1-CG 4.33Å; Y115-L213 HydrophobicContact CD2-CB 4Å; Y115-L213 HydrophobicContact CD2-CD2 4.43Å; Y115-L213 HydrophobicContact CE1-CB 4.48Å; Y115-L213 HydrophobicContact CE1-CD1 3.55Å; Y115-L213 HydrophobicContact CE1-CD2 4.19Å; Y115-L213 HydrophobicContact CE1-CG 4.28Å; Y115-L213 HydrophobicContact CE2-CB 4.4Å; Y115-L213 HydrophobicContact CE2-CD2 3.99Å; Y115-L213 HydrophobicContact CG-CB 3.81Å; Y115-L213 HydrophobicContact CG-CD1 4.27Å; Y115-L213 HydrophobicContact CG-CG 4.49Å
116	Q	64.3	Low	58.6	Low	10 Å²	10	88.2 Å²	88.2	5%	0.047	44%	0.437	C	S	.	.	H	α-helix	trans	-66.3	-42.7	173.6	-71.8	161.3	5.1	0	0	110.1	Y112 S113 R119 M120 I214 D215	Y112-Q116 VanDerWaalsContact CA-OE1 3.26Å; Y112-Q116 HydrophobicContact CG-CB 4.1Å; S113-Q116 WeakPolarHBondContact O-CB 3.43Å; S113-Q116 PolarHBondContact O-N 2.91Å; Q116-R119 PolarHBondContact O-N 3.3Å; Q116-M120 WeakPolarHBondContact O-CB 3.3Å; Q116-M120 WeakPolarHBondContact O-CG 3.48Å; Q116-M120 PolarHBondContact O-N 3.38Å; Q116-I214 HydrophobicContact CG-CG1 4.34Å; Q116-I214 HydrophobicContact CG-CG2 3.75Å; Q116-D215 PolarHBondContact NE2-OD1 3.38Å
117	L	62.2	Low	58	Low	27 Å²	27	91.2 Å²	91.2	14%	0.141	45%	0.445	C	S	.	.	H	α-helix	trans	-59.4	-55.5	172	-74.1	174.6	0	0	0	109.6	V109 Y112 S113 Y114 Y115 R119 M120 R121	V109-L117 HydrophobicContact CG1-CD2 4.33Å; Y112-L117 HydrophobicContact CD2-CD2 4.5Å; S113-L117 PolarHBondContact O-N 3.32Å; Y114-L117 WeakPolarHBondContact O-CB 3.43Å; Y114-L117 PolarHBondContact O-N 2.96Å; Y115-L117 VanDerWaalsContact C-N 3.34Å; L117-R119 PolarHBondContact O-N 2.97Å; L117-R119 VanDerWaalsContact O-N 3.12Å; L117-M120 CarbonylContact O-C 3.36Å; L117-M120 PolarHBondContact O-N 3.48Å; L117-R121 HydrophobicContact CB-CG 4.33Å; L117-R121 HydrophobicContact CD2-CG 4.3Å; L117-R121 VanDerWaalsContact O-CA 3.26Å; L117-R121 WeakPolarHBondContact O-CA 3.42Å; L117-R121 WeakPolarHBondContact O-CB 3.35Å; L117-R121 PolarHBondContact O-N 3.2Å
118	I	62.2	Low	57.4	Low	59 Å²	59	90.4 Å²	90.4	30%	0.303	44%	0.437	S	S	.	.	H	α-helix	trans	-51.5	-41.1	178.5	-80.9	176.3	0	0	0	113.1	Y114 Y115 M120 M140 I209	Y114-I118 HydrophobicContact CD1-CD1 3.65Å; Y114-I118 HydrophobicContact CD1-CG1 4.49Å; Y114-I118 HydrophobicContact CD2-CD1 4.46Å; Y114-I118 HydrophobicContact CE1-CD1 3.1Å; Y114-I118 HydrophobicContact CE1-CG1 4.21Å; Y114-I118 HydrophobicContact CE2-CD1 4Å; Y114-I118 HydrophobicContact CE2-CG1 4.4Å; Y114-I118 HydrophobicContact CG-CD1 4.31Å; Y114-I118 WeakPolarHBondContact O-CB 3.28Å; Y114-I118 WeakPolarHBondContact O-CG1 3.42Å; Y114-I118 PolarHBondContact O-N 3.45Å; Y115-I118 PolarHBondContact O-N 2.98Å; I118-M120 VanDerWaalsContact C-N 3.34Å; I118-M140 HydrophobicContact CG2-CE 4.4Å; I118-M140 HydrophobicContact CG2-CG 4.3Å; I118-M140 HydrophobicContact CG2-SD 3.32Å; I118-M140 WeakPolarHBondContact CG2-SD 3.28Å; I118-I209 HydrophobicContact CG2-CD1 4.35Å
119	R	62.8	Low	56.8	Low	35 Å²	35	94 Å²	94	13%	0.132	46%	0.464	C	S	.	.	H	α-helix	trans	-66.6	-34.3	176	-177.5	166.7	178.5	-93.2	5.6	113.1	Y115 Q116 L117 E210 I214 F219	Y115-R119 WeakPolarHBondContact O-CB 3.47Å; Y115-R119 PolarHBondContact O-N 3.45Å; Q116-R119 PolarHBondContact O-N 3.3Å; L117-R119 PolarHBondContact O-N 2.97Å; L117-R119 VanDerWaalsContact O-N 3.12Å; R119-E210 IonicContact CZ-OE1 3.29Å; R119-E210 IonicContact NE-OE1 2.73Å; R119-E210 PolarHBondContact NE-OE1 3.47Å; R119-E210 IonicContact NH2-OE1 3.63Å; R119-E210 PolarHBondContact NH2-OE1 2.96Å; R119-I214 HydrophobicContact CB-CD1 4.39Å; R119-F219 VanDerWaalsContact NH2-CE1 3.31Å
120	M	57.5	Low	56.2	Low	22 Å²	22	95.7 Å²	95.7	11%	0.108	48%	0.478	C	S	.	.	H	α-helix	trans	-112.6	-3.6	-169.4	-54.9	-73.6	-77.3	0	0	114.9	I102 Q116 L117 I118 K122	I102-M120 HydrophobicContact CB-CE 4.34Å; I102-M120 WeakPolarHBondContact CD1-O 3.4Å; I102-M120 HydrophobicContact CG1-CE 4.1Å; Q116-M120 WeakPolarHBondContact O-CB 3.3Å; Q116-M120 WeakPolarHBondContact O-CG 3.48Å; Q116-M120 PolarHBondContact O-N 3.38Å; L117-M120 CarbonylContact O-C 3.36Å; L117-M120 PolarHBondContact O-N 3.48Å; I118-M120 VanDerWaalsContact C-N 3.34Å; M120-K122 PolarHBondContact O-N 2.9Å; M120-K122 VanDerWaalsContact O-N 3.09Å
121	R	55.8	Low	55.4	Low	111 Å²	111	91 Å²	91	42%	0.419	48%	0.477	S	S	.	.			trans	-79.4	106.9	-158.2	-134.3	168.4	-178.6	174.1	-1.1	112.2	L117 L123	L117-R121 HydrophobicContact CB-CG 4.33Å; L117-R121 HydrophobicContact CD2-CG 4.3Å; L117-R121 VanDerWaalsContact O-CA 3.26Å; L117-R121 WeakPolarHBondContact O-CA 3.42Å; L117-R121 WeakPolarHBondContact O-CB 3.35Å; L117-R121 PolarHBondContact O-N 3.2Å; R121-L123 HydrophobicContact CB-CG 4.44Å; R121-L123 HydrophobicContact CG-CD2 4.28Å; R121-L123 HydrophobicContact CG-CG 3.93Å; R121-L123 VanDerWaalsContact CZ-CD2 3.43Å; R121-L123 VanDerWaalsContact NE-CD2 3.25Å; R121-L123 PolarHBondContact O-N 3.46Å
122	K	45.2	Very low	54.1	Low	165 Å²	165	95 Å²	95	72%	0.717	49%	0.494	S	S	*	.			trans	-67.3	95.3	134.9	-166.8	174.5	-173.1	176.3	0	108.1	M120 K124	M120-K122 PolarHBondContact O-N 2.9Å; M120-K122 VanDerWaalsContact O-N 3.09Å; K122-K124 PolarHBondContact O-N 3.35Å
123	L	45.1	Very low	53	Low	132 Å²	132	103.8 Å²	103.8	69%	0.691	53%	0.526	S	S	*	.			trans	-70.1	78	162.9	-88.1	167	0	0	0	108.4	R121	R121-L123 HydrophobicContact CB-CG 4.44Å; R121-L123 HydrophobicContact CG-CD2 4.28Å; R121-L123 HydrophobicContact CG-CG 3.93Å; R121-L123 VanDerWaalsContact CZ-CD2 3.43Å; R121-L123 VanDerWaalsContact NE-CD2 3.25Å; R121-L123 PolarHBondContact O-N 3.46Å
124	K	42.8	Very low	51.6	Low	152 Å²	152	112 Å²	112	66%	0.661	55%	0.551	S	S	*	*			trans	-83.9	111	157.8	-164.5	176.6	-178.9	-175.3	0	107	K122 L126	K122-K124 PolarHBondContact O-N 3.35Å; K124-L126 PolarHBondContact O-N 2.99Å
125	S	42.8	Very low	50.2	Low	79 Å²	79	110.4 Å²	110.4	55%	0.552	56%	0.557	S	S	*	*			trans	-42.7	122.8	162.7	171.9	0	0	0	0	109	N127	S125-N127 PolarHBondContact O-N 3.25Å
126	L	50.2	Low	49.1	Very low	156 Å²	156	112.7 Å²	112.7	82%	0.817	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	13.7	-178.8	-87.1	162.9	0	0	0	113.5	K124	K124-L126 PolarHBondContact O-N 2.99Å
127	N	47.9	Very low	48.1	Very low	155 Å²	155	118.8 Å²	118.8	83%	0.829	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.4	9.1	-170.3	-118.7	15.6	0	0	0	116.7	S125	S125-N127 PolarHBondContact O-N 3.25Å
128	D	49.6	Very low	47.5	Very low	101 Å²	101	120.5 Å²	120.5	54%	0.54	62%	0.615	S	S	.	*			trans	-117	107	-179.1	-143.4	-23.2	0	0	0	113	S130	D128-S130 VanDerWaalsContact C-N 3.27Å; D128-S130 PolarHBondContact O-N 3.46Å; D128-S130 PolarHBondContact OD1-OG 3.07Å
129	S	50.4	Low	47.7	Very low	128 Å²	128	118.3 Å²	118.3	90%	0.895	60%	0.604	S	S	*	*			trans	-92.7	41.8	176.2	-178.9	0	0	0	0	110.9
130	S	48.5	Very low	48.1	Very low	75 Å²	75	118.9 Å²	118.9	52%	0.524	61%	0.609	S	S	.	*			trans	-121.3	116.4	174.7	58.8	0	0	0	0	110.3	D128	D128-S130 VanDerWaalsContact C-N 3.27Å; D128-S130 PolarHBondContact O-N 3.46Å; D128-S130 PolarHBondContact OD1-OG 3.07Å
131	S	43.2	Very low	49	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	61%	0.607	S	S	*	*			trans	-56.6	146.6	160.5	52.9	0	0	0	0	109.4
132	D	39.5	Very low	50.1	Low	144 Å²	144	118.8 Å²	118.8	77%	0.77	61%	0.608	S	S	*	*			trans	78.2	85.2	178.5	-69.2	-21.6	0	0	0	118.6
133	R	42.3	Very low	51.8	Low	229 Å²	229	112.3 Å²	112.3	86%	0.864	58%	0.582	S	S	*	*				-167.5	112.4	126.1	-116.6	163.5	-79.2	-154.1	-0.7	113.1
134	R	37.7	Very low	53.7	Low	220 Å²	220	106 Å²	106	83%	0.83	55%	0.549	S	S	*	.			trans	27.9	124.9	137.1	-78.5	-179.9	-108.8	-136.5	-4.4	119
135	T	38.9	Very low	55.9	Low	117 Å²	117	99.9 Å²	99.9	72%	0.718	52%	0.524	S	S	*	.				82.7	126.6	129.4	49.7	0	0	0	0	121.2
136	L	42.5	Very low	58	Low	140 Å²	140	97.7 Å²	97.7	73%	0.733	51%	0.513	S	S	*	.			trans	60.6	112.3	145.9	-98.9	72.8	0	0	0	115.5
137	F	43.3	Very low	59.7	Low	138 Å²	138	92.5 Å²	92.5	61%	0.605	49%	0.486	S	S	*	.				-159.9	114.6	61.9	-93.1	-97.5	0	0	0	108.2	T143	F137-T143 HydrophobicContact CD1-CG2 3.89Å; F137-T143 WeakPolarHBondContact CD1-OG1 3.43Å; F137-T143 HydrophobicContact CE1-CG2 3.6Å
138	S	49.7	Very low	61.7	Low	63 Å²	63	85.1 Å²	85.1	44%	0.441	45%	0.447	S	S	.	.			trans	-88.7	133.4	165.1	57.4	0	0	0	0	108.8	R142 T143	S138-R142 WeakPolarHBondContact O-CB 3.07Å; S138-R142 WeakPolarHBondContact OG-CD 3.34Å; S138-T143 PolarHBondContact O-OG1 3.38Å
139	D	66.4	Low	63.7	Low	12 Å²	12	84 Å²	84	6%	0.064	44%	0.44	C	S	.	.			trans	46.7	120.7	163	-42	-31.6	0	0	0	116.6	Y100 M141 R142 T143	Y100-D139 VanDerWaalsContact CB-OD2 3.26Å; Y100-D139 WeakPolarHBondContact CB-OD2 2.95Å; Y100-D139 HydrophobicContact CD1-CB 3.54Å; Y100-D139 VanDerWaalsContact CD1-CG 3.48Å; Y100-D139 WeakPolarHBondContact CD1-OD2 3.22Å; Y100-D139 HydrophobicContact CE1-CB 3.81Å; Y100-D139 HydrophobicContact CG-CB 4.28Å; Y100-D139 VanDerWaalsContact CG-OD2 3.27Å; D139-M141 PolarHBondContact O-N 3.38Å; D139-R142 HydrophobicContact CB-CB 4.03Å; D139-R142 HydrophobicContact CB-CG 3.87Å; D139-R142 CarbonylContact O-C 3.54Å; D139-R142 WeakPolarHBondContact O-CA 3.26Å; D139-R142 WeakPolarHBondContact O-CB 3.5Å; D139-R142 PolarHBondContact O-N 2.83Å; D139-R142 WeakPolarHBondContact OD2-CD 3.46Å; D139-R142 IonicContact OD2-CZ 3.17Å; D139-R142 IonicContact OD2-NE 2.8Å; D139-R142 PolarHBondContact OD2-NE 3.46Å; D139-R142 IonicContact OD2-NH1 2.71Å; D139-R142 IonicContact OD2-NH2 3.41Å; D139-R142 PolarHBondContact OD2-NH2 2.86Å; D139-T143 PolarHBondContact O-N 3.36Å; D139-T143 PolarHBondContact O-OG1 2.89Å
140	M	71.7	Confident	65.5	Low	48 Å²	48	81.6 Å²	81.6	24%	0.236	42%	0.419	C	S	.	.	H	α-helix	trans	-50.5	-34.1	179.4	-69.9	-178.2	77.3	0	0	113	I118 T143 C144 V202 V206 I209	I118-M140 HydrophobicContact CG2-CE 4.4Å; I118-M140 HydrophobicContact CG2-CG 4.3Å; I118-M140 HydrophobicContact CG2-SD 3.32Å; I118-M140 WeakPolarHBondContact CG2-SD 3.28Å; M140-T143 WeakPolarHBondContact O-CB 3.3Å; M140-T143 PolarHBondContact O-N 2.95Å; M140-C144 PolarHBondContact O-N 3.45Å; M140-V202 VanDerWaalsContact O-CG1 3.28Å; M140-V202 WeakPolarHBondContact O-CG1 3.35Å; M140-V206 HydrophobicContact CB-CG2 3.37Å; M140-V206 HydrophobicContact CE-CG2 4.19Å; M140-V206 HydrophobicContact CG-CG2 4.42Å; M140-V206 HydrophobicContact SD-CG2 4.25Å; M140-I209 HydrophobicContact CE-CD1 3.77Å; M140-I209 HydrophobicContact SD-CD1 3.7Å
141	M	76.5	Confident	67.3	Low	14 Å²	14	78 Å²	78	7%	0.069	40%	0.395	C	S	.	.	H	α-helix	trans	-75.9	-35.9	176.3	-173.7	60.9	175.6	0	0	113.2	L70 Y100 D139 T143 C144 I145 W203 V206	L70-M141 HydrophobicContact CB-CE 4.36Å; L70-M141 HydrophobicContact CD2-CE 3.66Å; Y100-M141 HydrophobicContact CE1-CB 3.82Å; Y100-M141 HydrophobicContact CE1-CG 4.41Å; Y100-M141 WeakPolarHBondContact OH-CB 3.24Å; Y100-M141 WeakPolarHBondContact OH-CG 3.46Å; D139-M141 PolarHBondContact O-N 3.38Å; M141-T143 PolarHBondContact O-N 3.49Å; M141-C144 WeakPolarHBondContact O-CB 3.39Å; M141-C144 PolarHBondContact O-N 3.46Å; M141-C144 HydrophobicContact SD-CB 4.34Å; M141-I145 WeakPolarHBondContact O-CG1 3.4Å; M141-I145 PolarHBondContact O-N 3.09Å; M141-W203 VanDerWaalsContact SD-CD1 3.51Å; M141-V206 HydrophobicContact CB-CG1 4.49Å
142	R	78.6	Confident	69.6	Low	117 Å²	117	73.8 Å²	73.8	44%	0.442	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-31.8	168.3	-68.7	-178.5	-170.2	179.4	12.8	111.6	Y100 S138 D139 I145 G146	Y100-R142 HydrophobicContact CE2-CG 4.33Å; S138-R142 WeakPolarHBondContact O-CB 3.07Å; S138-R142 WeakPolarHBondContact OG-CD 3.34Å; D139-R142 HydrophobicContact CB-CB 4.03Å; D139-R142 HydrophobicContact CB-CG 3.87Å; D139-R142 CarbonylContact O-C 3.54Å; D139-R142 WeakPolarHBondContact O-CA 3.26Å; D139-R142 WeakPolarHBondContact O-CB 3.5Å; D139-R142 PolarHBondContact O-N 2.83Å; D139-R142 WeakPolarHBondContact OD2-CD 3.46Å; D139-R142 IonicContact OD2-CZ 3.17Å; D139-R142 IonicContact OD2-NE 2.8Å; D139-R142 PolarHBondContact OD2-NE 3.46Å; D139-R142 IonicContact OD2-NH1 2.71Å; D139-R142 IonicContact OD2-NH2 3.41Å; D139-R142 PolarHBondContact OD2-NH2 2.86Å; R142-I145 PolarHBondContact O-N 3.02Å; R142-G146 PolarHBondContact O-N 2.76Å
143	T	79.9	Confident	71.9	Confident	28 Å²	28	70.4 Å²	70.4	17%	0.172	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-45.3	172.2	-58	0	0	0	0	111	F137 S138 D139 M140 M141 I145 G146 L147	F137-T143 HydrophobicContact CD1-CG2 3.89Å; F137-T143 WeakPolarHBondContact CD1-OG1 3.43Å; F137-T143 HydrophobicContact CE1-CG2 3.6Å; S138-T143 PolarHBondContact O-OG1 3.38Å; D139-T143 PolarHBondContact O-N 3.36Å; D139-T143 PolarHBondContact O-OG1 2.89Å; M140-T143 WeakPolarHBondContact O-CB 3.3Å; M140-T143 PolarHBondContact O-N 2.95Å; M141-T143 PolarHBondContact O-N 3.49Å; T143-I145 PolarHBondContact O-N 3.28Å; T143-G146 PolarHBondContact O-N 3.25Å; T143-L147 HydrophobicContact CG2-CD1 4.01Å; T143-L147 HydrophobicContact CG2-CG 4.33Å; T143-L147 WeakPolarHBondContact O-CB 3.17Å; T143-L147 VanDerWaalsContact O-CG 3.29Å; T143-L147 WeakPolarHBondContact O-CG 3.15Å; T143-L147 PolarHBondContact O-N 3.24Å
144	C	86.3	Confident	74	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-53.6	-53.1	170.8	167.9	0	0	0	0	111	M140 M141 G146 L147 Y148 A199 V202	M140-C144 PolarHBondContact O-N 3.45Å; M141-C144 WeakPolarHBondContact O-CB 3.39Å; M141-C144 PolarHBondContact O-N 3.46Å; M141-C144 HydrophobicContact SD-CB 4.34Å; C144-G146 VanDerWaalsContact C-N 3.32Å; C144-G146 PolarHBondContact O-N 3.24Å; C144-L147 PolarHBondContact O-N 3.12Å; C144-Y148 WeakPolarHBondContact O-CB 3.14Å; C144-Y148 PolarHBondContact O-N 3.32Å; C144-A199 PolarHBondContact SG-O 3.36Å; C144-V202 HydrophobicContact CB-CB 4.34Å; C144-V202 HydrophobicContact CB-CG1 3.94Å
145	I	87.9	Confident	76.4	Confident	24 Å²	24	50.8 Å²	50.8	12%	0.123	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-45.6	178.6	-67.2	165	0	0	0	111	L70 F71 M141 R142 T143 Y148 I149	L70-I145 HydrophobicContact CB-CG1 4.42Å; F71-I145 HydrophobicContact CD1-CD1 4.19Å; F71-I145 HydrophobicContact CE1-CD1 3.91Å; F71-I145 HydrophobicContact CE1-CG1 4.19Å; F71-I145 HydrophobicContact CE1-CG2 3.64Å; F71-I145 HydrophobicContact CZ-CG1 4.49Å; F71-I145 HydrophobicContact CZ-CG2 3.87Å; M141-I145 WeakPolarHBondContact O-CG1 3.4Å; M141-I145 PolarHBondContact O-N 3.09Å; R142-I145 PolarHBondContact O-N 3.02Å; T143-I145 PolarHBondContact O-N 3.28Å; I145-Y148 WeakPolarHBondContact O-CB 3.23Å; I145-Y148 PolarHBondContact O-N 3.35Å; I145-I149 HydrophobicContact CG2-CD1 3.81Å; I145-I149 HydrophobicContact CG2-CG1 4.47Å; I145-I149 VanDerWaalsContact O-CG1 3.31Å; I145-I149 WeakPolarHBondContact O-CG1 3.45Å; I145-I149 PolarHBondContact O-N 3.16Å
146	G	86.3	Confident	78.7	Confident	32 Å²	32	47.8 Å²	47.8	33%	0.33	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-48.9	178.4	0	0	0	0	0	112.7	R142 T143 C144 Y148 I149 V150	R142-G146 PolarHBondContact O-N 2.76Å; T143-G146 PolarHBondContact O-N 3.25Å; C144-G146 VanDerWaalsContact C-N 3.32Å; C144-G146 PolarHBondContact O-N 3.24Å; G146-Y148 VanDerWaalsContact C-N 3.28Å; G146-Y148 PolarHBondContact O-N 3.26Å; G146-I149 PolarHBondContact O-N 3.25Å; G146-V150 VanDerWaalsContact O-CG2 3.29Å; G146-V150 WeakPolarHBondContact O-CG2 3.45Å; G146-V150 PolarHBondContact O-N 3.34Å
147	L	87.3	Confident	80.7	Confident	48 Å²	48	47.3 Å²	47.3	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-39.4	176.2	-70.1	171.5	0	0	0	111.4	T143 C144 G151 L195 A199 V202	T143-L147 HydrophobicContact CG2-CD1 4.01Å; T143-L147 HydrophobicContact CG2-CG 4.33Å; T143-L147 WeakPolarHBondContact O-CB 3.17Å; T143-L147 VanDerWaalsContact O-CG 3.29Å; T143-L147 WeakPolarHBondContact O-CG 3.15Å; T143-L147 PolarHBondContact O-N 3.24Å; C144-L147 PolarHBondContact O-N 3.12Å; L147-G151 PolarHBondContact O-N 3.47Å; L147-L195 HydrophobicContact CB-CD2 4.41Å; L147-L195 HydrophobicContact CD2-CD2 3.49Å; L147-L195 VanDerWaalsContact CD2-CD2 3.49Å; L147-A199 HydrophobicContact CB-CB 3.88Å; L147-V202 HydrophobicContact CD1-CG2 4.25Å
148	Y	89.8	Confident	82.7	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-46.4	177.6	-154.4	-71.4	0	0	0	111.8	V21 F25 W30 C144 I145 G146 G151 L152 L196 A199 V200	V21-Y148 HydrophobicContact CG1-CE1 3.63Å; V21-Y148 WeakPolarHBondContact CG1-OH 3.48Å; V21-Y148 PolarHBondContact O-OH 3.47Å; F25-Y148 HydrophobicContact CB-CD1 4.1Å; F25-Y148 HydrophobicContact CB-CE1 3.5Å; F25-Y148 VanDerWaalsContact CB-CE1 3.5Å; F25-Y148 AromaticContact CD2-CD1 3.16Å; F25-Y148 HydrophobicContact CD2-CD1 3.16Å; F25-Y148 AromaticContact CD2-CE1 3.51Å; F25-Y148 HydrophobicContact CD2-CE1 3.51Å; F25-Y148 AromaticContact CD2-CG 3.74Å; F25-Y148 HydrophobicContact CD2-CG 3.74Å; F25-Y148 AromaticContact CE2-CD1 3.73Å; F25-Y148 HydrophobicContact CE2-CD1 3.73Å; F25-Y148 HydrophobicContact CE2-CE1 4.49Å; F25-Y148 HydrophobicContact CE2-CG 4.11Å; F25-Y148 AromaticContact CG-CD1 3.85Å; F25-Y148 HydrophobicContact CG-CD1 3.85Å; F25-Y148 AromaticContact CG-CE1 3.79Å; F25-Y148 HydrophobicContact CG-CE1 3.79Å; W30-Y148 AromaticContact CH2-CE2 3.94Å; W30-Y148 HydrophobicContact CH2-CE2 3.94Å; W30-Y148 HydrophobicContact CZ2-CE2 4.18Å; C144-Y148 WeakPolarHBondContact O-CB 3.14Å; C144-Y148 PolarHBondContact O-N 3.32Å; I145-Y148 WeakPolarHBondContact O-CB 3.23Å; I145-Y148 PolarHBondContact O-N 3.35Å; G146-Y148 VanDerWaalsContact C-N 3.28Å; G146-Y148 PolarHBondContact O-N 3.26Å; Y148-G151 PolarHBondContact O-N 2.88Å; Y148-L152 HydrophobicContact CD1-CD1 3.78Å; Y148-L152 HydrophobicContact CD1-CG 3.87Å; Y148-L152 HydrophobicContact CE1-CD1 3.81Å; Y148-L152 HydrophobicContact CE1-CD2 4.19Å; Y148-L152 HydrophobicContact CE1-CG 3.88Å; Y148-L152 WeakPolarHBondContact O-CG 3.1Å; Y148-L152 PolarHBondContact O-N 2.73Å; Y148-L196 HydrophobicContact CD1-CD2 4.05Å; Y148-L196 HydrophobicContact CD2-CD2 4.29Å; Y148-L196 HydrophobicContact CE1-CD2 4.05Å; Y148-L196 HydrophobicContact CE2-CD2 4.32Å; Y148-L196 HydrophobicContact CG-CD2 4.19Å; Y148-A199 HydrophobicContact CD2-CB 3.93Å; Y148-A199 HydrophobicContact CG-CB 4.41Å; Y148-V200 HydrophobicContact CE2-CG2 4.41Å
149	I	90.5	Very high	84.5	Confident	77 Å²	77	39.3 Å²	39.3	40%	0.395	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-47.9	177.2	-68.6	167	0	0	0	110.6	F25 I145 G146 G151 L152 V153	F25-I149 HydrophobicContact CE1-CG1 4.42Å; F25-I149 HydrophobicContact CE2-CG1 3.97Å; F25-I149 HydrophobicContact CZ-CD1 4.05Å; F25-I149 HydrophobicContact CZ-CG1 3.47Å; F25-I149 VanDerWaalsContact CZ-CG1 3.47Å; I145-I149 HydrophobicContact CG2-CD1 3.81Å; I145-I149 HydrophobicContact CG2-CG1 4.47Å; I145-I149 VanDerWaalsContact O-CG1 3.31Å; I145-I149 WeakPolarHBondContact O-CG1 3.45Å; I145-I149 PolarHBondContact O-N 3.16Å; G146-I149 PolarHBondContact O-N 3.25Å; I149-G151 VanDerWaalsContact C-N 3.26Å; I149-G151 PolarHBondContact O-N 3.34Å; I149-L152 PolarHBondContact O-N 3.33Å; I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 WeakPolarHBondContact O-CG2 3.46Å; I149-V153 PolarHBondContact O-N 2.8Å
150	V	88.3	Confident	85.4	Confident	78 Å²	78	42.9 Å²	42.9	47%	0.473	23%	0.231	S	C	.	.	H	α-helix	trans	-60.4	-41.7	177.5	178.4	0	0	0	0	109.9	G146 L152 V153 V154 L195	G146-V150 VanDerWaalsContact O-CG2 3.29Å; G146-V150 WeakPolarHBondContact O-CG2 3.45Å; G146-V150 PolarHBondContact O-N 3.34Å; V150-L152 PolarHBondContact O-N 3.14Å; V150-V153 PolarHBondContact O-N 2.75Å; V150-V154 HydrophobicContact CG1-CG2 4.35Å; V150-V154 VanDerWaalsContact O-CG2 3.28Å; V150-V154 WeakPolarHBondContact O-CG2 3.28Å; V150-V154 PolarHBondContact O-N 3.4Å; V150-L195 HydrophobicContact CB-CD1 4.21Å; V150-L195 HydrophobicContact CG1-CD1 3.64Å
151	G	87.4	Confident	86	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.2	-47.6	173.6	0	0	0	0	0	112.9	L147 Y148 I149 V154 L155	L147-G151 PolarHBondContact O-N 3.47Å; Y148-G151 PolarHBondContact O-N 2.88Å; I149-G151 VanDerWaalsContact C-N 3.26Å; I149-G151 PolarHBondContact O-N 3.34Å; G151-V154 PolarHBondContact O-N 3.21Å; G151-L155 VanDerWaalsContact O-CB 3.23Å; G151-L155 WeakPolarHBondContact O-CB 2.93Å; G151-L155 PolarHBondContact O-N 3.48Å
152	L	90.2	Very high	86.3	Confident	21 Å²	21	43 Å²	43	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-40.5	176.9	-76.3	178.7	0	0	0	113	V21 I22 F25 Y148 I149 V150 L155 S156	V21-L152 HydrophobicContact CG1-CD2 3.68Å; I22-L152 HydrophobicContact CG1-CD2 3.8Å; F25-L152 HydrophobicContact CB-CD1 4.31Å; F25-L152 HydrophobicContact CD1-CD1 4.01Å; F25-L152 HydrophobicContact CD2-CD1 4.4Å; F25-L152 HydrophobicContact CE1-CD1 4.39Å; F25-L152 HydrophobicContact CG-CD1 3.99Å; Y148-L152 HydrophobicContact CD1-CD1 3.78Å; Y148-L152 HydrophobicContact CD1-CG 3.87Å; Y148-L152 HydrophobicContact CE1-CD1 3.81Å; Y148-L152 HydrophobicContact CE1-CD2 4.19Å; Y148-L152 HydrophobicContact CE1-CG 3.88Å; Y148-L152 WeakPolarHBondContact O-CG 3.1Å; Y148-L152 PolarHBondContact O-N 2.73Å; I149-L152 PolarHBondContact O-N 3.33Å; V150-L152 PolarHBondContact O-N 3.14Å; L152-L155 PolarHBondContact O-N 2.96Å; L152-S156 WeakPolarHBondContact O-CB 3.34Å; L152-S156 PolarHBondContact O-N 2.96Å; L152-S156 PolarHBondContact O-OG 3.34Å
153	V	89.1	Confident	86.6	Confident	72 Å²	72	42.3 Å²	42.3	44%	0.436	24%	0.238	S	C	.	.	H	α-helix	trans	-65	-49.4	177.8	170.2	0	0	0	0	110.2	I149 V150 L155 S156 F157	I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 WeakPolarHBondContact O-CG2 3.46Å; I149-V153 PolarHBondContact O-N 2.8Å; V150-V153 PolarHBondContact O-N 2.75Å; V153-L155 VanDerWaalsContact C-N 3.34Å; V153-L155 PolarHBondContact O-N 2.91Å; V153-S156 WeakPolarHBondContact O-CB 3.5Å; V153-S156 PolarHBondContact O-N 2.94Å; V153-F157 HydrophobicContact CG1-CD2 3.8Å; V153-F157 HydrophobicContact CG1-CE2 3.52Å; V153-F157 WeakPolarHBondContact O-CD2 3.23Å; V153-F157 PolarHBondContact O-N 3.32Å
154	V	86.4	Confident	86.8	Confident	36 Å²	36	48.5 Å²	48.5	22%	0.218	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-43.9	177.4	177.9	0	0	0	0	110.4	V150 G151 S156 F157 C158	V150-V154 HydrophobicContact CG1-CG2 4.35Å; V150-V154 VanDerWaalsContact O-CG2 3.28Å; V150-V154 WeakPolarHBondContact O-CG2 3.28Å; V150-V154 PolarHBondContact O-N 3.4Å; G151-V154 PolarHBondContact O-N 3.21Å; V154-S156 VanDerWaalsContact C-N 3.31Å; V154-S156 PolarHBondContact O-N 2.73Å; V154-F157 PolarHBondContact O-N 3.16Å; V154-C158 PolarHBondContact O-N 2.94Å; V154-C158 PolarHBondContact O-SG 3.4Å
155	L	87.7	Confident	86.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-43.4	176	-178.4	63.1	0	0	0	111.7	T18 G151 L152 V153 F157 C158 L159 L181 L196 I249	T18-L155 HydrophobicContact CG2-CD2 3.93Å; T18-L155 HydrophobicContact CG2-CG 4.4Å; T18-L155 WeakPolarHBondContact OG1-CD2 3.32Å; G151-L155 VanDerWaalsContact O-CB 3.23Å; G151-L155 WeakPolarHBondContact O-CB 2.93Å; G151-L155 PolarHBondContact O-N 3.48Å; L152-L155 PolarHBondContact O-N 2.96Å; V153-L155 VanDerWaalsContact C-N 3.34Å; V153-L155 PolarHBondContact O-N 2.91Å; L155-F157 PolarHBondContact O-N 3.02Å; L155-C158 WeakPolarHBondContact O-CB 3.17Å; L155-C158 PolarHBondContact O-N 3.2Å; L155-L159 WeakPolarHBondContact O-CG 3.22Å; L155-L159 PolarHBondContact O-N 3.45Å; L155-L181 HydrophobicContact CD1-CD2 3.61Å; L155-L196 HydrophobicContact CD2-CD1 4.28Å; L155-I249 HydrophobicContact CD1-CD1 4.14Å; L155-I249 HydrophobicContact CD1-CG1 4.48Å; L155-I249 HydrophobicContact CD1-CG2 4.22Å; L155-I249 HydrophobicContact CD2-CD1 3.66Å
156	S	87	Confident	86.1	Confident	55 Å²	55	49.4 Å²	49.4	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-44.1	176.6	-58.3	0	0	0	0	111.7	L152 V153 V154 L159 L160	L152-S156 WeakPolarHBondContact O-CB 3.34Å; L152-S156 PolarHBondContact O-N 2.96Å; L152-S156 PolarHBondContact O-OG 3.34Å; V153-S156 WeakPolarHBondContact O-CB 3.5Å; V153-S156 PolarHBondContact O-N 2.94Å; V154-S156 VanDerWaalsContact C-N 3.31Å; V154-S156 PolarHBondContact O-N 2.73Å; S156-L159 PolarHBondContact O-N 3.14Å; S156-L160 WeakPolarHBondContact O-CG 3.04Å; S156-L160 PolarHBondContact O-N 2.91Å; S156-L160 VanDerWaalsContact O-N 3.07Å
157	F	85.4	Confident	85.8	Confident	129 Å²	129	58.5 Å²	58.5	57%	0.566	29%	0.291	S	S	*	.	H	α-helix	trans	-62.4	-42	173.7	-77.6	-66.8	0	0	0	112.2	V153 V154 L155 L159 L160 I161	V153-F157 HydrophobicContact CG1-CD2 3.8Å; V153-F157 HydrophobicContact CG1-CE2 3.52Å; V153-F157 WeakPolarHBondContact O-CD2 3.23Å; V153-F157 PolarHBondContact O-N 3.32Å; V154-F157 PolarHBondContact O-N 3.16Å; L155-F157 PolarHBondContact O-N 3.02Å; F157-L159 VanDerWaalsContact C-N 3.35Å; F157-L159 PolarHBondContact O-N 3.25Å; F157-L160 PolarHBondContact O-N 3.35Å; F157-I161 VanDerWaalsContact O-CG1 3.3Å; F157-I161 WeakPolarHBondContact O-CG1 3.25Å; F157-I161 PolarHBondContact O-N 3.42Å
158	C	85	Confident	85.4	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.034	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-42.8	177.5	-64.3	0	0	0	0	111.6	V154 L155 I161 G162 L181	V154-C158 PolarHBondContact O-N 2.94Å; V154-C158 PolarHBondContact O-SG 3.4Å; L155-C158 WeakPolarHBondContact O-CB 3.17Å; L155-C158 PolarHBondContact O-N 3.2Å; C158-I161 PolarHBondContact O-N 2.86Å; C158-G162 PolarHBondContact O-N 2.95Å; C158-L181 HydrophobicContact CB-CD2 3.95Å; C158-L181 HydrophobicContact CB-CG 4.34Å
159	L	85.8	Confident	84.7	Confident	28 Å²	28	74.4 Å²	74.4	15%	0.147	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-43.8	175.1	-73.9	177.9	0	0	0	112	S14 T18 L155 S156 F157 I161 G162 I163	S14-L159 VanDerWaalsContact OG-CD2 3.27Å; S14-L159 WeakPolarHBondContact OG-CD2 3.46Å; T18-L159 HydrophobicContact CG2-CD1 3.75Å; T18-L159 WeakPolarHBondContact OG1-CD1 3.45Å; L155-L159 WeakPolarHBondContact O-CG 3.22Å; L155-L159 PolarHBondContact O-N 3.45Å; S156-L159 PolarHBondContact O-N 3.14Å; F157-L159 VanDerWaalsContact C-N 3.35Å; F157-L159 PolarHBondContact O-N 3.25Å; L159-I161 VanDerWaalsContact C-N 3.34Å; L159-I161 PolarHBondContact O-N 3.45Å; L159-G162 PolarHBondContact O-N 3.47Å; L159-G162 VanDerWaalsContact O-N 3.16Å; L159-I163 VanDerWaalsContact O-CG1 3.25Å; L159-I163 WeakPolarHBondContact O-CG1 3.21Å; L159-I163 PolarHBondContact O-N 2.94Å
160	L	85.5	Confident	84.1	Confident	88 Å²	88	75.3 Å²	75.3	46%	0.461	35%	0.35	S	S	.	.	H	α-helix	trans	-63.5	-39.5	178	-69.1	175.3	0	0	0	112.2	S156 F157 G162 R164	S156-L160 WeakPolarHBondContact O-CG 3.04Å; S156-L160 PolarHBondContact O-N 2.91Å; S156-L160 VanDerWaalsContact O-N 3.07Å; F157-L160 PolarHBondContact O-N 3.35Å; L160-G162 VanDerWaalsContact C-N 3.35Å; L160-R164 WeakPolarHBondContact O-CG 2.94Å; L160-R164 PolarHBondContact O-N 2.97Å
161	I	85.1	Confident	83.5	Confident	56 Å²	56	73.2 Å²	73.2	29%	0.287	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-40.1	173.8	-62	167	0	0	0	109.8	F157 C158 L159 R164 G165 L173 T177 L180	F157-I161 VanDerWaalsContact O-CG1 3.3Å; F157-I161 WeakPolarHBondContact O-CG1 3.25Å; F157-I161 PolarHBondContact O-N 3.42Å; C158-I161 PolarHBondContact O-N 2.86Å; L159-I161 VanDerWaalsContact C-N 3.34Å; L159-I161 PolarHBondContact O-N 3.45Å; I161-R164 PolarHBondContact O-N 3.31Å; I161-G165 PolarHBondContact O-N 3.47Å; I161-L173 HydrophobicContact CG2-CD2 4.06Å; I161-T177 HydrophobicContact CB-CG2 3.86Å; I161-T177 HydrophobicContact CG2-CG2 3.51Å; I161-L180 HydrophobicContact CD1-CD1 4.14Å
162	G	83	Confident	83.1	Confident	9 Å²	9	76.4 Å²	76.4	9%	0.093	36%	0.358	C	S	.	.	H	α-helix	trans	-62.8	-45.9	178.9	0	0	0	0	0	112.8	C158 L159 L160 R164 G165 C166	C158-G162 PolarHBondContact O-N 2.95Å; L159-G162 PolarHBondContact O-N 3.47Å; L159-G162 VanDerWaalsContact O-N 3.16Å; L160-G162 VanDerWaalsContact C-N 3.35Å; G162-R164 VanDerWaalsContact C-N 3.35Å; G162-R164 PolarHBondContact O-N 3.28Å; G162-G165 PolarHBondContact O-N 2.85Å; G162-C166 WeakPolarHBondContact O-CB 3.13Å; G162-C166 PolarHBondContact O-N 2.91Å; G162-C166 PolarHBondContact O-SG 3.44Å
163	I	84.4	Confident	82.5	Confident	101 Å²	101	78 Å²	78	52%	0.518	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-45.6	175.4	-67.8	163.4	0	0	0	110.1	L159 C166 W167	L159-I163 VanDerWaalsContact O-CG1 3.25Å; L159-I163 WeakPolarHBondContact O-CG1 3.21Å; L159-I163 PolarHBondContact O-N 2.94Å; I163-C166 PolarHBondContact O-N 3.32Å; I163-W167 VanDerWaalsContact O-CB 3.31Å; I163-W167 WeakPolarHBondContact O-CB 3.34Å; I163-W167 PolarHBondContact O-N 2.79Å
164	R	84.1	Confident	81.9	Confident	159 Å²	159	74.7 Å²	74.7	60%	0.6	35%	0.346	S	S	*	.	H	α-helix	trans	-64.1	-40.8	176.8	-73.3	-175.6	179.1	108.2	-3.4	112.5	L160 I161 G162 W167 R168	L160-R164 WeakPolarHBondContact O-CG 2.94Å; L160-R164 PolarHBondContact O-N 2.97Å; I161-R164 PolarHBondContact O-N 3.31Å; G162-R164 VanDerWaalsContact C-N 3.35Å; G162-R164 PolarHBondContact O-N 3.28Å; R164-W167 PolarHBondContact O-N 2.7Å; R164-R168 PolarHBondContact O-N 2.98Å; R164-R168 VanDerWaalsContact O-N 3.12Å
165	G	78.1	Confident	81.5	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-44.7	177.1	0	0	0	0	0	112.5	I161 G162 R169 H170	I161-G165 PolarHBondContact O-N 3.47Å; G162-G165 PolarHBondContact O-N 2.85Å; G165-R169 VanDerWaalsContact O-CA 3.32Å; G165-R169 WeakPolarHBondContact O-CA 3.47Å; G165-R169 PolarHBondContact O-N 3.47Å; G165-H170 PolarHBondContact O-N 3.31Å
166	C	81.9	Confident	81	Confident	43 Å²	43	81.2 Å²	81.2	29%	0.291	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-42.7	176.2	-65.7	0	0	0	0	111.7	G162 I163 R168 R169	G162-C166 WeakPolarHBondContact O-CB 3.13Å; G162-C166 PolarHBondContact O-N 2.91Å; G162-C166 PolarHBondContact O-SG 3.44Å; I163-C166 PolarHBondContact O-N 3.32Å; C166-R168 PolarHBondContact O-N 3.29Å; C166-R169 PolarHBondContact O-N 2.81Å
167	W	80.1	Confident	80.6	Confident	223 Å²	223	78.7 Å²	78.7	85%	0.845	36%	0.359	S	S	*	.	H	α-helix	trans	-61.6	-45.5	-179.3	-171.4	-73	0	0	0	112.4	I163 R164	I163-W167 VanDerWaalsContact O-CB 3.31Å; I163-W167 WeakPolarHBondContact O-CB 3.34Å; I163-W167 PolarHBondContact O-N 2.79Å; R164-W167 PolarHBondContact O-N 2.7Å
168	R	79.3	Confident	79.9	Confident	211 Å²	211	72.6 Å²	72.6	80%	0.796	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	2.2	179.9	-67.2	-168	178.1	-177	-0.7	113.8	R164 C166 H170	R164-R168 PolarHBondContact O-N 2.98Å; R164-R168 VanDerWaalsContact O-N 3.12Å; C166-R168 PolarHBondContact O-N 3.29Å; R168-H170 HydrophobicContact CB-CB 4.45Å; R168-H170 PolarHBondContact O-N 2.81Å; R168-H170 VanDerWaalsContact O-N 3.14Å
169	R	73.7	Confident	79.5	Confident	170 Å²	170	75 Å²	75	64%	0.642	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	39.4	-171.4	-63.8	-179.3	67.6	-178.4	-2	112.8	G165 C166 L171 M263	G165-R169 VanDerWaalsContact O-CA 3.32Å; G165-R169 WeakPolarHBondContact O-CA 3.47Å; G165-R169 PolarHBondContact O-N 3.47Å; C166-R169 PolarHBondContact O-N 2.81Å; R169-L171 PolarHBondContact O-N 2.66Å; R169-M263 HydrophobicContact CB-CE 4.48Å
170	H	78.3	Confident	78.9	Confident	97 Å²	97	74.5 Å²	74.5	45%	0.449	34%	0.342	S	S	.	.			trans	-86	109.4	-175.1	-169	-90.7	0	0	0	110.4	G165 R168 S172 L173 I174	G165-H170 PolarHBondContact O-N 3.31Å; R168-H170 HydrophobicContact CB-CB 4.45Å; R168-H170 PolarHBondContact O-N 2.81Å; R168-H170 VanDerWaalsContact O-N 3.14Å; H170-S172 VanDerWaalsContact C-N 3.32Å; H170-S172 PolarHBondContact O-N 3.32Å; H170-L173 HydrophobicContact CB-CB 4.28Å; H170-L173 HydrophobicContact CB-CD1 4.13Å; H170-L173 HydrophobicContact CB-CG 4.24Å; H170-L173 PolarHBondContact ND1-N 3.15Å; H170-L173 PolarHBondContact O-N 3.02Å; H170-I174 PolarHBondContact O-N 2.95Å
171	L	76.3	Confident	78.1	Confident	34 Å²	34	70.6 Å²	70.6	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-54.2	-45.5	-171.9	-174.9	67.6	0	0	0	112.8	R169 L173 I174 M175 H260 M263 K264 E267	R169-L171 PolarHBondContact O-N 2.66Å; L171-L173 VanDerWaalsContact C-N 3.32Å; L171-L173 PolarHBondContact O-N 3.49Å; L171-I174 PolarHBondContact O-N 3.48Å; L171-M175 PolarHBondContact O-N 3.32Å; L171-H260 WeakPolarHBondContact CD1-CD2 3.28Å; L171-H260 PolarHBondContact O-CD2 3.39Å; L171-M263 HydrophobicContact CD1-CB 3.64Å; L171-K264 HydrophobicContact CD2-CB 4.11Å; L171-K264 HydrophobicContact CD2-CG 4.39Å; L171-E267 WeakPolarHBondContact CD2-OE2 3.08Å
172	S	78.9	Confident	77.1	Confident	67 Å²	67	69.6 Å²	69.6	47%	0.469	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-33.5	179.8	166.7	0	0	0	0	112.8	H170 M175 M176	H170-S172 VanDerWaalsContact C-N 3.32Å; H170-S172 PolarHBondContact O-N 3.32Å; S172-M175 WeakPolarHBondContact O-CB 3.32Å; S172-M175 PolarHBondContact O-N 2.92Å; S172-M176 WeakPolarHBondContact O-CB 3.36Å; S172-M176 VanDerWaalsContact O-CG 3.23Å; S172-M176 WeakPolarHBondContact O-CG 3.48Å; S172-M176 PolarHBondContact O-N 2.83Å
173	L	77.5	Confident	75.8	Confident	55 Å²	55	73.9 Å²	73.9	29%	0.288	33%	0.333	S	S	.	.	H	α-helix	trans	-72.9	-36.7	177.7	-71.8	-179	0	0	0	111.3	I161 H170 L171 M176 T177	I161-L173 HydrophobicContact CG2-CD2 4.06Å; H170-L173 HydrophobicContact CB-CB 4.28Å; H170-L173 HydrophobicContact CB-CD1 4.13Å; H170-L173 HydrophobicContact CB-CG 4.24Å; H170-L173 PolarHBondContact ND1-N 3.15Å; H170-L173 PolarHBondContact O-N 3.02Å; L171-L173 VanDerWaalsContact C-N 3.32Å; L171-L173 PolarHBondContact O-N 3.49Å; L173-M176 PolarHBondContact O-N 2.81Å; L173-T177 WeakPolarHBondContact O-CG2 3.28Å; L173-T177 PolarHBondContact O-N 3.31Å; L173-T177 PolarHBondContact O-OG1 3.49Å
174	I	76.9	Confident	73.9	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-44.8	175	-62.4	171.3	0	0	0	109.8	L7 H170 L171 M176 T177 G178 M256 H260 M263	L7-I174 HydrophobicContact CD2-CD1 4.37Å; L7-I174 HydrophobicContact CD2-CG2 4.18Å; H170-I174 PolarHBondContact O-N 2.95Å; L171-I174 PolarHBondContact O-N 3.48Å; I174-M176 PolarHBondContact O-N 3.26Å; I174-T177 WeakPolarHBondContact CA-OG1 3.47Å; I174-T177 PolarHBondContact O-N 2.93Å; I174-T177 PolarHBondContact O-OG1 3.19Å; I174-G178 PolarHBondContact O-N 3.39Å; I174-M256 HydrophobicContact CG2-SD 4.17Å; I174-H260 HydrophobicContact CG2-CB 4.27Å; I174-M263 HydrophobicContact CD1-CE 3.88Å; I174-M263 HydrophobicContact CD1-SD 3.51Å; I174-M263 VanDerWaalsContact CD1-SD 3.51Å
175	M	78.5	Confident	72.1	Confident	82 Å²	82	71.8 Å²	71.8	40%	0.404	34%	0.339	S	S	.	.	H	α-helix	trans	-55.9	-52.3	174.3	-163.5	-164.4	-162	0	0	111.5	L171 S172 T177 G178 I179 H260	L171-M175 PolarHBondContact O-N 3.32Å; S172-M175 WeakPolarHBondContact O-CB 3.32Å; S172-M175 PolarHBondContact O-N 2.92Å; M175-T177 VanDerWaalsContact C-N 3.28Å; M175-T177 PolarHBondContact O-N 2.87Å; M175-G178 PolarHBondContact O-N 2.84Å; M175-I179 HydrophobicContact CE-CD1 4.23Å; M175-I179 HydrophobicContact CG-CD1 3.85Å; M175-I179 WeakPolarHBondContact O-CG1 3.27Å; M175-I179 PolarHBondContact O-N 2.88Å; M175-I179 HydrophobicContact SD-CD1 4.27Å; M175-H260 VanDerWaalsContact CB-CD2 3.47Å; M175-H260 WeakPolarHBondContact CB-CD2 3.32Å
176	M	76.2	Confident	70.6	Confident	92 Å²	92	75.9 Å²	75.9	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-55.6	-48	178.6	-73	-60.7	-67.3	0	0	109.6	S172 L173 I174 G178 I179 L180	S172-M176 WeakPolarHBondContact O-CB 3.36Å; S172-M176 VanDerWaalsContact O-CG 3.23Å; S172-M176 WeakPolarHBondContact O-CG 3.48Å; S172-M176 PolarHBondContact O-N 2.83Å; L173-M176 PolarHBondContact O-N 2.81Å; I174-M176 PolarHBondContact O-N 3.26Å; M176-G178 PolarHBondContact O-N 2.96Å; M176-I179 PolarHBondContact O-N 3.42Å; M176-L180 HydrophobicContact CB-CD1 4.37Å; M176-L180 VanDerWaalsContact O-CB 3.23Å; M176-L180 WeakPolarHBondContact O-CB 3.28Å; M176-L180 WeakPolarHBondContact O-CD1 3.42Å; M176-L180 WeakPolarHBondContact O-CG 3.39Å; M176-L180 PolarHBondContact O-N 2.76Å
177	T	78	Confident	68.9	Low	3 Å²	3	81 Å²	81	2%	0.018	39%	0.392	C	S	.	.	H	α-helix	trans	-64.8	-38.4	-178.5	60.1	0	0	0	0	113.8	I161 L173 I174 M175 L181	I161-T177 HydrophobicContact CB-CG2 3.86Å; I161-T177 HydrophobicContact CG2-CG2 3.51Å; L173-T177 WeakPolarHBondContact O-CG2 3.28Å; L173-T177 PolarHBondContact O-N 3.31Å; L173-T177 PolarHBondContact O-OG1 3.49Å; I174-T177 WeakPolarHBondContact CA-OG1 3.47Å; I174-T177 PolarHBondContact O-N 2.93Å; I174-T177 PolarHBondContact O-OG1 3.19Å; M175-T177 VanDerWaalsContact C-N 3.28Å; M175-T177 PolarHBondContact O-N 2.87Å; T177-L181 WeakPolarHBondContact O-CB 3.41Å; T177-L181 WeakPolarHBondContact O-CD1 3.44Å; T177-L181 WeakPolarHBondContact O-CG 3.35Å; T177-L181 PolarHBondContact O-N 3.25Å; T177-L181 VanDerWaalsContact O-N 3.12Å
178	G	72.3	Confident	67.8	Low	0 Å²	0	79.7 Å²	79.7	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-60	-49.7	172.3	0	0	0	0	0	111.3	I174 M175 M176 L181 L182 S253	I174-G178 PolarHBondContact O-N 3.39Å; M175-G178 PolarHBondContact O-N 2.84Å; M176-G178 PolarHBondContact O-N 2.96Å; G178-L181 PolarHBondContact O-N 2.87Å; G178-L182 PolarHBondContact O-N 2.88Å; G178-L182 VanDerWaalsContact O-N 3.08Å; G178-S253 PolarHBondContact O-OG 3.04Å
179	I	76.2	Confident	66.5	Low	55 Å²	55	74 Å²	74	28%	0.282	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-46.4	-179.4	-64.4	167.6	0	0	0	111.5	M175 M176 L181 L182 F183 L257	M175-I179 HydrophobicContact CE-CD1 4.23Å; M175-I179 HydrophobicContact CG-CD1 3.85Å; M175-I179 WeakPolarHBondContact O-CG1 3.27Å; M175-I179 PolarHBondContact O-N 2.88Å; M175-I179 HydrophobicContact SD-CD1 4.27Å; M176-I179 PolarHBondContact O-N 3.42Å; I179-L181 PolarHBondContact O-N 3.36Å; I179-L182 PolarHBondContact O-N 2.78Å; I179-F183 PolarHBondContact O-N 2.91Å; I179-L257 HydrophobicContact CG1-CD2 4.27Å
180	L	72.2	Confident	65.4	Low	19 Å²	19	67.8 Å²	67.8	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-58.9	-31.3	179.5	-70.4	171.4	0	0	0	112.6	I161 M176 T190 S192	I161-L180 HydrophobicContact CD1-CD1 4.14Å; M176-L180 HydrophobicContact CB-CD1 4.37Å; M176-L180 VanDerWaalsContact O-CB 3.23Å; M176-L180 WeakPolarHBondContact O-CB 3.28Å; M176-L180 WeakPolarHBondContact O-CD1 3.42Å; M176-L180 WeakPolarHBondContact O-CG 3.39Å; M176-L180 PolarHBondContact O-N 2.76Å; L180-T190 VanDerWaalsContact CD2-CB 3.41Å; L180-T190 HydrophobicContact CD2-CG2 3.06Å; L180-T190 VanDerWaalsContact CD2-OG1 3.3Å; L180-T190 WeakPolarHBondContact CD2-OG1 3.48Å; L180-T190 HydrophobicContact CG-CG2 4.48Å; L180-S192 PolarHBondContact O-OG 2.92Å
181	L	69.4	Low	64.4	Low	5 Å²	5	67.3 Å²	67.3	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-85.5	-32.2	179	-71.3	172.4	0	0	0	113.7	L155 C158 T177 G178 I179 S192 A193 I249 S253	L155-L181 HydrophobicContact CD1-CD2 3.61Å; C158-L181 HydrophobicContact CB-CD2 3.95Å; C158-L181 HydrophobicContact CB-CG 4.34Å; T177-L181 WeakPolarHBondContact O-CB 3.41Å; T177-L181 WeakPolarHBondContact O-CD1 3.44Å; T177-L181 WeakPolarHBondContact O-CG 3.35Å; T177-L181 PolarHBondContact O-N 3.25Å; T177-L181 VanDerWaalsContact O-N 3.12Å; G178-L181 PolarHBondContact O-N 2.87Å; I179-L181 PolarHBondContact O-N 3.36Å; L181-S192 WeakPolarHBondContact CA-OG 3.4Å; L181-A193 VanDerWaalsContact O-CB 3.24Å; L181-A193 WeakPolarHBondContact O-CB 3.4Å; L181-I249 HydrophobicContact CD2-CG2 4.08Å; L181-S253 WeakPolarHBondContact CB-OG 3.29Å
182	L	63.9	Low	63.6	Low	36 Å²	36	65.8 Å²	65.8	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-87.2	-83.3	-178	-104	160.4	0	0	0	110.8	G178 I179 L250 S253 I254 L257	G178-L182 PolarHBondContact O-N 2.88Å; G178-L182 VanDerWaalsContact O-N 3.08Å; I179-L182 PolarHBondContact O-N 2.78Å; L182-L250 HydrophobicContact CD2-CD2 4.17Å; L182-S253 VanDerWaalsContact CB-OG 3.22Å; L182-S253 WeakPolarHBondContact CB-OG 3.41Å; L182-S253 WeakPolarHBondContact CD1-OG 3.48Å; L182-S253 WeakPolarHBondContact CG-OG 3.42Å; L182-S253 PolarHBondContact N-OG 3.13Å; L182-S253 VanDerWaalsContact N-OG 3.14Å; L182-I254 HydrophobicContact CD1-CG1 3.87Å; L182-I254 HydrophobicContact CD2-CG1 4.26Å; L182-L257 HydrophobicContact CD1-CD1 3.3Å; L182-L257 HydrophobicContact CD1-CG 4.1Å
183	F	56.5	Low	63	Low	99 Å²	99	62.6 Å²	62.6	43%	0.434	34%	0.339	S	S	.	.			trans	-169.1	122.8	-162.1	-93.8	-93	0	0	0	107.7	I179 I185 L194	I179-F183 PolarHBondContact O-N 2.91Å; F183-I185 PolarHBondContact O-N 3.38Å; F183-L194 HydrophobicContact CD1-CD1 3.51Å; F183-L194 HydrophobicContact CD1-CD2 4.21Å; F183-L194 HydrophobicContact CD1-CG 3.83Å; F183-L194 HydrophobicContact CE1-CD1 3.39Å; F183-L194 HydrophobicContact CE1-CD2 3.23Å; F183-L194 HydrophobicContact CE1-CG 3.35Å; F183-L194 HydrophobicContact CE2-CD2 4.21Å; F183-L194 HydrophobicContact CE2-CG 4.17Å; F183-L194 HydrophobicContact CG-CD1 4.38Å; F183-L194 HydrophobicContact CG-CG 4.46Å; F183-L194 HydrophobicContact CZ-CD1 4.1Å; F183-L194 HydrophobicContact CZ-CD2 3.2Å; F183-L194 HydrophobicContact CZ-CG 3.51Å
184	A	43.2	Very low	63	Low	46 Å²	46	62.8 Å²	62.8	38%	0.38	34%	0.34	S	S	.	.			trans	-65	111.8	170.8	0	0	0	0	0	110.4	S186	A184-S186 VanDerWaalsContact C-N 3.31Å
185	I	47.3	Very low	63.3	Low	170 Å²	170	63.2 Å²	63.2	87%	0.872	34%	0.342	S	S	*	.	S	Bend	trans	-87.3	-1.7	164.7	-72.5	176.7	0	0	0	111.3	F183	F183-I185 PolarHBondContact O-N 3.38Å
186	S	45.5	Very low	63.7	Low	85 Å²	85	59.3 Å²	59.3	59%	0.594	32%	0.323	S	S	*	.	S	Bend	trans	-146.7	115.4	-179	56.4	0	0	0	0	112	A184	A184-S186 VanDerWaalsContact C-N 3.31Å
187	N	46.6	Very low	64.3	Low	152 Å²	152	57 Å²	57	81%	0.813	31%	0.312	S	S	*	.	S	Bend	trans	34.5	111.6	156.7	-58.6	-19.3	0	0	0	118.4	S189	N187-S189 PolarHBondContact O-N 2.89Å
188	E	58	Low	64.7	Low	194 Å²	194	58.8 Å²	58.8	91%	0.907	33%	0.327	S	S	*	.	S	Bend	trans	62	34.3	148.4	-58.1	-175.4	-178.3	0	0	118.6
189	S	50.9	Low	65.5	Low	91 Å²	91	58.8 Å²	58.8	64%	0.636	33%	0.327	S	S	*	.			trans	174.6	107.6	149.6	31.1	0	0	0	0	110.4	N187	N187-S189 PolarHBondContact O-N 2.89Å
190	T	50.1	Low	66.1	Low	41 Å²	41	56.1 Å²	56.1	25%	0.252	31%	0.314	S	S	.	.				157.6	131	123.8	46.7	0	0	0	0	112.5	L180	L180-T190 VanDerWaalsContact CD2-CB 3.41Å; L180-T190 HydrophobicContact CD2-CG2 3.06Å; L180-T190 VanDerWaalsContact CD2-OG1 3.3Å; L180-T190 WeakPolarHBondContact CD2-OG1 3.48Å; L180-T190 HydrophobicContact CG-CG2 4.48Å
191	L	58.9	Low	67	Low	86 Å²	86	57.7 Å²	57.7	45%	0.45	33%	0.329	S	S	.	.			trans	-139	29.5	-146.8	-153.8	80.9	0	0	0	109.8	L194 L195	L191-L194 HydrophobicContact CD1-CB 4.43Å; L191-L194 HydrophobicContact CD1-CD1 4.4Å; L191-L194 HydrophobicContact CG-CB 4.35Å; L191-L195 HydrophobicContact CB-CD1 3.87Å; L191-L195 HydrophobicContact CB-CG 3.85Å; L191-L195 HydrophobicContact CD2-CD1 3.8Å; L191-L195 HydrophobicContact CD2-CD2 3.25Å; L191-L195 HydrophobicContact CD2-CG 3.29Å; L191-L195 HydrophobicContact CG-CD1 4.13Å; L191-L195 HydrophobicContact CG-CD2 4.07Å; L191-L195 HydrophobicContact CG-CG 3.57Å; L191-L195 WeakPolarHBondContact O-CB 3.45Å; L191-L195 WeakPolarHBondContact O-CD1 3.19Å; L191-L195 WeakPolarHBondContact O-CG 3.49Å; L191-L195 PolarHBondContact O-N 3.41Å
192	S	59.2	Low	67.9	Low	2 Å²	2	59.2 Å²	59.2	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-71.3	-63.1	-166.4	65.1	0	0	0	0	113.3	L180 L181 L194 L195 L196	L180-S192 PolarHBondContact O-OG 2.92Å; L181-S192 WeakPolarHBondContact CA-OG 3.4Å; S192-L194 VanDerWaalsContact C-N 3.31Å; S192-L194 PolarHBondContact O-N 2.94Å; S192-L195 PolarHBondContact O-N 3.46Å; S192-L196 PolarHBondContact O-N 3.32Å
193	A	65	Low	69.1	Low	1 Å²	1	58.1 Å²	58.1	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-37.8	178.4	0	0	0	0	0	111.6	L181 L195 L196 I197 L250	L181-A193 VanDerWaalsContact O-CB 3.24Å; L181-A193 WeakPolarHBondContact O-CB 3.4Å; A193-L195 PolarHBondContact O-N 3.17Å; A193-L196 PolarHBondContact O-N 2.89Å; A193-I197 WeakPolarHBondContact O-CB 3.04Å; A193-I197 VanDerWaalsContact O-CG1 3.25Å; A193-I197 WeakPolarHBondContact O-CG1 3.42Å; A193-I197 PolarHBondContact O-N 2.9Å; A193-L250 HydrophobicContact CB-CD2 3.87Å
194	L	78.8	Confident	70.7	Confident	58 Å²	58	55.5 Å²	55.5	30%	0.304	32%	0.321	S	S	.	.	H	α-helix	trans	-62.3	-38.9	175.7	-89.3	-179.3	0	0	0	113.6	F183 L191 S192 A198	F183-L194 HydrophobicContact CD1-CD1 3.51Å; F183-L194 HydrophobicContact CD1-CD2 4.21Å; F183-L194 HydrophobicContact CD1-CG 3.83Å; F183-L194 HydrophobicContact CE1-CD1 3.39Å; F183-L194 HydrophobicContact CE1-CD2 3.23Å; F183-L194 HydrophobicContact CE1-CG 3.35Å; F183-L194 HydrophobicContact CE2-CD2 4.21Å; F183-L194 HydrophobicContact CE2-CG 4.17Å; F183-L194 HydrophobicContact CG-CD1 4.38Å; F183-L194 HydrophobicContact CG-CG 4.46Å; F183-L194 HydrophobicContact CZ-CD1 4.1Å; F183-L194 HydrophobicContact CZ-CD2 3.2Å; F183-L194 HydrophobicContact CZ-CG 3.51Å; L191-L194 HydrophobicContact CD1-CB 4.43Å; L191-L194 HydrophobicContact CD1-CD1 4.4Å; L191-L194 HydrophobicContact CG-CB 4.35Å; S192-L194 VanDerWaalsContact C-N 3.31Å; S192-L194 PolarHBondContact O-N 2.94Å; L194-A198 WeakPolarHBondContact O-CB 3.46Å; L194-A198 PolarHBondContact O-N 2.89Å
195	L	83.2	Confident	72.7	Confident	10 Å²	10	54.6 Å²	54.6	5%	0.052	32%	0.316	C	S	.	.	H	α-helix	trans	-65.4	-42.3	175.9	-83	169.8	0	0	0	112	L147 V150 L191 S192 A193 A198 A199	L147-L195 HydrophobicContact CB-CD2 4.41Å; L147-L195 HydrophobicContact CD2-CD2 3.49Å; L147-L195 VanDerWaalsContact CD2-CD2 3.49Å; V150-L195 HydrophobicContact CB-CD1 4.21Å; V150-L195 HydrophobicContact CG1-CD1 3.64Å; L191-L195 HydrophobicContact CB-CD1 3.87Å; L191-L195 HydrophobicContact CB-CG 3.85Å; L191-L195 HydrophobicContact CD2-CD1 3.8Å; L191-L195 HydrophobicContact CD2-CD2 3.25Å; L191-L195 HydrophobicContact CD2-CG 3.29Å; L191-L195 HydrophobicContact CG-CD1 4.13Å; L191-L195 HydrophobicContact CG-CD2 4.07Å; L191-L195 HydrophobicContact CG-CG 3.57Å; L191-L195 WeakPolarHBondContact O-CB 3.45Å; L191-L195 WeakPolarHBondContact O-CD1 3.19Å; L191-L195 WeakPolarHBondContact O-CG 3.49Å; L191-L195 PolarHBondContact O-N 3.41Å; S192-L195 PolarHBondContact O-N 3.46Å; A193-L195 PolarHBondContact O-N 3.17Å; L195-A198 PolarHBondContact O-N 3.39Å; L195-A199 VanDerWaalsContact O-CB 3.29Å; L195-A199 WeakPolarHBondContact O-CB 3.36Å; L195-A199 PolarHBondContact O-N 2.95Å
196	L	86.2	Confident	74.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-43.3	179.5	-66.9	174	0	0	0	110.8	V21 Y148 L155 S192 A193 A199 V200 I246 I249	V21-L196 HydrophobicContact CG1-CD1 3.86Å; V21-L196 HydrophobicContact CG1-CD2 3.87Å; V21-L196 HydrophobicContact CG1-CG 4.49Å; V21-L196 HydrophobicContact CG2-CD1 4.43Å; Y148-L196 HydrophobicContact CD1-CD2 4.05Å; Y148-L196 HydrophobicContact CD2-CD2 4.29Å; Y148-L196 HydrophobicContact CE1-CD2 4.05Å; Y148-L196 HydrophobicContact CE2-CD2 4.32Å; Y148-L196 HydrophobicContact CG-CD2 4.19Å; L155-L196 HydrophobicContact CD2-CD1 4.28Å; S192-L196 PolarHBondContact O-N 3.32Å; A193-L196 PolarHBondContact O-N 2.89Å; L196-A199 PolarHBondContact O-N 3.28Å; L196-V200 WeakPolarHBondContact O-CG2 3.44Å; L196-V200 PolarHBondContact O-N 2.81Å; L196-I246 HydrophobicContact CB-CD1 4.05Å; L196-I246 HydrophobicContact CB-CG1 4.06Å; L196-I249 HydrophobicContact CD1-CD1 4.25Å
197	I	89.3	Confident	76.4	Confident	43 Å²	43	43.1 Å²	43.1	22%	0.221	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-45.8	173.1	-66.7	165.7	0	0	0	110.4	A193 A199 V200 A201 W243 I246 L250	A193-I197 WeakPolarHBondContact O-CB 3.04Å; A193-I197 VanDerWaalsContact O-CG1 3.25Å; A193-I197 WeakPolarHBondContact O-CG1 3.42Å; A193-I197 PolarHBondContact O-N 2.9Å; I197-A199 VanDerWaalsContact C-N 3.35Å; I197-A199 PolarHBondContact O-N 3.46Å; I197-V200 PolarHBondContact O-N 2.96Å; I197-A201 WeakPolarHBondContact O-CB 3.21Å; I197-A201 PolarHBondContact O-N 3.38Å; I197-W243 HydrophobicContact CG1-CZ3 4.46Å; I197-W243 HydrophobicContact CG2-CH2 4.38Å; I197-I246 HydrophobicContact CD1-CG2 4.01Å; I197-I246 HydrophobicContact CG1-CD1 4.37Å; I197-I246 HydrophobicContact CG1-CG2 3.62Å; I197-L250 HydrophobicContact CD1-CD1 4.45Å
198	A	86.3	Confident	78.3	Confident	40 Å²	40	42.3 Å²	42.3	33%	0.331	24%	0.236	S	C	.	.	H	α-helix	trans	-62.7	-40.8	177.7	0	0	0	0	0	111.8	L194 L195 A201 V202	L194-A198 WeakPolarHBondContact O-CB 3.46Å; L194-A198 PolarHBondContact O-N 2.89Å; L195-A198 PolarHBondContact O-N 3.39Å; A198-A201 PolarHBondContact O-N 2.98Å; A198-V202 WeakPolarHBondContact O-CB 3.42Å; A198-V202 WeakPolarHBondContact O-CG2 3.09Å; A198-V202 PolarHBondContact O-N 2.88Å
199	A	88.4	Confident	79.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-49	176.1	0	0	0	0	0	111.1	C144 L147 Y148 L195 L196 I197 A201 V202 W203	C144-A199 PolarHBondContact SG-O 3.36Å; L147-A199 HydrophobicContact CB-CB 3.88Å; Y148-A199 HydrophobicContact CD2-CB 3.93Å; Y148-A199 HydrophobicContact CG-CB 4.41Å; L195-A199 VanDerWaalsContact O-CB 3.29Å; L195-A199 WeakPolarHBondContact O-CB 3.36Å; L195-A199 PolarHBondContact O-N 2.95Å; L196-A199 PolarHBondContact O-N 3.28Å; I197-A199 VanDerWaalsContact C-N 3.35Å; I197-A199 PolarHBondContact O-N 3.46Å; A199-A201 VanDerWaalsContact C-N 3.33Å; A199-A201 PolarHBondContact O-N 2.04Å; A199-V202 PolarHBondContact O-N 2.78Å; A199-W203 PolarHBondContact O-N 2.81Å
200	V	90.5	Very high	80.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-37.6	177.6	178.2	0	0	0	0	111.4	W30 Y148 L196 I197 W203 H204 Y239 A242 W243 I246	W30-V200 HydrophobicContact CH2-CG2 4.17Å; W30-V200 HydrophobicContact CZ3-CG2 4.35Å; Y148-V200 HydrophobicContact CE2-CG2 4.41Å; L196-V200 WeakPolarHBondContact O-CG2 3.44Å; L196-V200 PolarHBondContact O-N 2.81Å; I197-V200 PolarHBondContact O-N 2.96Å; V200-W203 WeakPolarHBondContact O-CB 3.44Å; V200-W203 PolarHBondContact O-N 2.85Å; V200-H204 PolarHBondContact O-CD2 2.68Å; V200-H204 VanDerWaalsContact O-CD2 3.29Å; V200-H204 PolarHBondContact O-N 3.21Å; V200-Y239 HydrophobicContact CG1-CD2 4.46Å; V200-Y239 HydrophobicContact CG1-CE2 3.97Å; V200-A242 HydrophobicContact CG2-CB 4.46Å; V200-W243 HydrophobicContact CB-CZ2 4.4Å; V200-W243 HydrophobicContact CG1-CD2 4.45Å; V200-W243 HydrophobicContact CG1-CH2 4.49Å; V200-W243 HydrophobicContact CG1-CZ2 3.62Å; V200-I246 HydrophobicContact CG2-CD1 4Å
201	A	89.4	Confident	82.4	Confident	51 Å²	51	31.7 Å²	31.7	42%	0.421	17%	0.172	S	C	.	.	H	α-helix	trans	-66.5	-40	175	0	0	0	0	0	112.4	I197 A198 A199 W203 H204 G205	I197-A201 WeakPolarHBondContact O-CB 3.21Å; I197-A201 PolarHBondContact O-N 3.38Å; A198-A201 PolarHBondContact O-N 2.98Å; A199-A201 VanDerWaalsContact C-N 3.33Å; A199-A201 PolarHBondContact O-N 2.04Å; A201-W203 VanDerWaalsContact C-N 3.34Å; A201-H204 WeakPolarHBondContact O-CB 3.47Å; A201-H204 PolarHBondContact O-N 2.73Å; A201-G205 PolarHBondContact O-N 3.43Å
202	V	87.9	Confident	83.6	Confident	38 Å²	38	32.2 Å²	32.2	23%	0.23	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-43	172.9	171.1	0	0	0	0	110	M140 C144 L147 A198 A199 H204 G205 V206	M140-V202 VanDerWaalsContact O-CG1 3.28Å; M140-V202 WeakPolarHBondContact O-CG1 3.35Å; C144-V202 HydrophobicContact CB-CB 4.34Å; C144-V202 HydrophobicContact CB-CG1 3.94Å; L147-V202 HydrophobicContact CD1-CG2 4.25Å; A198-V202 WeakPolarHBondContact O-CB 3.42Å; A198-V202 WeakPolarHBondContact O-CG2 3.09Å; A198-V202 PolarHBondContact O-N 2.88Å; A199-V202 PolarHBondContact O-N 2.78Å; V202-H204 PolarHBondContact O-N 3.3Å; V202-G205 WeakPolarHBondContact O-CA 3.4Å; V202-G205 PolarHBondContact O-N 2.88Å; V202-G205 VanDerWaalsContact O-N 3.12Å; V202-V206 WeakPolarHBondContact O-CG2 3.35Å; V202-V206 PolarHBondContact O-N 2.85Å
203	W	89.4	Confident	84.7	Confident	13 Å²	13	34 Å²	34	5%	0.049	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-47.5	175.2	-174.8	87.3	0	0	0	111.9	W30 Q31 M141 A199 V200 A201 G205 V206 D207 Y235 Y239	W30-W203 HydrophobicContact CB-CH2 4.29Å; W30-W203 HydrophobicContact CB-CZ2 3.73Å; W30-W203 AromaticContact CE3-CD2 3.77Å; W30-W203 HydrophobicContact CE3-CD2 3.77Å; W30-W203 AromaticContact CE3-CE2 3.8Å; W30-W203 HydrophobicContact CE3-CE3 4.12Å; W30-W203 HydrophobicContact CE3-CG 4.13Å; W30-W203 HydrophobicContact CE3-CZ2 4.2Å; W30-W203 HydrophobicContact CE3-CZ3 4.47Å; W30-W203 HydrophobicContact CZ3-CD2 4.17Å; W30-W203 HydrophobicContact CZ3-CE3 4.46Å; W30-W203 HydrophobicContact CZ3-CG 4.2Å; Q31-W203 HydrophobicContact CB-CH2 4.25Å; Q31-W203 HydrophobicContact CB-CZ2 4.22Å; M141-W203 VanDerWaalsContact SD-CD1 3.51Å; A199-W203 PolarHBondContact O-N 2.81Å; V200-W203 WeakPolarHBondContact O-CB 3.44Å; V200-W203 PolarHBondContact O-N 2.85Å; A201-W203 VanDerWaalsContact C-N 3.34Å; W203-G205 VanDerWaalsContact C-N 3.32Å; W203-G205 PolarHBondContact O-N 2.88Å; W203-V206 WeakPolarHBondContact O-CB 3.31Å; W203-V206 PolarHBondContact O-N 3.02Å; W203-D207 PolarHBondContact O-N 3.29Å; W203-Y235 AromaticContact CH2-CD1 3.91Å; W203-Y235 HydrophobicContact CH2-CD1 3.91Å; W203-Y235 AromaticContact CH2-CE1 3.92Å; W203-Y235 HydrophobicContact CH2-CE1 3.92Å; W203-Y235 AromaticContact CZ3-CD1 3.91Å; W203-Y235 HydrophobicContact CZ3-CD1 3.91Å; W203-Y235 AromaticContact CZ3-CE1 3.71Å; W203-Y235 HydrophobicContact CZ3-CE1 3.71Å; W203-Y239 HydrophobicContact CE3-CD2 4.17Å; W203-Y239 HydrophobicContact CE3-CE2 4.5Å; W203-Y239 AromaticContact CZ3-CD2 3.85Å; W203-Y239 HydrophobicContact CZ3-CD2 3.85Å; W203-Y239 HydrophobicContact CZ3-CE2 4.29Å; W203-Y239 HydrophobicContact CZ3-CG 4.47Å
204	H	89.8	Confident	85.1	Confident	44 Å²	44	34 Å²	34	20%	0.204	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-41.2	172.8	-84.9	-62.3	0	0	0	113.8	V200 A201 V202 V206 D207 Y208 Y239 W243	V200-H204 PolarHBondContact O-CD2 2.68Å; V200-H204 VanDerWaalsContact O-CD2 3.29Å; V200-H204 PolarHBondContact O-N 3.21Å; A201-H204 WeakPolarHBondContact O-CB 3.47Å; A201-H204 PolarHBondContact O-N 2.73Å; V202-H204 PolarHBondContact O-N 3.3Å; H204-V206 VanDerWaalsContact C-N 3.28Å; H204-V206 PolarHBondContact O-N 3.27Å; H204-D207 PolarHBondContact O-N 3.43Å; H204-Y208 WeakPolarHBondContact O-CB 3.29Å; H204-Y208 PolarHBondContact O-N 3.27Å; H204-Y239 AromaticContact CD2-CE2 3.9Å; H204-Y239 AromaticContact CE1-CE2 3.17Å; H204-Y239 WeakPolarHBondContact CE1-CE2 3.3Å; H204-Y239 AromaticContact CE1-CZ 3.16Å; H204-Y239 PolarHBondContact CE1-OH 2.98Å; H204-Y239 AromaticContact NE2-CE2 2.93Å; H204-Y239 WeakPolarHBondContact NE2-CE2 3.24Å; H204-Y239 AromaticContact NE2-CZ 3.09Å; H204-Y239 PolarHBondContact NE2-OH 3.24Å; H204-W243 AromaticContact NE2-NE1 3.75Å
205	G	86	Confident	85	Confident	26 Å²	26	35.5 Å²	35.5	27%	0.268	19%	0.19	S	C	.	.	H	α-helix	trans	-60.1	-41.7	175.7	0	0	0	0	0	111.4	A201 V202 W203 Y208 I209	A201-G205 PolarHBondContact O-N 3.43Å; V202-G205 WeakPolarHBondContact O-CA 3.4Å; V202-G205 PolarHBondContact O-N 2.88Å; V202-G205 VanDerWaalsContact O-N 3.12Å; W203-G205 VanDerWaalsContact C-N 3.32Å; W203-G205 PolarHBondContact O-N 2.88Å; G205-Y208 PolarHBondContact O-N 3.23Å; G205-I209 WeakPolarHBondContact O-CB 3.33Å; G205-I209 WeakPolarHBondContact O-CD1 3.43Å; G205-I209 WeakPolarHBondContact O-CG1 3.36Å; G205-I209 PolarHBondContact O-N 2.93Å
206	V	83.6	Confident	84.3	Confident	8 Å²	8	40.1 Å²	40.1	5%	0.048	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-49.1	174.8	174.7	0	0	0	0	111	M140 M141 V202 W203 H204 Y208 I209 E210	M140-V206 HydrophobicContact CB-CG2 3.37Å; M140-V206 HydrophobicContact CE-CG2 4.19Å; M140-V206 HydrophobicContact CG-CG2 4.42Å; M140-V206 HydrophobicContact SD-CG2 4.25Å; M141-V206 HydrophobicContact CB-CG1 4.49Å; V202-V206 WeakPolarHBondContact O-CG2 3.35Å; V202-V206 PolarHBondContact O-N 2.85Å; W203-V206 WeakPolarHBondContact O-CB 3.31Å; W203-V206 PolarHBondContact O-N 3.02Å; H204-V206 VanDerWaalsContact C-N 3.28Å; H204-V206 PolarHBondContact O-N 3.27Å; V206-Y208 VanDerWaalsContact C-N 3.33Å; V206-Y208 PolarHBondContact O-N 2.85Å; V206-I209 PolarHBondContact O-N 2.83Å; V206-E210 HydrophobicContact CG1-CG 4.27Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.4Å; V206-E210 WeakPolarHBondContact O-CB 3.29Å; V206-E210 WeakPolarHBondContact O-CG 3.39Å; V206-E210 PolarHBondContact O-N 3.4Å
207	D	86.2	Confident	83.4	Confident	6 Å²	6	48.5 Å²	48.5	3%	0.032	24%	0.243	C	C	.	.	H	α-helix	trans	-56.8	-45.7	177.4	179	57.2	0	0	0	111.5	Q31 W203 H204 E210 R211 Y235	Q31-D207 PolarHBondContact NE2-OD1 3.28Å; Q31-D207 VanDerWaalsContact NE2-OD1 3.11Å; Q31-D207 PolarHBondContact OE1-OD1 2.99Å; W203-D207 PolarHBondContact O-N 3.29Å; H204-D207 PolarHBondContact O-N 3.43Å; D207-E210 PolarHBondContact O-N 3.02Å; D207-R211 WeakPolarHBondContact O-CB 3.38Å; D207-R211 VanDerWaalsContact O-CG 3.31Å; D207-R211 WeakPolarHBondContact O-CG 3.48Å; D207-R211 PolarHBondContact O-N 3.43Å; D207-R211 IonicContact OD1-CZ 3.61Å; D207-R211 VanDerWaalsContact OD1-CZ 3.23Å; D207-R211 IonicContact OD1-NE 2.92Å; D207-R211 PolarHBondContact OD1-NE 3.28Å; D207-R211 IonicContact OD1-NH2 3.23Å; D207-R211 PolarHBondContact OD1-NH2 2.88Å; D207-R211 IonicContact OD2-CZ 2.73Å; D207-R211 IonicContact OD2-NE 2.68Å; D207-R211 PolarHBondContact OD2-NE 3.15Å; D207-R211 IonicContact OD2-NH2 3.48Å; D207-R211 PolarHBondContact OD2-NH2 3.44Å; D207-R211 VanDerWaalsContact OD2-NH2 3.17Å; D207-Y235 WeakPolarHBondContact OD2-CE1 3.25Å; D207-Y235 PolarHBondContact OD2-OH 3.36Å
208	Y	87.2	Confident	82.5	Confident	136 Å²	136	50.2 Å²	50.2	53%	0.533	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.5	178.1	-101.8	0	0	0	112.4	H204 G205 V206 E210 R211 E212 L213	H204-Y208 WeakPolarHBondContact O-CB 3.29Å; H204-Y208 PolarHBondContact O-N 3.27Å; G205-Y208 PolarHBondContact O-N 3.23Å; V206-Y208 VanDerWaalsContact C-N 3.33Å; V206-Y208 PolarHBondContact O-N 2.85Å; Y208-E210 VanDerWaalsContact C-N 3.34Å; Y208-E210 PolarHBondContact O-N 3.16Å; Y208-R211 PolarHBondContact O-N 3.48Å; Y208-E212 HydrophobicContact CD2-CB 4.43Å; Y208-E212 HydrophobicContact CD2-CG 4.05Å; Y208-E212 HydrophobicContact CE2-CB 4.07Å; Y208-E212 HydrophobicContact CE2-CG 3.81Å; Y208-E212 PolarHBondContact O-N 3.32Å; Y208-L213 HydrophobicContact CD1-CD1 3.96Å; Y208-L213 HydrophobicContact CE1-CD1 3.69Å; Y208-L213 HydrophobicContact CE1-CG 4.13Å
209	I	82.1	Confident	82.1	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.087	25%	0.248	C	C	.	.	I	π-helix	trans	-60.6	-45.6	177.3	-71.1	163.6	0	0	0	110.7	I118 M140 G205 V206 R211 L213 I214	I118-I209 HydrophobicContact CG2-CD1 4.35Å; M140-I209 HydrophobicContact CE-CD1 3.77Å; M140-I209 HydrophobicContact SD-CD1 3.7Å; G205-I209 WeakPolarHBondContact O-CB 3.33Å; G205-I209 WeakPolarHBondContact O-CD1 3.43Å; G205-I209 WeakPolarHBondContact O-CG1 3.36Å; G205-I209 PolarHBondContact O-N 2.93Å; V206-I209 PolarHBondContact O-N 2.83Å; I209-R211 VanDerWaalsContact C-N 3.34Å; I209-R211 PolarHBondContact O-N 3.24Å; I209-L213 HydrophobicContact CB-CD1 4.35Å; I209-L213 HydrophobicContact CG1-CD1 3.79Å; I209-L213 HydrophobicContact CG2-CB 4.45Å; I209-L213 WeakPolarHBondContact O-CB 3.41Å; I209-L213 PolarHBondContact O-N 3.34Å; I209-L213 VanDerWaalsContact O-N 3.13Å; I209-I214 HydrophobicContact CG2-CD1 3.87Å; I209-I214 HydrophobicContact CG2-CG1 3.94Å; I209-I214 WeakPolarHBondContact O-CG1 3.34Å; I209-I214 PolarHBondContact O-N 2.94Å
210	E	79.8	Confident	81.8	Confident	44 Å²	44	52.1 Å²	52.1	21%	0.206	26%	0.257	C	S	.	.	I	π-helix	trans	-65.3	-34.6	-179.7	-74.1	-175.3	-177.7	0	0	113.3	R119 V206 D207 Y208 I214 F219	R119-E210 IonicContact CZ-OE1 3.29Å; R119-E210 IonicContact NE-OE1 2.73Å; R119-E210 PolarHBondContact NE-OE1 3.47Å; R119-E210 IonicContact NH2-OE1 3.63Å; R119-E210 PolarHBondContact NH2-OE1 2.96Å; V206-E210 HydrophobicContact CG1-CG 4.27Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.4Å; V206-E210 WeakPolarHBondContact O-CB 3.29Å; V206-E210 WeakPolarHBondContact O-CG 3.39Å; V206-E210 PolarHBondContact O-N 3.4Å; D207-E210 PolarHBondContact O-N 3.02Å; Y208-E210 VanDerWaalsContact C-N 3.34Å; Y208-E210 PolarHBondContact O-N 3.16Å; E210-I214 HydrophobicContact CG-CD1 4.46Å; E210-F219 HydrophobicContact CB-CD1 4.17Å; E210-F219 HydrophobicContact CG-CD1 4.18Å; E210-F219 HydrophobicContact CG-CE1 4.18Å
211	R	82.4	Confident	81.5	Confident	41 Å²	41	57.1 Å²	57.1	16%	0.155	28%	0.279	C	S	.	.	I	π-helix	trans	-82.6	-47.5	-178.3	-69.4	-176.5	-166.7	-163.1	20.8	113.5	Q31 D207 Y208 I209 Y220 I233	Q31-R211 VanDerWaalsContact NE2-CZ 3.35Å; D207-R211 WeakPolarHBondContact O-CB 3.38Å; D207-R211 VanDerWaalsContact O-CG 3.31Å; D207-R211 WeakPolarHBondContact O-CG 3.48Å; D207-R211 PolarHBondContact O-N 3.43Å; D207-R211 IonicContact OD1-CZ 3.61Å; D207-R211 VanDerWaalsContact OD1-CZ 3.23Å; D207-R211 IonicContact OD1-NE 2.92Å; D207-R211 PolarHBondContact OD1-NE 3.28Å; D207-R211 IonicContact OD1-NH2 3.23Å; D207-R211 PolarHBondContact OD1-NH2 2.88Å; D207-R211 IonicContact OD2-CZ 2.73Å; D207-R211 IonicContact OD2-NE 2.68Å; D207-R211 PolarHBondContact OD2-NE 3.15Å; D207-R211 IonicContact OD2-NH2 3.48Å; D207-R211 PolarHBondContact OD2-NH2 3.44Å; D207-R211 VanDerWaalsContact OD2-NH2 3.17Å; Y208-R211 PolarHBondContact O-N 3.48Å; I209-R211 VanDerWaalsContact C-N 3.34Å; I209-R211 PolarHBondContact O-N 3.24Å; R211-Y220 HydrophobicContact CB-CD1 4.48Å; R211-I233 VanDerWaalsContact NH1-CG2 3.28Å
212	E	85.9	Confident	81.1	Confident	98 Å²	98	56.7 Å²	56.7	46%	0.458	27%	0.271	S	S	.	.	I	π-helix	trans	-104.8	-30.4	-165.2	-62.8	-55.1	141	0	0	113.5	Y208 K221	Y208-E212 HydrophobicContact CD2-CB 4.43Å; Y208-E212 HydrophobicContact CD2-CG 4.05Å; Y208-E212 HydrophobicContact CE2-CB 4.07Å; Y208-E212 HydrophobicContact CE2-CG 3.81Å; Y208-E212 PolarHBondContact O-N 3.32Å; E212-K221 WeakPolarHBondContact O-CD 3.33Å; E212-K221 PolarHBondContact O-NZ 3Å
213	L	80.7	Confident	80.9	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.199	26%	0.263	C	S	.	.	I	π-helix	trans	-101.9	-32.8	-167.9	-63.2	171.5	0	0	0	113.1	Y115 Y208 I209 D215	Y115-L213 HydrophobicContact CD1-CB 4.09Å; Y115-L213 HydrophobicContact CD1-CD1 3.66Å; Y115-L213 HydrophobicContact CD1-CG 4.33Å; Y115-L213 HydrophobicContact CD2-CB 4Å; Y115-L213 HydrophobicContact CD2-CD2 4.43Å; Y115-L213 HydrophobicContact CE1-CB 4.48Å; Y115-L213 HydrophobicContact CE1-CD1 3.55Å; Y115-L213 HydrophobicContact CE1-CD2 4.19Å; Y115-L213 HydrophobicContact CE1-CG 4.28Å; Y115-L213 HydrophobicContact CE2-CB 4.4Å; Y115-L213 HydrophobicContact CE2-CD2 3.99Å; Y115-L213 HydrophobicContact CG-CB 3.81Å; Y115-L213 HydrophobicContact CG-CD1 4.27Å; Y115-L213 HydrophobicContact CG-CG 4.49Å; Y208-L213 HydrophobicContact CD1-CD1 3.96Å; Y208-L213 HydrophobicContact CE1-CD1 3.69Å; Y208-L213 HydrophobicContact CE1-CG 4.13Å; I209-L213 HydrophobicContact CB-CD1 4.35Å; I209-L213 HydrophobicContact CG1-CD1 3.79Å; I209-L213 HydrophobicContact CG2-CB 4.45Å; I209-L213 WeakPolarHBondContact O-CB 3.41Å; I209-L213 PolarHBondContact O-N 3.34Å; I209-L213 VanDerWaalsContact O-N 3.13Å; L213-D215 PolarHBondContact O-N 2.85Å
214	I	73.9	Confident	80.7	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.278	C	S	.	.			trans	-87.1	117.1	-179.1	-56.6	173.9	0	0	0	111.3	Q116 R119 I209 E210 F219 K221	Q116-I214 HydrophobicContact CG-CG1 4.34Å; Q116-I214 HydrophobicContact CG-CG2 3.75Å; R119-I214 HydrophobicContact CB-CD1 4.39Å; I209-I214 HydrophobicContact CG2-CD1 3.87Å; I209-I214 HydrophobicContact CG2-CG1 3.94Å; I209-I214 WeakPolarHBondContact O-CG1 3.34Å; I209-I214 PolarHBondContact O-N 2.94Å; E210-I214 HydrophobicContact CG-CD1 4.46Å; I214-F219 HydrophobicContact CB-CB 4.12Å; I214-F219 HydrophobicContact CB-CD2 3.93Å; I214-F219 HydrophobicContact CB-CG 3.9Å; I214-F219 HydrophobicContact CD1-CD1 4.46Å; I214-F219 HydrophobicContact CD1-CD2 4.44Å; I214-F219 HydrophobicContact CD1-CG 4.46Å; I214-F219 HydrophobicContact CG2-CB 4.07Å; I214-F219 HydrophobicContact CG2-CD2 3.15Å; I214-F219 HydrophobicContact CG2-CE2 3.84Å; I214-F219 HydrophobicContact CG2-CG 3.65Å; I214-K221 VanDerWaalsContact O-CB 3.27Å; I214-K221 WeakPolarHBondContact O-CB 3.5Å
215	D	75.8	Confident	80.5	Confident	91 Å²	91	59.3 Å²	59.3	49%	0.487	29%	0.294	S	S	.	.			trans	-102.7	25.2	-176.1	65.6	-24.2	0	0	0	113.8	Q116 L213 K221 T222	Q116-D215 PolarHBondContact NE2-OD1 3.38Å; L213-D215 PolarHBondContact O-N 2.85Å; D215-K221 HydrophobicContact CB-CD 4.05Å; D215-T222 WeakPolarHBondContact O-CG2 3.3Å
216	R	68.7	Low	80.4	Confident	107 Å²	107	59.5 Å²	59.5	40%	0.404	29%	0.288	S	S	.	.	S	Bend	trans	-120.4	157.3	175.6	-74.9	-173.5	-169.3	-111.9	9.8	111.8	S111 F219 T222	S111-R216 PolarHBondContact O-NH2 3.26Å; S111-R216 PolarHBondContact OG-NH2 2.83Å; R216-F219 WeakPolarHBondContact O-CB 3.28Å; R216-F219 WeakPolarHBondContact O-CD2 3.45Å; R216-F219 PolarHBondContact O-N 2.71Å; R216-T222 VanDerWaalsContact CA-CG2 3.48Å; R216-T222 PolarHBondContact O-OG1 2.92Å
217	K	68.6	Low	80.5	Confident	176 Å²	176	59.1 Å²	59.1	77%	0.765	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	143.8	169.7	-66.9	-179.6	-179.4	178.3	0	109.3	T222	K217-T222 WeakPolarHBondContact CA-OG1 3.46Å; K217-T222 PolarHBondContact N-OG1 3.01Å
218	P	70.5	Confident	80.5	Confident	79 Å²	79	64.1 Å²	64.1	51%	0.513	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.2	23.3	4.3	37.3	-36.1	0	0	0	114.8	W223	P218-W223 PolarHBondContact O-NE1 3.25Å
219	F	76.5	Confident	80.5	Confident	32 Å²	32	64.4 Å²	64.4	14%	0.14	31%	0.31	C	S	.	.	S	Bend	trans	-77.4	154.9	-172	-59.6	-70.2	0	0	0	114.2	R119 E210 I214 R216 K221 T222 W223	R119-F219 VanDerWaalsContact NH2-CE1 3.31Å; E210-F219 HydrophobicContact CB-CD1 4.17Å; E210-F219 HydrophobicContact CG-CD1 4.18Å; E210-F219 HydrophobicContact CG-CE1 4.18Å; I214-F219 HydrophobicContact CB-CB 4.12Å; I214-F219 HydrophobicContact CB-CD2 3.93Å; I214-F219 HydrophobicContact CB-CG 3.9Å; I214-F219 HydrophobicContact CD1-CD1 4.46Å; I214-F219 HydrophobicContact CD1-CD2 4.44Å; I214-F219 HydrophobicContact CD1-CG 4.46Å; I214-F219 HydrophobicContact CG2-CB 4.07Å; I214-F219 HydrophobicContact CG2-CD2 3.15Å; I214-F219 HydrophobicContact CG2-CE2 3.84Å; I214-F219 HydrophobicContact CG2-CG 3.65Å; R216-F219 WeakPolarHBondContact O-CB 3.28Å; R216-F219 WeakPolarHBondContact O-CD2 3.45Å; R216-F219 PolarHBondContact O-N 2.71Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 3.37Å; F219-K221 VanDerWaalsContact O-N 3.12Å; F219-T222 PolarHBondContact O-N 3.03Å; F219-T222 PolarHBondContact O-OG1 3.22Å; F219-W223 PolarHBondContact O-NE1 2.71Å
220	Y	82.9	Confident	80.7	Confident	48 Å²	48	64.1 Å²	64.1	19%	0.188	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-51	-40.6	-169.9	179.8	-109.4	0	0	0	113.7	R211 T222 W223 R228 I233	R211-Y220 HydrophobicContact CB-CD1 4.48Å; Y220-T222 PolarHBondContact O-N 3.45Å; Y220-T222 VanDerWaalsContact O-N 3.15Å; Y220-W223 AromaticContact CD2-CD2 3.98Å; Y220-W223 HydrophobicContact CD2-CD2 3.98Å; Y220-W223 AromaticContact CD2-CE3 3.55Å; Y220-W223 HydrophobicContact CD2-CE3 3.55Å; Y220-W223 HydrophobicContact CD2-CH2 4.07Å; Y220-W223 AromaticContact CD2-CZ3 3.61Å; Y220-W223 HydrophobicContact CD2-CZ3 3.61Å; Y220-W223 AromaticContact CE2-CE3 3.97Å; Y220-W223 HydrophobicContact CE2-CE3 3.97Å; Y220-W223 HydrophobicContact CE2-CZ3 4.04Å; Y220-W223 VanDerWaalsContact O-CB 3.32Å; Y220-W223 WeakPolarHBondContact O-CB 3.48Å; Y220-W223 PolarHBondContact O-N 3.29Å; Y220-R228 HydrophobicContact CD2-CG 4.45Å; Y220-R228 HydrophobicContact CE2-CB 4.38Å; Y220-R228 HydrophobicContact CE2-CG 3.84Å; Y220-I233 HydrophobicContact CD2-CD1 3.59Å; Y220-I233 HydrophobicContact CE2-CD1 3.48Å; Y220-I233 VanDerWaalsContact CE2-CD1 3.48Å; Y220-I233 HydrophobicContact CG-CD1 4.34Å
221	K	83.2	Confident	81.2	Confident	105 Å²	105	62.3 Å²	62.3	46%	0.457	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-58.9	-28.8	179.8	-164.3	169.7	-173.6	166.2	0	113.9	E212 I214 D215 F219	E212-K221 WeakPolarHBondContact O-CD 3.33Å; E212-K221 PolarHBondContact O-NZ 3Å; I214-K221 VanDerWaalsContact O-CB 3.27Å; I214-K221 WeakPolarHBondContact O-CB 3.5Å; D215-K221 HydrophobicContact CB-CD 4.05Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 3.37Å; F219-K221 VanDerWaalsContact O-N 3.12Å
222	T	82	Confident	81.7	Confident	42 Å²	42	66 Å²	66	26%	0.258	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-94.6	0.1	179.7	63.7	0	0	0	0	114.4	D215 R216 K217 F219 Y220	D215-T222 WeakPolarHBondContact O-CG2 3.3Å; R216-T222 VanDerWaalsContact CA-CG2 3.48Å; R216-T222 PolarHBondContact O-OG1 2.92Å; K217-T222 WeakPolarHBondContact CA-OG1 3.46Å; K217-T222 PolarHBondContact N-OG1 3.01Å; F219-T222 PolarHBondContact O-N 3.03Å; F219-T222 PolarHBondContact O-OG1 3.22Å; Y220-T222 PolarHBondContact O-N 3.45Å; Y220-T222 VanDerWaalsContact O-N 3.15Å
223	W	84.7	Confident	82	Confident	20 Å²	20	63.1 Å²	63.1	8%	0.076	31%	0.312	C	S	.	.	S	Bend	trans	-68.2	145.6	178.5	-69.5	9.6	0	0	0	110.8	F33 I62 P218 F219 Y220 S225 L227 R228 T231	F33-W223 AromaticContact CD1-CH2 3.9Å; F33-W223 HydrophobicContact CD1-CH2 3.9Å; F33-W223 AromaticContact CE1-CH2 3.79Å; F33-W223 HydrophobicContact CE1-CH2 3.79Å; I62-W223 HydrophobicContact CB-CZ2 4.42Å; I62-W223 HydrophobicContact CG2-CZ2 4.22Å; P218-W223 PolarHBondContact O-NE1 3.25Å; F219-W223 PolarHBondContact O-NE1 2.71Å; Y220-W223 AromaticContact CD2-CD2 3.98Å; Y220-W223 HydrophobicContact CD2-CD2 3.98Å; Y220-W223 AromaticContact CD2-CE3 3.55Å; Y220-W223 HydrophobicContact CD2-CE3 3.55Å; Y220-W223 HydrophobicContact CD2-CH2 4.07Å; Y220-W223 AromaticContact CD2-CZ3 3.61Å; Y220-W223 HydrophobicContact CD2-CZ3 3.61Å; Y220-W223 AromaticContact CE2-CE3 3.97Å; Y220-W223 HydrophobicContact CE2-CE3 3.97Å; Y220-W223 HydrophobicContact CE2-CZ3 4.04Å; Y220-W223 VanDerWaalsContact O-CB 3.32Å; Y220-W223 WeakPolarHBondContact O-CB 3.48Å; Y220-W223 PolarHBondContact O-N 3.29Å; W223-S225 PolarHBondContact O-N 3.11Å; W223-L227 HydrophobicContact CB-CD2 4.22Å; W223-L227 HydrophobicContact CD2-CD2 3.85Å; W223-L227 HydrophobicContact CD2-CG 4.49Å; W223-L227 HydrophobicContact CE3-CD2 3.71Å; W223-L227 HydrophobicContact CE3-CG 3.9Å; W223-L227 HydrophobicContact CG-CD2 4.09Å; W223-L227 HydrophobicContact CZ3-CD2 4.46Å; W223-R228 HydrophobicContact CB-CG 3.8Å; W223-T231 HydrophobicContact CZ3-CG2 4.08Å
224	P	84.1	Confident	82.6	Confident	54 Å²	54	63.5 Å²	63.5	35%	0.351	32%	0.318	S	S	.	.			trans	-52.7	140.1	171.5	-24.4	33.7	0	0	0	111	I226 L227 R228	P224-I226 PolarHBondContact O-N 2.94Å; P224-L227 HydrophobicContact CB-CB 4.41Å; P224-L227 WeakPolarHBondContact O-CA 3.31Å; P224-L227 WeakPolarHBondContact O-CB 3.47Å; P224-L227 PolarHBondContact O-N 2.87Å; P224-R228 PolarHBondContact O-N 3.17Å
225	S	84.8	Confident	83.6	Confident	77 Å²	77	67.9 Å²	67.9	54%	0.538	34%	0.335	S	S	.	.	H	α-helix	trans	-55	-36.9	178.3	54.3	0	0	0	0	112.2	W223 L227 R228 Q229	W223-S225 PolarHBondContact O-N 3.11Å; S225-L227 VanDerWaalsContact C-N 3.31Å; S225-L227 PolarHBondContact O-N 3.2Å; S225-R228 PolarHBondContact O-N 3.47Å; S225-Q229 WeakPolarHBondContact O-CB 3.37Å; S225-Q229 VanDerWaalsContact O-CG 3.3Å; S225-Q229 WeakPolarHBondContact O-CG 3.16Å; S225-Q229 PolarHBondContact O-N 2.88Å
226	I	84.3	Confident	84.4	Confident	30 Å²	30	63.7 Å²	63.7	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-42.8	175.9	-59.7	172.5	0	0	0	111.3	L40 K43 Y44 P224 S230	L40-I226 HydrophobicContact CD1-CG2 4.03Å; K43-I226 HydrophobicContact CB-CG2 3.68Å; K43-I226 HydrophobicContact CD-CG2 3.78Å; K43-I226 HydrophobicContact CG-CG2 4.39Å; Y44-I226 HydrophobicContact CD2-CG2 3.86Å; Y44-I226 HydrophobicContact CE2-CB 4.13Å; Y44-I226 HydrophobicContact CE2-CG2 3.6Å; P224-I226 PolarHBondContact O-N 2.94Å; I226-S230 WeakPolarHBondContact O-CB 3.41Å; I226-S230 PolarHBondContact O-N 3.34Å; I226-S230 PolarHBondContact O-OG 3.36Å
227	L	86.1	Confident	85.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.9	-49	176.9	-179.5	58.2	0	0	0	110.4	V35 L40 I62 F63 W223 P224 S225 Q229 S230 T231	V35-L227 HydrophobicContact CG1-CD1 3.93Å; L40-L227 HydrophobicContact CD1-CB 4.37Å; L40-L227 HydrophobicContact CD1-CD1 3.97Å; L40-L227 HydrophobicContact CD2-CD1 4.32Å; I62-L227 HydrophobicContact CB-CD2 4.18Å; I62-L227 HydrophobicContact CD1-CD2 3.83Å; I62-L227 HydrophobicContact CG1-CD2 3.98Å; F63-L227 HydrophobicContact CD1-CD1 3.64Å; F63-L227 HydrophobicContact CD1-CD2 3.92Å; F63-L227 HydrophobicContact CD1-CG 4.3Å; F63-L227 HydrophobicContact CE1-CB 4.32Å; F63-L227 HydrophobicContact CE1-CD1 4.05Å; F63-L227 HydrophobicContact CE1-CD2 3.77Å; F63-L227 HydrophobicContact CE1-CG 4.27Å; F63-L227 HydrophobicContact CZ-CD2 4.48Å; W223-L227 HydrophobicContact CB-CD2 4.22Å; W223-L227 HydrophobicContact CD2-CD2 3.85Å; W223-L227 HydrophobicContact CD2-CG 4.49Å; W223-L227 HydrophobicContact CE3-CD2 3.71Å; W223-L227 HydrophobicContact CE3-CG 3.9Å; W223-L227 HydrophobicContact CG-CD2 4.09Å; W223-L227 HydrophobicContact CZ3-CD2 4.46Å; P224-L227 HydrophobicContact CB-CB 4.41Å; P224-L227 WeakPolarHBondContact O-CA 3.31Å; P224-L227 WeakPolarHBondContact O-CB 3.47Å; P224-L227 PolarHBondContact O-N 2.87Å; S225-L227 VanDerWaalsContact C-N 3.31Å; S225-L227 PolarHBondContact O-N 3.2Å; L227-Q229 VanDerWaalsContact C-N 3.27Å; L227-Q229 PolarHBondContact O-N 3.4Å; L227-S230 CarbonylContact O-C 3.5Å; L227-S230 PolarHBondContact O-N 3.42Å; L227-T231 WeakPolarHBondContact CD1-OG1 3.44Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 PolarHBondContact O-N 2.99Å; L227-T231 PolarHBondContact O-OG1 3.46Å
228	R	86.4	Confident	86.8	Confident	111 Å²	111	55.7 Å²	55.7	42%	0.419	28%	0.279	S	S	.	.	H	α-helix	trans	-56.8	-39.1	-179.9	-69.5	179.5	53.9	-166	-5.3	113.1	Y220 W223 P224 S225 S230	Y220-R228 HydrophobicContact CD2-CG 4.45Å; Y220-R228 HydrophobicContact CE2-CB 4.38Å; Y220-R228 HydrophobicContact CE2-CG 3.84Å; W223-R228 HydrophobicContact CB-CG 3.8Å; P224-R228 PolarHBondContact O-N 3.17Å; S225-R228 PolarHBondContact O-N 3.47Å; R228-S230 VanDerWaalsContact C-N 3.26Å; R228-S230 PolarHBondContact O-N 3.12Å
229	Q	87.3	Confident	87.9	Confident	141 Å²	141	53.2 Å²	53.2	66%	0.659	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-14.7	177.1	-70.4	174.4	5.5	0	0	114	S225 L227	S225-Q229 WeakPolarHBondContact O-CB 3.37Å; S225-Q229 VanDerWaalsContact O-CG 3.3Å; S225-Q229 WeakPolarHBondContact O-CG 3.16Å; S225-Q229 PolarHBondContact O-N 2.88Å; L227-Q229 VanDerWaalsContact C-N 3.27Å; L227-Q229 PolarHBondContact O-N 3.4Å
230	S	86.9	Confident	88.8	Confident	11 Å²	11	55.9 Å²	55.9	8%	0.077	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	8.8	-177.1	-44.3	0	0	0	0	111.7	N36 K43 I226 L227 R228	N36-S230 PolarHBondContact N-O 2.96Å; K43-S230 PolarHBondContact NZ-OG 2.97Å; I226-S230 WeakPolarHBondContact O-CB 3.41Å; I226-S230 PolarHBondContact O-N 3.34Å; I226-S230 PolarHBondContact O-OG 3.36Å; L227-S230 CarbonylContact O-C 3.5Å; L227-S230 PolarHBondContact O-N 3.42Å; R228-S230 VanDerWaalsContact C-N 3.26Å; R228-S230 PolarHBondContact O-N 3.12Å
231	T	89.7	Confident	89.3	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.037	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.2	179.7	-59.4	0	0	0	0	109.9	F33 R34 V35 W223 L227 I233	F33-T231 HydrophobicContact CB-CG2 4.47Å; F33-T231 HydrophobicContact CD1-CG2 4.32Å; R34-T231 CarbonylContact O-C 3.24Å; R34-T231 VanDerWaalsContact O-CA 3.27Å; R34-T231 WeakPolarHBondContact O-CA 3.41Å; V35-T231 HydrophobicContact CG2-CG2 3.93Å; W223-T231 HydrophobicContact CZ3-CG2 4.08Å; L227-T231 WeakPolarHBondContact CD1-OG1 3.44Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 PolarHBondContact O-N 2.99Å; L227-T231 PolarHBondContact O-OG1 3.46Å; T231-I233 HydrophobicContact CG2-CG1 4.06Å
232	D	92.4	Very high	89.8	Confident	118 Å²	118	50.6 Å²	50.6	63%	0.631	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.3	170	-66.5	-37.5	0	0	0	109.1	R34	R34-D232 HydrophobicContact CB-CB 4.46Å; R34-D232 PolarHBondContact N-O 2.95Å; R34-D232 PolarHBondContact O-N 3.09Å
233	I	92.2	Very high	90.4	Very high	38 Å²	38	53 Å²	53	20%	0.195	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.2	177.9	-47.8	175.5	0	0	0	108.1	Q31 E32 F33 R211 Y220 T231	Q31-I233 HydrophobicContact CG-CG2 4.13Å; E32-I233 WeakPolarHBondContact O-CA 2.88Å; F33-I233 HydrophobicContact CD1-CB 4.43Å; F33-I233 HydrophobicContact CD1-CD1 3.97Å; F33-I233 HydrophobicContact CD1-CG1 3.7Å; F33-I233 HydrophobicContact CD1-CG2 4.04Å; F33-I233 HydrophobicContact CE1-CD1 3.69Å; F33-I233 HydrophobicContact CE1-CG1 3.89Å; F33-I233 HydrophobicContact CE1-CG2 3.83Å; F33-I233 HydrophobicContact CZ-CG2 4.14Å; R211-I233 VanDerWaalsContact NH1-CG2 3.28Å; Y220-I233 HydrophobicContact CD2-CD1 3.59Å; Y220-I233 HydrophobicContact CE2-CD1 3.48Å; Y220-I233 VanDerWaalsContact CE2-CD1 3.48Å; Y220-I233 HydrophobicContact CG-CD1 4.34Å; T231-I233 HydrophobicContact CG2-CG1 4.06Å
234	S	94.1	Very high	90.8	Very high	47 Å²	47	56.2 Å²	56.2	33%	0.329	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	156.4	-179.6	60.5	0	0	0	0	111.2	E32	E32-S234 PolarHBondContact N-O 3.49Å; E32-S234 PolarHBondContact O-N 3.47Å
235	Y	94.2	Very high	91.3	Very high	92 Å²	92	53.7 Å²	53.7	36%	0.361	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133.3	169.8	-69.9	-61.7	0	0	0	109.3	W203 D207 Y239	W203-Y235 AromaticContact CH2-CD1 3.91Å; W203-Y235 HydrophobicContact CH2-CD1 3.91Å; W203-Y235 AromaticContact CH2-CE1 3.92Å; W203-Y235 HydrophobicContact CH2-CE1 3.92Å; W203-Y235 AromaticContact CZ3-CD1 3.91Å; W203-Y235 HydrophobicContact CZ3-CD1 3.91Å; W203-Y235 AromaticContact CZ3-CE1 3.71Å; W203-Y235 HydrophobicContact CZ3-CE1 3.71Å; D207-Y235 WeakPolarHBondContact OD2-CE1 3.25Å; D207-Y235 PolarHBondContact OD2-OH 3.36Å; Y235-Y239 HydrophobicContact CD1-CD1 4.23Å; Y235-Y239 HydrophobicContact CD1-CE1 4.43Å; Y235-Y239 HydrophobicContact CD1-CG 4.41Å; Y235-Y239 HydrophobicContact CD2-CE1 4.4Å; Y235-Y239 AromaticContact CG-CD1 3.97Å; Y235-Y239 HydrophobicContact CG-CD1 3.97Å; Y235-Y239 HydrophobicContact CG-CE1 4.07Å
236	G	92.7	Very high	91.6	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.031	23%	0.234	C	C	.	.			trans	-78.4	169.2	-178.9	0	0	0	0	0	112.7	N29 W30 S238 Y239 M240	N29-G236 CarbonylContact O-C 3.53Å; N29-G236 WeakPolarHBondContact O-CA 3.26Å; N29-G236 VanDerWaalsContact OD1-CA 3.23Å; N29-G236 WeakPolarHBondContact OD1-CA 3.36Å; W30-G236 PolarHBondContact O-N 2.92Å; G236-S238 VanDerWaalsContact C-N 3.31Å; G236-S238 PolarHBondContact O-N 2.91Å; G236-Y239 WeakPolarHBondContact O-CB 3.41Å; G236-Y239 PolarHBondContact O-N 2.82Å; G236-M240 PolarHBondContact O-N 3.19Å
237	W	93.6	Very high	91.9	Very high	116 Å²	116	49.9 Å²	49.9	44%	0.439	24%	0.239	S	C	.	.	H	α-helix	trans	-67.8	-30	-177	63.2	-96.6	0	0	0	113	I23 T27 N29 Y239 M240 I241	I23-W237 HydrophobicContact CG2-CH2 4.19Å; I23-W237 HydrophobicContact CG2-CZ3 3.96Å; T27-W237 HydrophobicContact CG2-CH2 3.48Å; T27-W237 VanDerWaalsContact CG2-CH2 3.48Å; T27-W237 HydrophobicContact CG2-CZ2 4.05Å; T27-W237 HydrophobicContact CG2-CZ3 4.29Å; N29-W237 HydrophobicContact CB-CG 4.48Å; N29-W237 VanDerWaalsContact CG-CD1 3.45Å; N29-W237 PolarHBondContact ND2-NE1 3.28Å; N29-W237 VanDerWaalsContact ND2-NE1 3.12Å; N29-W237 PolarHBondContact O-N 2.79Å; W237-Y239 PolarHBondContact O-N 2.92Å; W237-M240 PolarHBondContact O-N 2.81Å; W237-M240 VanDerWaalsContact O-N 3.14Å; W237-I241 HydrophobicContact CE3-CD1 3.45Å; W237-I241 VanDerWaalsContact CE3-CD1 3.45Å; W237-I241 HydrophobicContact CE3-CG1 4.13Å; W237-I241 HydrophobicContact CZ3-CD1 3.69Å; W237-I241 WeakPolarHBondContact O-CB 3.34Å; W237-I241 WeakPolarHBondContact O-CG1 3.28Å; W237-I241 PolarHBondContact O-N 3.07Å
238	S	94.4	Very high	92.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-38.4	177.8	-55.4	0	0	0	0	110.9	A24 T27 N29 G236 I241 A242	A24-S238 VanDerWaalsContact CB-O 3.28Å; A24-S238 WeakPolarHBondContact CB-O 3.48Å; T27-S238 WeakPolarHBondContact CB-OG 3.29Å; T27-S238 VanDerWaalsContact OG1-CB 3.28Å; T27-S238 WeakPolarHBondContact OG1-CB 3.47Å; T27-S238 PolarHBondContact OG1-OG 3.41Å; N29-S238 WeakPolarHBondContact O-CB 3.04Å; N29-S238 PolarHBondContact O-N 2.71Å; N29-S238 PolarHBondContact O-OG 2.8Å; G236-S238 VanDerWaalsContact C-N 3.31Å; G236-S238 PolarHBondContact O-N 2.91Å; S238-I241 PolarHBondContact O-N 3.17Å; S238-A242 WeakPolarHBondContact O-CB 3.44Å; S238-A242 PolarHBondContact O-N 2.77Å
239	Y	93.6	Very high	92.4	Very high	26 Å²	26	47.5 Å²	47.5	10%	0.102	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-42.6	175.8	164.9	-94.7	0	0	0	111.8	W30 V200 W203 H204 Y235 G236 W237 A242 W243	W30-Y239 HydrophobicContact CE3-CD2 4.22Å; W30-Y239 HydrophobicContact CZ3-CD2 4.32Å; V200-Y239 HydrophobicContact CG1-CD2 4.46Å; V200-Y239 HydrophobicContact CG1-CE2 3.97Å; W203-Y239 HydrophobicContact CE3-CD2 4.17Å; W203-Y239 HydrophobicContact CE3-CE2 4.5Å; W203-Y239 AromaticContact CZ3-CD2 3.85Å; W203-Y239 HydrophobicContact CZ3-CD2 3.85Å; W203-Y239 HydrophobicContact CZ3-CE2 4.29Å; W203-Y239 HydrophobicContact CZ3-CG 4.47Å; H204-Y239 AromaticContact CD2-CE2 3.9Å; H204-Y239 AromaticContact CE1-CE2 3.17Å; H204-Y239 WeakPolarHBondContact CE1-CE2 3.3Å; H204-Y239 AromaticContact CE1-CZ 3.16Å; H204-Y239 PolarHBondContact CE1-OH 2.98Å; H204-Y239 AromaticContact NE2-CE2 2.93Å; H204-Y239 WeakPolarHBondContact NE2-CE2 3.24Å; H204-Y239 AromaticContact NE2-CZ 3.09Å; H204-Y239 PolarHBondContact NE2-OH 3.24Å; Y235-Y239 HydrophobicContact CD1-CD1 4.23Å; Y235-Y239 HydrophobicContact CD1-CE1 4.43Å; Y235-Y239 HydrophobicContact CD1-CG 4.41Å; Y235-Y239 HydrophobicContact CD2-CE1 4.4Å; Y235-Y239 AromaticContact CG-CD1 3.97Å; Y235-Y239 HydrophobicContact CG-CD1 3.97Å; Y235-Y239 HydrophobicContact CG-CE1 4.07Å; G236-Y239 WeakPolarHBondContact O-CB 3.41Å; G236-Y239 PolarHBondContact O-N 2.82Å; W237-Y239 PolarHBondContact O-N 2.92Å; Y239-A242 WeakPolarHBondContact O-CB 2.88Å; Y239-A242 PolarHBondContact O-N 3.32Å; Y239-W243 AromaticContact CE1-CD1 3.93Å; Y239-W243 AromaticContact CE2-CD1 3.5Å; Y239-W243 AromaticContact CE2-NE1 3.13Å; Y239-W243 AromaticContact CZ-CD1 3.34Å; Y239-W243 AromaticContact CZ-NE1 3.1Å; Y239-W243 PolarHBondContact O-N 2.86Å; Y239-W243 PolarHBondContact OH-NE1 3.07Å
240	M	94.3	Very high	92.4	Very high	89 Å²	89	43 Å²	43	44%	0.438	21%	0.211	S	C	.	.	H	α-helix	trans	-65.7	-43.2	176.1	-59.7	-57.8	169.1	0	0	111.8	G236 W237 A242 W243 I244	G236-M240 PolarHBondContact O-N 3.19Å; W237-M240 PolarHBondContact O-N 2.81Å; W237-M240 VanDerWaalsContact O-N 3.14Å; M240-A242 VanDerWaalsContact C-N 3.29Å; M240-A242 PolarHBondContact O-N 2.99Å; M240-W243 PolarHBondContact O-N 2.92Å; M240-I244 VanDerWaalsContact O-CG1 3.31Å; M240-I244 WeakPolarHBondContact O-CG1 3.48Å; M240-I244 PolarHBondContact O-N 3.11Å
241	I	95.2	Very high	92.5	Very high	40 Å²	40	46.1 Å²	46.1	21%	0.205	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-35.6	177.1	-72.1	-168.1	0	0	0	111.5	L20 A24 W237 S238 W243 I244 G245	L20-I241 HydrophobicContact CB-CG2 3.7Å; L20-I241 HydrophobicContact CD2-CG2 3.69Å; L20-I241 HydrophobicContact CG-CG2 4.2Å; L20-I241 WeakPolarHBondContact O-CG2 3.02Å; A24-I241 HydrophobicContact CB-CG2 4.45Å; W237-I241 HydrophobicContact CE3-CD1 3.45Å; W237-I241 VanDerWaalsContact CE3-CD1 3.45Å; W237-I241 HydrophobicContact CE3-CG1 4.13Å; W237-I241 HydrophobicContact CZ3-CD1 3.69Å; W237-I241 WeakPolarHBondContact O-CB 3.34Å; W237-I241 WeakPolarHBondContact O-CG1 3.28Å; W237-I241 PolarHBondContact O-N 3.07Å; S238-I241 PolarHBondContact O-N 3.17Å; I241-W243 PolarHBondContact O-N 2.68Å; I241-I244 PolarHBondContact O-N 2.71Å; I241-G245 PolarHBondContact O-N 2.91Å
242	A	93.3	Very high	92.5	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-48.2	174.7	0	0	0	0	0	111.5	A24 W30 V200 S238 Y239 M240 G245 I246	A24-A242 HydrophobicContact CB-CB 3.79Å; W30-A242 HydrophobicContact CH2-CB 4.06Å; W30-A242 HydrophobicContact CZ2-CB 4.42Å; V200-A242 HydrophobicContact CG2-CB 4.46Å; S238-A242 WeakPolarHBondContact O-CB 3.44Å; S238-A242 PolarHBondContact O-N 2.77Å; Y239-A242 WeakPolarHBondContact O-CB 2.88Å; Y239-A242 PolarHBondContact O-N 3.32Å; M240-A242 VanDerWaalsContact C-N 3.29Å; M240-A242 PolarHBondContact O-N 2.99Å; A242-G245 PolarHBondContact O-N 2.81Å; A242-I246 VanDerWaalsContact O-CG1 3.28Å; A242-I246 WeakPolarHBondContact O-CG1 3.41Å; A242-I246 PolarHBondContact O-N 3.07Å
243	W	93.4	Very high	92.2	Very high	92 Å²	92	40.2 Å²	40.2	35%	0.348	20%	0.195	S	C	.	.	H	α-helix	trans	-65.4	-42.1	177.2	-80.4	113	0	0	0	113.2	I197 V200 H204 Y239 M240 I241 G245 I246 G247	I197-W243 HydrophobicContact CG1-CZ3 4.46Å; I197-W243 HydrophobicContact CG2-CH2 4.38Å; V200-W243 HydrophobicContact CB-CZ2 4.4Å; V200-W243 HydrophobicContact CG1-CD2 4.45Å; V200-W243 HydrophobicContact CG1-CH2 4.49Å; V200-W243 HydrophobicContact CG1-CZ2 3.62Å; H204-W243 AromaticContact NE2-NE1 3.75Å; Y239-W243 AromaticContact CE1-CD1 3.93Å; Y239-W243 AromaticContact CE2-CD1 3.5Å; Y239-W243 AromaticContact CE2-NE1 3.13Å; Y239-W243 AromaticContact CZ-CD1 3.34Å; Y239-W243 AromaticContact CZ-NE1 3.1Å; Y239-W243 PolarHBondContact O-N 2.86Å; Y239-W243 PolarHBondContact OH-NE1 3.07Å; M240-W243 PolarHBondContact O-N 2.92Å; I241-W243 PolarHBondContact O-N 2.68Å; W243-G245 VanDerWaalsContact C-N 3.3Å; W243-G245 PolarHBondContact O-N 3.39Å; W243-I246 HydrophobicContact CE3-CD1 4.44Å; W243-I246 PolarHBondContact O-N 3.35Å; W243-G247 PolarHBondContact O-N 3.43Å
244	I	94.9	Very high	91.9	Very high	89 Å²	89	42.7 Å²	42.7	46%	0.456	21%	0.207	S	C	.	.	H	α-helix	trans	-61.1	-43.6	176.1	-65.7	166.2	0	0	0	110	L20 M240 I241 G247 F248	L20-I244 HydrophobicContact CD1-CG2 3.94Å; M240-I244 VanDerWaalsContact O-CG1 3.31Å; M240-I244 WeakPolarHBondContact O-CG1 3.48Å; M240-I244 PolarHBondContact O-N 3.11Å; I241-I244 PolarHBondContact O-N 2.71Å; I244-G247 PolarHBondContact O-N 2.85Å; I244-F248 HydrophobicContact CG2-CD2 4.34Å; I244-F248 HydrophobicContact CG2-CE2 3.96Å; I244-F248 HydrophobicContact CG2-CZ 4.07Å; I244-F248 PolarHBondContact O-N 3.49Å
245	G	93.1	Very high	91.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-45.9	177	0	0	0	0	0	112.8	G17 I241 A242 W243 G247 F248 I249	G17-G245 WeakPolarHBondContact CA-O 3.28Å; I241-G245 PolarHBondContact O-N 2.91Å; A242-G245 PolarHBondContact O-N 2.81Å; W243-G245 VanDerWaalsContact C-N 3.3Å; W243-G245 PolarHBondContact O-N 3.39Å; G245-G247 VanDerWaalsContact C-N 3.32Å; G245-G247 PolarHBondContact O-N 3.49Å; G245-F248 PolarHBondContact O-N 3.45Å; G245-I249 WeakPolarHBondContact O-CG1 3.41Å; G245-I249 PolarHBondContact O-N 3.42Å
246	I	91.3	Very high	91.2	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.015	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-43.9	173	-68.9	166.2	0	0	0	110.7	V21 L196 I197 V200 A242 W243 F248 I249 L250	V21-I246 HydrophobicContact CG2-CG1 4.34Å; L196-I246 HydrophobicContact CB-CD1 4.05Å; L196-I246 HydrophobicContact CB-CG1 4.06Å; I197-I246 HydrophobicContact CD1-CG2 4.01Å; I197-I246 HydrophobicContact CG1-CD1 4.37Å; I197-I246 HydrophobicContact CG1-CG2 3.62Å; V200-I246 HydrophobicContact CG2-CD1 4Å; A242-I246 VanDerWaalsContact O-CG1 3.28Å; A242-I246 WeakPolarHBondContact O-CG1 3.41Å; A242-I246 PolarHBondContact O-N 3.07Å; W243-I246 HydrophobicContact CE3-CD1 4.44Å; W243-I246 PolarHBondContact O-N 3.35Å; I246-F248 PolarHBondContact O-N 3.12Å; I246-I249 PolarHBondContact O-N 2.79Å; I246-L250 HydrophobicContact CG2-CD1 4.24Å; I246-L250 WeakPolarHBondContact O-CG 2.8Å; I246-L250 PolarHBondContact O-N 3.47Å
247	G	90.8	Very high	90.8	Very high	25 Å²	25	41.2 Å²	41.2	26%	0.258	20%	0.2	S	C	.	.	H	α-helix	trans	-58.7	-44.2	177.2	0	0	0	0	0	112.8	W243 I244 G245 L250 I251	W243-G247 PolarHBondContact O-N 3.43Å; I244-G247 PolarHBondContact O-N 2.85Å; G245-G247 VanDerWaalsContact C-N 3.32Å; G245-G247 PolarHBondContact O-N 3.49Å; G247-L250 PolarHBondContact O-N 2.72Å; G247-I251 VanDerWaalsContact O-CG1 3.32Å; G247-I251 WeakPolarHBondContact O-CG1 3.1Å; G247-I251 PolarHBondContact O-N 2.7Å
248	F	92.1	Very high	90.5	Very high	60 Å²	60	38.6 Å²	38.6	26%	0.263	20%	0.197	S	C	.	.	H	α-helix	trans	-65.5	-36.3	175.3	-72.3	-16.4	0	0	0	113.2	F13 L16 L20 I244 G245 I246 I251 S252	F13-F248 HydrophobicContact CD1-CB 4.44Å; F13-F248 AromaticContact CD1-CD1 3.87Å; F13-F248 HydrophobicContact CD1-CD1 3.87Å; F13-F248 HydrophobicContact CD1-CE1 4.26Å; F13-F248 HydrophobicContact CD1-CG 4.1Å; F13-F248 HydrophobicContact CE1-CD1 4.21Å; F13-F248 HydrophobicContact CE1-CE1 4.19Å; L16-F248 HydrophobicContact CB-CD2 4.15Å; L20-F248 HydrophobicContact CD1-CD2 3.79Å; L20-F248 HydrophobicContact CD1-CE2 3.86Å; I244-F248 HydrophobicContact CG2-CD2 4.34Å; I244-F248 HydrophobicContact CG2-CE2 3.96Å; I244-F248 HydrophobicContact CG2-CZ 4.07Å; I244-F248 PolarHBondContact O-N 3.49Å; G245-F248 PolarHBondContact O-N 3.45Å; I246-F248 PolarHBondContact O-N 3.12Å; F248-I251 HydrophobicContact CD1-CD1 4.42Å; F248-I251 PolarHBondContact O-N 2.96Å; F248-S252 VanDerWaalsContact O-CB 3.24Å; F248-S252 WeakPolarHBondContact O-CB 3.33Å; F248-S252 PolarHBondContact O-N 2.97Å
249	I	90.3	Very high	90.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-42.6	174.5	-66.6	164	0	0	0	110.6	V21 L155 L181 L196 G245 I246 S252 S253	V21-I249 HydrophobicContact CG2-CD1 4.02Å; L155-I249 HydrophobicContact CD1-CD1 4.14Å; L155-I249 HydrophobicContact CD1-CG1 4.48Å; L155-I249 HydrophobicContact CD1-CG2 4.22Å; L155-I249 HydrophobicContact CD2-CD1 3.66Å; L181-I249 HydrophobicContact CD2-CG2 4.08Å; L196-I249 HydrophobicContact CD1-CD1 4.25Å; G245-I249 WeakPolarHBondContact O-CG1 3.41Å; G245-I249 PolarHBondContact O-N 3.42Å; I246-I249 PolarHBondContact O-N 2.79Å; I249-S252 WeakPolarHBondContact O-CB 3.49Å; I249-S252 PolarHBondContact O-N 3.16Å; I249-S253 WeakPolarHBondContact O-CB 3.47Å; I249-S253 PolarHBondContact O-N 3.15Å
250	L	88.3	Confident	89.6	Confident	45 Å²	45	38.4 Å²	38.4	24%	0.236	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-46.3	176.1	-70.5	173.9	0	0	0	111.9	L182 A193 I197 I246 G247 S252 S253 I254	L182-L250 HydrophobicContact CD2-CD2 4.17Å; A193-L250 HydrophobicContact CB-CD2 3.87Å; I197-L250 HydrophobicContact CD1-CD1 4.45Å; I246-L250 HydrophobicContact CG2-CD1 4.24Å; I246-L250 WeakPolarHBondContact O-CG 2.8Å; I246-L250 PolarHBondContact O-N 3.47Å; G247-L250 PolarHBondContact O-N 2.72Å; L250-S252 PolarHBondContact O-N 3.19Å; L250-S253 PolarHBondContact O-N 2.94Å; L250-I254 WeakPolarHBondContact O-CG1 3.41Å; L250-I254 PolarHBondContact O-N 2.94Å
251	I	89.1	Confident	89.2	Confident	78 Å²	78	42.6 Å²	42.6	40%	0.4	21%	0.208	S	C	.	.	H	α-helix	trans	-60.5	-47	176.2	-68.7	166.1	0	0	0	110.3	F13 G247 F248 S253 I254 L255	F13-I251 HydrophobicContact CD2-CG2 4.23Å; F13-I251 HydrophobicContact CE2-CG2 4.47Å; F13-I251 HydrophobicContact CG-CG2 4.42Å; G247-I251 VanDerWaalsContact O-CG1 3.32Å; G247-I251 WeakPolarHBondContact O-CG1 3.1Å; G247-I251 PolarHBondContact O-N 2.7Å; F248-I251 HydrophobicContact CD1-CD1 4.42Å; F248-I251 PolarHBondContact O-N 2.96Å; I251-S253 VanDerWaalsContact C-N 3.27Å; I251-S253 PolarHBondContact O-N 3.12Å; I251-I254 PolarHBondContact O-N 3.5Å; I251-L255 HydrophobicContact CG2-CD1 3.94Å; I251-L255 HydrophobicContact CG2-CG 4.34Å; I251-L255 VanDerWaalsContact O-CG 3.31Å; I251-L255 WeakPolarHBondContact O-CG 3.32Å; I251-L255 PolarHBondContact O-N 2.89Å
252	S	88.4	Confident	88.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54	-45.6	176.5	173.3	0	0	0	0	111.6	S10 S14 F248 I249 L250 L255 M256	S10-S252 WeakPolarHBondContact O-CB 3.04Å; S10-S252 PolarHBondContact O-OG 2.89Å; S10-S252 PolarHBondContact OG-O 3.46Å; S10-S252 PolarHBondContact OG-OG 2.76Å; S10-S252 VanDerWaalsContact OG-OG 3.12Å; S14-S252 WeakPolarHBondContact CB-OG 3.44Å; S14-S252 PolarHBondContact OG-OG 3.05Å; F248-S252 VanDerWaalsContact O-CB 3.24Å; F248-S252 WeakPolarHBondContact O-CB 3.33Å; F248-S252 PolarHBondContact O-N 2.97Å; I249-S252 WeakPolarHBondContact O-CB 3.49Å; I249-S252 PolarHBondContact O-N 3.16Å; L250-S252 PolarHBondContact O-N 3.19Å; S252-L255 WeakPolarHBondContact O-CB 3.5Å; S252-L255 PolarHBondContact O-N 3.04Å; S252-M256 PolarHBondContact O-N 3.22Å
253	S	86.2	Confident	88.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-41.1	-179.7	-177.9	0	0	0	0	113.3	G178 L181 L182 I249 L250 I251 L255 M256 L257	G178-S253 PolarHBondContact O-OG 3.04Å; L181-S253 WeakPolarHBondContact CB-OG 3.29Å; L182-S253 VanDerWaalsContact CB-OG 3.22Å; L182-S253 WeakPolarHBondContact CB-OG 3.41Å; L182-S253 WeakPolarHBondContact CD1-OG 3.48Å; L182-S253 WeakPolarHBondContact CG-OG 3.42Å; L182-S253 PolarHBondContact N-OG 3.13Å; L182-S253 VanDerWaalsContact N-OG 3.14Å; I249-S253 WeakPolarHBondContact O-CB 3.47Å; I249-S253 PolarHBondContact O-N 3.15Å; L250-S253 PolarHBondContact O-N 2.94Å; I251-S253 VanDerWaalsContact C-N 3.27Å; I251-S253 PolarHBondContact O-N 3.12Å; S253-L255 VanDerWaalsContact C-N 3.3Å; S253-L255 PolarHBondContact O-N 2.7Å; S253-M256 PolarHBondContact O-N 3.32Å; S253-L257 PolarHBondContact O-N 2.78Å
254	I	86.2	Confident	87.9	Confident	90 Å²	90	45.5 Å²	45.5	46%	0.462	22%	0.222	S	C	.	.	H	α-helix	trans	-59.1	-45.3	172.2	-65.1	167.6	0	0	0	110	L182 L250 I251 M256 L257 V258	L182-I254 HydrophobicContact CD1-CG1 3.87Å; L182-I254 HydrophobicContact CD2-CG1 4.26Å; L250-I254 WeakPolarHBondContact O-CG1 3.41Å; L250-I254 PolarHBondContact O-N 2.94Å; I251-I254 PolarHBondContact O-N 3.5Å; I254-M256 VanDerWaalsContact C-N 3.34Å; I254-M256 PolarHBondContact O-N 3.06Å; I254-L257 PolarHBondContact O-N 3.45Å; I254-V258 WeakPolarHBondContact O-CG2 3.46Å; I254-V258 PolarHBondContact O-N 3.09Å
255	L	89	Confident	87.4	Confident	44 Å²	44	45.4 Å²	45.4	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-39.2	177.3	-67.1	172.9	0	0	0	112	I6 F9 F13 I251 S252 S253 L257 V258 A259	I6-L255 HydrophobicContact CG2-CB 4.06Å; I6-L255 HydrophobicContact CG2-CD2 4.18Å; I6-L255 VanDerWaalsContact CG2-O 3.27Å; I6-L255 WeakPolarHBondContact CG2-O 2.79Å; F9-L255 HydrophobicContact CB-CD1 4.25Å; F13-L255 HydrophobicContact CD2-CD1 3.74Å; F13-L255 HydrophobicContact CE2-CD1 4.09Å; I251-L255 HydrophobicContact CG2-CD1 3.94Å; I251-L255 HydrophobicContact CG2-CG 4.34Å; I251-L255 VanDerWaalsContact O-CG 3.31Å; I251-L255 WeakPolarHBondContact O-CG 3.32Å; I251-L255 PolarHBondContact O-N 2.89Å; S252-L255 WeakPolarHBondContact O-CB 3.5Å; S252-L255 PolarHBondContact O-N 3.04Å; S253-L255 VanDerWaalsContact C-N 3.3Å; S253-L255 PolarHBondContact O-N 2.7Å; L255-L257 PolarHBondContact O-N 3.28Å; L255-V258 PolarHBondContact O-N 3.32Å; L255-A259 WeakPolarHBondContact O-CB 3.44Å; L255-A259 PolarHBondContact O-N 2.77Å
256	M	85	Confident	87	Confident	10 Å²	10	48 Å²	48	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-41.8	173.9	-82.3	-49.5	176.3	0	0	111.9	L7 S10 I174 S252 S253 I254 A259 H260	L7-M256 HydrophobicContact CD2-CE 4.47Å; L7-M256 HydrophobicContact CD2-SD 3.63Å; S10-M256 WeakPolarHBondContact OG-CE 3.27Å; S10-M256 WeakPolarHBondContact OG-CG 3.15Å; I174-M256 HydrophobicContact CG2-SD 4.17Å; S252-M256 PolarHBondContact O-N 3.22Å; S253-M256 PolarHBondContact O-N 3.32Å; I254-M256 VanDerWaalsContact C-N 3.34Å; I254-M256 PolarHBondContact O-N 3.06Å; M256-A259 PolarHBondContact O-N 3.1Å; M256-H260 WeakPolarHBondContact O-CB 3.39Å; M256-H260 PolarHBondContact O-N 2.97Å
257	L	84.8	Confident	86.5	Confident	56 Å²	56	52.4 Å²	52.4	29%	0.293	25%	0.252	S	S	.	.	H	α-helix	trans	-66.8	-39.5	177.9	-68.9	-177.1	0	0	0	112.3	I179 L182 S253 I254 L255 H260 R261	I179-L257 HydrophobicContact CG1-CD2 4.27Å; L182-L257 HydrophobicContact CD1-CD1 3.3Å; L182-L257 HydrophobicContact CD1-CG 4.1Å; S253-L257 PolarHBondContact O-N 2.78Å; I254-L257 PolarHBondContact O-N 3.45Å; L255-L257 PolarHBondContact O-N 3.28Å; L257-H260 PolarHBondContact O-N 3.33Å; L257-R261 WeakPolarHBondContact O-CG 3.33Å; L257-R261 PolarHBondContact O-N 3.33Å; L257-R261 VanDerWaalsContact O-N 3.09Å
258	V	86.1	Confident	86.2	Confident	62 Å²	62	55.2 Å²	55.2	38%	0.376	26%	0.259	S	S	.	.	H	α-helix	trans	-65.1	-44.5	174.2	175.4	0	0	0	0	110.5	I6 I254 L255 H260 R261 K262	I6-V258 HydrophobicContact CD1-CG1 4.09Å; I254-V258 WeakPolarHBondContact O-CG2 3.46Å; I254-V258 PolarHBondContact O-N 3.09Å; L255-V258 PolarHBondContact O-N 3.32Å; V258-H260 VanDerWaalsContact C-N 3.34Å; V258-H260 PolarHBondContact O-N 2.7Å; V258-R261 PolarHBondContact O-N 2.82Å; V258-K262 WeakPolarHBondContact O-CG 3.47Å; V258-K262 PolarHBondContact O-N 2.91Å
259	A	86	Confident	85.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-43.1	176.3	0	0	0	0	0	111.8	I6 L7 L255 M256 R261 K262 M263	I6-A259 HydrophobicContact CB-CB 4.23Å; I6-A259 HydrophobicContact CG2-CB 3.82Å; L7-A259 HydrophobicContact CD2-CB 3.47Å; L7-A259 VanDerWaalsContact CD2-CB 3.47Å; L7-A259 HydrophobicContact CG-CB 3.77Å; L255-A259 WeakPolarHBondContact O-CB 3.44Å; L255-A259 PolarHBondContact O-N 2.77Å; M256-A259 PolarHBondContact O-N 3.1Å; A259-R261 PolarHBondContact O-N 3.29Å; A259-K262 PolarHBondContact O-N 2.73Å; A259-M263 WeakPolarHBondContact O-CG 3.49Å; A259-M263 PolarHBondContact O-N 3.36Å
260	H	83.5	Confident	85.5	Confident	21 Å²	21	61.6 Å²	61.6	10%	0.097	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-47.9	175.1	171.4	-86.9	0	0	0	112	L171 I174 M175 M256 L257 V258 K262 M263 K264	L171-H260 WeakPolarHBondContact CD1-CD2 3.28Å; L171-H260 PolarHBondContact O-CD2 3.39Å; I174-H260 HydrophobicContact CG2-CB 4.27Å; M175-H260 VanDerWaalsContact CB-CD2 3.47Å; M175-H260 WeakPolarHBondContact CB-CD2 3.32Å; M256-H260 WeakPolarHBondContact O-CB 3.39Å; M256-H260 PolarHBondContact O-N 2.97Å; L257-H260 PolarHBondContact O-N 3.33Å; V258-H260 VanDerWaalsContact C-N 3.34Å; V258-H260 PolarHBondContact O-N 2.7Å; H260-K262 VanDerWaalsContact C-N 3.3Å; H260-K262 PolarHBondContact O-N 3.5Å; H260-M263 PolarHBondContact O-N 3.22Å; H260-K264 WeakPolarHBondContact O-CB 3.46Å; H260-K264 PolarHBondContact O-N 2.85Å
261	R	85.1	Confident	85	Confident	178 Å²	178	64.1 Å²	64.1	67%	0.672	31%	0.307	S	S	*	.	H	α-helix	trans	-58.4	-44.4	176.5	-72.4	-178.4	-179.2	-176.9	0.5	111.3	L257 V258 A259 K264 E265	L257-R261 WeakPolarHBondContact O-CG 3.33Å; L257-R261 PolarHBondContact O-N 3.33Å; L257-R261 VanDerWaalsContact O-N 3.09Å; V258-R261 PolarHBondContact O-N 2.82Å; A259-R261 PolarHBondContact O-N 3.29Å; R261-K264 PolarHBondContact O-N 3.47Å; R261-E265 WeakPolarHBondContact O-CG 3.29Å; R261-E265 PolarHBondContact O-N 2.96Å
262	K	86.3	Confident	84.6	Confident	76 Å²	76	65.7 Å²	65.7	33%	0.33	32%	0.317	S	S	.	.	H	α-helix	trans	-65.3	-39.2	178.1	-72.4	-73.6	160.5	-150.4	0	113	V258 A259 H260 E265 E266	V258-K262 WeakPolarHBondContact O-CG 3.47Å; V258-K262 PolarHBondContact O-N 2.91Å; A259-K262 PolarHBondContact O-N 2.73Å; H260-K262 VanDerWaalsContact C-N 3.3Å; H260-K262 PolarHBondContact O-N 3.5Å; K262-E265 IonicContact NZ-OE1 2.73Å; K262-E265 IonicContact NZ-OE2 3.76Å; K262-E265 PolarHBondContact NZ-OE2 3.26Å; K262-E265 PolarHBondContact O-N 2.85Å; K262-E266 WeakPolarHBondContact O-CB 3.44Å; K262-E266 WeakPolarHBondContact O-CG 3.4Å; K262-E266 PolarHBondContact O-N 3Å
263	M	83.5	Confident	84.1	Confident	19 Å²	19	68.8 Å²	68.8	9%	0.094	34%	0.342	C	S	.	.	H	α-helix	trans	-65.8	-40.2	174.8	-74.5	-176.2	64.8	0	0	112.2	S3 L7 R169 L171 I174 A259 H260 E266 E267	S3-M263 WeakPolarHBondContact OG-CG 3.26Å; L7-M263 HydrophobicContact CD1-SD 3.83Å; R169-M263 HydrophobicContact CB-CE 4.48Å; L171-M263 HydrophobicContact CD1-CB 3.64Å; I174-M263 HydrophobicContact CD1-CE 3.88Å; I174-M263 HydrophobicContact CD1-SD 3.51Å; I174-M263 VanDerWaalsContact CD1-SD 3.51Å; A259-M263 WeakPolarHBondContact O-CG 3.49Å; A259-M263 PolarHBondContact O-N 3.36Å; H260-M263 PolarHBondContact O-N 3.22Å; M263-E266 PolarHBondContact O-N 3.39Å; M263-E267 WeakPolarHBondContact O-CB 3.46Å; M263-E267 PolarHBondContact O-N 2.98Å
264	K	84.9	Confident	83.5	Confident	98 Å²	98	74.5 Å²	74.5	43%	0.426	37%	0.367	S	S	.	.	H	α-helix	trans	-64	-43.8	176.3	-175.6	175.2	170.5	176.9	0	111.5	L171 H260 R261 E267 E268	L171-K264 HydrophobicContact CD2-CB 4.11Å; L171-K264 HydrophobicContact CD2-CG 4.39Å; H260-K264 WeakPolarHBondContact O-CB 3.46Å; H260-K264 PolarHBondContact O-N 2.85Å; R261-K264 PolarHBondContact O-N 3.47Å; K264-E267 PolarHBondContact O-N 3Å; K264-E268 WeakPolarHBondContact CE-OE1 3.26Å; K264-E268 IonicContact NZ-OE1 3.11Å; K264-E268 WeakPolarHBondContact O-CB 2.98Å; K264-E268 VanDerWaalsContact O-CG 3.31Å; K264-E268 WeakPolarHBondContact O-CG 3.39Å; K264-E268 PolarHBondContact O-N 3.41Å
265	E	85.9	Confident	82.4	Confident	88 Å²	88	70.8 Å²	70.8	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-45.5	172.7	-72.3	166.9	-160.6	0	0	111.3	R261 K262 E268 T269	R261-E265 WeakPolarHBondContact O-CG 3.29Å; R261-E265 PolarHBondContact O-N 2.96Å; K262-E265 IonicContact NZ-OE1 2.73Å; K262-E265 IonicContact NZ-OE2 3.76Å; K262-E265 PolarHBondContact NZ-OE2 3.26Å; K262-E265 PolarHBondContact O-N 2.85Å; E265-E268 PolarHBondContact O-N 2.62Å; E265-T269 VanDerWaalsContact O-CG2 3.29Å; E265-T269 WeakPolarHBondContact O-CG2 3.18Å; E265-T269 PolarHBondContact O-N 3.12Å; E265-T269 PolarHBondContact O-OG1 3.22Å
266	E	83.1	Confident	80.9	Confident	54 Å²	54	73.4 Å²	73.4	25%	0.252	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-44.3	176.8	-74.9	177.1	166.1	0	0	111	M1 S3 K262 M263 T269 E270	M1-E266 PolarHBondContact N-OE1 3.46Å; S3-E266 VanDerWaalsContact CB-OE2 3.3Å; S3-E266 WeakPolarHBondContact CB-OE2 3.42Å; K262-E266 WeakPolarHBondContact O-CB 3.44Å; K262-E266 WeakPolarHBondContact O-CG 3.4Å; K262-E266 PolarHBondContact O-N 3Å; M263-E266 PolarHBondContact O-N 3.39Å; E266-T269 WeakPolarHBondContact CA-OG1 3.1Å; E266-T269 PolarHBondContact O-N 2.8Å; E266-T269 PolarHBondContact O-OG1 3.09Å; E266-E270 WeakPolarHBondContact O-CG 3.44Å; E266-E270 PolarHBondContact O-N 3.37Å
267	E	82.5	Confident	79.5	Confident	95 Å²	95	76.8 Å²	76.8	44%	0.444	39%	0.39	S	S	.	.	H	α-helix	trans	-64.8	-43.7	177.1	-174.3	174.4	-165.2	0	0	112.6	L171 M263 K264 E270 M271	L171-E267 WeakPolarHBondContact CD2-OE2 3.08Å; M263-E267 WeakPolarHBondContact O-CB 3.46Å; M263-E267 PolarHBondContact O-N 2.98Å; K264-E267 PolarHBondContact O-N 3Å; E267-E270 PolarHBondContact O-N 3.2Å; E267-M271 HydrophobicContact CG-CE 4.39Å; E267-M271 VanDerWaalsContact O-CG 3.32Å; E267-M271 WeakPolarHBondContact O-CG 3.41Å; E267-M271 PolarHBondContact O-N 3.09Å
268	E	84.7	Confident	78	Confident	84 Å²	84	81.7 Å²	81.7	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174.4	-74.2	172.4	178.1	0	0	111.1	K264 E265 E270 M271 D272	K264-E268 WeakPolarHBondContact CE-OE1 3.26Å; K264-E268 IonicContact NZ-OE1 3.11Å; K264-E268 WeakPolarHBondContact O-CB 2.98Å; K264-E268 VanDerWaalsContact O-CG 3.31Å; K264-E268 WeakPolarHBondContact O-CG 3.39Å; K264-E268 PolarHBondContact O-N 3.41Å; E265-E268 PolarHBondContact O-N 2.62Å; E268-E270 VanDerWaalsContact C-N 3.32Å; E268-E270 PolarHBondContact O-N 2.97Å; E268-M271 HydrophobicContact CB-CE 4.39Å; E268-M271 HydrophobicContact CG-CE 3.94Å; E268-M271 PolarHBondContact O-N 3.25Å; E268-D272 WeakPolarHBondContact O-CB 3.37Å; E268-D272 PolarHBondContact O-N 3.33Å
269	T	84.2	Confident	76.4	Confident	87 Å²	87	85.3 Å²	85.3	53%	0.534	42%	0.42	S	S	.	.	H	α-helix	trans	-64.6	-33.7	176.3	58.5	0	0	0	0	113.2	E265 E266 A273	E265-T269 VanDerWaalsContact O-CG2 3.29Å; E265-T269 WeakPolarHBondContact O-CG2 3.18Å; E265-T269 PolarHBondContact O-N 3.12Å; E265-T269 PolarHBondContact O-OG1 3.22Å; E266-T269 WeakPolarHBondContact CA-OG1 3.1Å; E266-T269 PolarHBondContact O-N 2.8Å; E266-T269 PolarHBondContact O-OG1 3.09Å; T269-A273 WeakPolarHBondContact O-CB 3.26Å; T269-A273 PolarHBondContact O-N 3.09Å
270	E	82.2	Confident	74.9	Confident	109 Å²	109	91.2 Å²	91.2	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-37.9	174.5	-76.3	-174.9	-162.8	0	0	112.2	E266 E267 E268 K274	E266-E270 WeakPolarHBondContact O-CG 3.44Å; E266-E270 PolarHBondContact O-N 3.37Å; E267-E270 PolarHBondContact O-N 3.2Å; E268-E270 VanDerWaalsContact C-N 3.32Å; E268-E270 PolarHBondContact O-N 2.97Å; E270-K274 VanDerWaalsContact O-CB 3.32Å; E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 WeakPolarHBondContact O-CD 3.42Å; E270-K274 WeakPolarHBondContact O-CG 3.2Å; E270-K274 PolarHBondContact O-N 2.88Å; E270-K274 IonicContact OE2-NZ 3.99Å
271	M	78.8	Confident	73.3	Confident	98 Å²	98	92.9 Å²	92.9	48%	0.483	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-45.3	174.1	-73	-171.7	-61.5	0	0	110.8	E267 E268 K274 A275 Y278	E267-M271 HydrophobicContact CG-CE 4.39Å; E267-M271 VanDerWaalsContact O-CG 3.32Å; E267-M271 WeakPolarHBondContact O-CG 3.41Å; E267-M271 PolarHBondContact O-N 3.09Å; E268-M271 HydrophobicContact CB-CE 4.39Å; E268-M271 HydrophobicContact CG-CE 3.94Å; E268-M271 PolarHBondContact O-N 3.25Å; M271-K274 PolarHBondContact O-N 2.82Å; M271-A275 WeakPolarHBondContact O-CB 3.07Å; M271-A275 PolarHBondContact O-N 3.19Å; M271-Y278 PolarHBondContact O-OH 3.15Å
272	D	80.4	Confident	71.6	Confident	111 Å²	111	88 Å²	88	59%	0.594	46%	0.457	S	S	*	.	H	α-helix	trans	-65.7	-43.4	177.5	-70.9	-20.5	0	0	0	111.6	E268 K274 A275 V276	E268-D272 WeakPolarHBondContact O-CB 3.37Å; E268-D272 PolarHBondContact O-N 3.33Å; D272-K274 VanDerWaalsContact C-N 3.34Å; D272-K274 PolarHBondContact O-N 2.88Å; D272-A275 WeakPolarHBondContact O-CA 3.39Å; D272-A275 PolarHBondContact O-N 2.96Å; D272-V276 WeakPolarHBondContact O-CG2 3.04Å; D272-V276 PolarHBondContact O-N 3.07Å; D272-V276 VanDerWaalsContact O-N 3.12Å
273	A	77.8	Confident	69.7	Low	65 Å²	65	93 Å²	93	54%	0.537	47%	0.474	S	S	.	.	H	α-helix	trans	-65.6	-35.7	178	0	0	0	0	0	112.7	T269 A275 P277	T269-A273 WeakPolarHBondContact O-CB 3.26Å; T269-A273 PolarHBondContact O-N 3.09Å; A273-A275 VanDerWaalsContact C-N 3.31Å; A273-P277 WeakPolarHBondContact O-CD 3.31Å
274	K	72.7	Confident	67.8	Low	119 Å²	119	97.8 Å²	97.8	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-69	-34.5	169.4	-72.3	168.1	-173.4	160.2	0	109.9	E270 M271 D272 V276 P277 Y278	E270-K274 VanDerWaalsContact O-CB 3.32Å; E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 WeakPolarHBondContact O-CD 3.42Å; E270-K274 WeakPolarHBondContact O-CG 3.2Å; E270-K274 PolarHBondContact O-N 2.88Å; E270-K274 IonicContact OE2-NZ 3.99Å; M271-K274 PolarHBondContact O-N 2.82Å; D272-K274 VanDerWaalsContact C-N 3.34Å; D272-K274 PolarHBondContact O-N 2.88Å; K274-V276 PolarHBondContact O-N 3.34Å; K274-P277 WeakPolarHBondContact O-CD 3.07Å; K274-P277 WeakPolarHBondContact O-CG 3.35Å; K274-Y278 HydrophobicContact CB-CE1 3.83Å; K274-Y278 WeakPolarHBondContact CB-OH 3.35Å; K274-Y278 WeakPolarHBondContact O-CD1 3.22Å; K274-Y278 WeakPolarHBondContact O-CE1 3.05Å; K274-Y278 PolarHBondContact O-OH 3.49Å
275	A	63.3	Low	65.9	Low	12 Å²	12	99 Å²	99	10%	0.099	50%	0.503	C	S	.	.	H	α-helix	trans	-71.7	-25.1	-175.1	0	0	0	0	0	116.8	M271 D272 A273 Y278 M279	M271-A275 WeakPolarHBondContact O-CB 3.07Å; M271-A275 PolarHBondContact O-N 3.19Å; D272-A275 WeakPolarHBondContact O-CA 3.39Å; D272-A275 PolarHBondContact O-N 2.96Å; A273-A275 VanDerWaalsContact C-N 3.31Å; A275-Y278 WeakPolarHBondContact CA-OH 2.92Å; A275-Y278 HydrophobicContact CB-CD2 4.12Å; A275-Y278 HydrophobicContact CB-CE2 3.4Å; A275-Y278 VanDerWaalsContact N-CZ 3.31Å; A275-Y278 PolarHBondContact N-OH 3.35Å; A275-Y278 PolarHBondContact O-N 3.36Å; A275-M279 HydrophobicContact CB-CE 3.46Å; A275-M279 VanDerWaalsContact CB-CE 3.46Å; A275-M279 WeakPolarHBondContact O-CB 3.26Å; A275-M279 VanDerWaalsContact O-CG 3.29Å; A275-M279 WeakPolarHBondContact O-CG 3.5Å; A275-M279 PolarHBondContact O-N 3.27Å; A275-M279 VanDerWaalsContact O-N 3.17Å
276	V	58.3	Low	64	Low	99 Å²	99	102 Å²	102	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-59.5	-48.7	172.5	-178.8	0	0	0	0	112.4	D272 K274 Y278 M279 I280	D272-V276 WeakPolarHBondContact O-CG2 3.04Å; D272-V276 PolarHBondContact O-N 3.07Å; D272-V276 VanDerWaalsContact O-N 3.12Å; K274-V276 PolarHBondContact O-N 3.34Å; V276-Y278 PolarHBondContact O-N 3.4Å; V276-M279 PolarHBondContact O-N 3.14Å; V276-I280 WeakPolarHBondContact O-CG1 3.24Å; V276-I280 PolarHBondContact O-N 3.11Å
277	P	56	Low	62.3	Low	81 Å²	81	105.9 Å²	105.9	53%	0.526	54%	0.536	S	S	.	.	H	α-helix	trans	-63.8	-27.9	178.5	-0.3	-9.3	0	0	0	116.5	A273 K274	A273-P277 WeakPolarHBondContact O-CD 3.31Å; K274-P277 WeakPolarHBondContact O-CD 3.07Å; K274-P277 WeakPolarHBondContact O-CG 3.35Å
278	Y	52.8	Low	60.3	Low	159 Å²	159	108.2 Å²	108.2	62%	0.624	55%	0.549	S	S	*	.	H	α-helix	trans	-92.9	2.2	174.4	34.7	-94.6	0	0	0	114.4	M271 K274 A275 V276	M271-Y278 PolarHBondContact O-OH 3.15Å; K274-Y278 HydrophobicContact CB-CE1 3.83Å; K274-Y278 WeakPolarHBondContact CB-OH 3.35Å; K274-Y278 WeakPolarHBondContact O-CD1 3.22Å; K274-Y278 WeakPolarHBondContact O-CE1 3.05Å; K274-Y278 PolarHBondContact O-OH 3.49Å; A275-Y278 WeakPolarHBondContact CA-OH 2.92Å; A275-Y278 HydrophobicContact CB-CD2 4.12Å; A275-Y278 HydrophobicContact CB-CE2 3.4Å; A275-Y278 VanDerWaalsContact N-CZ 3.31Å; A275-Y278 PolarHBondContact N-OH 3.35Å; A275-Y278 PolarHBondContact O-N 3.36Å; V276-Y278 PolarHBondContact O-N 3.4Å
279	M	52.7	Low	58.4	Low	139 Å²	139	109.4 Å²	109.4	69%	0.685	56%	0.556	S	S	*	*			trans	-108.9	7.5	169.6	-64.6	-166	-126.6	0	0	113.3	A275 V276	A275-M279 HydrophobicContact CB-CE 3.46Å; A275-M279 VanDerWaalsContact CB-CE 3.46Å; A275-M279 WeakPolarHBondContact O-CB 3.26Å; A275-M279 VanDerWaalsContact O-CG 3.29Å; A275-M279 WeakPolarHBondContact O-CG 3.5Å; A275-M279 PolarHBondContact O-N 3.27Å; A275-M279 VanDerWaalsContact O-N 3.17Å; V276-M279 PolarHBondContact O-N 3.14Å
280	I	53.8	Low	56.4	Low	124 Å²	124	113.6 Å²	113.6	64%	0.636	57%	0.571	S	S	*	*	S	Bend	trans	-64.8	129.7	168.5	-58.1	178.2	0	0	0	108.1	V276 S282	V276-I280 WeakPolarHBondContact O-CG1 3.24Å; V276-I280 PolarHBondContact O-N 3.11Å; I280-S282 PolarHBondContact O-N 3.05Å
281	P	50.9	Low	54.1	Low	56 Å²	56	113.1 Å²	113.1	36%	0.364	58%	0.578	S	S	.	*			trans	-87.4	116.9	-133.9	-2.7	19.8	0	0	0	112.1	Y283 H284	P281-Y283 HydrophobicContact CB-CD2 4.13Å; P281-Y283 HydrophobicContact CB-CG 4.36Å; P281-Y283 PolarHBondContact O-N 2.69Å; P281-H284 PolarHBondContact O-N 2.92Å
282	S	48.1	Very low	52	Low	76 Å²	76	119.5 Å²	119.5	53%	0.531	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.8	-0.5	149.1	51	0	0	0	0	112.5	I280 H284 E285 K286	I280-S282 PolarHBondContact O-N 3.05Å; S282-H284 VanDerWaalsContact C-N 3.3Å; S282-E285 PolarHBondContact O-N 3.25Å; S282-K286 PolarHBondContact O-N 2.94Å
283	Y	46.8	Very low	50	Low	179 Å²	179	119.4 Å²	119.4	70%	0.702	61%	0.613	S	S	*	*	H	α-helix	trans	-68.5	-22.7	164.5	-72.6	-92.9	0	0	0	113.6	P281 I287	P281-Y283 HydrophobicContact CB-CD2 4.13Å; P281-Y283 HydrophobicContact CB-CG 4.36Å; P281-Y283 PolarHBondContact O-N 2.69Å; Y283-I287 VanDerWaalsContact O-CD1 3.26Å; Y283-I287 WeakPolarHBondContact O-CD1 3.47Å; Y283-I287 VanDerWaalsContact O-CG1 3.3Å; Y283-I287 WeakPolarHBondContact O-CG1 3.36Å
284	H	44.8	Very low	47.8	Very low	121 Å²	121	124 Å²	124	56%	0.56	62%	0.623	S	S	*	*	H	α-helix	trans	-74	-37.1	170.8	-82.6	-64.5	0	0	0	111.2	P281 S282 M288	P281-H284 PolarHBondContact O-N 2.92Å; S282-H284 VanDerWaalsContact C-N 3.3Å; H284-M288 HydrophobicContact CB-CE 3.67Å; H284-M288 WeakPolarHBondContact O-CE 3.48Å; H284-M288 WeakPolarHBondContact O-CG 3.36Å
285	E	43.7	Very low	46	Very low	122 Å²	122	124.6 Å²	124.6	57%	0.57	63%	0.632	S	S	*	*	H	α-helix	trans	-63.6	-47.5	177.6	-122	-179.1	138.8	0	0	111.6	S282 I287 M288 M289	S282-E285 PolarHBondContact O-N 3.25Å; E285-I287 VanDerWaalsContact C-N 3.26Å; E285-I287 PolarHBondContact O-N 2.74Å; E285-I287 VanDerWaalsContact O-N 3.13Å; E285-M288 PolarHBondContact O-N 3.01Å; E285-M289 HydrophobicContact CB-CE 3.99Å; E285-M289 HydrophobicContact CB-SD 4.39Å; E285-M289 HydrophobicContact CG-CE 3.68Å; E285-M289 WeakPolarHBondContact O-CG 3.42Å; E285-M289 PolarHBondContact O-N 3.45Å
286	K	46.3	Very low	44.6	Very low	152 Å²	152	132.6 Å²	132.6	66%	0.661	66%	0.66	S	S	*	*	H	α-helix	trans	-65	-18.2	-175.4	-72	-175.9	-179.3	-179.7	0	115.9	S282 M289	S282-K286 PolarHBondContact O-N 2.94Å; K286-M289 HydrophobicContact CG-SD 4.28Å
287	I	47	Very low	43.4	Very low	135 Å²	135	137.5 Å²	137.5	69%	0.692	67%	0.67	S	S	*	*	H	α-helix	trans	-88.1	-15.6	176.5	-52	164.8	0	0	0	111.1	Y283 E285	Y283-I287 VanDerWaalsContact O-CD1 3.26Å; Y283-I287 WeakPolarHBondContact O-CD1 3.47Å; Y283-I287 VanDerWaalsContact O-CG1 3.3Å; Y283-I287 WeakPolarHBondContact O-CG1 3.36Å; E285-I287 VanDerWaalsContact C-N 3.26Å; E285-I287 PolarHBondContact O-N 2.74Å; E285-I287 VanDerWaalsContact O-N 3.13Å
288	M	41.8	Very low	42.4	Very low	145 Å²	145	137.4 Å²	137.4	71%	0.714	68%	0.684	S	S	*	*	H	α-helix	trans	-97.7	-3.4	177	-10.4	-167.8	-174.5	0	0	113.6	H284 E285	H284-M288 HydrophobicContact CB-CE 3.67Å; H284-M288 WeakPolarHBondContact O-CE 3.48Å; H284-M288 WeakPolarHBondContact O-CG 3.36Å; E285-M288 PolarHBondContact O-N 3.01Å
289	M	44.7	Very low	41.5	Very low	109 Å²	109	132.9 Å²	132.9	54%	0.537	69%	0.686	S	S	.	*			trans	-102.3	11.3	-176.5	-14.2	179.8	105.6	0	0	113.3	E285 K286 P291	E285-M289 HydrophobicContact CB-CE 3.99Å; E285-M289 HydrophobicContact CB-SD 4.39Å; E285-M289 HydrophobicContact CG-CE 3.68Å; E285-M289 WeakPolarHBondContact O-CG 3.42Å; E285-M289 PolarHBondContact O-N 3.45Å; K286-M289 HydrophobicContact CG-SD 4.28Å; M289-P291 WeakPolarHBondContact O-CD 3.5Å
290	M	40.8	Very low	40.7	Very low	174 Å²	174	137.2 Å²	137.2	86%	0.857	70%	0.696	S	S	*	*			trans	-77	110.1	178.9	-155.7	116	-165	0	0	109.6
291	P	35.6	Very low	39.9	Very low	100 Å²	100	136.9 Å²	136.9	65%	0.649	70%	0.702	S	S	*	*			trans	-97.4	152.9	177.9	36.5	-21.5	0	0	0	109.3	M289	M289-P291 WeakPolarHBondContact O-CD 3.5Å
292	Y	34.6	Very low	39.4	Very low	232 Å²	232	143.3 Å²	143.3	91%	0.91	73%	0.727	S	S	*	*			trans	73.8	101.6	171.7	-76.3	-97.8	0	0	0	118.3
293	A	36.7	Very low	38.7	Very low	108 Å²	108	147.9 Å²	147.9	89%	0.893	74%	0.74	S	S	*	*				-156.3	135.5	121.5	0	0	0	0	0	111
294	H	32.6	Very low	38.1	Very low	162 Å²	162	147.3 Å²	147.3	75%	0.75	75%	0.746	S	S	*	*			trans	-76.6	143.2	-170.1	-169.4	63.2	0	0	0	112.6
295	N	35.5	Very low	37.6	Very low	132 Å²	132	151.9 Å²	151.9	71%	0.706	76%	0.759	S	S	*	*			trans	150.8	111.6	141.8	-80.2	-35.9	0	0	0	110.5
296	Y	33.5	Very low	37.2	Very low	179 Å²	179	149.4 Å²	149.4	70%	0.702	77%	0.767	S	S	*	*				105	108.1	74.1	-137.8	-101.2	0	0	0	109.7
297	Y	32.7	Very low	36.8	Very low	202 Å²	202	146 Å²	146	79%	0.792	77%	0.774	S	S	*	*			trans	64.2	114.3	155.7	-80.1	-113.2	0	0	0	120.4
298	G	34.5	Very low	36.2	Very low	80 Å²	80	144.3 Å²	144.3	83%	0.825	78%	0.775	S	S	*	*			trans	144	95.7	143.7	0	0	0	0	0	117.5
299	G	34.1	Very low	35.9	Very low	64 Å²	64	148.4 Å²	148.4	66%	0.66	78%	0.784	S	S	*	*			trans	91.6	109.3	130	0	0	0	0	0	120.6
300	Y	36.1	Very low	35.4	Very low	229 Å²	229	146.7 Å²	146.7	90%	0.898	79%	0.794	S	S	*	*			trans	87.2	117.5	149.2	-66.2	-83.3	0	0	0	120.7
301	P	37.1	Very low	35.3	Very low	117 Å²	117	143.1 Å²	143.1	76%	0.76	79%	0.792	S	S	*	*			trans	-92	130.3	165.7	34	-26.2	0	0	0	111.2
302	Q	40.4	Very low	35.3	Very low	192 Å²	192	144.3 Å²	144.3	90%	0.897	80%	0.8	S	S	*	*			trans	-104.2	117.9	163.4	-80.8	-82.2	-29.2	0	0	108.3
303	Q	34.4	Very low	35.1	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	80%	0.8	S	S	*	*			trans	-101.8	169.9	170.6	-78.2	-170.9	-13.8	0	0	110.4
304	M	32.8	Very low	35.1	Very low	168 Å²	168	143.7 Å²	143.7	83%	0.828	80%	0.799	S	S	*	*			trans	89.3	134.4	165	-80.3	-160.5	166.5	0	0	116.1
305	Y	34	Very low	35.2	Very low	216 Å²	216	144.2 Å²	144.2	85%	0.847	81%	0.807	S	S	*	*			cis	179.9	152.9	4	-162.8	-107	0	0	0	107.9
306	G	35.2	Very low	35.1	Very low	71 Å²	71	141.2 Å²	141.2	73%	0.732	81%	0.807	S	S	*	*			trans	140.5	103.6	147.4	0	0	0	0	0	119.9
307	G	39.1	Very low	35.2	Very low	79 Å²	79	143.8 Å²	143.8	81%	0.814	82%	0.817	S	S	*	*			trans	89.8	103.5	147.8	0	0	0	0	0	116.8
308	S	34.3	Very low	35.1	Very low	101 Å²	101	144.1 Å²	144.1	71%	0.706	82%	0.819	S	S	*	*			cis	93.5	120.2	35.1	-150.2	0	0	0	0	115.6
309	Y	35.7	Very low	35.3	Very low	231 Å²	231	144 Å²	144	91%	0.906	82%	0.817	S	S	*	*			trans	88.1	112.1	161.4	-69	-77	0	0	0	122.5
310	G	34.3	Very low	35.6	Very low	73 Å²	73	151.1 Å²	151.1	75%	0.753	83%	0.825	S	S	*	*			trans	125.1	74	134.6	0	0	0	0	0	117.9
311	A	37.2	Very low	36.1	Very low	98 Å²	98	148.4 Å²	148.4	81%	0.81	83%	0.826	S	S	*	*				88.5	160.8	105.5	0	0	0	0	0	114.6
312	P	36.2	Very low	36.4	Very low	125 Å²	125	150.1 Å²	150.1	81%	0.812	83%	0.829	S	S	*	*				-116.6	171.2	-110.5	21.2	2.3	0	0	0	115.7
313	M	31.4	Very low	36.4	Very low	187 Å²	187	151.8 Å²	151.8	92%	0.921	83%	0.828	S	S	*	*			trans	-46.2	134.6	-176.5	-53.1	-172.6	178.9	0	0	116.5
314	T	36.3	Very low	37.1	Very low	140 Å²	140	147.1 Å²	147.1	86%	0.859	83%	0.825	S	S	*	*			trans	-144.1	126.7	147.9	62.1	0	0	0	0	111.8
315	N	34.5	Very low	37.4	Very low	174 Å²	174	152 Å²	152	93%	0.93	85%	0.846	S	S	*	*			trans	-30.6	148	169.2	-76	-33.7	0	0	0	117.5
316	G	34.2	Very low	37.6	Very low	68 Å²	68	148.8 Å²	148.8	70%	0.701	85%	0.846	S	S	*	*			trans	164.6	83.9	151.1	0	0	0	0	0	117.8
317	Y	34.4	Very low	37.7	Very low	234 Å²	234	152.9 Å²	152.9	92%	0.918	85%	0.852	S	S	*	*			trans	71.2	100.6	144.4	-86.2	-95.8	0	0	0	121.1
318	Y	32	Very low	37.7	Very low	209 Å²	209	157 Å²	157	82%	0.82	85%	0.854	S	S	*	*			trans	-53.6	129.4	140.9	-87.7	-101.8	0	0	0	110.6	Y320	Y318-Y320 HydrophobicContact CD1-CE2 4.47Å
319	G	38.3	Very low	37.9	Very low	76 Å²	76	160.3 Å²	160.3	78%	0.784	86%	0.863	S	S	*	*			trans	-127	97.6	172.1	0	0	0	0	0	110.9
320	Y	40.9	Very low	38	Very low	214 Å²	214	155.9 Å²	155.9	84%	0.839	86%	0.86	S	S	*	*			trans	-71.3	130	166	-86.3	-95	0	0	0	109.8	Y318	Y318-Y320 HydrophobicContact CD1-CE2 4.47Å
321	L	45.1	Very low	38.2	Very low	173 Å²	173	161.4 Å²	161.4	91%	0.906	87%	0.867	S	S	*	*			trans	-85.5	113.4	161.3	-88.3	157.5	0	0	0	108.6
322	N	42.9	Very low	38.3	Very low	153 Å²	153	165.9 Å²	165.9	82%	0.818	87%	0.871	S	S	*	*			trans	-80	129.4	-177.2	-150.4	7.3	0	0	0	109.8
323	Y	41.3	Very low	38.5	Very low	227 Å²	227	169.1 Å²	169.1	89%	0.89	88%	0.876	S	S	*	*			trans	-83.1	114.9	161.2	-75.9	-85.7	0	0	0	107.5
324	G	50.2	Low	39.1	Very low	72 Å²	72	167.6 Å²	167.6	74%	0.742	87%	0.872	S	S	*	*			trans	-72.4	146.5	176.3	0	0	0	0	0	112.3
325	H	39	Very low	39.3	Very low	271 Å²	271	170.1 Å²	170.1	100%	1.255	87%	0.873	S	S	*	*			trans	-42.7	0	176.8	-84.9	-78.5	0	0	0	117

Retrieved 325 of 325 residues in 685.7 ms (Link to these results)

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