A0A077ZGZ5_TRITR Loading...

EAL and HAMP and GGDEF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGZ5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 651 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	65.2	Low	81.3	Confident	189 Å²	189	98.6 Å²	98.6	93%	0.931	58%	0.576	S	S	*	*				0	-55.5	0	-63.1	-53.9	-87.5	0	0	112.7	M3 V4 A5	M1-M3 PolarHBondContact O-N 3.15Å; M1-V4 PolarHBondContact O-N 3.03Å; M1-A5 PolarHBondContact O-N 3.41Å
2	A	75.8	Confident	81.9	Confident	84 Å²	84	92.4 Å²	92.4	69%	0.694	54%	0.54	S	S	*	.	H	α-helix	trans	-56.2	-44.5	-179.3	0	0	0	0	0	114.2	V4 A5 A6	A2-V4 PolarHBondContact O-N 3.03Å; A2-A5 PolarHBondContact O-N 3.01Å; A2-A6 PolarHBondContact O-N 3.46Å
3	M	78.1	Confident	82.5	Confident	158 Å²	158	96.1 Å²	96.1	78%	0.778	55%	0.546	S	S	*	.	H	α-helix	trans	-59.5	-44.2	175.6	-82.6	-96.5	-82	0	0	113.2	M1 A6 V7	M1-M3 PolarHBondContact O-N 3.15Å; M3-A6 PolarHBondContact O-N 2.87Å; M3-V7 WeakPolarHBondContact O-CG2 3.31Å; M3-V7 PolarHBondContact O-N 2.85Å
4	V	78.8	Confident	83.1	Confident	94 Å²	94	95 Å²	95	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-65.2	-43.5	179.4	179.2	0	0	0	0	110.4	M1 A2 A6 V7 V8	M1-V4 PolarHBondContact O-N 3.03Å; A2-V4 PolarHBondContact O-N 3.03Å; V4-A6 VanDerWaalsContact C-N 3.31Å; V4-A6 PolarHBondContact O-N 3.48Å; V4-V7 PolarHBondContact O-N 3.31Å; V4-V8 HydrophobicContact CG1-CG2 4.39Å; V4-V8 VanDerWaalsContact O-CG2 3.29Å; V4-V8 WeakPolarHBondContact O-CG2 3.45Å; V4-V8 PolarHBondContact O-N 3.44Å
5	A	79.9	Confident	83.6	Confident	62 Å²	62	95.7 Å²	95.7	51%	0.512	53%	0.532	S	S	.	.	H	α-helix	trans	-61	-41	176	0	0	0	0	0	111.9	M1 A2 V8 L9	M1-A5 PolarHBondContact O-N 3.41Å; A2-A5 PolarHBondContact O-N 3.01Å; A5-V8 PolarHBondContact O-N 3.45Å; A5-L9 WeakPolarHBondContact O-CB 3.49Å; A5-L9 PolarHBondContact O-N 3.3Å
6	A	82.5	Confident	84.1	Confident	53 Å²	53	90.1 Å²	90.1	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-46	176.5	0	0	0	0	0	111.9	A2 M3 V4 L9 V10	A2-A6 PolarHBondContact O-N 3.46Å; M3-A6 PolarHBondContact O-N 2.87Å; V4-A6 VanDerWaalsContact C-N 3.31Å; V4-A6 PolarHBondContact O-N 3.48Å; A6-L9 PolarHBondContact O-N 3.15Å; A6-V10 WeakPolarHBondContact O-CG2 3.32Å; A6-V10 PolarHBondContact O-N 3.48Å
7	V	86.4	Confident	84.5	Confident	75 Å²	75	88.3 Å²	88.3	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-45.8	177.6	172.8	0	0	0	0	111	M3 V4 L9 V10 F11	M3-V7 WeakPolarHBondContact O-CG2 3.31Å; M3-V7 PolarHBondContact O-N 2.85Å; V4-V7 PolarHBondContact O-N 3.31Å; V7-L9 VanDerWaalsContact C-N 3.33Å; V7-L9 PolarHBondContact O-N 2.81Å; V7-V10 PolarHBondContact O-N 2.87Å; V7-F11 HydrophobicContact CG1-CD2 3.67Å; V7-F11 HydrophobicContact CG1-CE2 3.58Å; V7-F11 VanDerWaalsContact O-CD2 3.26Å; V7-F11 WeakPolarHBondContact O-CD2 3.31Å; V7-F11 PolarHBondContact O-N 2.98Å
8	V	84.7	Confident	85	Confident	55 Å²	55	88.4 Å²	88.4	33%	0.333	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-43.5	177	171.5	0	0	0	0	111.2	V4 A5 V10 F11 V12 S156	V4-V8 HydrophobicContact CG1-CG2 4.39Å; V4-V8 VanDerWaalsContact O-CG2 3.29Å; V4-V8 WeakPolarHBondContact O-CG2 3.45Å; V4-V8 PolarHBondContact O-N 3.44Å; A5-V8 PolarHBondContact O-N 3.45Å; V8-V10 VanDerWaalsContact C-N 3.32Å; V8-V10 PolarHBondContact O-N 3.42Å; V8-F11 PolarHBondContact O-N 3.11Å; V8-V12 HydrophobicContact CG1-CG2 4.18Å; V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.24Å; V8-V12 PolarHBondContact O-N 3.38Å; V8-S156 WeakPolarHBondContact CG1-OG 3.15Å
9	L	86.5	Confident	85.4	Confident	119 Å²	119	86.7 Å²	86.7	62%	0.623	49%	0.485	S	S	*	.	H	α-helix	trans	-60.7	-42.7	177.8	-166.8	87.4	0	0	0	111.6	A5 A6 V7 V12 F13	A5-L9 WeakPolarHBondContact O-CB 3.49Å; A5-L9 PolarHBondContact O-N 3.3Å; A6-L9 PolarHBondContact O-N 3.15Å; V7-L9 VanDerWaalsContact C-N 3.33Å; V7-L9 PolarHBondContact O-N 2.81Å; L9-V12 PolarHBondContact O-N 2.74Å; L9-F13 WeakPolarHBondContact O-CB 3.31Å; L9-F13 PolarHBondContact O-N 3.35Å
10	V	89.3	Confident	85.8	Confident	83 Å²	83	83.4 Å²	83.4	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-46.6	176.6	170.8	0	0	0	0	110.9	A6 V7 V8 F13 I14	A6-V10 WeakPolarHBondContact O-CG2 3.32Å; A6-V10 PolarHBondContact O-N 3.48Å; V7-V10 PolarHBondContact O-N 2.87Å; V8-V10 VanDerWaalsContact C-N 3.32Å; V8-V10 PolarHBondContact O-N 3.42Å; V10-F13 PolarHBondContact O-N 3.09Å; V10-I14 HydrophobicContact CG1-CD1 3.82Å; V10-I14 VanDerWaalsContact O-CG1 3.31Å; V10-I14 WeakPolarHBondContact O-CG1 3.31Å; V10-I14 PolarHBondContact O-N 2.84Å
11	F	87.1	Confident	86.1	Confident	113 Å²	113	84.3 Å²	84.3	50%	0.496	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-45.9	177	-83.3	-73.3	0	0	0	112.1	V7 V8 F13 I14 F15	V7-F11 HydrophobicContact CG1-CD2 3.67Å; V7-F11 HydrophobicContact CG1-CE2 3.58Å; V7-F11 VanDerWaalsContact O-CD2 3.26Å; V7-F11 WeakPolarHBondContact O-CD2 3.31Å; V7-F11 PolarHBondContact O-N 2.98Å; V8-F11 PolarHBondContact O-N 3.11Å; F11-F13 VanDerWaalsContact C-N 3.26Å; F11-F13 PolarHBondContact O-N 3.02Å; F11-I14 PolarHBondContact O-N 3.13Å; F11-F15 HydrophobicContact CB-CD2 4.39Å; F11-F15 HydrophobicContact CB-CE2 4.43Å; F11-F15 HydrophobicContact CD1-CE2 4.1Å; F11-F15 WeakPolarHBondContact O-CD2 3.31Å; F11-F15 PolarHBondContact O-N 3.31Å
12	V	88.3	Confident	87.5	Confident	24 Å²	24	80.8 Å²	80.8	15%	0.145	45%	0.447	C	S	.	.	H	α-helix	trans	-57.7	-42.2	175.9	168.3	0	0	0	0	110.7	V8 L9 F15 C16	V8-V12 HydrophobicContact CG1-CG2 4.18Å; V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.24Å; V8-V12 PolarHBondContact O-N 3.38Å; L9-V12 PolarHBondContact O-N 2.74Å; V12-F15 PolarHBondContact O-N 2.86Å; V12-C16 VanDerWaalsContact O-CB 3.23Å; V12-C16 WeakPolarHBondContact O-CB 3.49Å; V12-C16 PolarHBondContact O-N 2.96Å; V12-C16 PolarHBondContact O-SG 2.78Å
13	F	89.9	Confident	88.3	Confident	140 Å²	140	79.4 Å²	79.4	61%	0.614	43%	0.427	S	S	*	.	H	α-helix	trans	-62.6	-46.2	176	-179.5	-99.2	0	0	0	112.3	L9 V10 F11 C16 T17	L9-F13 WeakPolarHBondContact O-CB 3.31Å; L9-F13 PolarHBondContact O-N 3.35Å; V10-F13 PolarHBondContact O-N 3.09Å; F11-F13 VanDerWaalsContact C-N 3.26Å; F11-F13 PolarHBondContact O-N 3.02Å; F13-C16 PolarHBondContact O-N 2.8Å; F13-T17 HydrophobicContact CD1-CG2 4.33Å; F13-T17 HydrophobicContact CD2-CG2 4.36Å; F13-T17 HydrophobicContact CE1-CG2 3.97Å; F13-T17 HydrophobicContact CE2-CG2 4Å; F13-T17 HydrophobicContact CZ-CG2 3.79Å; F13-T17 WeakPolarHBondContact O-CB 3.19Å; F13-T17 VanDerWaalsContact O-CG2 3.26Å; F13-T17 WeakPolarHBondContact O-CG2 3.44Å; F13-T17 PolarHBondContact O-N 2.77Å; F13-T17 PolarHBondContact O-OG1 2.8Å
14	I	91.3	Very high	89	Confident	81 Å²	81	71.9 Å²	71.9	42%	0.415	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-46.6	177.3	-67	166.5	0	0	0	110.8	V10 F11 T17 V18	V10-I14 HydrophobicContact CG1-CD1 3.82Å; V10-I14 VanDerWaalsContact O-CG1 3.31Å; V10-I14 WeakPolarHBondContact O-CG1 3.31Å; V10-I14 PolarHBondContact O-N 2.84Å; F11-I14 PolarHBondContact O-N 3.13Å; I14-T17 WeakPolarHBondContact CA-OG1 3.36Å; I14-T17 PolarHBondContact O-N 3.09Å; I14-T17 PolarHBondContact O-OG1 3.45Å; I14-V18 HydrophobicContact CG2-CG2 4.44Å; I14-V18 VanDerWaalsContact O-CG2 3.3Å; I14-V18 WeakPolarHBondContact O-CG2 3.46Å; I14-V18 PolarHBondContact O-N 3.31Å
15	F	90.5	Very high	89.6	Confident	106 Å²	106	70.4 Å²	70.4	47%	0.465	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-44.7	178.8	-79.7	-68	0	0	0	112.4	F11 V12 T17 V18 L19 Y152	F11-F15 HydrophobicContact CB-CD2 4.39Å; F11-F15 HydrophobicContact CB-CE2 4.43Å; F11-F15 HydrophobicContact CD1-CE2 4.1Å; F11-F15 WeakPolarHBondContact O-CD2 3.31Å; F11-F15 PolarHBondContact O-N 3.31Å; V12-F15 PolarHBondContact O-N 2.86Å; F15-T17 VanDerWaalsContact C-N 3.33Å; F15-T17 PolarHBondContact O-N 3.31Å; F15-V18 PolarHBondContact O-N 3.32Å; F15-L19 WeakPolarHBondContact O-CB 3.42Å; F15-L19 WeakPolarHBondContact O-CG 3.37Å; F15-L19 PolarHBondContact O-N 3.48Å; F15-Y152 HydrophobicContact CB-CE1 4.43Å
16	C	91.9	Very high	90.2	Very high	6 Å²	6	72.1 Å²	72.1	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-42.3	176.6	-76.8	0	0	0	0	111.8	V12 F13 L20 Y152	V12-C16 VanDerWaalsContact O-CB 3.23Å; V12-C16 WeakPolarHBondContact O-CB 3.49Å; V12-C16 PolarHBondContact O-N 2.96Å; V12-C16 PolarHBondContact O-SG 2.78Å; F13-C16 PolarHBondContact O-N 2.8Å; C16-L20 WeakPolarHBondContact O-CB 3.4Å; C16-L20 PolarHBondContact O-N 2.89Å; C16-Y152 VanDerWaalsContact SG-CD2 3.59Å
17	T	90.7	Very high	90.6	Very high	59 Å²	59	71.2 Å²	71.2	36%	0.362	36%	0.362	S	S	.	.	H	α-helix	trans	-68	-46.1	-179.9	49.8	0	0	0	0	112.1	F13 I14 F15 L20 F21	F13-T17 HydrophobicContact CD1-CG2 4.33Å; F13-T17 HydrophobicContact CD2-CG2 4.36Å; F13-T17 HydrophobicContact CE1-CG2 3.97Å; F13-T17 HydrophobicContact CE2-CG2 4Å; F13-T17 HydrophobicContact CZ-CG2 3.79Å; F13-T17 WeakPolarHBondContact O-CB 3.19Å; F13-T17 VanDerWaalsContact O-CG2 3.26Å; F13-T17 WeakPolarHBondContact O-CG2 3.44Å; F13-T17 PolarHBondContact O-N 2.77Å; F13-T17 PolarHBondContact O-OG1 2.8Å; I14-T17 WeakPolarHBondContact CA-OG1 3.36Å; I14-T17 PolarHBondContact O-N 3.09Å; I14-T17 PolarHBondContact O-OG1 3.45Å; F15-T17 VanDerWaalsContact C-N 3.33Å; F15-T17 PolarHBondContact O-N 3.31Å; T17-L20 PolarHBondContact O-N 3.47Å; T17-F21 WeakPolarHBondContact O-CB 3.42Å; T17-F21 PolarHBondContact O-N 3.46Å
18	V	92.5	Very high	90.7	Very high	91 Å²	91	69.5 Å²	69.5	55%	0.552	35%	0.347	S	S	*	.	H	α-helix	trans	-61.4	-46.9	177.4	172	0	0	0	0	111.3	I14 F15 F21 H22	I14-V18 HydrophobicContact CG2-CG2 4.44Å; I14-V18 VanDerWaalsContact O-CG2 3.3Å; I14-V18 WeakPolarHBondContact O-CG2 3.46Å; I14-V18 PolarHBondContact O-N 3.31Å; F15-V18 PolarHBondContact O-N 3.32Å; V18-F21 PolarHBondContact O-N 3.44Å; V18-H22 WeakPolarHBondContact O-CB 3.36Å; V18-H22 PolarHBondContact O-N 3.11Å
19	L	93.2	Very high	91	Very high	55 Å²	55	74.8 Å²	74.8	29%	0.288	36%	0.363	S	S	.	.	H	α-helix	trans	-69.8	-38.7	-179.6	-74	171.7	0	0	0	112.9	F15 F21 H22 L23 L148 Y152	F15-L19 WeakPolarHBondContact O-CB 3.42Å; F15-L19 WeakPolarHBondContact O-CG 3.37Å; F15-L19 PolarHBondContact O-N 3.48Å; L19-F21 VanDerWaalsContact C-N 3.32Å; L19-F21 PolarHBondContact O-N 3.49Å; L19-H22 PolarHBondContact O-N 3.1Å; L19-L23 WeakPolarHBondContact O-CB 3Å; L19-L23 VanDerWaalsContact O-CG 3.3Å; L19-L23 WeakPolarHBondContact O-CG 3.28Å; L19-L23 PolarHBondContact O-N 2.63Å; L19-L148 HydrophobicContact CB-CD1 3.99Å; L19-L148 HydrophobicContact CB-CD2 4.18Å; L19-L148 HydrophobicContact CD1-CD2 4.18Å; L19-Y152 HydrophobicContact CD1-CE2 3.72Å; L19-Y152 WeakPolarHBondContact CD1-OH 3.31Å
20	L	93.5	Very high	91.2	Very high	20 Å²	20	72.6 Å²	72.6	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-47.3	174	-178.8	68.9	0	0	0	110.1	C16 T17 H22 L23 V24 F103 V141 T144 L145 L148	C16-L20 WeakPolarHBondContact O-CB 3.4Å; C16-L20 PolarHBondContact O-N 2.89Å; T17-L20 PolarHBondContact O-N 3.47Å; L20-H22 PolarHBondContact O-N 3.48Å; L20-L23 PolarHBondContact O-N 2.89Å; L20-V24 HydrophobicContact CD1-CG2 4.06Å; L20-V24 HydrophobicContact CG-CG2 4.28Å; L20-V24 WeakPolarHBondContact O-CB 3.33Å; L20-V24 WeakPolarHBondContact O-CG2 3.46Å; L20-V24 PolarHBondContact O-N 3.21Å; L20-F103 HydrophobicContact CD2-CZ 4.23Å; L20-F103 HydrophobicContact CG-CZ 4.37Å; L20-V141 HydrophobicContact CD1-CG1 4.34Å; L20-T144 HydrophobicContact CD1-CG2 3.91Å; L20-L145 HydrophobicContact CD1-CB 4.07Å; L20-L145 HydrophobicContact CD2-CB 4.28Å; L20-L145 HydrophobicContact CD2-CD1 4.15Å; L20-L148 HydrophobicContact CB-CD1 4.1Å
21	F	92.6	Very high	91.3	Very high	104 Å²	104	69.2 Å²	69.2	46%	0.456	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-44.6	179.1	-167.1	-96.2	0	0	0	111.4	T17 V18 L19 V24 Q25 F103	T17-F21 WeakPolarHBondContact O-CB 3.42Å; T17-F21 PolarHBondContact O-N 3.46Å; V18-F21 PolarHBondContact O-N 3.44Å; L19-F21 VanDerWaalsContact C-N 3.32Å; L19-F21 PolarHBondContact O-N 3.49Å; F21-V24 PolarHBondContact O-N 3.18Å; F21-Q25 HydrophobicContact CD1-CG 3.89Å; F21-Q25 HydrophobicContact CE1-CG 3.62Å; F21-Q25 HydrophobicContact CG-CG 4.48Å; F21-Q25 HydrophobicContact CZ-CG 4Å; F21-Q25 WeakPolarHBondContact O-CB 3.48Å; F21-Q25 VanDerWaalsContact O-CG 3.27Å; F21-Q25 WeakPolarHBondContact O-CG 3.39Å; F21-Q25 PolarHBondContact O-N 3.46Å; F21-F103 HydrophobicContact CD2-CD1 4.43Å; F21-F103 AromaticContact CD2-CE1 3.99Å; F21-F103 HydrophobicContact CD2-CE1 3.99Å
22	H	93.9	Very high	91.4	Very high	115 Å²	115	65.1 Å²	65.1	53%	0.532	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-50.6	176.7	-176.8	69.6	0	0	0	112.5	V18 L19 L20 V24 Q25 Q26	V18-H22 WeakPolarHBondContact O-CB 3.36Å; V18-H22 PolarHBondContact O-N 3.11Å; L19-H22 PolarHBondContact O-N 3.1Å; L20-H22 PolarHBondContact O-N 3.48Å; H22-V24 VanDerWaalsContact C-N 3.35Å; H22-V24 PolarHBondContact O-N 3.26Å; H22-Q25 PolarHBondContact O-N 3.48Å; H22-Q26 WeakPolarHBondContact O-CB 3.45Å; H22-Q26 PolarHBondContact O-N 2.83Å
23	L	93.4	Very high	91.5	Very high	55 Å²	55	67 Å²	67	29%	0.288	33%	0.33	S	S	.	.	H	α-helix	trans	-65.6	-37.3	-179.1	-71.9	169.2	0	0	0	112.2	L19 L20 N27 T144 L148	L19-L23 WeakPolarHBondContact O-CB 3Å; L19-L23 VanDerWaalsContact O-CG 3.3Å; L19-L23 WeakPolarHBondContact O-CG 3.28Å; L19-L23 PolarHBondContact O-N 2.63Å; L20-L23 PolarHBondContact O-N 2.89Å; L23-N27 WeakPolarHBondContact O-CB 3.16Å; L23-N27 PolarHBondContact O-N 2.88Å; L23-T144 HydrophobicContact CB-CG2 4.09Å; L23-T144 HydrophobicContact CD1-CG2 3.44Å; L23-T144 VanDerWaalsContact CD1-CG2 3.44Å; L23-T144 HydrophobicContact CG-CG2 4.41Å; L23-L148 HydrophobicContact CD1-CD1 4.28Å; L23-L148 HydrophobicContact CD1-CD2 4.5Å
24	V	92.2	Very high	91.4	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-43.5	176.9	176.1	0	0	0	0	110.8	L20 F21 H22 Q26 N27 R28 F103 F140 V141	L20-V24 HydrophobicContact CD1-CG2 4.06Å; L20-V24 HydrophobicContact CG-CG2 4.28Å; L20-V24 WeakPolarHBondContact O-CB 3.33Å; L20-V24 WeakPolarHBondContact O-CG2 3.46Å; L20-V24 PolarHBondContact O-N 3.21Å; F21-V24 PolarHBondContact O-N 3.18Å; H22-V24 VanDerWaalsContact C-N 3.35Å; H22-V24 PolarHBondContact O-N 3.26Å; V24-Q26 VanDerWaalsContact C-N 3.33Å; V24-Q26 PolarHBondContact O-N 3.31Å; V24-N27 PolarHBondContact O-N 3.33Å; V24-R28 HydrophobicContact CG1-CG 4.4Å; V24-R28 WeakPolarHBondContact O-CG 3.44Å; V24-R28 PolarHBondContact O-N 3.48Å; V24-F103 HydrophobicContact CB-CD1 3.94Å; V24-F103 HydrophobicContact CB-CE1 3.84Å; V24-F103 HydrophobicContact CG1-CB 4.13Å; V24-F103 HydrophobicContact CG1-CD1 3.33Å; V24-F103 HydrophobicContact CG1-CE1 3.75Å; V24-F103 HydrophobicContact CG1-CG 3.77Å; V24-F103 HydrophobicContact CG2-CD1 4.47Å; V24-F103 HydrophobicContact CG2-CE1 4.05Å; V24-F103 HydrophobicContact CG2-CZ 4.29Å; V24-F140 HydrophobicContact CG2-CD1 4.44Å; V24-F140 HydrophobicContact CG2-CE1 4.35Å; V24-V141 HydrophobicContact CG1-CG2 4.05Å; V24-V141 HydrophobicContact CG2-CB 4.39Å; V24-V141 HydrophobicContact CG2-CG2 3.62Å
25	Q	90.8	Very high	91.4	Very high	62 Å²	62	60.8 Å²	60.8	29%	0.29	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-40.6	175.2	-70.6	-65.5	2.8	0	0	111.9	F21 H22 N27 R28 Y29	F21-Q25 HydrophobicContact CD1-CG 3.89Å; F21-Q25 HydrophobicContact CE1-CG 3.62Å; F21-Q25 HydrophobicContact CG-CG 4.48Å; F21-Q25 HydrophobicContact CZ-CG 4Å; F21-Q25 WeakPolarHBondContact O-CB 3.48Å; F21-Q25 VanDerWaalsContact O-CG 3.27Å; F21-Q25 WeakPolarHBondContact O-CG 3.39Å; F21-Q25 PolarHBondContact O-N 3.46Å; H22-Q25 PolarHBondContact O-N 3.48Å; Q25-N27 PolarHBondContact O-N 3.01Å; Q25-R28 PolarHBondContact O-N 3.39Å; Q25-Y29 WeakPolarHBondContact O-CB 3.5Å; Q25-Y29 PolarHBondContact O-N 2.89Å
26	Q	92.2	Very high	91.3	Very high	98 Å²	98	59.2 Å²	59.2	46%	0.458	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-43.8	174.2	-171.7	178.8	7.2	0	0	111.6	H22 V24 Y29 N30	H22-Q26 WeakPolarHBondContact O-CB 3.45Å; H22-Q26 PolarHBondContact O-N 2.83Å; V24-Q26 VanDerWaalsContact C-N 3.33Å; V24-Q26 PolarHBondContact O-N 3.31Å; Q26-Y29 PolarHBondContact O-N 2.96Å; Q26-N30 VanDerWaalsContact O-CG 3.23Å; Q26-N30 PolarHBondContact O-N 3.45Å; Q26-N30 PolarHBondContact O-ND2 2.99Å
27	N	90.9	Very high	91.2	Very high	35 Å²	35	62.8 Å²	62.8	19%	0.187	32%	0.32	C	S	.	.	H	α-helix	trans	-67.5	-37	177.1	-167.2	32.6	0	0	0	112.5	L23 V24 Q25 N30 T31 M137 F140	L23-N27 WeakPolarHBondContact O-CB 3.16Å; L23-N27 PolarHBondContact O-N 2.88Å; V24-N27 PolarHBondContact O-N 3.33Å; Q25-N27 PolarHBondContact O-N 3.01Å; N27-N30 PolarHBondContact O-N 2.94Å; N27-T31 WeakPolarHBondContact O-CB 3.28Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 PolarHBondContact O-OG1 2.87Å; N27-M137 HydrophobicContact CB-CE 4.41Å; N27-M137 HydrophobicContact CB-SD 4.18Å; N27-M137 PolarHBondContact ND2-SD 3.28Å; N27-F140 HydrophobicContact CB-CD1 3.99Å; N27-F140 HydrophobicContact CB-CE1 3.6Å; N27-F140 HydrophobicContact CB-CZ 3.92Å; N27-F140 VanDerWaalsContact ND2-CD1 3.28Å; N27-F140 WeakPolarHBondContact ND2-CD1 3.35Å; N27-F140 VanDerWaalsContact ND2-CG 3.27Å; N27-F140 WeakPolarHBondContact ND2-CG 3.44Å
28	R	90.5	Very high	91.1	Very high	38 Å²	38	61.4 Å²	61.4	14%	0.143	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-48.1	173.1	-74.6	-179.8	72.6	-149.7	8.3	111.3	V24 Q25 N30 T31 A32 F103 E104 V107 M137	V24-R28 HydrophobicContact CG1-CG 4.4Å; V24-R28 WeakPolarHBondContact O-CG 3.44Å; V24-R28 PolarHBondContact O-N 3.48Å; Q25-R28 PolarHBondContact O-N 3.39Å; R28-N30 PolarHBondContact O-N 3.03Å; R28-T31 WeakPolarHBondContact O-CB 3.49Å; R28-T31 PolarHBondContact O-N 2.87Å; R28-A32 WeakPolarHBondContact O-CB 3.33Å; R28-A32 PolarHBondContact O-N 2.87Å; R28-F103 WeakPolarHBondContact CD-O 3.37Å; R28-F103 VanDerWaalsContact CZ-O 3.31Å; R28-F103 PolarHBondContact NE-O 2.91Å; R28-F103 VanDerWaalsContact NE-O 3.1Å; R28-E104 IonicContact CZ-OE2 3.59Å; R28-E104 IonicContact NH1-OE2 3.59Å; R28-E104 PolarHBondContact NH1-OE2 2.9Å; R28-E104 VanDerWaalsContact NH1-OE2 3.15Å; R28-E104 PolarHBondContact NH2-O 3.41Å; R28-E104 IonicContact NH2-OE2 3.15Å; R28-E104 PolarHBondContact NH2-OE2 3.36Å; R28-V107 HydrophobicContact CB-CG2 4.25Å; R28-V107 HydrophobicContact CG-CG2 3.93Å; R28-M137 HydrophobicContact CB-CE 4.46Å; R28-M137 HydrophobicContact CG-CE 3.9Å; R28-M137 HydrophobicContact CG-SD 4.4Å
29	Y	90.6	Very high	90.9	Very high	167 Å²	167	57.1 Å²	57.1	66%	0.655	28%	0.284	S	S	*	.	H	α-helix	trans	-59.3	-45.9	177.5	-179.4	-95.7	0	0	0	111.9	Q25 Q26 T31 A32 T33	Q25-Y29 WeakPolarHBondContact O-CB 3.5Å; Q25-Y29 PolarHBondContact O-N 2.89Å; Q26-Y29 PolarHBondContact O-N 2.96Å; Y29-T31 VanDerWaalsContact C-N 3.32Å; Y29-T31 PolarHBondContact O-N 2.87Å; Y29-A32 PolarHBondContact O-N 2.77Å; Y29-T33 WeakPolarHBondContact O-CB 3.46Å; Y29-T33 PolarHBondContact O-N 3.1Å; Y29-T33 PolarHBondContact O-OG1 3.44Å
30	N	90.5	Very high	90.6	Very high	73 Å²	73	61.1 Å²	61.1	39%	0.39	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-40.9	175.8	-69.6	-17.4	0	0	0	111.9	Q26 N27 R28 T33 Q34	Q26-N30 VanDerWaalsContact O-CG 3.23Å; Q26-N30 PolarHBondContact O-N 3.45Å; Q26-N30 PolarHBondContact O-ND2 2.99Å; N27-N30 PolarHBondContact O-N 2.94Å; R28-N30 PolarHBondContact O-N 3.03Å; N30-T33 PolarHBondContact O-N 3.21Å; N30-Q34 WeakPolarHBondContact O-CG 3.44Å; N30-Q34 PolarHBondContact O-N 3.06Å
31	T	90.6	Very high	90.3	Very high	11 Å²	11	64.2 Å²	64.2	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-44.8	177.7	-56.9	0	0	0	0	111.2	N27 R28 Y29 T33 Q34 L35 V70 V107 A132	N27-T31 WeakPolarHBondContact O-CB 3.28Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 PolarHBondContact O-OG1 2.87Å; R28-T31 WeakPolarHBondContact O-CB 3.49Å; R28-T31 PolarHBondContact O-N 2.87Å; Y29-T31 VanDerWaalsContact C-N 3.32Å; Y29-T31 PolarHBondContact O-N 2.87Å; T31-T33 VanDerWaalsContact C-N 3.35Å; T31-T33 PolarHBondContact O-N 2.87Å; T31-Q34 PolarHBondContact O-N 2.94Å; T31-L35 WeakPolarHBondContact O-CG 3.38Å; T31-L35 PolarHBondContact O-N 2.91Å; T31-V70 HydrophobicContact CG2-CG1 3.94Å; T31-V107 HydrophobicContact CG2-CB 4.43Å; T31-V107 HydrophobicContact CG2-CG1 4.39Å; T31-A132 HydrophobicContact CG2-CB 3.56Å
32	A	90.1	Very high	90.1	Very high	28 Å²	28	59.7 Å²	59.7	23%	0.231	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-43.4	177.4	0	0	0	0	0	111.6	R28 Y29 Q34 L35 E36 V107 I109	R28-A32 WeakPolarHBondContact O-CB 3.33Å; R28-A32 PolarHBondContact O-N 2.87Å; Y29-A32 PolarHBondContact O-N 2.77Å; A32-Q34 VanDerWaalsContact C-N 3.34Å; A32-Q34 PolarHBondContact O-N 3.15Å; A32-L35 PolarHBondContact O-N 3.41Å; A32-E36 WeakPolarHBondContact O-CB 3.25Å; A32-E36 PolarHBondContact O-N 3.04Å; A32-V107 HydrophobicContact CB-CG1 4.04Å; A32-I109 HydrophobicContact CB-CG2 4.39Å
33	T	89.6	Confident	89.7	Confident	64 Å²	64	57.9 Å²	57.9	39%	0.393	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-40.6	176.2	-52.8	0	0	0	0	111.7	Y29 N30 T31 E36 S37	Y29-T33 WeakPolarHBondContact O-CB 3.46Å; Y29-T33 PolarHBondContact O-N 3.1Å; Y29-T33 PolarHBondContact O-OG1 3.44Å; N30-T33 PolarHBondContact O-N 3.21Å; T31-T33 VanDerWaalsContact C-N 3.35Å; T31-T33 PolarHBondContact O-N 2.87Å; T33-E36 PolarHBondContact O-N 3.35Å; T33-S37 PolarHBondContact O-N 3.05Å
34	Q	89.1	Confident	89.3	Confident	89 Å²	89	61.4 Å²	61.4	42%	0.416	30%	0.303	S	S	.	.	H	α-helix	trans	-64.3	-45.9	174.8	-76	176.5	1.4	0	0	112.1	N30 T31 A32 E36 S37 I38	N30-Q34 WeakPolarHBondContact O-CG 3.44Å; N30-Q34 PolarHBondContact O-N 3.06Å; T31-Q34 PolarHBondContact O-N 2.94Å; A32-Q34 VanDerWaalsContact C-N 3.34Å; A32-Q34 PolarHBondContact O-N 3.15Å; Q34-E36 VanDerWaalsContact C-N 3.25Å; Q34-E36 PolarHBondContact O-N 3.32Å; Q34-S37 PolarHBondContact O-N 2.99Å; Q34-I38 WeakPolarHBondContact O-CG1 3.46Å; Q34-I38 PolarHBondContact O-N 3.32Å; Q34-I38 VanDerWaalsContact O-N 3.11Å
35	L	90	Very high	89	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-41.4	175.2	-68.1	179.7	0	0	0	110.7	T31 A32 S37 I38 A39 V70 V71 V107 I109 L130 A132	T31-L35 WeakPolarHBondContact O-CG 3.38Å; T31-L35 PolarHBondContact O-N 2.91Å; A32-L35 PolarHBondContact O-N 3.41Å; L35-S37 PolarHBondContact O-N 3.42Å; L35-I38 PolarHBondContact O-N 3.14Å; L35-I38 VanDerWaalsContact O-N 3.16Å; L35-A39 WeakPolarHBondContact O-CB 3.3Å; L35-A39 PolarHBondContact O-N 3.4Å; L35-V70 HydrophobicContact CD2-CG1 4.04Å; L35-V70 HydrophobicContact CG-CG1 4.48Å; L35-V71 HydrophobicContact CD2-CG2 3.73Å; L35-V107 HydrophobicContact CD1-CG1 4.39Å; L35-I109 HydrophobicContact CB-CD1 3.55Å; L35-I109 HydrophobicContact CB-CG1 3.73Å; L35-I109 HydrophobicContact CB-CG2 4.33Å; L35-I109 HydrophobicContact CD1-CG1 4.23Å; L35-I109 HydrophobicContact CD1-CG2 4.4Å; L35-I109 WeakPolarHBondContact O-CD1 3.36Å; L35-L130 HydrophobicContact CD2-CB 4.21Å; L35-A132 HydrophobicContact CD1-CB 4.05Å
36	E	89.8	Confident	88.8	Confident	74 Å²	74	61.4 Å²	61.4	35%	0.346	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-41	-177.8	-169.7	178	-169.7	0	0	111.5	A32 T33 Q34 I38 A39 R40 I109	A32-E36 WeakPolarHBondContact O-CB 3.25Å; A32-E36 PolarHBondContact O-N 3.04Å; T33-E36 PolarHBondContact O-N 3.35Å; Q34-E36 VanDerWaalsContact C-N 3.25Å; Q34-E36 PolarHBondContact O-N 3.32Å; E36-I38 VanDerWaalsContact C-N 3.31Å; E36-I38 PolarHBondContact O-N 2.64Å; E36-A39 PolarHBondContact O-N 3.5Å; E36-R40 WeakPolarHBondContact O-CB 3.18Å; E36-R40 WeakPolarHBondContact O-CG 3.38Å; E36-R40 PolarHBondContact O-N 3.44Å; E36-R40 IonicContact OE1-CZ 2.77Å; E36-R40 IonicContact OE1-NE 3.78Å; E36-R40 IonicContact OE1-NH2 3.31Å; E36-R40 PolarHBondContact OE1-NH2 3.47Å; E36-R40 IonicContact OE2-NH2 3.32Å; E36-I109 VanDerWaalsContact CA-CD1 3.4Å; E36-I109 HydrophobicContact CB-CD1 4.09Å; E36-I109 VanDerWaalsContact N-CD1 3.3Å
37	S	88.6	Confident	88.5	Confident	80 Å²	80	57 Å²	57	56%	0.559	29%	0.289	S	S	*	.	H	α-helix	trans	-59.3	-41.6	172.5	-171.5	0	0	0	0	112.1	T33 Q34 L35 S41	T33-S37 PolarHBondContact O-N 3.05Å; Q34-S37 PolarHBondContact O-N 2.99Å; L35-S37 PolarHBondContact O-N 3.42Å; S37-S41 PolarHBondContact O-N 3.32Å
38	I	88.7	Confident	88.2	Confident	31 Å²	31	57.1 Å²	57.1	16%	0.159	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-42.8	178.2	-65.5	166.9	0	0	0	111	Q34 L35 E36 R40 S41 V42 I65 V71 L130	Q34-I38 WeakPolarHBondContact O-CG1 3.46Å; Q34-I38 PolarHBondContact O-N 3.32Å; Q34-I38 VanDerWaalsContact O-N 3.11Å; L35-I38 PolarHBondContact O-N 3.14Å; L35-I38 VanDerWaalsContact O-N 3.16Å; E36-I38 VanDerWaalsContact C-N 3.31Å; E36-I38 PolarHBondContact O-N 2.64Å; I38-R40 VanDerWaalsContact C-N 3.32Å; I38-R40 PolarHBondContact O-N 2.96Å; I38-S41 PolarHBondContact O-N 2.98Å; I38-S41 PolarHBondContact O-OG 2.9Å; I38-V42 VanDerWaalsContact O-CG2 3.32Å; I38-V42 WeakPolarHBondContact O-CG2 3.34Å; I38-V42 PolarHBondContact O-N 3.47Å; I38-I65 HydrophobicContact CG2-CG2 3.61Å; I38-V71 HydrophobicContact CD1-CG2 3.77Å; I38-V71 HydrophobicContact CG2-CG2 4.35Å; I38-L130 HydrophobicContact CB-CD1 4.22Å; I38-L130 HydrophobicContact CG2-CD1 3.95Å
39	A	88.2	Confident	87.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-42.2	178.3	0	0	0	0	0	111.1	L35 E36 S41 V42 R43 I109 L111 L128 L130	L35-A39 WeakPolarHBondContact O-CB 3.3Å; L35-A39 PolarHBondContact O-N 3.4Å; E36-A39 PolarHBondContact O-N 3.5Å; A39-S41 PolarHBondContact O-N 3.44Å; A39-V42 PolarHBondContact O-N 3.22Å; A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 PolarHBondContact O-N 3.34Å; A39-I109 HydrophobicContact CB-CD1 3.83Å; A39-L111 HydrophobicContact CB-CB 4.15Å; A39-L111 HydrophobicContact CB-CD2 3.65Å; A39-L128 HydrophobicContact CB-CD2 4.12Å; A39-L130 HydrophobicContact CB-CD1 3.72Å; A39-L130 HydrophobicContact CB-CG 4.35Å
40	R	87.1	Confident	87.5	Confident	140 Å²	140	49.2 Å²	49.2	53%	0.528	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-37.5	177.6	-72.7	177.7	-169.1	165.1	0.9	112.8	E36 I38 V42 R43 L111	E36-R40 WeakPolarHBondContact O-CB 3.18Å; E36-R40 WeakPolarHBondContact O-CG 3.38Å; E36-R40 PolarHBondContact O-N 3.44Å; E36-R40 IonicContact OE1-CZ 2.77Å; E36-R40 IonicContact OE1-NE 3.78Å; E36-R40 IonicContact OE1-NH2 3.31Å; E36-R40 PolarHBondContact OE1-NH2 3.47Å; E36-R40 IonicContact OE2-NH2 3.32Å; I38-R40 VanDerWaalsContact C-N 3.32Å; I38-R40 PolarHBondContact O-N 2.96Å; R40-V42 PolarHBondContact O-N 3.43Å; R40-R43 PolarHBondContact O-N 3.39Å; R40-L111 HydrophobicContact CG-CD2 4.14Å
41	S	87.7	Confident	87.2	Confident	84 Å²	84	49.9 Å²	49.9	59%	0.587	27%	0.267	S	S	*	.	H	α-helix	trans	-68.9	-22.2	180	62.5	0	0	0	0	113.8	S37 I38 A39	S37-S41 PolarHBondContact O-N 3.32Å; I38-S41 PolarHBondContact O-N 2.98Å; I38-S41 PolarHBondContact O-OG 2.9Å; A39-S41 PolarHBondContact O-N 3.44Å
42	V	87.2	Confident	86.7	Confident	10 Å²	10	56 Å²	56	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-104.7	-16.5	-176.3	-171	0	0	0	0	111.3	I38 A39 R40 E44 P45 L46 I61 I65	I38-V42 VanDerWaalsContact O-CG2 3.32Å; I38-V42 WeakPolarHBondContact O-CG2 3.34Å; I38-V42 PolarHBondContact O-N 3.47Å; A39-V42 PolarHBondContact O-N 3.22Å; R40-V42 PolarHBondContact O-N 3.43Å; V42-E44 PolarHBondContact O-N 3.34Å; V42-P45 WeakPolarHBondContact O-CD 3.42Å; V42-L46 HydrophobicContact CG1-CB 4.38Å; V42-L46 WeakPolarHBondContact O-CB 3.27Å; V42-L46 PolarHBondContact O-N 3.16Å; V42-I61 HydrophobicContact CG1-CG2 3.32Å; V42-I65 HydrophobicContact CG1-CD1 4.32Å; V42-I65 HydrophobicContact CG1-CG1 4.29Å; V42-I65 HydrophobicContact CG2-CD1 4.11Å; V42-I65 HydrophobicContact CG2-CG1 3.74Å
43	R	85.6	Confident	86.1	Confident	77 Å²	77	57.2 Å²	57.2	29%	0.291	31%	0.308	S	S	.	.	H	α-helix	trans	-53.9	-50.1	-174.4	-174.6	-176.4	66.4	-179.4	3.3	113	A39 R40 S47 L111	A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 PolarHBondContact O-N 3.34Å; R40-R43 PolarHBondContact O-N 3.39Å; R43-S47 WeakPolarHBondContact O-CB 3.45Å; R43-S47 PolarHBondContact O-N 3.48Å; R43-S47 PolarHBondContact O-OG 3.26Å; R43-L111 HydrophobicContact CB-CD2 4.2Å; R43-L111 HydrophobicContact CG-CD2 4.28Å
44	E	84.9	Confident	85.9	Confident	128 Å²	128	57.3 Å²	57.3	60%	0.598	31%	0.306	S	S	*	.	H	α-helix	trans	-67.1	-52.6	-176.4	-83.4	171.8	-159.2	0	0	112.9	V42 L46 S47 S48	V42-E44 PolarHBondContact O-N 3.34Å; E44-L46 VanDerWaalsContact C-N 3.28Å; E44-L46 PolarHBondContact O-N 2.9Å; E44-S47 WeakPolarHBondContact O-CB 3.34Å; E44-S47 PolarHBondContact O-N 2.82Å; E44-S48 PolarHBondContact O-N 2.83Å; E44-S48 VanDerWaalsContact O-N 3.1Å
45	P	86.8	Confident	85.6	Confident	62 Å²	62	58 Å²	58	40%	0.403	31%	0.312	S	S	.	.	H	α-helix	trans	-54.2	-45.2	173.5	-26.5	32.5	0	0	0	112.6	V42 S47 S48 A49 I61	V42-P45 WeakPolarHBondContact O-CD 3.42Å; P45-S47 PolarHBondContact O-N 3.47Å; P45-S48 WeakPolarHBondContact O-CB 3.32Å; P45-S48 PolarHBondContact O-N 3.37Å; P45-A49 PolarHBondContact O-N 3.38Å; P45-I61 HydrophobicContact CB-CD1 3.79Å; P45-I61 HydrophobicContact CB-CG1 4.25Å; P45-I61 HydrophobicContact CB-CG2 4.04Å; P45-I61 WeakPolarHBondContact O-CD1 3.49Å
46	L	86.5	Confident	85.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-66.9	-37.7	-178.3	-172.2	67.3	0	0	0	112	V42 E44 S48 A49 I50 A58 I61 L62 V76 V113 L128	V42-L46 HydrophobicContact CG1-CB 4.38Å; V42-L46 WeakPolarHBondContact O-CB 3.27Å; V42-L46 PolarHBondContact O-N 3.16Å; E44-L46 VanDerWaalsContact C-N 3.28Å; E44-L46 PolarHBondContact O-N 2.9Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-S48 PolarHBondContact O-N 3.33Å; L46-A49 PolarHBondContact O-N 2.63Å; L46-I50 HydrophobicContact CD1-CD1 4.14Å; L46-I50 HydrophobicContact CD1-CG1 4.42Å; L46-I50 HydrophobicContact CD2-CD1 4.45Å; L46-I50 HydrophobicContact CG-CD1 3.84Å; L46-I50 HydrophobicContact CG-CG1 4.46Å; L46-I50 WeakPolarHBondContact O-CB 3.29Å; L46-I50 VanDerWaalsContact O-CG1 3.31Å; L46-I50 WeakPolarHBondContact O-CG1 3.41Å; L46-I50 PolarHBondContact O-N 3.44Å; L46-A58 HydrophobicContact CD1-CB 4.09Å; L46-I61 HydrophobicContact CB-CG2 4.14Å; L46-I61 HydrophobicContact CD1-CG2 4.31Å; L46-L62 HydrophobicContact CD1-CD2 4.46Å; L46-L62 HydrophobicContact CD1-CG 4.13Å; L46-L62 HydrophobicContact CD2-CD2 4.38Å; L46-V76 HydrophobicContact CD1-CG2 4.42Å; L46-V76 HydrophobicContact CD2-CG2 4Å; L46-V113 HydrophobicContact CD2-CG2 4.2Å; L46-L128 HydrophobicContact CD2-CB 4.25Å; L46-L128 HydrophobicContact CD2-CD1 3.94Å; L46-L128 HydrophobicContact CD2-CD2 4.15Å; L46-L128 HydrophobicContact CD2-CG 4.34Å
47	S	85.6	Confident	85.2	Confident	7 Å²	7	62.2 Å²	62.2	5%	0.049	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-45.3	174.1	-58	0	0	0	0	111.3	R43 E44 P45 L51 V113 Y114	R43-S47 WeakPolarHBondContact O-CB 3.45Å; R43-S47 PolarHBondContact O-N 3.48Å; R43-S47 PolarHBondContact O-OG 3.26Å; E44-S47 WeakPolarHBondContact O-CB 3.34Å; E44-S47 PolarHBondContact O-N 2.82Å; P45-S47 PolarHBondContact O-N 3.47Å; S47-L51 WeakPolarHBondContact O-CB 3.22Å; S47-L51 WeakPolarHBondContact O-CG 3.41Å; S47-L51 PolarHBondContact O-N 3.34Å; S47-L51 VanDerWaalsContact O-N 3.09Å; S47-V113 WeakPolarHBondContact OG-CG1 3.47Å; S47-Y114 VanDerWaalsContact CB-O 3.31Å; S47-Y114 WeakPolarHBondContact CB-O 3.46Å; S47-Y114 PolarHBondContact OG-O 2.85Å
48	S	84.2	Confident	85	Confident	37 Å²	37	58.5 Å²	58.5	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-46.7	177.4	168.2	0	0	0	0	112	E44 P45 L46 L51 K52	E44-S48 PolarHBondContact O-N 2.83Å; E44-S48 VanDerWaalsContact O-N 3.1Å; P45-S48 WeakPolarHBondContact O-CB 3.32Å; P45-S48 PolarHBondContact O-N 3.37Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-S48 PolarHBondContact O-N 3.33Å; S48-L51 PolarHBondContact O-N 2.85Å; S48-K52 WeakPolarHBondContact O-CG 3.49Å; S48-K52 PolarHBondContact O-N 3.3Å; S48-K52 VanDerWaalsContact O-N 3.15Å
49	A	84.9	Confident	84.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.7	-43.5	-178.2	0	0	0	0	0	112.6	P45 L46 L51 K52 G53 D54 E57 A58 I61	P45-A49 PolarHBondContact O-N 3.38Å; L46-A49 PolarHBondContact O-N 2.63Å; A49-L51 PolarHBondContact O-N 2.92Å; A49-K52 PolarHBondContact O-N 3.48Å; A49-G53 PolarHBondContact O-N 3.18Å; A49-D54 PolarHBondContact O-N 2.87Å; A49-D54 VanDerWaalsContact O-N 3.13Å; A49-E57 HydrophobicContact CB-CB 4.08Å; A49-E57 HydrophobicContact CB-CG 3.92Å; A49-A58 HydrophobicContact CB-CB 3.89Å; A49-I61 HydrophobicContact CB-CD1 3.74Å
50	I	83	Confident	84.8	Confident	38 Å²	38	65.1 Å²	65.1	20%	0.195	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-40.1	177.8	-67.2	171.4	0	0	0	111	L46 K52 G53 A58 V76 V113 I125 A126	L46-I50 HydrophobicContact CD1-CD1 4.14Å; L46-I50 HydrophobicContact CD1-CG1 4.42Å; L46-I50 HydrophobicContact CD2-CD1 4.45Å; L46-I50 HydrophobicContact CG-CD1 3.84Å; L46-I50 HydrophobicContact CG-CG1 4.46Å; L46-I50 WeakPolarHBondContact O-CB 3.29Å; L46-I50 VanDerWaalsContact O-CG1 3.31Å; L46-I50 WeakPolarHBondContact O-CG1 3.41Å; L46-I50 PolarHBondContact O-N 3.44Å; I50-K52 VanDerWaalsContact C-N 3.33Å; I50-K52 PolarHBondContact O-N 3.09Å; I50-G53 PolarHBondContact O-N 3.28Å; I50-G53 VanDerWaalsContact O-N 3.11Å; I50-A58 HydrophobicContact CG1-CB 4.33Å; I50-V76 HydrophobicContact CD1-CG1 3.65Å; I50-V113 HydrophobicContact CD1-CG1 4.32Å; I50-I125 HydrophobicContact CG2-CG2 3.9Å; I50-A126 HydrophobicContact CD1-CB 4.25Å
51	L	82.2	Confident	84.8	Confident	87 Å²	87	59.5 Å²	59.5	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-39.4	176.2	-86.2	172.1	0	0	0	113.1	S47 S48 A49 G53 I125	S47-L51 WeakPolarHBondContact O-CB 3.22Å; S47-L51 WeakPolarHBondContact O-CG 3.41Å; S47-L51 PolarHBondContact O-N 3.34Å; S47-L51 VanDerWaalsContact O-N 3.09Å; S48-L51 PolarHBondContact O-N 2.85Å; A49-L51 PolarHBondContact O-N 2.92Å; L51-G53 PolarHBondContact O-N 3.41Å; L51-I125 HydrophobicContact CD1-CD1 4.39Å; L51-I125 HydrophobicContact CD2-CD1 3.4Å; L51-I125 HydrophobicContact CG-CD1 3.59Å
52	K	82	Confident	84.7	Confident	139 Å²	139	55.6 Å²	55.6	60%	0.604	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.8	177.1	-68.2	175.5	-169.4	171.4	0	113.2	S48 A49 I50 D54 E57	S48-K52 WeakPolarHBondContact O-CG 3.49Å; S48-K52 PolarHBondContact O-N 3.3Å; S48-K52 VanDerWaalsContact O-N 3.15Å; A49-K52 PolarHBondContact O-N 3.48Å; I50-K52 VanDerWaalsContact C-N 3.33Å; I50-K52 PolarHBondContact O-N 3.09Å; K52-D54 HydrophobicContact CB-CB 4.34Å; K52-D54 PolarHBondContact O-N 2.96Å; K52-E57 IonicContact NZ-OE2 2.78Å
53	G	76.7	Confident	84.5	Confident	55 Å²	55	57.4 Å²	57.4	57%	0.567	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	16.2	-170.5	0	0	0	0	0	113.4	A49 I50 L51 I55	A49-G53 PolarHBondContact O-N 3.18Å; I50-G53 PolarHBondContact O-N 3.28Å; I50-G53 VanDerWaalsContact O-N 3.11Å; L51-G53 PolarHBondContact O-N 3.41Å; G53-I55 PolarHBondContact O-N 3.3Å; G53-I55 VanDerWaalsContact O-N 3.09Å
54	D	84.5	Confident	84.5	Confident	65 Å²	65	57.5 Å²	57.5	35%	0.348	34%	0.335	S	S	.	.			trans	-84.1	84	179.7	-165.2	-26.5	0	0	0	109.5	A49 K52 P56 E57 A58	A49-D54 PolarHBondContact O-N 2.87Å; A49-D54 VanDerWaalsContact O-N 3.13Å; K52-D54 HydrophobicContact CB-CB 4.34Å; K52-D54 PolarHBondContact O-N 2.96Å; D54-P56 WeakPolarHBondContact OD1-CD 3.49Å; D54-E57 HydrophobicContact CB-CB 3.83Å; D54-E57 PolarHBondContact O-N 3.5Å; D54-E57 WeakPolarHBondContact OD1-CB 3.41Å; D54-E57 PolarHBondContact OD1-N 2.83Å; D54-A58 WeakPolarHBondContact O-CB 3.28Å; D54-A58 PolarHBondContact O-N 3.42Å
55	I	83.1	Confident	84.4	Confident	104 Å²	104	51.7 Å²	51.7	53%	0.533	31%	0.308	S	S	.	.	H	α-helix	trans	-58.2	-44.7	177.5	-58.1	-176	0	0	0	111.2	G53 E57 A58 E59 L85	G53-I55 PolarHBondContact O-N 3.3Å; G53-I55 VanDerWaalsContact O-N 3.09Å; I55-E57 PolarHBondContact O-N 3.48Å; I55-A58 PolarHBondContact O-N 3.37Å; I55-E59 WeakPolarHBondContact O-CG 3.42Å; I55-E59 PolarHBondContact O-N 3.28Å; I55-L85 HydrophobicContact CG2-CD2 3.8Å
56	P	85.3	Confident	83.7	Confident	93 Å²	93	57.5 Å²	57.5	60%	0.604	33%	0.327	S	S	*	.	H	α-helix	trans	-57.2	-44.3	173.4	-25.7	32.9	0	0	0	114.5	D54 E59 A60	D54-P56 WeakPolarHBondContact OD1-CD 3.49Å; P56-E59 PolarHBondContact O-N 3Å; P56-A60 WeakPolarHBondContact O-CB 3.31Å; P56-A60 PolarHBondContact O-N 2.82Å
57	E	86.6	Confident	82.8	Confident	69 Å²	69	60.2 Å²	60.2	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-43.8	176.9	-172.4	-178.6	-160.8	0	0	110.8	A49 K52 D54 I55 E59 A60 I61	A49-E57 HydrophobicContact CB-CB 4.08Å; A49-E57 HydrophobicContact CB-CG 3.92Å; K52-E57 IonicContact NZ-OE2 2.78Å; D54-E57 HydrophobicContact CB-CB 3.83Å; D54-E57 PolarHBondContact O-N 3.5Å; D54-E57 WeakPolarHBondContact OD1-CB 3.41Å; D54-E57 PolarHBondContact OD1-N 2.83Å; I55-E57 PolarHBondContact O-N 3.48Å; E57-E59 PolarHBondContact O-N 3.43Å; E57-A60 PolarHBondContact O-N 2.9Å; E57-I61 HydrophobicContact CG-CD1 3.98Å; E57-I61 VanDerWaalsContact O-CG1 3.27Å; E57-I61 WeakPolarHBondContact O-CG1 3.49Å; E57-I61 PolarHBondContact O-N 3.35Å
58	A	84.9	Confident	81.9	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.017	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-40.3	177.1	0	0	0	0	0	112.4	L46 A49 I50 D54 I55 I61 L62 L85	L46-A58 HydrophobicContact CD1-CB 4.09Å; A49-A58 HydrophobicContact CB-CB 3.89Å; I50-A58 HydrophobicContact CG1-CB 4.33Å; D54-A58 WeakPolarHBondContact O-CB 3.28Å; D54-A58 PolarHBondContact O-N 3.42Å; I55-A58 PolarHBondContact O-N 3.37Å; A58-I61 PolarHBondContact O-N 3.37Å; A58-L62 WeakPolarHBondContact O-CG 3.46Å; A58-L62 PolarHBondContact O-N 2.87Å; A58-L85 HydrophobicContact CB-CD1 3.62Å
59	E	86.6	Confident	81.3	Confident	110 Å²	110	63.5 Å²	63.5	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-40.7	172.6	-78.4	-171	176.1	0	0	112.5	I55 P56 E57 L62 A63 L85	I55-E59 WeakPolarHBondContact O-CG 3.42Å; I55-E59 PolarHBondContact O-N 3.28Å; P56-E59 PolarHBondContact O-N 3Å; E57-E59 PolarHBondContact O-N 3.43Å; E59-L62 PolarHBondContact O-N 3.33Å; E59-A63 VanDerWaalsContact O-CB 3.31Å; E59-A63 WeakPolarHBondContact O-CB 3.27Å; E59-A63 PolarHBondContact O-N 2.86Å; E59-L85 HydrophobicContact CG-CD1 4.35Å; E59-L85 HydrophobicContact CG-CD2 3.51Å; E59-L85 HydrophobicContact CG-CG 4.5Å
60	A	86	Confident	81.2	Confident	60 Å²	60	63.8 Å²	63.8	50%	0.496	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-40.7	176.7	0	0	0	0	0	111.7	P56 E57 A63 S64	P56-A60 WeakPolarHBondContact O-CB 3.31Å; P56-A60 PolarHBondContact O-N 2.82Å; E57-A60 PolarHBondContact O-N 2.9Å; A60-A63 CarbonylContact O-C 3.55Å; A60-A63 PolarHBondContact O-N 3.32Å; A60-S64 WeakPolarHBondContact O-CB 3.4Å; A60-S64 PolarHBondContact O-N 3.48Å
61	I	85.8	Confident	81.4	Confident	22 Å²	22	62 Å²	62	11%	0.113	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-44.5	175.2	-70.2	165.4	0	0	0	110.7	V42 P45 L46 A49 E57 A58 A63 S64	V42-I61 HydrophobicContact CG1-CG2 3.32Å; P45-I61 HydrophobicContact CB-CD1 3.79Å; P45-I61 HydrophobicContact CB-CG1 4.25Å; P45-I61 HydrophobicContact CB-CG2 4.04Å; P45-I61 WeakPolarHBondContact O-CD1 3.49Å; L46-I61 HydrophobicContact CB-CG2 4.14Å; L46-I61 HydrophobicContact CD1-CG2 4.31Å; A49-I61 HydrophobicContact CB-CD1 3.74Å; E57-I61 HydrophobicContact CG-CD1 3.98Å; E57-I61 VanDerWaalsContact O-CG1 3.27Å; E57-I61 WeakPolarHBondContact O-CG1 3.49Å; E57-I61 PolarHBondContact O-N 3.35Å; A58-I61 PolarHBondContact O-N 3.37Å; I61-A63 VanDerWaalsContact C-N 3.33Å; I61-A63 PolarHBondContact O-N 2.84Å; I61-S64 WeakPolarHBondContact O-CB 3.34Å; I61-S64 PolarHBondContact O-N 2.9Å; I61-S64 PolarHBondContact O-OG 3.38Å
62	L	85.6	Confident	81.6	Confident	2 Å²	2	58 Å²	58	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-41.7	172.7	-74.1	168.5	0	0	0	111.5	L46 A58 E59 S64 I65 A74 V76 L85 K87 F89 L128	L46-L62 HydrophobicContact CD1-CD2 4.46Å; L46-L62 HydrophobicContact CD1-CG 4.13Å; L46-L62 HydrophobicContact CD2-CD2 4.38Å; A58-L62 WeakPolarHBondContact O-CG 3.46Å; A58-L62 PolarHBondContact O-N 2.87Å; E59-L62 PolarHBondContact O-N 3.33Å; L62-S64 VanDerWaalsContact C-N 3.25Å; L62-S64 PolarHBondContact O-N 2.87Å; L62-I65 HydrophobicContact CD2-CD1 4.33Å; L62-I65 WeakPolarHBondContact O-CB 3.35Å; L62-I65 VanDerWaalsContact O-CG1 3.29Å; L62-I65 WeakPolarHBondContact O-CG1 3.34Å; L62-I65 PolarHBondContact O-N 3.24Å; L62-A74 HydrophobicContact CD2-CB 4.01Å; L62-V76 HydrophobicContact CD1-CG2 3.75Å; L62-V76 HydrophobicContact CD2-CG2 4.06Å; L62-V76 HydrophobicContact CG-CG2 4.37Å; L62-L85 HydrophobicContact CD1-CB 3.64Å; L62-L85 HydrophobicContact CD1-CD1 3.74Å; L62-L85 HydrophobicContact CD1-CG 4.32Å; L62-K87 HydrophobicContact CB-CB 4.43Å; L62-F89 WeakPolarHBondContact O-CZ 3.25Å; L62-L128 HydrophobicContact CD2-CD1 3.71Å
63	A	84.3	Confident	81.9	Confident	49 Å²	49	53.4 Å²	53.4	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-67.8	-23.8	176.7	0	0	0	0	0	113.2	E59 A60 I61 I65	E59-A63 VanDerWaalsContact O-CB 3.31Å; E59-A63 WeakPolarHBondContact O-CB 3.27Å; E59-A63 PolarHBondContact O-N 2.86Å; A60-A63 CarbonylContact O-C 3.55Å; A60-A63 PolarHBondContact O-N 3.32Å; I61-A63 VanDerWaalsContact C-N 3.33Å; I61-A63 PolarHBondContact O-N 2.84Å; A63-I65 PolarHBondContact O-N 3.11Å
64	S	84.2	Confident	82.5	Confident	79 Å²	79	50.8 Å²	50.8	55%	0.552	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-15.6	177.5	81.7	0	0	0	0	113.9	A60 I61 L62 K66	A60-S64 WeakPolarHBondContact O-CB 3.4Å; A60-S64 PolarHBondContact O-N 3.48Å; I61-S64 WeakPolarHBondContact O-CB 3.34Å; I61-S64 PolarHBondContact O-N 2.9Å; I61-S64 PolarHBondContact O-OG 3.38Å; L62-S64 VanDerWaalsContact C-N 3.25Å; L62-S64 PolarHBondContact O-N 2.87Å; S64-K66 VanDerWaalsContact C-N 3.35Å; S64-K66 PolarHBondContact O-N 3.05Å
65	I	82.8	Confident	82.7	Confident	6 Å²	6	48 Å²	48	3%	0.031	29%	0.287	C	S	.	.	S	Bend	trans	-61.1	97.9	174	-58.1	-178.8	0	0	0	107.5	I38 V42 L62 A63 P67 V71 A74 F89 L130	I38-I65 HydrophobicContact CG2-CG2 3.61Å; V42-I65 HydrophobicContact CG1-CD1 4.32Å; V42-I65 HydrophobicContact CG1-CG1 4.29Å; V42-I65 HydrophobicContact CG2-CD1 4.11Å; V42-I65 HydrophobicContact CG2-CG1 3.74Å; L62-I65 HydrophobicContact CD2-CD1 4.33Å; L62-I65 WeakPolarHBondContact O-CB 3.35Å; L62-I65 VanDerWaalsContact O-CG1 3.29Å; L62-I65 WeakPolarHBondContact O-CG1 3.34Å; L62-I65 PolarHBondContact O-N 3.24Å; A63-I65 PolarHBondContact O-N 3.11Å; I65-P67 WeakPolarHBondContact O-CD 3.3Å; I65-V71 HydrophobicContact CG2-CG2 4.34Å; I65-A74 HydrophobicContact CD1-CB 4.24Å; I65-F89 HydrophobicContact CB-CE1 4.07Å; I65-F89 HydrophobicContact CB-CZ 3.78Å; I65-F89 HydrophobicContact CD1-CZ 4.41Å; I65-F89 HydrophobicContact CG1-CZ 4.49Å; I65-F89 HydrophobicContact CG2-CZ 4.27Å; I65-F89 VanDerWaalsContact O-CE1 3.28Å; I65-F89 WeakPolarHBondContact O-CE1 3.38Å; I65-L130 HydrophobicContact CD1-CD2 4.24Å
66	K	73.6	Confident	83	Confident	183 Å²	183	43.2 Å²	43.2	80%	0.796	26%	0.262	S	S	*	.			trans	-61.7	113.5	173.4	-76.3	-174	179.4	178.9	0	107.2	S64 A68	S64-K66 VanDerWaalsContact C-N 3.35Å; S64-K66 PolarHBondContact O-N 3.05Å; K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.35Å
67	P	66.3	Low	83	Confident	58 Å²	58	40.2 Å²	40.2	38%	0.377	24%	0.242	S	C	.	.			trans	-70	99.2	174.4	30.4	-31.9	0	0	0	105.7	I65 G69 F89	I65-P67 WeakPolarHBondContact O-CD 3.3Å; P67-G69 PolarHBondContact O-N 3.38Å; P67-F89 HydrophobicContact CB-CB 3.83Å; P67-F89 HydrophobicContact CB-CD1 4.33Å; P67-F89 HydrophobicContact CB-CG 4.18Å; P67-F89 HydrophobicContact CG-CB 4.02Å; P67-F89 HydrophobicContact CG-CD1 4.15Å; P67-F89 HydrophobicContact CG-CG 4.38Å
68	A	67.6	Low	82.8	Confident	79 Å²	79	40 Å²	40	65%	0.653	24%	0.243	S	C	*	.			trans	-68.9	36.3	169	0	0	0	0	0	111.1	K66 V70	K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.35Å; A68-V70 HydrophobicContact CB-CG2 4.43Å; A68-V70 PolarHBondContact O-N 2.82Å
69	G	71.3	Confident	82.5	Confident	33 Å²	33	43.3 Å²	43.3	34%	0.34	26%	0.264	S	S	.	.	S	Bend	trans	65.1	13.6	-170.9	0	0	0	0	0	114.8	P67 R136	P67-G69 PolarHBondContact O-N 3.38Å; G69-R136 WeakPolarHBondContact O-CD 3.26Å; G69-R136 PolarHBondContact O-NH1 3.23Å
70	V	82.2	Confident	82.1	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.042	28%	0.278	C	S	.	.			trans	-100.2	-54.2	-178.8	-165.1	0	0	0	0	111	T31 L35 A68 S72 A132 D133	T31-V70 HydrophobicContact CG2-CG1 3.94Å; L35-V70 HydrophobicContact CD2-CG1 4.04Å; L35-V70 HydrophobicContact CG-CG1 4.48Å; A68-V70 HydrophobicContact CB-CG2 4.43Å; A68-V70 PolarHBondContact O-N 2.82Å; V70-S72 PolarHBondContact O-N 3.02Å; V70-A132 CarbonylContact O-C 3.53Å; V70-A132 VanDerWaalsContact O-CA 3.25Å; V70-A132 WeakPolarHBondContact O-CA 3.31Å; V70-D133 PolarHBondContact O-N 2.88Å
71	V	87.3	Confident	81.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	119	-174.2	-170.6	0	0	0	0	109.5	L35 I38 I65 F89 L130	L35-V71 HydrophobicContact CD2-CG2 3.73Å; I38-V71 HydrophobicContact CD1-CG2 3.77Å; I38-V71 HydrophobicContact CG2-CG2 4.35Å; I65-V71 HydrophobicContact CG2-CG2 4.34Å; V71-F89 HydrophobicContact CB-CD2 4.42Å; V71-F89 HydrophobicContact CG1-CD2 3.9Å; V71-F89 HydrophobicContact CG1-CE2 3.91Å; V71-L130 HydrophobicContact CG1-CD2 4.33Å
72	S	87.2	Confident	81.1	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.028	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-42.7	171.9	170.6	0	0	0	0	111	V70 F89 I90 Q131	V70-S72 PolarHBondContact O-N 3.02Å; S72-F89 PolarHBondContact O-N 3.25Å; S72-I90 PolarHBondContact O-N 3.45Å; S72-Q131 PolarHBondContact N-O 2.93Å
73	R	87.8	Confident	80.4	Confident	42 Å²	42	59.5 Å²	59.5	16%	0.158	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	143.1	-177.2	-159.1	171.6	81.4	-154.7	6.9	111.6	D75 K87 E92 Q131	R73-D75 IonicContact CZ-OD2 3.74Å; R73-D75 IonicContact NE-OD1 2.7Å; R73-D75 PolarHBondContact NE-OD1 2.97Å; R73-D75 IonicContact NE-OD2 3.6Å; R73-D75 PolarHBondContact NE-OD2 3.48Å; R73-D75 IonicContact NH2-OD2 2.69Å; R73-D75 PolarHBondContact NH2-OD2 3.43Å; R73-K87 CarbonylContact C-O 3.49Å; R73-K87 WeakPolarHBondContact CA-O 3.43Å; R73-E92 IonicContact NH1-OE1 3.21Å; R73-E92 PolarHBondContact NH1-OE1 3.47Å; R73-Q131 HydrophobicContact CB-CB 4.3Å; R73-Q131 PolarHBondContact N-O 3.24Å; R73-Q131 PolarHBondContact O-N 3.17Å
74	A	89.6	Confident	80.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.5	167.8	0	0	0	0	0	109	L62 I65 K87 F89 V129 L130	L62-A74 HydrophobicContact CD2-CB 4.01Å; I65-A74 HydrophobicContact CD1-CB 4.24Å; A74-K87 PolarHBondContact N-O 3.01Å; A74-K87 PolarHBondContact O-N 3.26Å; A74-F89 HydrophobicContact CB-CE2 3.72Å; A74-F89 HydrophobicContact CB-CZ 4.26Å; A74-V129 WeakPolarHBondContact CA-O 3.4Å; A74-L130 HydrophobicContact CB-CD2 3.42Å; A74-L130 VanDerWaalsContact CB-CD2 3.42Å
75	D	89.4	Confident	80.1	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.032	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.1	177.5	-60.8	-36.3	0	0	0	109.7	R73 V77 Q83 L85 R86 V129	R73-D75 IonicContact CZ-OD2 3.74Å; R73-D75 IonicContact NE-OD1 2.7Å; R73-D75 PolarHBondContact NE-OD1 2.97Å; R73-D75 IonicContact NE-OD2 3.6Å; R73-D75 PolarHBondContact NE-OD2 3.48Å; R73-D75 IonicContact NH2-OD2 2.69Å; R73-D75 PolarHBondContact NH2-OD2 3.43Å; D75-V77 HydrophobicContact CB-CG2 4.13Å; D75-Q83 PolarHBondContact OD1-NE2 2.91Å; D75-Q83 PolarHBondContact OD2-NE2 2.9Å; D75-L85 WeakPolarHBondContact CA-O 3.26Å; D75-R86 WeakPolarHBondContact OD1-CG 3.49Å; D75-V129 HydrophobicContact CB-CB 4.35Å; D75-V129 PolarHBondContact N-O 3.35Å; D75-V129 PolarHBondContact O-N 3.48Å
76	V	88.1	Confident	80.2	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	116	166.2	178.7	0	0	0	0	107.2	L46 I50 L62 A84 L85 A126 Y127 L128	L46-V76 HydrophobicContact CD1-CG2 4.42Å; L46-V76 HydrophobicContact CD2-CG2 4Å; I50-V76 HydrophobicContact CD1-CG1 3.65Å; L62-V76 HydrophobicContact CD1-CG2 3.75Å; L62-V76 HydrophobicContact CD2-CG2 4.06Å; L62-V76 HydrophobicContact CG-CG2 4.37Å; V76-A84 HydrophobicContact CG1-CB 4.49Å; V76-A84 PolarHBondContact O-N 2.74Å; V76-L85 HydrophobicContact CB-CB 4.03Å; V76-L85 HydrophobicContact CG2-CB 4.22Å; V76-L85 HydrophobicContact CG2-CD1 4.46Å; V76-L85 PolarHBondContact N-O 3.19Å; V76-L85 PolarHBondContact O-N 2.93Å; V76-A126 HydrophobicContact CG1-CB 3.56Å; V76-Y127 WeakPolarHBondContact CA-O 3.49Å; V76-L128 HydrophobicContact CG2-CD1 4.3Å
77	V	85.8	Confident	80.8	Confident	30 Å²	30	59.2 Å²	59.2	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.2	-174.5	-174.9	0	0	0	0	109	D75 A126 Y127 V129	D75-V77 HydrophobicContact CB-CG2 4.13Å; V77-A126 CarbonylContact O-C 3.5Å; V77-A126 WeakPolarHBondContact O-CA 3.27Å; V77-Y127 PolarHBondContact N-O 3.37Å; V77-Y127 PolarHBondContact O-N 3.46Å; V77-V129 HydrophobicContact CG2-CG2 3.98Å
78	L	82.2	Confident	81.7	Confident	64 Å²	64	60.3 Å²	60.3	34%	0.335	33%	0.326	S	S	.	.			trans	-73	160.2	176.1	-69.1	164	0	0	0	110.7	N80 Q81 F82 A84 I125 A126	L78-N80 PolarHBondContact O-N 2.86Å; L78-Q81 WeakPolarHBondContact O-CA 3.43Å; L78-Q81 PolarHBondContact O-N 2.95Å; L78-F82 HydrophobicContact CD1-CB 4.43Å; L78-F82 PolarHBondContact N-O 3.46Å; L78-A84 HydrophobicContact CD1-CB 4.14Å; L78-A84 HydrophobicContact CG-CB 4.11Å; L78-I125 WeakPolarHBondContact CD2-O 3.28Å; L78-A126 HydrophobicContact CD2-CB 4.33Å
79	P	77.9	Confident	82.6	Confident	72 Å²	72	58.6 Å²	58.6	47%	0.468	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.8	177.6	-28.2	34.6	0	0	0	114	Q81 P124 I125	P79-Q81 PolarHBondContact O-N 3.22Å; P79-Q81 VanDerWaalsContact O-N 3.15Å; P79-P124 WeakPolarHBondContact CG-O 3.13Å; P79-I125 WeakPolarHBondContact CD-O 3.31Å
80	N	79.2	Confident	83.1	Confident	150 Å²	150	59 Å²	59	80%	0.802	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	16.7	175.8	-63.1	0.5	0	0	0	113.5	L78 F82	L78-N80 PolarHBondContact O-N 2.86Å; N80-F82 PolarHBondContact O-N 2.84Å
81	Q	72	Confident	83	Confident	175 Å²	175	63.5 Å²	63.5	82%	0.818	33%	0.328	S	S	*	.	S	Bend	trans	59.9	9.7	-174.9	-56.6	-173.4	-6.9	0	0	115.2	L78 P79 Q83	L78-Q81 WeakPolarHBondContact O-CA 3.43Å; L78-Q81 PolarHBondContact O-N 2.95Å; P79-Q81 PolarHBondContact O-N 3.22Å; P79-Q81 VanDerWaalsContact O-N 3.15Å; Q81-Q83 PolarHBondContact O-N 3.38Å
82	F	78.3	Confident	82.6	Confident	146 Å²	146	69.5 Å²	69.5	64%	0.64	36%	0.356	S	S	*	.			trans	-76.4	126.9	176.5	-162	-90.7	0	0	0	109.9	L78 N80 A84	L78-F82 HydrophobicContact CD1-CB 4.43Å; L78-F82 PolarHBondContact N-O 3.46Å; N80-F82 PolarHBondContact O-N 2.84Å; F82-A84 PolarHBondContact O-N 2.97Å
83	Q	71.6	Confident	82.5	Confident	64 Å²	64	76 Å²	76	30%	0.299	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.5	177.7	-175.8	164.8	14.3	0	0	109.7	D75 Q81	D75-Q83 PolarHBondContact OD1-NE2 2.91Å; D75-Q83 PolarHBondContact OD2-NE2 2.9Å; Q81-Q83 PolarHBondContact O-N 3.38Å
84	A	76.9	Confident	82.4	Confident	48 Å²	48	79.9 Å²	79.9	40%	0.397	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-42.1	-176.5	0	0	0	0	0	112.5	V76 L78 F82	V76-A84 HydrophobicContact CG1-CB 4.49Å; V76-A84 PolarHBondContact O-N 2.74Å; L78-A84 HydrophobicContact CD1-CB 4.14Å; L78-A84 HydrophobicContact CG-CB 4.11Å; F82-A84 PolarHBondContact O-N 2.97Å
85	L	84.4	Confident	82.3	Confident	17 Å²	17	81 Å²	81	9%	0.089	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147.7	178	-66.4	172	0	0	0	110.5	I55 A58 E59 L62 D75 V76	I55-L85 HydrophobicContact CG2-CD2 3.8Å; A58-L85 HydrophobicContact CB-CD1 3.62Å; E59-L85 HydrophobicContact CG-CD1 4.35Å; E59-L85 HydrophobicContact CG-CD2 3.51Å; E59-L85 HydrophobicContact CG-CG 4.5Å; L62-L85 HydrophobicContact CD1-CB 3.64Å; L62-L85 HydrophobicContact CD1-CD1 3.74Å; L62-L85 HydrophobicContact CD1-CG 4.32Å; D75-L85 WeakPolarHBondContact CA-O 3.26Å; V76-L85 HydrophobicContact CB-CB 4.03Å; V76-L85 HydrophobicContact CG2-CB 4.22Å; V76-L85 HydrophobicContact CG2-CD1 4.46Å; V76-L85 PolarHBondContact N-O 3.19Å; V76-L85 PolarHBondContact O-N 2.93Å
86	R	85.1	Confident	82.3	Confident	152 Å²	152	83.5 Å²	83.5	57%	0.574	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	126	176.9	179.2	179.2	-71.8	-159.9	-1.2	109.8	D75	D75-R86 WeakPolarHBondContact OD1-CG 3.49Å
87	K	86.8	Confident	82.2	Confident	93 Å²	93	87.8 Å²	87.8	40%	0.404	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.8	167.9	-168.4	67.3	174.9	-174.5	0	110.8	L62 R73 A74 F89	L62-K87 HydrophobicContact CB-CB 4.43Å; R73-K87 CarbonylContact C-O 3.49Å; R73-K87 WeakPolarHBondContact CA-O 3.43Å; A74-K87 PolarHBondContact N-O 3.01Å; A74-K87 PolarHBondContact O-N 3.26Å; K87-F89 HydrophobicContact CB-CE2 4.38Å; K87-F89 HydrophobicContact CB-CZ 4.22Å; K87-F89 HydrophobicContact CG-CD1 4.49Å; K87-F89 HydrophobicContact CG-CE1 3.96Å; K87-F89 HydrophobicContact CG-CE2 4.25Å; K87-F89 HydrophobicContact CG-CZ 3.81Å
88	S	84.8	Confident	82.2	Confident	82 Å²	82	94.3 Å²	94.3	57%	0.573	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	127.6	169.5	56	0	0	0	0	110
89	F	85.8	Confident	82.4	Confident	43 Å²	43	92.4 Å²	92.4	19%	0.189	48%	0.481	C	S	.	.	S	Bend	trans	-99.5	-32.7	179.1	-58	-86	0	0	0	112.5	L62 I65 P67 V71 S72 A74 K87	L62-F89 WeakPolarHBondContact O-CZ 3.25Å; I65-F89 HydrophobicContact CB-CE1 4.07Å; I65-F89 HydrophobicContact CB-CZ 3.78Å; I65-F89 HydrophobicContact CD1-CZ 4.41Å; I65-F89 HydrophobicContact CG1-CZ 4.49Å; I65-F89 HydrophobicContact CG2-CZ 4.27Å; I65-F89 VanDerWaalsContact O-CE1 3.28Å; I65-F89 WeakPolarHBondContact O-CE1 3.38Å; P67-F89 HydrophobicContact CB-CB 3.83Å; P67-F89 HydrophobicContact CB-CD1 4.33Å; P67-F89 HydrophobicContact CB-CG 4.18Å; P67-F89 HydrophobicContact CG-CB 4.02Å; P67-F89 HydrophobicContact CG-CD1 4.15Å; P67-F89 HydrophobicContact CG-CG 4.38Å; V71-F89 HydrophobicContact CB-CD2 4.42Å; V71-F89 HydrophobicContact CG1-CD2 3.9Å; V71-F89 HydrophobicContact CG1-CE2 3.91Å; S72-F89 PolarHBondContact O-N 3.25Å; A74-F89 HydrophobicContact CB-CE2 3.72Å; A74-F89 HydrophobicContact CB-CZ 4.26Å; K87-F89 HydrophobicContact CB-CE2 4.38Å; K87-F89 HydrophobicContact CB-CZ 4.22Å; K87-F89 HydrophobicContact CG-CD1 4.49Å; K87-F89 HydrophobicContact CG-CE1 3.96Å; K87-F89 HydrophobicContact CG-CE2 4.25Å; K87-F89 HydrophobicContact CG-CZ 3.81Å
90	I	82.2	Confident	82.9	Confident	41 Å²	41	90.5 Å²	90.5	21%	0.21	47%	0.468	C	S	.	.	S	Bend	trans	-130.8	133.3	-176.5	-54.6	172.5	0	0	0	108	S72 E92 D133	S72-I90 PolarHBondContact O-N 3.45Å; I90-E92 PolarHBondContact O-N 3.39Å; I90-D133 HydrophobicContact CD1-CB 4.46Å
91	P	80.8	Confident	83.2	Confident	102 Å²	102	93 Å²	93	66%	0.662	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-62.3	123.9	175.6	24.5	-32.6	0	0	0	110.7	R93	P91-R93 PolarHBondContact O-N 2.96Å
92	E	78.8	Confident	83.9	Confident	126 Å²	126	90.2 Å²	90.2	59%	0.589	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63.3	123.5	178.2	-69.8	178.6	-163.3	0	0	109.9	R73 I90	R73-E92 IonicContact NH1-OE1 3.21Å; R73-E92 PolarHBondContact NH1-OE1 3.47Å; I90-E92 PolarHBondContact O-N 3.39Å
93	R	85.4	Confident	84.4	Confident	139 Å²	139	83.7 Å²	83.7	53%	0.525	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-101.9	147.2	175.6	-65.5	179.5	-174.1	-164.9	1.7	109.9	P91 V95 F135	P91-R93 PolarHBondContact O-N 2.96Å; R93-V95 PolarHBondContact O-N 2.9Å; R93-F135 HydrophobicContact CB-CB 3.93Å; R93-F135 HydrophobicContact CB-CD1 4.32Å; R93-F135 HydrophobicContact CB-CD2 3.64Å; R93-F135 HydrophobicContact CB-CE2 4.19Å; R93-F135 HydrophobicContact CB-CG 3.71Å; R93-F135 HydrophobicContact CG-CD1 4.48Å; R93-F135 HydrophobicContact CG-CG 4.34Å
94	P	85.2	Confident	85.1	Confident	124 Å²	124	86.7 Å²	86.7	81%	0.805	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-65.2	132	-177.5	26.5	-34	0	0	0	111.1
95	V	87.6	Confident	85.4	Confident	23 Å²	23	85.3 Å²	85.3	14%	0.139	43%	0.428	C	S	.	.			trans	-115.8	135.9	171.5	180	0	0	0	0	108.2	R93 V97 V99 T100 L105 F135 Y138	R93-V95 PolarHBondContact O-N 2.9Å; V95-V97 PolarHBondContact O-N 3.42Å; V95-V99 HydrophobicContact CG1-CB 4.29Å; V95-V99 HydrophobicContact CG1-CG1 4.49Å; V95-T100 HydrophobicContact CB-CG2 3.83Å; V95-T100 HydrophobicContact CG1-CG2 3.68Å; V95-L105 HydrophobicContact CG1-CD1 4.4Å; V95-F135 HydrophobicContact CG2-CB 4.43Å; V95-Y138 HydrophobicContact CG1-CD2 3.87Å; V95-Y138 HydrophobicContact CG1-CG 3.9Å; V95-Y138 HydrophobicContact CG2-CG 4.38Å
96	P	89.2	Confident	85.4	Confident	59 Å²	59	86.9 Å²	86.9	38%	0.383	44%	0.439	S	S	.	.			trans	-54.3	137.5	179.3	-26.4	34.4	0	0	0	113.1	M98 V99 T100 Y138	P96-M98 PolarHBondContact O-N 3.45Å; P96-V99 HydrophobicContact CB-CG2 4.29Å; P96-V99 PolarHBondContact O-N 3.36Å; P96-T100 PolarHBondContact O-N 3.47Å; P96-T100 VanDerWaalsContact O-N 3.14Å; P96-T100 PolarHBondContact O-OG1 3.49Å; P96-Y138 HydrophobicContact CG-CE2 3.93Å
97	V	86.9	Confident	85.5	Confident	93 Å²	93	80.2 Å²	80.2	56%	0.564	42%	0.415	S	S	*	.	H	α-helix	trans	-59.9	-31.6	-175.6	-178.1	0	0	0	0	112.6	V95 T100 R101	V95-V97 PolarHBondContact O-N 3.42Å; V97-T100 VanDerWaalsContact CA-OG1 3.28Å; V97-T100 WeakPolarHBondContact CA-OG1 3.33Å; V97-T100 PolarHBondContact O-OG1 2.92Å; V97-R101 HydrophobicContact CG1-CG 4.46Å; V97-R101 WeakPolarHBondContact O-CG 3.5Å; V97-R101 PolarHBondContact O-N 3.16Å; V97-R101 VanDerWaalsContact O-N 3.11Å
98	M	84.9	Confident	85.7	Confident	167 Å²	167	81.2 Å²	81.2	82%	0.823	42%	0.421	S	S	*	.	H	α-helix	trans	-65.3	-42.9	176.3	-70.8	-167.1	-173.7	0	0	112.1	P96 R101 L102	P96-M98 PolarHBondContact O-N 3.45Å; M98-R101 PolarHBondContact O-N 3.32Å; M98-L102 WeakPolarHBondContact O-CB 3.33Å; M98-L102 PolarHBondContact O-N 3.49Å
99	V	86.7	Confident	85.8	Confident	24 Å²	24	78.8 Å²	78.8	15%	0.145	40%	0.402	C	S	.	.	H	α-helix	trans	-70.4	-39.4	-178.9	-175.9	0	0	0	0	110.6	V95 P96 R101 L102 F103 L105 Y138	V95-V99 HydrophobicContact CG1-CB 4.29Å; V95-V99 HydrophobicContact CG1-CG1 4.49Å; P96-V99 HydrophobicContact CB-CG2 4.29Å; P96-V99 PolarHBondContact O-N 3.36Å; V99-R101 VanDerWaalsContact C-N 3.34Å; V99-R101 PolarHBondContact O-N 3.35Å; V99-L102 PolarHBondContact O-N 3.01Å; V99-F103 HydrophobicContact CG1-CD2 3.72Å; V99-F103 HydrophobicContact CG1-CE2 4.2Å; V99-F103 PolarHBondContact O-N 3.44Å; V99-L105 HydrophobicContact CG1-CD1 4.25Å; V99-Y138 HydrophobicContact CB-CD2 4.42Å; V99-Y138 HydrophobicContact CG1-CD2 4.11Å; V99-Y138 HydrophobicContact CG2-CD2 4.27Å; V99-Y138 HydrophobicContact CG2-CE2 4.15Å
100	T	87.3	Confident	85.9	Confident	33 Å²	33	80.9 Å²	80.9	20%	0.202	42%	0.421	C	S	.	.	H	α-helix	trans	-63.8	-39.5	177.9	52.2	0	0	0	0	112.1	V95 P96 V97 E104 L105	V95-T100 HydrophobicContact CB-CG2 3.83Å; V95-T100 HydrophobicContact CG1-CG2 3.68Å; P96-T100 PolarHBondContact O-N 3.47Å; P96-T100 VanDerWaalsContact O-N 3.14Å; P96-T100 PolarHBondContact O-OG1 3.49Å; V97-T100 VanDerWaalsContact CA-OG1 3.28Å; V97-T100 WeakPolarHBondContact CA-OG1 3.33Å; V97-T100 PolarHBondContact O-OG1 2.92Å; T100-E104 CarbonylContact O-C 3.51Å; T100-E104 VanDerWaalsContact O-CA 3.25Å; T100-E104 WeakPolarHBondContact O-CA 3.48Å; T100-E104 PolarHBondContact O-N 2.86Å; T100-L105 HydrophobicContact CG2-CB 4.25Å; T100-L105 PolarHBondContact O-N 2.84Å
101	R	87.2	Confident	86.1	Confident	201 Å²	201	80.3 Å²	80.3	76%	0.758	42%	0.419	S	S	*	.	H	α-helix	trans	-71.8	-44.1	174.3	-71	-177	-175.2	179.5	1.8	112.7	V97 M98 V99 F103	V97-R101 HydrophobicContact CG1-CG 4.46Å; V97-R101 WeakPolarHBondContact O-CG 3.5Å; V97-R101 PolarHBondContact O-N 3.16Å; V97-R101 VanDerWaalsContact O-N 3.11Å; M98-R101 PolarHBondContact O-N 3.32Å; V99-R101 VanDerWaalsContact C-N 3.34Å; V99-R101 PolarHBondContact O-N 3.35Å; R101-F103 VanDerWaalsContact C-N 3.34Å; R101-F103 PolarHBondContact O-N 2.97Å
102	L	87	Confident	86.3	Confident	117 Å²	117	75.8 Å²	75.8	61%	0.613	39%	0.39	S	S	*	.	H	α-helix	trans	-67.2	-35	-174	-171.7	66.6	0	0	0	112.8	M98 V99	M98-L102 WeakPolarHBondContact O-CB 3.33Å; M98-L102 PolarHBondContact O-N 3.49Å; V99-L102 PolarHBondContact O-N 3.01Å
103	F	87.6	Confident	86.3	Confident	9 Å²	9	69.8 Å²	69.8	4%	0.039	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	14.6	-179.3	-60	-71.8	0	0	0	113.5	L20 F21 V24 R28 V99 R101 L105 V141	L20-F103 HydrophobicContact CD2-CZ 4.23Å; L20-F103 HydrophobicContact CG-CZ 4.37Å; F21-F103 HydrophobicContact CD2-CD1 4.43Å; F21-F103 AromaticContact CD2-CE1 3.99Å; F21-F103 HydrophobicContact CD2-CE1 3.99Å; V24-F103 HydrophobicContact CB-CD1 3.94Å; V24-F103 HydrophobicContact CB-CE1 3.84Å; V24-F103 HydrophobicContact CG1-CB 4.13Å; V24-F103 HydrophobicContact CG1-CD1 3.33Å; V24-F103 HydrophobicContact CG1-CE1 3.75Å; V24-F103 HydrophobicContact CG1-CG 3.77Å; V24-F103 HydrophobicContact CG2-CD1 4.47Å; V24-F103 HydrophobicContact CG2-CE1 4.05Å; V24-F103 HydrophobicContact CG2-CZ 4.29Å; R28-F103 WeakPolarHBondContact CD-O 3.37Å; R28-F103 VanDerWaalsContact CZ-O 3.31Å; R28-F103 PolarHBondContact NE-O 2.91Å; R28-F103 VanDerWaalsContact NE-O 3.1Å; V99-F103 HydrophobicContact CG1-CD2 3.72Å; V99-F103 HydrophobicContact CG1-CE2 4.2Å; V99-F103 PolarHBondContact O-N 3.44Å; R101-F103 VanDerWaalsContact C-N 3.34Å; R101-F103 PolarHBondContact O-N 2.97Å; F103-L105 HydrophobicContact CB-CG 4.35Å; F103-L105 PolarHBondContact O-N 3.38Å; F103-V141 HydrophobicContact CD2-CG1 4.49Å; F103-V141 HydrophobicContact CD2-CG2 4.29Å; F103-V141 HydrophobicContact CE2-CG1 3.8Å; F103-V141 HydrophobicContact CE2-CG2 4.28Å; F103-V141 HydrophobicContact CZ-CG1 4.29Å
104	E	85.4	Confident	86	Confident	127 Å²	127	67.5 Å²	67.5	59%	0.593	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	61.8	176.7	-62.7	168.8	171.7	0	0	112.6	R28 T100	R28-E104 IonicContact CZ-OE2 3.59Å; R28-E104 IonicContact NH1-OE2 3.59Å; R28-E104 PolarHBondContact NH1-OE2 2.9Å; R28-E104 VanDerWaalsContact NH1-OE2 3.15Å; R28-E104 PolarHBondContact NH2-O 3.41Å; R28-E104 IonicContact NH2-OE2 3.15Å; R28-E104 PolarHBondContact NH2-OE2 3.36Å; T100-E104 CarbonylContact O-C 3.51Å; T100-E104 VanDerWaalsContact O-CA 3.25Å; T100-E104 WeakPolarHBondContact O-CA 3.48Å; T100-E104 PolarHBondContact O-N 2.86Å
105	L	85.2	Confident	85	Confident	19 Å²	19	63.2 Å²	63.2	10%	0.099	33%	0.327	C	S	.	.	S	Bend	trans	-98	146.9	176.6	-53.5	176.1	0	0	0	110.7	V95 V99 T100 F103 V107 M137	V95-L105 HydrophobicContact CG1-CD1 4.4Å; V99-L105 HydrophobicContact CG1-CD1 4.25Å; T100-L105 HydrophobicContact CG2-CB 4.25Å; T100-L105 PolarHBondContact O-N 2.84Å; F103-L105 HydrophobicContact CB-CG 4.35Å; F103-L105 PolarHBondContact O-N 3.38Å; L105-V107 HydrophobicContact CD2-CG2 4.4Å; L105-M137 HydrophobicContact CD1-CB 4.39Å; L105-M137 HydrophobicContact CD1-CG 4.34Å; L105-M137 HydrophobicContact CD2-CB 3.96Å; L105-M137 HydrophobicContact CD2-CG 3.54Å
106	P	84.2	Confident	83.6	Confident	50 Å²	50	68.6 Å²	68.6	33%	0.325	36%	0.355	S	S	.	.	S	Bend	cis	-72	149.8	-1.6	27.4	-33.7	0	0	0	113.2	Q108 S134	P106-Q108 PolarHBondContact O-N 2.88Å; P106-S134 WeakPolarHBondContact CA-OG 3.21Å; P106-S134 VanDerWaalsContact CB-OG 3.3Å; P106-S134 WeakPolarHBondContact CB-OG 3.33Å
107	V	87.1	Confident	81.8	Confident	13 Å²	13	74.1 Å²	74.1	8%	0.079	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-68.2	116.7	163.8	-179.9	0	0	0	0	107.1	R28 T31 A32 L35 L105 A132 M137	R28-V107 HydrophobicContact CB-CG2 4.25Å; R28-V107 HydrophobicContact CG-CG2 3.93Å; T31-V107 HydrophobicContact CG2-CB 4.43Å; T31-V107 HydrophobicContact CG2-CG1 4.39Å; A32-V107 HydrophobicContact CB-CG1 4.04Å; L35-V107 HydrophobicContact CD1-CG1 4.39Å; L105-V107 HydrophobicContact CD2-CG2 4.4Å; V107-A132 HydrophobicContact CB-CB 4.15Å; V107-A132 WeakPolarHBondContact O-CB 3.12Å; V107-A132 PolarHBondContact O-N 3.26Å; V107-M137 HydrophobicContact CG2-CE 4.25Å
108	Q	89.7	Confident	80.3	Confident	114 Å²	114	78.8 Å²	78.8	53%	0.533	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.7	178.7	65.8	-178.6	3.2	0	0	110.6	P106 L130 Q131	P106-Q108 PolarHBondContact O-N 2.88Å; Q108-L130 VanDerWaalsContact CA-O 3.28Å; Q108-L130 WeakPolarHBondContact CA-O 3.12Å; Q108-Q131 HydrophobicContact CB-CG 3.96Å
109	I	88.3	Confident	79	Confident	31 Å²	31	77.3 Å²	77.3	16%	0.159	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	149.4	171.2	61.8	158.1	0	0	0	108.9	A32 L35 E36 A39 V129 L130	A32-I109 HydrophobicContact CB-CG2 4.39Å; L35-I109 HydrophobicContact CB-CD1 3.55Å; L35-I109 HydrophobicContact CB-CG1 3.73Å; L35-I109 HydrophobicContact CB-CG2 4.33Å; L35-I109 HydrophobicContact CD1-CG1 4.23Å; L35-I109 HydrophobicContact CD1-CG2 4.4Å; L35-I109 WeakPolarHBondContact O-CD1 3.36Å; E36-I109 VanDerWaalsContact CA-CD1 3.4Å; E36-I109 HydrophobicContact CB-CD1 4.09Å; E36-I109 VanDerWaalsContact N-CD1 3.3Å; A39-I109 HydrophobicContact CB-CD1 3.83Å; I109-V129 WeakPolarHBondContact O-CA 3.4Å; I109-L130 HydrophobicContact CG1-CB 4.01Å; I109-L130 PolarHBondContact N-O 2.86Å; I109-L130 PolarHBondContact O-N 3.43Å
110	S	86.6	Confident	77.7	Confident	86 Å²	86	81 Å²	81	60%	0.601	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.4	173.5	56.4	0	0	0	0	109
111	L	86.7	Confident	76.5	Confident	30 Å²	30	85.9 Å²	85.9	16%	0.157	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.2	176.7	-168.9	68.8	0	0	0	109.9	A39 R40 R43 Y127 L128	A39-L111 HydrophobicContact CB-CB 4.15Å; A39-L111 HydrophobicContact CB-CD2 3.65Å; R40-L111 HydrophobicContact CG-CD2 4.14Å; R43-L111 HydrophobicContact CB-CD2 4.2Å; R43-L111 HydrophobicContact CG-CD2 4.28Å; L111-Y127 WeakPolarHBondContact O-CA 3.4Å; L111-L128 PolarHBondContact N-O 3.49Å; L111-L128 PolarHBondContact O-N 2.7Å
112	G	84.6	Confident	75.5	Confident	6 Å²	6	79 Å²	79	6%	0.062	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	135.9	174.9	0	0	0	0	0	112.2	Y114	G112-Y114 WeakPolarHBondContact O-CE2 3.38Å
113	V	80.2	Confident	74.9	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.006	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.3	174.4	-173.6	0	0	0	0	107.2	L46 S47 I50 P124 I125 A126 L128	L46-V113 HydrophobicContact CD2-CG2 4.2Å; S47-V113 WeakPolarHBondContact OG-CG1 3.47Å; I50-V113 HydrophobicContact CD1-CG1 4.32Å; V113-P124 CarbonylContact O-C 3.56Å; V113-P124 VanDerWaalsContact O-CA 3.31Å; V113-P124 WeakPolarHBondContact O-CA 3.42Å; V113-I125 PolarHBondContact O-N 2.87Å; V113-A126 VanDerWaalsContact CB-O 3.31Å; V113-A126 WeakPolarHBondContact CB-O 3.41Å; V113-A126 PolarHBondContact N-O 2.92Å; V113-L128 HydrophobicContact CG2-CB 4.06Å
114	Y	77.4	Confident	74.3	Confident	91 Å²	91	81.7 Å²	81.7	36%	0.357	44%	0.437	S	S	.	.			trans	-109.2	153.9	-166.8	-61.5	-75.5	0	0	0	112.3	S47 G112 P122 P124	S47-Y114 VanDerWaalsContact CB-O 3.31Å; S47-Y114 WeakPolarHBondContact CB-O 3.46Å; S47-Y114 PolarHBondContact OG-O 2.85Å; G112-Y114 WeakPolarHBondContact O-CE2 3.38Å; Y114-P122 HydrophobicContact CD1-CB 3.74Å; Y114-P122 HydrophobicContact CD1-CG 4.24Å; Y114-P122 HydrophobicContact CE1-CB 4.23Å; Y114-P122 HydrophobicContact CE1-CG 4.33Å; Y114-P122 VanDerWaalsContact CE1-O 3.31Å; Y114-P122 WeakPolarHBondContact CE1-O 3.3Å; Y114-P124 HydrophobicContact CD1-CB 4.36Å; Y114-P124 HydrophobicContact CE1-CB 4.19Å
115	S	65	Low	74	Confident	34 Å²	34	78 Å²	78	24%	0.238	42%	0.42	C	S	.	.			trans	-75	140.2	165	69.3	0	0	0	0	110.2	E117	S115-E117 PolarHBondContact O-N 3.42Å
116	L	58	Low	73.9	Confident	136 Å²	136	77.1 Å²	77.1	71%	0.712	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	1	-177.6	-86.7	150	0	0	0	114.5
117	E	52.9	Low	74.1	Confident	174 Å²	174	79.3 Å²	79.3	81%	0.813	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.8	35.4	-164.4	-66	-172.2	164.3	0	0	117.1	S115	S115-E117 PolarHBondContact O-N 3.42Å
118	R	54.4	Low	74.2	Confident	191 Å²	191	78.7 Å²	78.7	72%	0.721	41%	0.414	S	S	*	.			trans	-133.8	102	166.9	-73.3	-169.7	-177.1	179	2.7	113.7	A120	R118-A120 PolarHBondContact O-N 3.15Å
119	P	57.2	Low	74.3	Confident	137 Å²	137	74.3 Å²	74.3	89%	0.89	40%	0.395	S	S	*	.	S	Bend	trans	-76	-12.4	-177.5	25.5	-30.9	0	0	0	115.5
120	A	59.2	Low	74.4	Confident	101 Å²	101	72.9 Å²	72.9	84%	0.835	39%	0.388	S	S	*	.	S	Bend	trans	-92.7	-30.3	-167.9	0	0	0	0	0	116.4	R118	R118-A120 PolarHBondContact O-N 3.15Å
121	N	63.7	Low	74.6	Confident	135 Å²	135	69.8 Å²	69.8	72%	0.722	36%	0.364	S	S	*	.			trans	-173.2	80.1	172	-157.6	-2.3	0	0	0	108.8	Q123	N121-Q123 PolarHBondContact O-N 2.99Å
122	P	65	Low	74.7	Confident	58 Å²	58	68.7 Å²	68.7	38%	0.377	36%	0.359	S	S	.	.			trans	-69.1	107.6	-172.2	28.2	-33.7	0	0	0	109.8	Y114	Y114-P122 HydrophobicContact CD1-CB 3.74Å; Y114-P122 HydrophobicContact CD1-CG 4.24Å; Y114-P122 HydrophobicContact CE1-CB 4.23Å; Y114-P122 HydrophobicContact CE1-CG 4.33Å; Y114-P122 VanDerWaalsContact CE1-O 3.31Å; Y114-P122 WeakPolarHBondContact CE1-O 3.3Å
123	Q	73.7	Confident	74.9	Confident	161 Å²	161	69.6 Å²	69.6	75%	0.752	36%	0.363	S	S	*	.			trans	-75.3	132.9	166.1	-70.4	-177	2.4	0	0	108.4	N121 I125	N121-Q123 PolarHBondContact O-N 2.99Å; Q123-I125 PolarHBondContact O-N 3.47Å
124	P	75.2	Confident	75.3	Confident	21 Å²	21	70.8 Å²	70.8	14%	0.136	37%	0.371	C	S	.	.			trans	-65.1	134.8	176.6	26.1	-31.9	0	0	0	110	P79 V113 Y114 A126 Y127	P79-P124 WeakPolarHBondContact CG-O 3.13Å; V113-P124 CarbonylContact O-C 3.56Å; V113-P124 VanDerWaalsContact O-CA 3.31Å; V113-P124 WeakPolarHBondContact O-CA 3.42Å; Y114-P124 HydrophobicContact CD1-CB 4.36Å; Y114-P124 HydrophobicContact CE1-CB 4.19Å; P124-A126 VanDerWaalsContact C-N 3.27Å; P124-Y127 HydrophobicContact CB-CE1 4.29Å; P124-Y127 HydrophobicContact CG-CD1 4.4Å; P124-Y127 HydrophobicContact CG-CE1 3.61Å; P124-Y127 HydrophobicContact CG-CE2 3.87Å; P124-Y127 VanDerWaalsContact CG-OH 3.24Å; P124-Y127 WeakPolarHBondContact CG-OH 3.35Å
125	I	79.4	Confident	75.9	Confident	50 Å²	50	68.2 Å²	68.2	26%	0.256	36%	0.362	S	S	.	.	S	Bend	trans	-68.7	-36.2	175.9	-52.1	171.1	0	0	0	109.6	I50 L51 L78 P79 V113 Q123	I50-I125 HydrophobicContact CG2-CG2 3.9Å; L51-I125 HydrophobicContact CD1-CD1 4.39Å; L51-I125 HydrophobicContact CD2-CD1 3.4Å; L51-I125 HydrophobicContact CG-CD1 3.59Å; L78-I125 WeakPolarHBondContact CD2-O 3.28Å; P79-I125 WeakPolarHBondContact CD-O 3.31Å; V113-I125 PolarHBondContact O-N 2.87Å; Q123-I125 PolarHBondContact O-N 3.47Å
126	A	84.4	Confident	76.9	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	165.4	175.8	0	0	0	0	0	109.5	I50 V76 V77 L78 V113 P124	I50-A126 HydrophobicContact CD1-CB 4.25Å; V76-A126 HydrophobicContact CG1-CB 3.56Å; V77-A126 CarbonylContact O-C 3.5Å; V77-A126 WeakPolarHBondContact O-CA 3.27Å; L78-A126 HydrophobicContact CD2-CB 4.33Å; V113-A126 VanDerWaalsContact CB-O 3.31Å; V113-A126 WeakPolarHBondContact CB-O 3.41Å; V113-A126 PolarHBondContact N-O 2.92Å; P124-A126 VanDerWaalsContact C-N 3.27Å
127	Y	88	Confident	78.4	Confident	95 Å²	95	65.9 Å²	65.9	37%	0.373	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.4	173.2	-65	-88.1	0	0	0	109	V76 V77 L111 P124 V129	V76-Y127 WeakPolarHBondContact CA-O 3.49Å; V77-Y127 PolarHBondContact N-O 3.37Å; V77-Y127 PolarHBondContact O-N 3.46Å; L111-Y127 WeakPolarHBondContact O-CA 3.4Å; P124-Y127 HydrophobicContact CB-CE1 4.29Å; P124-Y127 HydrophobicContact CG-CD1 4.4Å; P124-Y127 HydrophobicContact CG-CE1 3.61Å; P124-Y127 HydrophobicContact CG-CE2 3.87Å; P124-Y127 VanDerWaalsContact CG-OH 3.24Å; P124-Y127 WeakPolarHBondContact CG-OH 3.35Å; Y127-V129 PolarHBondContact O-N 2.89Å
128	L	89.5	Confident	80.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	110.3	166.4	178.3	62.5	0	0	0	108	A39 L46 L62 V76 L111 V113 L130	A39-L128 HydrophobicContact CB-CD2 4.12Å; L46-L128 HydrophobicContact CD2-CB 4.25Å; L46-L128 HydrophobicContact CD2-CD1 3.94Å; L46-L128 HydrophobicContact CD2-CD2 4.15Å; L46-L128 HydrophobicContact CD2-CG 4.34Å; L62-L128 HydrophobicContact CD2-CD1 3.71Å; V76-L128 HydrophobicContact CG2-CD1 4.3Å; L111-L128 PolarHBondContact N-O 3.49Å; L111-L128 PolarHBondContact O-N 2.7Å; V113-L128 HydrophobicContact CG2-CB 4.06Å; L128-L130 HydrophobicContact CD1-CD2 3.92Å; L128-L130 HydrophobicContact CD2-CD2 4.34Å; L128-L130 HydrophobicContact CD2-CG 4.44Å; L128-L130 HydrophobicContact CG-CD2 4.03Å; L128-L130 HydrophobicContact CG-CG 4.2Å
129	V	90.5	Very high	81.9	Confident	22 Å²	22	56.8 Å²	56.8	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	110.9	175.8	-177.3	0	0	0	0	108.3	A74 D75 V77 I109 Y127 Q131	A74-V129 WeakPolarHBondContact CA-O 3.4Å; D75-V129 HydrophobicContact CB-CB 4.35Å; D75-V129 PolarHBondContact N-O 3.35Å; D75-V129 PolarHBondContact O-N 3.48Å; V77-V129 HydrophobicContact CG2-CG2 3.98Å; I109-V129 WeakPolarHBondContact O-CA 3.4Å; Y127-V129 PolarHBondContact O-N 2.89Å; V129-Q131 HydrophobicContact CG1-CG 4.33Å
130	L	91	Very high	83.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.4	172.9	-60.4	-173	0	0	0	109.4	L35 I38 A39 I65 V71 A74 Q108 I109 L128	L35-L130 HydrophobicContact CD2-CB 4.21Å; I38-L130 HydrophobicContact CB-CD1 4.22Å; I38-L130 HydrophobicContact CG2-CD1 3.95Å; A39-L130 HydrophobicContact CB-CD1 3.72Å; A39-L130 HydrophobicContact CB-CG 4.35Å; I65-L130 HydrophobicContact CD1-CD2 4.24Å; V71-L130 HydrophobicContact CG1-CD2 4.33Å; A74-L130 HydrophobicContact CB-CD2 3.42Å; A74-L130 VanDerWaalsContact CB-CD2 3.42Å; Q108-L130 VanDerWaalsContact CA-O 3.28Å; Q108-L130 WeakPolarHBondContact CA-O 3.12Å; I109-L130 HydrophobicContact CG1-CB 4.01Å; I109-L130 PolarHBondContact N-O 2.86Å; I109-L130 PolarHBondContact O-N 3.43Å; L128-L130 HydrophobicContact CD1-CD2 3.92Å; L128-L130 HydrophobicContact CD2-CD2 4.34Å; L128-L130 HydrophobicContact CD2-CG 4.44Å; L128-L130 HydrophobicContact CG-CD2 4.03Å; L128-L130 HydrophobicContact CG-CG 4.2Å
131	Q	90.4	Very high	85.1	Confident	22 Å²	22	48.9 Å²	48.9	10%	0.103	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.3	176.7	-60.7	-169.1	-28	0	0	110.1	S72 R73 Q108 V129	S72-Q131 PolarHBondContact N-O 2.93Å; R73-Q131 HydrophobicContact CB-CB 4.3Å; R73-Q131 PolarHBondContact N-O 3.24Å; R73-Q131 PolarHBondContact O-N 3.17Å; Q108-Q131 HydrophobicContact CB-CG 3.96Å; V129-Q131 HydrophobicContact CG1-CG 4.33Å
132	A	89.5	Confident	86.4	Confident	7 Å²	7	46.5 Å²	46.5	6%	0.058	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	155.7	172.8	0	0	0	0	0	111.9	T31 L35 V70 V107 S134	T31-A132 HydrophobicContact CG2-CB 3.56Å; L35-A132 HydrophobicContact CD1-CB 4.05Å; V70-A132 CarbonylContact O-C 3.53Å; V70-A132 VanDerWaalsContact O-CA 3.25Å; V70-A132 WeakPolarHBondContact O-CA 3.31Å; V107-A132 HydrophobicContact CB-CB 4.15Å; V107-A132 WeakPolarHBondContact O-CB 3.12Å; V107-A132 PolarHBondContact O-N 3.26Å; A132-S134 PolarHBondContact O-N 3.47Å; A132-S134 VanDerWaalsContact O-N 3.09Å
133	D	88.8	Confident	87.7	Confident	24 Å²	24	47.2 Å²	47.2	13%	0.128	23%	0.226	C	C	.	.			trans	-63.9	108.3	170.3	179.9	13.1	0	0	0	111.6	V70 I90 F135 R136 M137	V70-D133 PolarHBondContact O-N 2.88Å; I90-D133 HydrophobicContact CD1-CB 4.46Å; D133-F135 VanDerWaalsContact C-N 3.25Å; D133-F135 PolarHBondContact O-N 3.47Å; D133-F135 WeakPolarHBondContact OD1-CB 3.22Å; D133-F135 PolarHBondContact OD1-N 3.43Å; D133-R136 HydrophobicContact CB-CB 4.07Å; D133-R136 PolarHBondContact O-N 2.95Å; D133-R136 WeakPolarHBondContact OD2-CB 3.42Å; D133-R136 PolarHBondContact OD2-N 2.99Å; D133-M137 PolarHBondContact O-N 2.97Å
134	S	88.5	Confident	88.6	Confident	27 Å²	27	40.1 Å²	40.1	19%	0.189	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-32.3	176.1	-66.9	0	0	0	0	112.6	P106 A132 M137 Y138	P106-S134 WeakPolarHBondContact CA-OG 3.21Å; P106-S134 VanDerWaalsContact CB-OG 3.3Å; P106-S134 WeakPolarHBondContact CB-OG 3.33Å; A132-S134 PolarHBondContact O-N 3.47Å; A132-S134 VanDerWaalsContact O-N 3.09Å; S134-M137 PolarHBondContact O-N 3.45Å; S134-Y138 WeakPolarHBondContact O-CB 3.14Å; S134-Y138 PolarHBondContact O-N 3.3Å
135	F	89.2	Confident	89.4	Confident	36 Å²	36	42 Å²	42	16%	0.158	20%	0.202	C	C	.	.	H	α-helix	trans	-72.1	-34	-178	-175.1	-105.2	0	0	0	111.9	R93 V95 D133 Y138 K139	R93-F135 HydrophobicContact CB-CB 3.93Å; R93-F135 HydrophobicContact CB-CD1 4.32Å; R93-F135 HydrophobicContact CB-CD2 3.64Å; R93-F135 HydrophobicContact CB-CE2 4.19Å; R93-F135 HydrophobicContact CB-CG 3.71Å; R93-F135 HydrophobicContact CG-CD1 4.48Å; R93-F135 HydrophobicContact CG-CG 4.34Å; V95-F135 HydrophobicContact CG2-CB 4.43Å; D133-F135 VanDerWaalsContact C-N 3.25Å; D133-F135 PolarHBondContact O-N 3.47Å; D133-F135 WeakPolarHBondContact OD1-CB 3.22Å; D133-F135 PolarHBondContact OD1-N 3.43Å; F135-Y138 HydrophobicContact CD2-CD1 4.15Å; F135-Y138 HydrophobicContact CE2-CD1 4.14Å; F135-Y138 PolarHBondContact O-N 3.43Å; F135-K139 HydrophobicContact CD1-CD 4.08Å; F135-K139 HydrophobicContact CD1-CG 4.41Å; F135-K139 HydrophobicContact CE1-CD 3.7Å; F135-K139 HydrophobicContact CE1-CG 4.09Å; F135-K139 HydrophobicContact CZ-CD 4.32Å; F135-K139 HydrophobicContact CZ-CG 4.31Å; F135-K139 PolarHBondContact O-N 2.9Å
136	R	87.3	Confident	90	Very high	113 Å²	113	43.1 Å²	43.1	43%	0.426	21%	0.214	S	C	.	.	H	α-helix	trans	-60.8	-45.3	170.5	-177.6	178.5	175.6	-163.7	-6.4	111.5	G69 D133 K139 F140	G69-R136 WeakPolarHBondContact O-CD 3.26Å; G69-R136 PolarHBondContact O-NH1 3.23Å; D133-R136 HydrophobicContact CB-CB 4.07Å; D133-R136 PolarHBondContact O-N 2.95Å; D133-R136 WeakPolarHBondContact OD2-CB 3.42Å; D133-R136 PolarHBondContact OD2-N 2.99Å; R136-K139 PolarHBondContact O-N 2.93Å; R136-F140 PolarHBondContact O-N 2.99Å
137	M	88.1	Confident	90.4	Very high	9 Å²	9	46.4 Å²	46.4	4%	0.044	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-41.6	176.8	-168.1	63.3	74.7	0	0	111.3	N27 R28 L105 V107 D133 S134 K139 F140 V141	N27-M137 HydrophobicContact CB-CE 4.41Å; N27-M137 HydrophobicContact CB-SD 4.18Å; N27-M137 PolarHBondContact ND2-SD 3.28Å; R28-M137 HydrophobicContact CB-CE 4.46Å; R28-M137 HydrophobicContact CG-CE 3.9Å; R28-M137 HydrophobicContact CG-SD 4.4Å; L105-M137 HydrophobicContact CD1-CB 4.39Å; L105-M137 HydrophobicContact CD1-CG 4.34Å; L105-M137 HydrophobicContact CD2-CB 3.96Å; L105-M137 HydrophobicContact CD2-CG 3.54Å; V107-M137 HydrophobicContact CG2-CE 4.25Å; D133-M137 PolarHBondContact O-N 2.97Å; S134-M137 PolarHBondContact O-N 3.45Å; M137-K139 PolarHBondContact O-N 2.85Å; M137-F140 WeakPolarHBondContact O-CB 3.26Å; M137-F140 PolarHBondContact O-N 3.43Å; M137-F140 VanDerWaalsContact O-N 3.15Å; M137-F140 HydrophobicContact SD-CD1 4.38Å; M137-V141 VanDerWaalsContact O-CG2 3.26Å; M137-V141 WeakPolarHBondContact O-CG2 3.39Å; M137-V141 PolarHBondContact O-N 3.18Å
138	Y	90.3	Very high	90.7	Very high	55 Å²	55	42.8 Å²	42.8	22%	0.216	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-46	173.6	174.4	-113.9	0	0	0	112.6	V95 P96 V99 S134 F135 F140 V141 M142	V95-Y138 HydrophobicContact CG1-CD2 3.87Å; V95-Y138 HydrophobicContact CG1-CG 3.9Å; V95-Y138 HydrophobicContact CG2-CG 4.38Å; P96-Y138 HydrophobicContact CG-CE2 3.93Å; V99-Y138 HydrophobicContact CB-CD2 4.42Å; V99-Y138 HydrophobicContact CG1-CD2 4.11Å; V99-Y138 HydrophobicContact CG2-CD2 4.27Å; V99-Y138 HydrophobicContact CG2-CE2 4.15Å; S134-Y138 WeakPolarHBondContact O-CB 3.14Å; S134-Y138 PolarHBondContact O-N 3.3Å; F135-Y138 HydrophobicContact CD2-CD1 4.15Å; F135-Y138 HydrophobicContact CE2-CD1 4.14Å; F135-Y138 PolarHBondContact O-N 3.43Å; Y138-F140 VanDerWaalsContact C-N 3.31Å; Y138-F140 PolarHBondContact O-N 3.29Å; Y138-V141 PolarHBondContact O-N 3.35Å; Y138-M142 HydrophobicContact CD2-CG 4.06Å; Y138-M142 HydrophobicContact CE1-CG 4.16Å; Y138-M142 HydrophobicContact CE2-CG 3.56Å; Y138-M142 HydrophobicContact CE2-SD 3.95Å; Y138-M142 WeakPolarHBondContact O-CG 3.23Å; Y138-M142 PolarHBondContact O-N 3.03Å
139	K	90.7	Very high	90.7	Very high	119 Å²	119	45.3 Å²	45.3	52%	0.517	24%	0.237	S	C	.	.	H	α-helix	trans	-58.7	-42.5	173.6	-84.9	-179.7	161.1	178.5	0	112.1	F135 R136 M137 M142 S143	F135-K139 HydrophobicContact CD1-CD 4.08Å; F135-K139 HydrophobicContact CD1-CG 4.41Å; F135-K139 HydrophobicContact CE1-CD 3.7Å; F135-K139 HydrophobicContact CE1-CG 4.09Å; F135-K139 HydrophobicContact CZ-CD 4.32Å; F135-K139 HydrophobicContact CZ-CG 4.31Å; F135-K139 PolarHBondContact O-N 2.9Å; R136-K139 PolarHBondContact O-N 2.93Å; M137-K139 PolarHBondContact O-N 2.85Å; K139-M142 PolarHBondContact O-N 3.47Å; K139-S143 WeakPolarHBondContact O-CB 3.31Å; K139-S143 PolarHBondContact O-N 3.31Å
140	F	91.6	Very high	90.7	Very high	67 Å²	67	48.3 Å²	48.3	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-47.1	175.9	177.6	-94.6	0	0	0	111.6	V24 N27 R136 M137 Y138 M142 S143 T144	V24-F140 HydrophobicContact CG2-CD1 4.44Å; V24-F140 HydrophobicContact CG2-CE1 4.35Å; N27-F140 HydrophobicContact CB-CD1 3.99Å; N27-F140 HydrophobicContact CB-CE1 3.6Å; N27-F140 HydrophobicContact CB-CZ 3.92Å; N27-F140 VanDerWaalsContact ND2-CD1 3.28Å; N27-F140 WeakPolarHBondContact ND2-CD1 3.35Å; N27-F140 VanDerWaalsContact ND2-CG 3.27Å; N27-F140 WeakPolarHBondContact ND2-CG 3.44Å; R136-F140 PolarHBondContact O-N 2.99Å; M137-F140 WeakPolarHBondContact O-CB 3.26Å; M137-F140 PolarHBondContact O-N 3.43Å; M137-F140 VanDerWaalsContact O-N 3.15Å; M137-F140 HydrophobicContact SD-CD1 4.38Å; Y138-F140 VanDerWaalsContact C-N 3.31Å; Y138-F140 PolarHBondContact O-N 3.29Å; F140-M142 PolarHBondContact O-N 3.31Å; F140-S143 PolarHBondContact O-N 2.95Å; F140-T144 VanDerWaalsContact O-CB 3.22Å; F140-T144 WeakPolarHBondContact O-CB 3.3Å; F140-T144 PolarHBondContact O-N 2.96Å; F140-T144 PolarHBondContact O-OG1 3.47Å
141	V	91.5	Very high	90.8	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-50.6	176.5	174.3	0	0	0	0	110.5	L20 V24 F103 M137 Y138 T144 L145	L20-V141 HydrophobicContact CD1-CG1 4.34Å; V24-V141 HydrophobicContact CG1-CG2 4.05Å; V24-V141 HydrophobicContact CG2-CB 4.39Å; V24-V141 HydrophobicContact CG2-CG2 3.62Å; F103-V141 HydrophobicContact CD2-CG1 4.49Å; F103-V141 HydrophobicContact CD2-CG2 4.29Å; F103-V141 HydrophobicContact CE2-CG1 3.8Å; F103-V141 HydrophobicContact CE2-CG2 4.28Å; F103-V141 HydrophobicContact CZ-CG1 4.29Å; M137-V141 VanDerWaalsContact O-CG2 3.26Å; M137-V141 WeakPolarHBondContact O-CG2 3.39Å; M137-V141 PolarHBondContact O-N 3.18Å; Y138-V141 PolarHBondContact O-N 3.35Å; V141-T144 PolarHBondContact O-N 2.74Å; V141-L145 VanDerWaalsContact O-CB 3.31Å; V141-L145 WeakPolarHBondContact O-CB 3.29Å; V141-L145 PolarHBondContact O-N 2.93Å
142	M	91.9	Very high	90.8	Very high	85 Å²	85	54.7 Å²	54.7	42%	0.419	29%	0.285	S	S	.	.	H	α-helix	trans	-65.8	-42.5	-178.5	-70.1	-56.3	-61.6	0	0	112.5	Y138 K139 F140 S146	Y138-M142 HydrophobicContact CD2-CG 4.06Å; Y138-M142 HydrophobicContact CE1-CG 4.16Å; Y138-M142 HydrophobicContact CE2-CG 3.56Å; Y138-M142 HydrophobicContact CE2-SD 3.95Å; Y138-M142 WeakPolarHBondContact O-CG 3.23Å; Y138-M142 PolarHBondContact O-N 3.03Å; K139-M142 PolarHBondContact O-N 3.47Å; F140-M142 PolarHBondContact O-N 3.31Å; M142-S146 VanDerWaalsContact O-CB 3.31Å; M142-S146 WeakPolarHBondContact O-CB 3.01Å; M142-S146 PolarHBondContact O-N 3.28Å
143	S	92.1	Very high	90.8	Very high	72 Å²	72	58.9 Å²	58.9	50%	0.503	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-45.2	175.7	-173.1	0	0	0	0	111.1	K139 F140 S146 T147	K139-S143 WeakPolarHBondContact O-CB 3.31Å; K139-S143 PolarHBondContact O-N 3.31Å; F140-S143 PolarHBondContact O-N 2.95Å; S143-S146 PolarHBondContact O-N 3.36Å; S143-T147 WeakPolarHBondContact O-CG2 3.18Å; S143-T147 PolarHBondContact O-N 2.91Å; S143-T147 PolarHBondContact O-OG1 3.45Å; S143-T147 VanDerWaalsContact O-OG1 3.1Å
144	T	92.7	Very high	90.9	Very high	12 Å²	12	62.6 Å²	62.6	7%	0.074	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-42.4	-179.8	-56.3	0	0	0	0	111.6	L20 L23 F140 V141 T147 L148	L20-T144 HydrophobicContact CD1-CG2 3.91Å; L23-T144 HydrophobicContact CB-CG2 4.09Å; L23-T144 HydrophobicContact CD1-CG2 3.44Å; L23-T144 VanDerWaalsContact CD1-CG2 3.44Å; L23-T144 HydrophobicContact CG-CG2 4.41Å; F140-T144 VanDerWaalsContact O-CB 3.22Å; F140-T144 WeakPolarHBondContact O-CB 3.3Å; F140-T144 PolarHBondContact O-N 2.96Å; F140-T144 PolarHBondContact O-OG1 3.47Å; V141-T144 PolarHBondContact O-N 2.74Å; T144-T147 WeakPolarHBondContact CA-OG1 3.4Å; T144-T147 PolarHBondContact O-N 2.96Å; T144-T147 PolarHBondContact O-OG1 2.94Å; T144-L148 HydrophobicContact CG2-CD1 3.89Å; T144-L148 HydrophobicContact CG2-CG 4.26Å; T144-L148 VanDerWaalsContact O-CB 3.31Å; T144-L148 WeakPolarHBondContact O-CB 3.38Å; T144-L148 WeakPolarHBondContact O-CG 3.24Å; T144-L148 PolarHBondContact O-N 2.71Å
145	L	92	Very high	91	Very high	62 Å²	62	65.9 Å²	65.9	33%	0.325	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-47	175.1	175.3	62.9	0	0	0	110.8	L20 V141 L148 V149	L20-L145 HydrophobicContact CD1-CB 4.07Å; L20-L145 HydrophobicContact CD2-CB 4.28Å; L20-L145 HydrophobicContact CD2-CD1 4.15Å; V141-L145 VanDerWaalsContact O-CB 3.31Å; V141-L145 WeakPolarHBondContact O-CB 3.29Å; V141-L145 PolarHBondContact O-N 2.93Å; L145-L148 PolarHBondContact O-N 2.97Å; L145-V149 HydrophobicContact CD1-CG2 3.88Å; L145-V149 HydrophobicContact CG-CG2 4.44Å; L145-V149 WeakPolarHBondContact O-CB 3.25Å; L145-V149 VanDerWaalsContact O-CG2 3.24Å; L145-V149 WeakPolarHBondContact O-CG2 3.31Å; L145-V149 PolarHBondContact O-N 3.04Å
146	S	92.4	Very high	91	Very high	72 Å²	72	65.7 Å²	65.7	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-46.1	178.5	-176.5	0	0	0	0	112	M142 S143 T150	M142-S146 VanDerWaalsContact O-CB 3.31Å; M142-S146 WeakPolarHBondContact O-CB 3.01Å; M142-S146 PolarHBondContact O-N 3.28Å; S143-S146 PolarHBondContact O-N 3.36Å; S146-T150 WeakPolarHBondContact O-CB 3.33Å; S146-T150 PolarHBondContact O-N 2.94Å; S146-T150 PolarHBondContact O-OG1 3.45Å
147	T	93.2	Very high	91	Very high	70 Å²	70	65.4 Å²	65.4	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-44.6	178.6	53.6	0	0	0	0	111.9	S143 T144 T150 I151	S143-T147 WeakPolarHBondContact O-CG2 3.18Å; S143-T147 PolarHBondContact O-N 2.91Å; S143-T147 PolarHBondContact O-OG1 3.45Å; S143-T147 VanDerWaalsContact O-OG1 3.1Å; T144-T147 WeakPolarHBondContact CA-OG1 3.4Å; T144-T147 PolarHBondContact O-N 2.96Å; T144-T147 PolarHBondContact O-OG1 2.94Å; T147-T150 PolarHBondContact O-N 3.1Å; T147-I151 WeakPolarHBondContact O-CB 3.32Å; T147-I151 VanDerWaalsContact O-CG1 3.22Å; T147-I151 WeakPolarHBondContact O-CG1 3.41Å; T147-I151 PolarHBondContact O-N 3.35Å
148	L	92.7	Very high	91.2	Very high	18 Å²	18	69.7 Å²	69.7	9%	0.094	37%	0.372	C	S	.	.	H	α-helix	trans	-60.1	-51.6	177	-73.1	173.1	0	0	0	111.3	L19 L20 L23 T144 L145 T150 I151 Y152	L19-L148 HydrophobicContact CB-CD1 3.99Å; L19-L148 HydrophobicContact CB-CD2 4.18Å; L19-L148 HydrophobicContact CD1-CD2 4.18Å; L20-L148 HydrophobicContact CB-CD1 4.1Å; L23-L148 HydrophobicContact CD1-CD1 4.28Å; L23-L148 HydrophobicContact CD1-CD2 4.5Å; T144-L148 HydrophobicContact CG2-CD1 3.89Å; T144-L148 HydrophobicContact CG2-CG 4.26Å; T144-L148 VanDerWaalsContact O-CB 3.31Å; T144-L148 WeakPolarHBondContact O-CB 3.38Å; T144-L148 WeakPolarHBondContact O-CG 3.24Å; T144-L148 PolarHBondContact O-N 2.71Å; L145-L148 PolarHBondContact O-N 2.97Å; L148-T150 VanDerWaalsContact C-N 3.3Å; L148-T150 PolarHBondContact O-N 3.42Å; L148-I151 PolarHBondContact O-N 3.48Å; L148-Y152 HydrophobicContact CD2-CE2 4.22Å; L148-Y152 VanDerWaalsContact O-CD2 3.25Å; L148-Y152 WeakPolarHBondContact O-CD2 3.23Å; L148-Y152 PolarHBondContact O-N 2.96Å
149	V	90.4	Very high	91.2	Very high	54 Å²	54	71.8 Å²	71.8	33%	0.327	39%	0.387	S	S	.	.	H	α-helix	trans	-58.4	-44.3	179.1	170.6	0	0	0	0	110.8	L145 L153	L145-V149 HydrophobicContact CD1-CG2 3.88Å; L145-V149 HydrophobicContact CG-CG2 4.44Å; L145-V149 WeakPolarHBondContact O-CB 3.25Å; L145-V149 VanDerWaalsContact O-CG2 3.24Å; L145-V149 WeakPolarHBondContact O-CG2 3.31Å; L145-V149 PolarHBondContact O-N 3.04Å; V149-L153 HydrophobicContact CG1-CD1 3.69Å; V149-L153 HydrophobicContact CG1-CG 4.32Å; V149-L153 VanDerWaalsContact O-CB 3.31Å; V149-L153 WeakPolarHBondContact O-CB 3.22Å; V149-L153 VanDerWaalsContact O-CG 3.23Å; V149-L153 WeakPolarHBondContact O-CG 3.28Å; V149-L153 PolarHBondContact O-N 2.9Å
150	T	91.4	Very high	91.1	Very high	85 Å²	85	69.4 Å²	69.4	52%	0.521	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-46.9	179	-54.9	0	0	0	0	111.8	S146 T147 L148 L153 L154	S146-T150 WeakPolarHBondContact O-CB 3.33Å; S146-T150 PolarHBondContact O-N 2.94Å; S146-T150 PolarHBondContact O-OG1 3.45Å; T147-T150 PolarHBondContact O-N 3.1Å; L148-T150 VanDerWaalsContact C-N 3.3Å; L148-T150 PolarHBondContact O-N 3.42Å; T150-L153 PolarHBondContact O-N 3.37Å; T150-L154 WeakPolarHBondContact O-CB 3.25Å; T150-L154 PolarHBondContact O-N 3.39Å
151	I	92.6	Very high	91.1	Very high	102 Å²	102	70.5 Å²	70.5	52%	0.523	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-46.9	179.6	-72.2	167.1	0	0	0	110.7	T147 L148 L154 L155	T147-I151 WeakPolarHBondContact O-CB 3.32Å; T147-I151 VanDerWaalsContact O-CG1 3.22Å; T147-I151 WeakPolarHBondContact O-CG1 3.41Å; T147-I151 PolarHBondContact O-N 3.35Å; L148-I151 PolarHBondContact O-N 3.48Å; I151-L154 PolarHBondContact O-N 3.47Å; I151-L155 VanDerWaalsContact O-CB 3.28Å; I151-L155 WeakPolarHBondContact O-CB 3.47Å; I151-L155 PolarHBondContact O-N 3.46Å
152	Y	90.2	Very high	91.2	Very high	54 Å²	54	72.7 Å²	72.7	21%	0.212	41%	0.412	C	S	.	.	H	α-helix	trans	-71.2	-35.6	-178.1	-81.5	-70.4	0	0	0	113.2	F15 C16 L19 L148 L155 S156	F15-Y152 HydrophobicContact CB-CE1 4.43Å; C16-Y152 VanDerWaalsContact SG-CD2 3.59Å; L19-Y152 HydrophobicContact CD1-CE2 3.72Å; L19-Y152 WeakPolarHBondContact CD1-OH 3.31Å; L148-Y152 HydrophobicContact CD2-CE2 4.22Å; L148-Y152 VanDerWaalsContact O-CD2 3.25Å; L148-Y152 WeakPolarHBondContact O-CD2 3.23Å; L148-Y152 PolarHBondContact O-N 2.96Å; Y152-L155 HydrophobicContact CD1-CD2 4.28Å; Y152-L155 HydrophobicContact CE1-CD2 4.43Å; Y152-S156 VanDerWaalsContact O-CB 3.25Å; Y152-S156 WeakPolarHBondContact O-CB 3.34Å; Y152-S156 PolarHBondContact O-N 2.94Å
153	L	88.6	Confident	91.1	Very high	95 Å²	95	72.6 Å²	72.6	50%	0.497	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-43.6	172	-74.8	173.4	0	0	0	111.3	V149 T150 S156 L157	V149-L153 HydrophobicContact CG1-CD1 3.69Å; V149-L153 HydrophobicContact CG1-CG 4.32Å; V149-L153 VanDerWaalsContact O-CB 3.31Å; V149-L153 WeakPolarHBondContact O-CB 3.22Å; V149-L153 VanDerWaalsContact O-CG 3.23Å; V149-L153 WeakPolarHBondContact O-CG 3.28Å; V149-L153 PolarHBondContact O-N 2.9Å; T150-L153 PolarHBondContact O-N 3.37Å; L153-S156 PolarHBondContact O-N 2.69Å; L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 PolarHBondContact O-N 2.88Å
154	L	91.5	Very high	91.1	Very high	103 Å²	103	72.1 Å²	72.1	54%	0.539	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-45.9	176	-168.7	85	0	0	0	111.3	T150 I151 S156 L157 I158	T150-L154 WeakPolarHBondContact O-CB 3.25Å; T150-L154 PolarHBondContact O-N 3.39Å; I151-L154 PolarHBondContact O-N 3.47Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 2.94Å; L154-L157 WeakPolarHBondContact O-CB 3.28Å; L154-L157 PolarHBondContact O-N 3.41Å; L154-I158 HydrophobicContact CD2-CD1 4.07Å; L154-I158 HydrophobicContact CG-CD1 3.93Å; L154-I158 VanDerWaalsContact O-CG1 3.3Å; L154-I158 WeakPolarHBondContact O-CG1 3.28Å; L154-I158 PolarHBondContact O-N 2.88Å
155	L	90.7	Very high	91.2	Very high	95 Å²	95	78.9 Å²	78.9	50%	0.497	43%	0.434	S	S	.	.	H	α-helix	trans	-59.7	-44.9	176.9	179.8	65	0	0	0	111.2	I151 Y152 L157 I158 L159	I151-L155 VanDerWaalsContact O-CB 3.28Å; I151-L155 WeakPolarHBondContact O-CB 3.47Å; I151-L155 PolarHBondContact O-N 3.46Å; Y152-L155 HydrophobicContact CD1-CD2 4.28Å; Y152-L155 HydrophobicContact CE1-CD2 4.43Å; L155-L157 VanDerWaalsContact C-N 3.33Å; L155-L157 PolarHBondContact O-N 2.83Å; L155-I158 PolarHBondContact O-N 3.38Å; L155-L159 VanDerWaalsContact O-CB 3.28Å; L155-L159 WeakPolarHBondContact O-CB 3.24Å; L155-L159 PolarHBondContact O-N 2.95Å
156	S	88.1	Confident	91.2	Very high	32 Å²	32	78.5 Å²	78.5	22%	0.224	44%	0.436	C	S	.	.	H	α-helix	trans	-60.3	-42.7	175.6	-179.1	0	0	0	0	111.6	V8 Y152 L153 L154 T160	V8-S156 WeakPolarHBondContact CG1-OG 3.15Å; Y152-S156 VanDerWaalsContact O-CB 3.25Å; Y152-S156 WeakPolarHBondContact O-CB 3.34Å; Y152-S156 PolarHBondContact O-N 2.94Å; L153-S156 PolarHBondContact O-N 2.69Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 2.94Å; S156-T160 VanDerWaalsContact O-CB 3.28Å; S156-T160 WeakPolarHBondContact O-CB 3.26Å; S156-T160 PolarHBondContact O-N 3.45Å; S156-T160 PolarHBondContact O-OG1 3.2Å
157	L	88.5	Confident	91.1	Very high	107 Å²	107	79.4 Å²	79.4	56%	0.56	43%	0.434	S	S	*	.	H	α-helix	trans	-63.8	-49.9	177.1	179.8	65.2	0	0	0	111.2	L153 L154 L155 L159 T160 V161	L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 PolarHBondContact O-N 2.88Å; L154-L157 WeakPolarHBondContact O-CB 3.28Å; L154-L157 PolarHBondContact O-N 3.41Å; L155-L157 VanDerWaalsContact C-N 3.33Å; L155-L157 PolarHBondContact O-N 2.83Å; L157-L159 PolarHBondContact O-N 3.47Å; L157-T160 PolarHBondContact O-N 3.2Å; L157-V161 HydrophobicContact CD1-CG2 4.34Å; L157-V161 WeakPolarHBondContact O-CG2 3.36Å; L157-V161 PolarHBondContact O-N 3.42Å
158	I	91.6	Very high	91	Very high	99 Å²	99	79.5 Å²	79.5	51%	0.508	43%	0.432	S	S	.	.	H	α-helix	trans	-58.8	-48	179.2	-68.8	167.3	0	0	0	110.3	L154 L155 T160 V161 A162	L154-I158 HydrophobicContact CD2-CD1 4.07Å; L154-I158 HydrophobicContact CG-CD1 3.93Å; L154-I158 VanDerWaalsContact O-CG1 3.3Å; L154-I158 WeakPolarHBondContact O-CG1 3.28Å; L154-I158 PolarHBondContact O-N 2.88Å; L155-I158 PolarHBondContact O-N 3.38Å; I158-T160 VanDerWaalsContact C-N 3.35Å; I158-T160 PolarHBondContact O-N 2.88Å; I158-V161 PolarHBondContact O-N 3.42Å; I158-A162 VanDerWaalsContact O-CB 3.26Å; I158-A162 WeakPolarHBondContact O-CB 3.48Å; I158-A162 PolarHBondContact O-N 2.84Å
159	L	90.3	Very high	90.9	Very high	100 Å²	100	85.7 Å²	85.7	52%	0.524	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-41.7	179.6	-173.7	66.9	0	0	0	111.4	L155 L157 A162 I163	L155-L159 VanDerWaalsContact O-CB 3.28Å; L155-L159 WeakPolarHBondContact O-CB 3.24Å; L155-L159 PolarHBondContact O-N 2.95Å; L157-L159 PolarHBondContact O-N 3.47Å; L159-A162 PolarHBondContact O-N 3.26Å; L159-I163 HydrophobicContact CD1-CD1 3.88Å; L159-I163 HydrophobicContact CD1-CG1 4.15Å; L159-I163 HydrophobicContact CD2-CD1 4.28Å; L159-I163 HydrophobicContact CG-CD1 3.68Å; L159-I163 HydrophobicContact CG-CG1 4.28Å; L159-I163 WeakPolarHBondContact O-CB 3.35Å; L159-I163 VanDerWaalsContact O-CG1 3.24Å; L159-I163 WeakPolarHBondContact O-CG1 3.18Å; L159-I163 PolarHBondContact O-N 2.7Å
160	T	89.7	Confident	90.9	Very high	69 Å²	69	86.2 Å²	86.2	42%	0.423	46%	0.455	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.2	-59.3	0	0	0	0	111.3	S156 L157 I158 S164	S156-T160 VanDerWaalsContact O-CB 3.28Å; S156-T160 WeakPolarHBondContact O-CB 3.26Å; S156-T160 PolarHBondContact O-N 3.45Å; S156-T160 PolarHBondContact O-OG1 3.2Å; L157-T160 PolarHBondContact O-N 3.2Å; I158-T160 VanDerWaalsContact C-N 3.35Å; I158-T160 PolarHBondContact O-N 2.88Å; T160-S164 WeakPolarHBondContact O-CB 3.3Å; T160-S164 PolarHBondContact O-N 2.93Å; T160-S164 PolarHBondContact O-OG 2.85Å
161	V	91.3	Very high	90.9	Very high	90 Å²	90	86.2 Å²	86.2	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-65.2	-44.1	177.3	172.9	0	0	0	0	110.7	L157 I158 S164 W165	L157-V161 HydrophobicContact CD1-CG2 4.34Å; L157-V161 WeakPolarHBondContact O-CG2 3.36Å; L157-V161 PolarHBondContact O-N 3.42Å; I158-V161 PolarHBondContact O-N 3.42Å; V161-S164 PolarHBondContact O-N 2.92Å; V161-W165 VanDerWaalsContact O-CB 3.24Å; V161-W165 WeakPolarHBondContact O-CB 3.49Å; V161-W165 PolarHBondContact O-N 2.92Å
162	A	92.7	Very high	90.8	Very high	50 Å²	50	84.5 Å²	84.5	41%	0.413	44%	0.442	S	S	.	.	H	α-helix	trans	-64.1	-47.3	179.6	0	0	0	0	0	112.3	I158 L159 W165 C166	I158-A162 VanDerWaalsContact O-CB 3.26Å; I158-A162 WeakPolarHBondContact O-CB 3.48Å; I158-A162 PolarHBondContact O-N 2.84Å; L159-A162 PolarHBondContact O-N 3.26Å; A162-W165 PolarHBondContact O-N 2.84Å; A162-C166 VanDerWaalsContact O-CB 3.27Å; A162-C166 WeakPolarHBondContact O-CB 3.46Å; A162-C166 PolarHBondContact O-N 3.24Å
163	I	91.1	Very high	90.9	Very high	83 Å²	83	86.8 Å²	86.8	43%	0.426	46%	0.455	S	S	.	.	H	α-helix	trans	-63.5	-45.4	176	-68	172.6	0	0	0	110.2	L159 W165 C166 I167	L159-I163 HydrophobicContact CD1-CD1 3.88Å; L159-I163 HydrophobicContact CD1-CG1 4.15Å; L159-I163 HydrophobicContact CD2-CD1 4.28Å; L159-I163 HydrophobicContact CG-CD1 3.68Å; L159-I163 HydrophobicContact CG-CG1 4.28Å; L159-I163 WeakPolarHBondContact O-CB 3.35Å; L159-I163 VanDerWaalsContact O-CG1 3.24Å; L159-I163 WeakPolarHBondContact O-CG1 3.18Å; L159-I163 PolarHBondContact O-N 2.7Å; I163-W165 VanDerWaalsContact C-N 3.32Å; I163-W165 PolarHBondContact O-N 3.37Å; I163-C166 WeakPolarHBondContact O-CB 3.24Å; I163-C166 PolarHBondContact O-N 2.84Å; I163-I167 HydrophobicContact CG2-CD1 3.66Å; I163-I167 HydrophobicContact CG2-CG1 4.23Å; I163-I167 WeakPolarHBondContact O-CG1 3.37Å; I163-I167 PolarHBondContact O-N 3.34Å
164	S	91.3	Very high	91.1	Very high	62 Å²	62	83.1 Å²	83.1	43%	0.434	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-42	178.5	-60.9	0	0	0	0	111.6	T160 V161 N168	T160-S164 WeakPolarHBondContact O-CB 3.3Å; T160-S164 PolarHBondContact O-N 2.93Å; T160-S164 PolarHBondContact O-OG 2.85Å; V161-S164 PolarHBondContact O-N 2.92Å; S164-N168 WeakPolarHBondContact O-CB 3.35Å; S164-N168 PolarHBondContact O-N 2.84Å
165	W	93.9	Very high	91.1	Very high	154 Å²	154	81.4 Å²	81.4	58%	0.583	43%	0.427	S	S	*	.	H	α-helix	trans	-64.3	-42.9	175.2	179.9	86.3	0	0	0	111.7	V161 A162 I163 N168 R169	V161-W165 VanDerWaalsContact O-CB 3.24Å; V161-W165 WeakPolarHBondContact O-CB 3.49Å; V161-W165 PolarHBondContact O-N 2.92Å; A162-W165 PolarHBondContact O-N 2.84Å; I163-W165 VanDerWaalsContact C-N 3.32Å; I163-W165 PolarHBondContact O-N 3.37Å; W165-N168 PolarHBondContact O-N 3.47Å; W165-R169 WeakPolarHBondContact O-CB 3.14Å; W165-R169 PolarHBondContact O-N 3.43Å
166	C	92.8	Very high	91.2	Very high	54 Å²	54	82.8 Å²	82.8	37%	0.365	43%	0.426	S	S	.	.	H	α-helix	trans	-62.2	-50.6	177.5	-170.3	0	0	0	0	111.7	A162 I163 N168 R169 L170	A162-C166 VanDerWaalsContact O-CB 3.27Å; A162-C166 WeakPolarHBondContact O-CB 3.46Å; A162-C166 PolarHBondContact O-N 3.24Å; I163-C166 WeakPolarHBondContact O-CB 3.24Å; I163-C166 PolarHBondContact O-N 2.84Å; C166-N168 PolarHBondContact O-N 3.31Å; C166-R169 PolarHBondContact O-N 2.95Å; C166-L170 VanDerWaalsContact O-CB 3.28Å; C166-L170 WeakPolarHBondContact O-CB 3.28Å; C166-L170 WeakPolarHBondContact O-CG 3.47Å; C166-L170 PolarHBondContact O-N 2.86Å; C166-L170 WeakPolarHBondContact SG-CD1 3.46Å
167	I	91.2	Very high	91.4	Very high	91 Å²	91	84.6 Å²	84.6	47%	0.467	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-45.5	177	-67.6	172.6	0	0	0	110.5	I163 R169 I171 L172	I163-I167 HydrophobicContact CG2-CD1 3.66Å; I163-I167 HydrophobicContact CG2-CG1 4.23Å; I163-I167 WeakPolarHBondContact O-CG1 3.37Å; I163-I167 PolarHBondContact O-N 3.34Å; I167-R169 PolarHBondContact O-N 2.6Å; I167-I171 WeakPolarHBondContact O-CA 3.28Å; I167-I171 WeakPolarHBondContact O-CB 3.27Å; I167-I171 PolarHBondContact O-N 2.94Å; I167-L172 PolarHBondContact O-N 3.47Å
168	N	90.6	Very high	91.6	Very high	73 Å²	73	80.2 Å²	80.2	39%	0.39	41%	0.41	S	S	.	.	I	π-helix	trans	-64.1	-41.6	-179	-173.3	43.6	0	0	0	111.7	S164 W165 C166 L172 H173	S164-N168 WeakPolarHBondContact O-CB 3.35Å; S164-N168 PolarHBondContact O-N 2.84Å; W165-N168 PolarHBondContact O-N 3.47Å; C166-N168 PolarHBondContact O-N 3.31Å; N168-L172 WeakPolarHBondContact OD1-CD2 3.26Å; N168-H173 WeakPolarHBondContact O-CB 3.34Å; N168-H173 PolarHBondContact O-N 3.16Å
169	R	91.5	Very high	91.6	Very high	147 Å²	147	77.8 Å²	77.8	56%	0.555	41%	0.405	S	S	*	.	I	π-helix	trans	-78.4	-42.7	-177.3	-174.7	176.6	178.6	-177.1	-0.6	113.3	W165 C166 I167 P174	W165-R169 WeakPolarHBondContact O-CB 3.14Å; W165-R169 PolarHBondContact O-N 3.43Å; C166-R169 PolarHBondContact O-N 2.95Å; I167-R169 PolarHBondContact O-N 2.6Å; R169-P174 WeakPolarHBondContact O-CD 3.44Å
170	L	89.5	Confident	91.8	Very high	66 Å²	66	80 Å²	80	35%	0.346	41%	0.406	S	S	.	.	I	π-helix	trans	-88.2	-30.1	-174.7	-62.7	-178	0	0	0	113	C166 P174 L200 H201	C166-L170 VanDerWaalsContact O-CB 3.28Å; C166-L170 WeakPolarHBondContact O-CB 3.28Å; C166-L170 WeakPolarHBondContact O-CG 3.47Å; C166-L170 PolarHBondContact O-N 2.86Å; C166-L170 WeakPolarHBondContact SG-CD1 3.46Å; L170-P174 WeakPolarHBondContact O-CG 3.38Å; L170-L200 HydrophobicContact CD2-CD1 3.76Å; L170-H201 PolarHBondContact O-CE1 3.24Å; L170-H201 PolarHBondContact O-NE2 3.07Å
171	I	90.6	Very high	91.9	Very high	85 Å²	85	80.2 Å²	80.2	44%	0.436	40%	0.402	S	S	.	.	I	π-helix	trans	-112.3	-56.6	-175.1	-57.7	175.2	0	0	0	110.4	I167 H173 P174 L175	I167-I171 WeakPolarHBondContact O-CA 3.28Å; I167-I171 WeakPolarHBondContact O-CB 3.27Å; I167-I171 PolarHBondContact O-N 2.94Å; I171-H173 PolarHBondContact O-N 2.83Å; I171-P174 WeakPolarHBondContact O-CD 3.37Å; I171-L175 HydrophobicContact CG2-CD1 3.71Å; I171-L175 WeakPolarHBondContact O-CB 3.38Å; I171-L175 VanDerWaalsContact O-CG 3.26Å; I171-L175 WeakPolarHBondContact O-CG 3.42Å; I171-L175 PolarHBondContact O-N 3.37Å
172	L	91.9	Very high	91.9	Very high	66 Å²	66	78.7 Å²	78.7	35%	0.346	39%	0.391	S	S	.	.	I	π-helix	trans	-70.1	-40.2	-168.4	-168	58.5	0	0	0	112.9	I167 N168 R176	I167-L172 PolarHBondContact O-N 3.47Å; N168-L172 WeakPolarHBondContact OD1-CD2 3.26Å; L172-R176 HydrophobicContact CD1-CG 4.41Å; L172-R176 HydrophobicContact CG-CG 4.47Å; L172-R176 VanDerWaalsContact O-CB 3.29Å; L172-R176 WeakPolarHBondContact O-CB 3.5Å; L172-R176 VanDerWaalsContact O-CG 3.23Å; L172-R176 WeakPolarHBondContact O-CG 3.43Å; L172-R176 PolarHBondContact O-N 3.28Å
173	H	92	Very high	91.8	Very high	101 Å²	101	83.3 Å²	83.3	47%	0.468	41%	0.409	S	S	.	.	H	α-helix	trans	-68.9	-47.7	-178.9	-163.8	-62	0	0	0	112.9	N168 I171 L175 R176 N177	N168-H173 WeakPolarHBondContact O-CB 3.34Å; N168-H173 PolarHBondContact O-N 3.16Å; I171-H173 PolarHBondContact O-N 2.83Å; H173-L175 PolarHBondContact O-N 2.87Å; H173-R176 PolarHBondContact O-N 2.86Å; H173-N177 PolarHBondContact CE1-ND2 3.19Å; H173-N177 PolarHBondContact CE1-OD1 2.87Å; H173-N177 PolarHBondContact ND1-ND2 3.48Å; H173-N177 PolarHBondContact ND1-OD1 3.46Å; H173-N177 VanDerWaalsContact O-CG 3.29Å; H173-N177 PolarHBondContact O-N 3.01Å; H173-N177 PolarHBondContact O-OD1 2.96Å
174	P	91.6	Very high	91.8	Very high	18 Å²	18	83 Å²	83	12%	0.117	42%	0.418	C	S	.	.	H	α-helix	trans	-59.2	-44.6	173.8	-26.9	37.5	0	0	0	112.9	R169 L170 I171 R176 N177 I178 P198	R169-P174 WeakPolarHBondContact O-CD 3.44Å; L170-P174 WeakPolarHBondContact O-CG 3.38Å; I171-P174 WeakPolarHBondContact O-CD 3.37Å; P174-R176 PolarHBondContact O-N 3.36Å; P174-N177 WeakPolarHBondContact O-CB 3.42Å; P174-N177 PolarHBondContact O-N 3.06Å; P174-I178 WeakPolarHBondContact O-CG1 3.19Å; P174-I178 PolarHBondContact O-N 3.44Å; P174-P198 HydrophobicContact CB-CG 4.5Å
175	L	92.5	Very high	91.7	Very high	67 Å²	67	81.1 Å²	81.1	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-41.3	177.4	-71.4	175.8	0	0	0	112.6	I171 H173 N177 I178 A179 I206	I171-L175 HydrophobicContact CG2-CD1 3.71Å; I171-L175 WeakPolarHBondContact O-CB 3.38Å; I171-L175 VanDerWaalsContact O-CG 3.26Å; I171-L175 WeakPolarHBondContact O-CG 3.42Å; I171-L175 PolarHBondContact O-N 3.37Å; H173-L175 PolarHBondContact O-N 2.87Å; L175-N177 VanDerWaalsContact C-N 3.31Å; L175-N177 PolarHBondContact O-N 3.39Å; L175-I178 PolarHBondContact O-N 2.9Å; L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.38Å; L175-I206 HydrophobicContact CD2-CD1 4.07Å; L175-I206 HydrophobicContact CD2-CG1 4.21Å; L175-I206 HydrophobicContact CG-CD1 3.98Å
176	R	92.4	Very high	91.4	Very high	124 Å²	124	77 Å²	77	47%	0.468	40%	0.396	S	S	.	.	H	α-helix	trans	-63.6	-37.1	174.8	-80.4	175.6	175.5	170.8	-1.6	112.2	L172 H173 P174 R180	L172-R176 HydrophobicContact CD1-CG 4.41Å; L172-R176 HydrophobicContact CG-CG 4.47Å; L172-R176 VanDerWaalsContact O-CB 3.29Å; L172-R176 WeakPolarHBondContact O-CB 3.5Å; L172-R176 VanDerWaalsContact O-CG 3.23Å; L172-R176 WeakPolarHBondContact O-CG 3.43Å; L172-R176 PolarHBondContact O-N 3.28Å; H173-R176 PolarHBondContact O-N 2.86Å; P174-R176 PolarHBondContact O-N 3.36Å; R176-R180 WeakPolarHBondContact O-CB 3.29Å; R176-R180 VanDerWaalsContact O-CG 3.26Å; R176-R180 WeakPolarHBondContact O-CG 3.47Å; R176-R180 PolarHBondContact O-N 3.36Å
177	N	91.8	Very high	90.9	Very high	70 Å²	70	78.9 Å²	78.9	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-49.3	176.5	-72.6	-5.6	0	0	0	110.7	H173 P174 L175 A179 R180 E181	H173-N177 PolarHBondContact CE1-ND2 3.19Å; H173-N177 PolarHBondContact CE1-OD1 2.87Å; H173-N177 PolarHBondContact ND1-ND2 3.48Å; H173-N177 PolarHBondContact ND1-OD1 3.46Å; H173-N177 VanDerWaalsContact O-CG 3.29Å; H173-N177 PolarHBondContact O-N 3.01Å; H173-N177 PolarHBondContact O-OD1 2.96Å; P174-N177 WeakPolarHBondContact O-CB 3.42Å; P174-N177 PolarHBondContact O-N 3.06Å; L175-N177 VanDerWaalsContact C-N 3.31Å; L175-N177 PolarHBondContact O-N 3.39Å; N177-A179 VanDerWaalsContact C-N 3.33Å; N177-A179 PolarHBondContact O-N 2.89Å; N177-R180 PolarHBondContact O-N 3.45Å; N177-R180 PolarHBondContact OD1-NH1 2.94Å; N177-E181 WeakPolarHBondContact O-CB 3.37Å; N177-E181 PolarHBondContact O-N 3.13Å
178	I	92.9	Very high	90.3	Very high	16 Å²	16	84.3 Å²	84.3	8%	0.082	44%	0.436	C	S	.	.	H	α-helix	trans	-57.6	-46.3	176	-66.2	165.1	0	0	0	110.7	P174 L175 R180 E181 L182 L195 P198 I206 V210	P174-I178 WeakPolarHBondContact O-CG1 3.19Å; P174-I178 PolarHBondContact O-N 3.44Å; L175-I178 PolarHBondContact O-N 2.9Å; I178-R180 PolarHBondContact O-N 3.41Å; I178-E181 PolarHBondContact O-N 3.46Å; I178-L182 HydrophobicContact CG2-CD1 3.93Å; I178-L182 HydrophobicContact CG2-CG 4.38Å; I178-L182 WeakPolarHBondContact O-CB 3.05Å; I178-L182 WeakPolarHBondContact O-CG 3.4Å; I178-L182 PolarHBondContact O-N 3.08Å; I178-L195 HydrophobicContact CG2-CD1 3.81Å; I178-L195 HydrophobicContact CG2-CD2 4.3Å; I178-P198 HydrophobicContact CD1-CG 4.43Å; I178-I206 HydrophobicContact CD1-CG2 3.97Å; I178-V210 HydrophobicContact CD1-CG2 3.77Å
179	A	92.9	Very high	90	Very high	47 Å²	47	86.8 Å²	86.8	39%	0.388	45%	0.445	S	S	.	.	H	α-helix	trans	-64.5	-37.7	179.6	0	0	0	0	0	113.1	L175 N177 N183	L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.38Å; N177-A179 VanDerWaalsContact C-N 3.33Å; N177-A179 PolarHBondContact O-N 2.89Å; A179-N183 WeakPolarHBondContact O-CB 3.35Å; A179-N183 VanDerWaalsContact O-CG 3.28Å; A179-N183 PolarHBondContact O-N 3.49Å; A179-N183 VanDerWaalsContact O-N 3.08Å; A179-N183 PolarHBondContact O-ND2 2.94Å; A179-N183 VanDerWaalsContact O-ND2 3.13Å
180	R	93.2	Very high	89.7	Confident	148 Å²	148	83.7 Å²	83.7	56%	0.558	44%	0.439	S	S	*	.	H	α-helix	trans	-68.6	-41.8	175.3	-75.6	179.3	-162.8	137.7	-4.4	111.7	R176 N177 I178 N183 A184	R176-R180 WeakPolarHBondContact O-CB 3.29Å; R176-R180 VanDerWaalsContact O-CG 3.26Å; R176-R180 WeakPolarHBondContact O-CG 3.47Å; R176-R180 PolarHBondContact O-N 3.36Å; N177-R180 PolarHBondContact O-N 3.45Å; N177-R180 PolarHBondContact OD1-NH1 2.94Å; I178-R180 PolarHBondContact O-N 3.41Å; R180-N183 PolarHBondContact O-N 2.92Å; R180-A184 VanDerWaalsContact O-CB 3.28Å; R180-A184 WeakPolarHBondContact O-CB 3.23Å; R180-A184 PolarHBondContact O-N 2.98Å
181	E	92.6	Very high	89.5	Confident	72 Å²	72	83.5 Å²	83.5	34%	0.336	44%	0.441	S	S	.	.	H	α-helix	trans	-58.5	-54.4	176.1	-171.6	173.2	158.5	0	0	109.5	N177 I178 N183 A184 I185 H193 L195	N177-E181 WeakPolarHBondContact O-CB 3.37Å; N177-E181 PolarHBondContact O-N 3.13Å; I178-E181 PolarHBondContact O-N 3.46Å; E181-N183 VanDerWaalsContact C-N 3.3Å; E181-N183 PolarHBondContact O-N 2.69Å; E181-A184 PolarHBondContact O-N 3.42Å; E181-I185 WeakPolarHBondContact O-CG1 3.47Å; E181-I185 PolarHBondContact O-N 2.93Å; E181-H193 IonicContact OE1-CE1 3.15Å; E181-H193 PolarHBondContact OE1-CE1 3.39Å; E181-H193 IonicContact OE1-NE2 2.77Å; E181-L195 HydrophobicContact CB-CD2 4.36Å; E181-L195 HydrophobicContact CG-CD2 4.02Å; E181-L195 WeakPolarHBondContact OE1-CD2 3.33Å
182	L	90.6	Very high	89.2	Confident	59 Å²	59	80.1 Å²	80.1	31%	0.309	43%	0.427	S	S	.	.	H	α-helix	trans	-57.9	-37.8	178.2	-68.9	175.3	0	0	0	113.8	I178 A184 I185 L195 Y213	I178-L182 HydrophobicContact CG2-CD1 3.93Å; I178-L182 HydrophobicContact CG2-CG 4.38Å; I178-L182 WeakPolarHBondContact O-CB 3.05Å; I178-L182 WeakPolarHBondContact O-CG 3.4Å; I178-L182 PolarHBondContact O-N 3.08Å; L182-A184 VanDerWaalsContact C-N 3.32Å; L182-I185 HydrophobicContact CD2-CD1 3.93Å; L182-L195 HydrophobicContact CD2-CD1 4.26Å; L182-L195 HydrophobicContact CD2-CD2 4.04Å; L182-L195 HydrophobicContact CD2-CG 4.39Å; L182-L195 HydrophobicContact CG-CD2 4.22Å; L182-Y213 HydrophobicContact CD2-CE1 4.13Å; L182-Y213 HydrophobicContact CD2-CE2 3.79Å; L182-Y213 WeakPolarHBondContact CD2-OH 3.41Å
183	N	91.7	Very high	89.2	Confident	146 Å²	146	78.9 Å²	78.9	78%	0.781	42%	0.419	S	S	*	.	H	α-helix	trans	-75.1	-19.6	177.1	-76.8	-30.1	0	0	0	113.8	A179 R180 E181	A179-N183 WeakPolarHBondContact O-CB 3.35Å; A179-N183 VanDerWaalsContact O-CG 3.28Å; A179-N183 PolarHBondContact O-N 3.49Å; A179-N183 VanDerWaalsContact O-N 3.08Å; A179-N183 PolarHBondContact O-ND2 2.94Å; A179-N183 VanDerWaalsContact O-ND2 3.13Å; R180-N183 PolarHBondContact O-N 2.92Å; E181-N183 VanDerWaalsContact C-N 3.3Å; E181-N183 PolarHBondContact O-N 2.69Å
184	A	91.2	Very high	89.2	Confident	76 Å²	76	79 Å²	79	63%	0.628	42%	0.42	S	S	*	.	H	α-helix	trans	-92.6	-11.3	-179	0	0	0	0	0	113.1	R180 E181 L182 P186	R180-A184 VanDerWaalsContact O-CB 3.28Å; R180-A184 WeakPolarHBondContact O-CB 3.23Å; R180-A184 PolarHBondContact O-N 2.98Å; E181-A184 PolarHBondContact O-N 3.42Å; L182-A184 VanDerWaalsContact C-N 3.32Å; A184-P186 WeakPolarHBondContact O-CD 3.44Å
185	I	88.2	Confident	89.2	Confident	24 Å²	24	78.6 Å²	78.6	12%	0.123	42%	0.417	C	S	.	.			trans	-64.6	122.5	-179	-62.6	164.8	0	0	0	109.6	E181 L182 E189 L190 H193	E181-I185 WeakPolarHBondContact O-CG1 3.47Å; E181-I185 PolarHBondContact O-N 2.93Å; L182-I185 HydrophobicContact CD2-CD1 3.93Å; I185-E189 HydrophobicContact CG2-CB 4.14Å; I185-L190 HydrophobicContact CB-CD1 4.32Å; I185-L190 HydrophobicContact CG2-CB 4.34Å; I185-L190 HydrophobicContact CG2-CD1 4Å; I185-H193 HydrophobicContact CD1-CB 4.21Å
186	P	88.3	Confident	89	Confident	66 Å²	66	79 Å²	79	43%	0.429	43%	0.43	S	S	.	.			trans	-67.1	145.8	172.4	27.3	-31.7	0	0	0	110.4	A184 K188 E189 L190	A184-P186 WeakPolarHBondContact O-CD 3.44Å; P186-K188 PolarHBondContact O-N 2.95Å; P186-E189 HydrophobicContact CG-CB 4.06Å; P186-E189 HydrophobicContact CG-CG 3.97Å; P186-E189 PolarHBondContact O-N 2.89Å; P186-L190 PolarHBondContact O-N 3.4Å
187	A	81.5	Confident	88.9	Confident	94 Å²	94	76.4 Å²	76.4	78%	0.777	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-53.9	-27.4	-173.4	0	0	0	0	0	114.9
188	K	79.2	Confident	88.7	Confident	205 Å²	205	74.5 Å²	74.5	89%	0.891	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-73.6	-26.1	178.1	-68.3	-174.6	176.8	-175.5	0	114.1	P186	P186-K188 PolarHBondContact O-N 2.95Å
189	E	83.8	Confident	88.3	Confident	126 Å²	126	85 Å²	85	59%	0.589	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-100.1	3.3	-177.2	-65.3	174.7	-167.3	0	0	111.9	I185 P186 V191 H193	I185-E189 HydrophobicContact CG2-CB 4.14Å; P186-E189 HydrophobicContact CG-CB 4.06Å; P186-E189 HydrophobicContact CG-CG 3.97Å; P186-E189 PolarHBondContact O-N 2.89Å; E189-V191 PolarHBondContact O-N 3.05Å; E189-H193 WeakPolarHBondContact O-CB 3.45Å
190	L	85.2	Confident	87.9	Confident	82 Å²	82	88.9 Å²	88.9	43%	0.429	47%	0.468	S	S	.	.			trans	-66.3	-39.4	-174.9	-165.1	75.2	0	0	0	112.5	I185 P186 Q217	I185-L190 HydrophobicContact CB-CD1 4.32Å; I185-L190 HydrophobicContact CG2-CB 4.34Å; I185-L190 HydrophobicContact CG2-CD1 4Å; P186-L190 PolarHBondContact O-N 3.4Å; L190-Q217 PolarHBondContact O-NE2 3.22Å; L190-Q217 PolarHBondContact O-OE1 3.4Å
191	V	84.7	Confident	87.7	Confident	62 Å²	62	82.3 Å²	82.3	38%	0.376	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	121	-179.7	179.5	0	0	0	0	109.1	E189 Q221	E189-V191 PolarHBondContact O-N 3.05Å; V191-Q221 HydrophobicContact CG1-CB 4.04Å
192	G	85	Confident	87.3	Confident	14 Å²	14	84.6 Å²	84.6	14%	0.144	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-1.9	178.9	0	0	0	0	0	114.7	Q194	G192-Q194 PolarHBondContact O-N 3.33Å
193	H	91.7	Very high	87.2	Confident	40 Å²	40	89.2 Å²	89.2	19%	0.185	48%	0.479	C	S	.	.			trans	-59.4	134.3	175.6	-178.1	-81.4	0	0	0	111.7	E181 I185 E189 Y213 Q217	E181-H193 IonicContact OE1-CE1 3.15Å; E181-H193 PolarHBondContact OE1-CE1 3.39Å; E181-H193 IonicContact OE1-NE2 2.77Å; I185-H193 HydrophobicContact CD1-CB 4.21Å; E189-H193 WeakPolarHBondContact O-CB 3.45Å; H193-Y213 WeakPolarHBondContact O-CE1 3.34Å; H193-Q217 WeakPolarHBondContact O-CB 3.26Å; H193-Q217 WeakPolarHBondContact O-CG 3.4Å
194	Q	91.9	Very high	87.1	Confident	104 Å²	104	84.2 Å²	84.2	49%	0.486	45%	0.453	S	S	.	.			trans	-116.3	127.7	177.1	-61.4	-174.2	25.3	0	0	111	G192 N214	G192-Q194 PolarHBondContact O-N 3.33Å; Q194-N214 WeakPolarHBondContact CA-OD1 3.5Å
195	L	91.4	Very high	87.2	Confident	9 Å²	9	87.9 Å²	87.9	5%	0.047	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-76.8	139.9	172.7	-69	170.1	0	0	0	110.3	I178 E181 L182 V210 Y213 N214	I178-L195 HydrophobicContact CG2-CD1 3.81Å; I178-L195 HydrophobicContact CG2-CD2 4.3Å; E181-L195 HydrophobicContact CB-CD2 4.36Å; E181-L195 HydrophobicContact CG-CD2 4.02Å; E181-L195 WeakPolarHBondContact OE1-CD2 3.33Å; L182-L195 HydrophobicContact CD2-CD1 4.26Å; L182-L195 HydrophobicContact CD2-CD2 4.04Å; L182-L195 HydrophobicContact CD2-CG 4.39Å; L182-L195 HydrophobicContact CG-CD2 4.22Å; L195-V210 HydrophobicContact CB-CG1 3.93Å; L195-Y213 HydrophobicContact CB-CD1 4.4Å; L195-Y213 HydrophobicContact CD1-CD1 3.46Å; L195-Y213 VanDerWaalsContact CD1-CD1 3.46Å; L195-Y213 HydrophobicContact CD1-CE1 3.88Å; L195-Y213 HydrophobicContact CD1-CG 3.88Å; L195-Y213 HydrophobicContact CG-CD1 3.71Å; L195-Y213 HydrophobicContact CG-CE1 3.75Å; L195-N214 PolarHBondContact N-OD1 3.47Å; L195-N214 PolarHBondContact O-ND2 3.34Å
196	A	89.8	Confident	87.4	Confident	75 Å²	75	87.6 Å²	87.6	62%	0.62	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-75.2	131.7	173.2	0	0	0	0	0	111.4	P198	A196-P198 WeakPolarHBondContact O-CD 3.45Å
197	L	88.4	Confident	87.6	Confident	70 Å²	70	84.5 Å²	84.5	37%	0.366	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-67.7	122.2	178.2	-167	71.7	0	0	0	110.6	R199 Q202 V210	L197-R199 PolarHBondContact O-N 3.4Å; L197-Q202 HydrophobicContact CD2-CG 4.08Å; L197-V210 HydrophobicContact CD1-CB 4.11Å; L197-V210 HydrophobicContact CD1-CG1 4.01Å
198	P	87.7	Confident	88.2	Confident	29 Å²	29	85.7 Å²	85.7	19%	0.188	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-64.4	136.7	176.5	-20	32.3	0	0	0	111.2	P174 I178 A196 L200 H201 I206	P174-P198 HydrophobicContact CB-CG 4.5Å; I178-P198 HydrophobicContact CD1-CG 4.43Å; A196-P198 WeakPolarHBondContact O-CD 3.45Å; P198-L200 VanDerWaalsContact C-N 3.25Å; P198-L200 PolarHBondContact O-N 3.42Å; P198-H201 HydrophobicContact CB-CB 4.04Å; P198-H201 HydrophobicContact CG-CB 4.37Å; P198-H201 PolarHBondContact O-N 2.93Å; P198-I206 HydrophobicContact CG-CG2 4.45Å
199	R	84.6	Confident	88.9	Confident	237 Å²	237	80.8 Å²	80.8	89%	0.894	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.3	-170.2	-66.5	-176.2	-178.8	178.3	-0.2	115.5	L197	L197-R199 PolarHBondContact O-N 3.4Å
200	L	85.6	Confident	89.4	Confident	129 Å²	129	74.9 Å²	74.9	68%	0.675	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.2	-178.5	-65.9	169.8	0	0	0	113.2	L170 P198	L170-L200 HydrophobicContact CD2-CD1 3.76Å; P198-L200 VanDerWaalsContact C-N 3.25Å; P198-L200 PolarHBondContact O-N 3.42Å
201	H	88.6	Confident	89.8	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.046	38%	0.38	C	S	.	.			trans	-117.4	49.3	-170.3	-64.7	-80.8	0	0	0	110.3	L170 P198 D204 I206 G207	L170-H201 PolarHBondContact O-CE1 3.24Å; L170-H201 PolarHBondContact O-NE2 3.07Å; P198-H201 HydrophobicContact CB-CB 4.04Å; P198-H201 HydrophobicContact CG-CB 4.37Å; P198-H201 PolarHBondContact O-N 2.93Å; H201-D204 WeakPolarHBondContact CA-OD1 3.44Å; H201-D204 VanDerWaalsContact CB-OD1 3.28Å; H201-D204 WeakPolarHBondContact CB-OD1 3.13Å; H201-D204 IonicContact CE1-OD2 2.79Å; H201-D204 PolarHBondContact CE1-OD2 3.21Å; H201-D204 IonicContact CG-OD1 3.07Å; H201-D204 IonicContact CG-OD2 3.98Å; H201-D204 IonicContact ND1-OD1 3.5Å; H201-D204 PolarHBondContact ND1-OD1 3.38Å; H201-D204 IonicContact ND1-OD2 2.69Å; H201-D204 PolarHBondContact ND1-OD2 2.91Å; H201-I206 HydrophobicContact CB-CB 4.15Å; H201-I206 HydrophobicContact CB-CG2 4.18Å; H201-G207 WeakPolarHBondContact O-CA 3.4Å
202	Q	84.8	Confident	90.2	Very high	120 Å²	120	75.9 Å²	75.9	56%	0.561	38%	0.383	S	S	*	.	S	Bend	trans	-78	-47.1	179.8	-68.6	-174.4	-11.3	0	0	111.2	L197 R211	L197-Q202 HydrophobicContact CD2-CG 4.08Å; Q202-R211 VanDerWaalsContact O-CZ 3.26Å; Q202-R211 PolarHBondContact O-NH1 3.49Å; Q202-R211 PolarHBondContact O-NH2 2.86Å
203	D	87.1	Confident	90.6	Very high	155 Å²	155	77.6 Å²	77.6	83%	0.829	39%	0.385	S	S	*	.	S	Bend	trans	-122.4	41.1	-174.3	-70.6	-28.4	0	0	0	113.3
204	D	90.6	Very high	90.7	Very high	42 Å²	42	76.9 Å²	76.9	23%	0.225	38%	0.382	C	S	.	.	S	Bend	trans	-127.3	-177.6	175.3	73.4	-3.2	0	0	0	112.7	H201 I206 G207 M208	H201-D204 WeakPolarHBondContact CA-OD1 3.44Å; H201-D204 VanDerWaalsContact CB-OD1 3.28Å; H201-D204 WeakPolarHBondContact CB-OD1 3.13Å; H201-D204 IonicContact CE1-OD2 2.79Å; H201-D204 PolarHBondContact CE1-OD2 3.21Å; H201-D204 IonicContact CG-OD1 3.07Å; H201-D204 IonicContact CG-OD2 3.98Å; H201-D204 IonicContact ND1-OD1 3.5Å; H201-D204 PolarHBondContact ND1-OD1 3.38Å; H201-D204 IonicContact ND1-OD2 2.69Å; H201-D204 PolarHBondContact ND1-OD2 2.91Å; D204-I206 VanDerWaalsContact C-N 3.26Å; D204-I206 PolarHBondContact O-N 2.99Å; D204-I206 PolarHBondContact OD1-N 3.18Å; D204-G207 PolarHBondContact O-N 3.24Å; D204-G207 VanDerWaalsContact O-N 3.16Å; D204-G207 PolarHBondContact OD1-N 3.34Å; D204-M208 WeakPolarHBondContact O-CG 3.48Å; D204-M208 PolarHBondContact O-N 3.45Å
205	E	92.9	Very high	90.8	Very high	153 Å²	153	76.5 Å²	76.5	72%	0.715	38%	0.383	S	S	*	.	H	α-helix	trans	-64	-30.5	-175.9	-60.8	85.7	169	0	0	112.6	L209	E205-L209 WeakPolarHBondContact O-CB 3.43Å; E205-L209 PolarHBondContact O-N 3.06Å
206	I	92.6	Very high	90.9	Very high	18 Å²	18	79.9 Å²	79.9	9%	0.092	40%	0.401	C	S	.	.	H	α-helix	trans	-71.2	-44.1	174.9	-61.2	-175.2	0	0	0	109.6	L175 I178 P198 H201 D204 L209 V210	L175-I206 HydrophobicContact CD2-CD1 4.07Å; L175-I206 HydrophobicContact CD2-CG1 4.21Å; L175-I206 HydrophobicContact CG-CD1 3.98Å; I178-I206 HydrophobicContact CD1-CG2 3.97Å; P198-I206 HydrophobicContact CG-CG2 4.45Å; H201-I206 HydrophobicContact CB-CB 4.15Å; H201-I206 HydrophobicContact CB-CG2 4.18Å; D204-I206 VanDerWaalsContact C-N 3.26Å; D204-I206 PolarHBondContact O-N 2.99Å; D204-I206 PolarHBondContact OD1-N 3.18Å; I206-L209 PolarHBondContact O-N 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.42Å; I206-V210 PolarHBondContact O-N 2.99Å
207	G	93.1	Very high	91	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-43	174.4	0	0	0	0	0	113	H201 D204 V210 R211	H201-G207 WeakPolarHBondContact O-CA 3.4Å; D204-G207 PolarHBondContact O-N 3.24Å; D204-G207 VanDerWaalsContact O-N 3.16Å; D204-G207 PolarHBondContact OD1-N 3.34Å; G207-V210 PolarHBondContact O-N 3.36Å; G207-R211 WeakPolarHBondContact O-CG 3.48Å; G207-R211 PolarHBondContact O-N 3.5Å
208	M	93.6	Very high	91.1	Very high	119 Å²	119	77.4 Å²	77.4	59%	0.586	38%	0.375	S	S	*	.	H	α-helix	trans	-61.1	-43.7	173.8	-73.7	179.3	60.8	0	0	112.1	D204 R211 S212	D204-M208 WeakPolarHBondContact O-CG 3.48Å; D204-M208 PolarHBondContact O-N 3.45Å; M208-R211 PolarHBondContact O-N 3.42Å; M208-S212 WeakPolarHBondContact O-CB 3.25Å; M208-S212 PolarHBondContact O-N 3.39Å
209	L	93.7	Very high	91.3	Very high	103 Å²	103	79.6 Å²	79.6	54%	0.539	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-46.8	177.4	-176.5	71.2	0	0	0	111.4	E205 I206 S212 Y213	E205-L209 WeakPolarHBondContact O-CB 3.43Å; E205-L209 PolarHBondContact O-N 3.06Å; I206-L209 PolarHBondContact O-N 3.24Å; L209-S212 PolarHBondContact O-N 3.09Å; L209-Y213 WeakPolarHBondContact O-CB 3.47Å; L209-Y213 PolarHBondContact O-N 3.42Å
210	V	94.6	Very high	91.5	Very high	2 Å²	2	72.8 Å²	72.8	1%	0.012	37%	0.366	C	S	.	.	H	α-helix	trans	-61.3	-45.5	177.5	168.7	0	0	0	0	111.1	I178 L195 L197 I206 G207 Y213 N214	I178-V210 HydrophobicContact CD1-CG2 3.77Å; L195-V210 HydrophobicContact CB-CG1 3.93Å; L197-V210 HydrophobicContact CD1-CB 4.11Å; L197-V210 HydrophobicContact CD1-CG1 4.01Å; I206-V210 WeakPolarHBondContact O-CG2 3.42Å; I206-V210 PolarHBondContact O-N 2.99Å; G207-V210 PolarHBondContact O-N 3.36Å; V210-Y213 PolarHBondContact O-N 3.44Å; V210-N214 WeakPolarHBondContact O-CB 3.42Å; V210-N214 PolarHBondContact O-N 3.17Å; V210-N214 PolarHBondContact O-OD1 2.88Å
211	R	93.3	Very high	91.5	Very high	103 Å²	103	70 Å²	70	39%	0.389	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-44.6	176.7	-76.9	-170.7	-71.4	-86.6	9.4	112.6	Q202 G207 M208 Y213 N214 L215	Q202-R211 VanDerWaalsContact O-CZ 3.26Å; Q202-R211 PolarHBondContact O-NH1 3.49Å; Q202-R211 PolarHBondContact O-NH2 2.86Å; G207-R211 WeakPolarHBondContact O-CG 3.48Å; G207-R211 PolarHBondContact O-N 3.5Å; M208-R211 PolarHBondContact O-N 3.42Å; R211-Y213 VanDerWaalsContact C-N 3.33Å; R211-N214 PolarHBondContact O-N 3.41Å; R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 PolarHBondContact O-N 3.41Å
212	S	93.3	Very high	91.2	Very high	62 Å²	62	76.6 Å²	76.6	43%	0.434	37%	0.374	S	S	.	.	H	α-helix	trans	-64.5	-39.7	178.7	-173.4	0	0	0	0	111.5	M208 L209 N216	M208-S212 WeakPolarHBondContact O-CB 3.25Å; M208-S212 PolarHBondContact O-N 3.39Å; L209-S212 PolarHBondContact O-N 3.09Å; S212-N216 WeakPolarHBondContact O-CB 3.32Å; S212-N216 VanDerWaalsContact O-CG 3.25Å; S212-N216 PolarHBondContact O-N 2.91Å; S212-N216 PolarHBondContact O-ND2 2.99Å
213	Y	93.7	Very high	91	Very high	49 Å²	49	76 Å²	76	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-50.5	173.1	175.3	-90.9	0	0	0	111.1	L182 H193 L195 L209 V210 R211 L215 N216 Q217	L182-Y213 HydrophobicContact CD2-CE1 4.13Å; L182-Y213 HydrophobicContact CD2-CE2 3.79Å; L182-Y213 WeakPolarHBondContact CD2-OH 3.41Å; H193-Y213 WeakPolarHBondContact O-CE1 3.34Å; L195-Y213 HydrophobicContact CB-CD1 4.4Å; L195-Y213 HydrophobicContact CD1-CD1 3.46Å; L195-Y213 VanDerWaalsContact CD1-CD1 3.46Å; L195-Y213 HydrophobicContact CD1-CE1 3.88Å; L195-Y213 HydrophobicContact CD1-CG 3.88Å; L195-Y213 HydrophobicContact CG-CD1 3.71Å; L195-Y213 HydrophobicContact CG-CE1 3.75Å; L209-Y213 WeakPolarHBondContact O-CB 3.47Å; L209-Y213 PolarHBondContact O-N 3.42Å; V210-Y213 PolarHBondContact O-N 3.44Å; R211-Y213 VanDerWaalsContact C-N 3.33Å; Y213-L215 VanDerWaalsContact C-N 3.34Å; Y213-L215 PolarHBondContact O-N 2.99Å; Y213-N216 PolarHBondContact O-N 2.93Å; Y213-Q217 HydrophobicContact CD1-CG 4.1Å; Y213-Q217 HydrophobicContact CE1-CG 3.6Å; Y213-Q217 HydrophobicContact CE2-CG 4.12Å; Y213-Q217 WeakPolarHBondContact O-CG 3.41Å; Y213-Q217 PolarHBondContact O-N 3.44Å; Y213-Q217 PolarHBondContact OH-NE2 2.95Å
214	N	93.9	Very high	90.6	Very high	25 Å²	25	75.3 Å²	75.3	13%	0.134	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-41.2	-179.2	-70.5	-5	0	0	0	112.1	Q194 L195 V210 R211 Q217 Q218	Q194-N214 WeakPolarHBondContact CA-OD1 3.5Å; L195-N214 PolarHBondContact N-OD1 3.47Å; L195-N214 PolarHBondContact O-ND2 3.34Å; V210-N214 WeakPolarHBondContact O-CB 3.42Å; V210-N214 PolarHBondContact O-N 3.17Å; V210-N214 PolarHBondContact O-OD1 2.88Å; R211-N214 PolarHBondContact O-N 3.41Å; N214-Q217 PolarHBondContact O-N 2.91Å; N214-Q218 WeakPolarHBondContact O-CG 3.33Å; N214-Q218 PolarHBondContact O-N 3.34Å
215	L	93.5	Very high	89.9	Confident	97 Å²	97	77.5 Å²	77.5	51%	0.508	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-47.6	175.2	178.9	64.3	0	0	0	111.3	R211 Y213 Q217 Q218 L219	R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 PolarHBondContact O-N 3.41Å; Y213-L215 VanDerWaalsContact C-N 3.34Å; Y213-L215 PolarHBondContact O-N 2.99Å; L215-Q217 VanDerWaalsContact C-N 3.28Å; L215-Q217 PolarHBondContact O-N 3.49Å; L215-Q218 PolarHBondContact O-N 3.18Å; L215-L219 HydrophobicContact CG-CD1 4.48Å; L215-L219 WeakPolarHBondContact O-CG 3.28Å; L215-L219 PolarHBondContact O-N 3.25Å
216	N	93.8	Very high	89.1	Confident	79 Å²	79	74.8 Å²	74.8	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-38.2	177.8	-73.3	-15.8	0	0	0	111.5	S212 Y213 L219 L220	S212-N216 WeakPolarHBondContact O-CB 3.32Å; S212-N216 VanDerWaalsContact O-CG 3.25Å; S212-N216 PolarHBondContact O-N 2.91Å; S212-N216 PolarHBondContact O-ND2 2.99Å; Y213-N216 PolarHBondContact O-N 2.93Å; N216-L219 PolarHBondContact O-N 2.97Å; N216-L220 WeakPolarHBondContact O-CD1 3.42Å; N216-L220 PolarHBondContact O-N 3.32Å
217	Q	92.5	Very high	88.3	Confident	19 Å²	19	80.4 Å²	80.4	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-64.3	-39.6	176.5	-75.5	-65.2	-12.8	0	0	113	L190 H193 Y213 N214 L215 L219 L220 Q221	L190-Q217 PolarHBondContact O-NE2 3.22Å; L190-Q217 PolarHBondContact O-OE1 3.4Å; H193-Q217 WeakPolarHBondContact O-CB 3.26Å; H193-Q217 WeakPolarHBondContact O-CG 3.4Å; Y213-Q217 HydrophobicContact CD1-CG 4.1Å; Y213-Q217 HydrophobicContact CE1-CG 3.6Å; Y213-Q217 HydrophobicContact CE2-CG 4.12Å; Y213-Q217 WeakPolarHBondContact O-CG 3.41Å; Y213-Q217 PolarHBondContact O-N 3.44Å; Y213-Q217 PolarHBondContact OH-NE2 2.95Å; N214-Q217 PolarHBondContact O-N 2.91Å; L215-Q217 VanDerWaalsContact C-N 3.28Å; L215-Q217 PolarHBondContact O-N 3.49Å; Q217-L219 VanDerWaalsContact C-N 3.33Å; Q217-L219 PolarHBondContact O-N 3.03Å; Q217-L220 PolarHBondContact O-N 3.11Å; Q217-Q221 WeakPolarHBondContact O-CB 3.43Å; Q217-Q221 PolarHBondContact O-N 3.49Å
218	Q	90.5	Very high	87.4	Confident	75 Å²	75	83.7 Å²	83.7	35%	0.35	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.5	-70.8	175.1	-3	0	0	112.1	N214 L215 R222	N214-Q218 WeakPolarHBondContact O-CG 3.33Å; N214-Q218 PolarHBondContact O-N 3.34Å; L215-Q218 PolarHBondContact O-N 3.18Å; Q218-R222 WeakPolarHBondContact O-CG 3.43Å; Q218-R222 PolarHBondContact O-N 3.05Å; Q218-R222 VanDerWaalsContact O-N 3.1Å
219	L	90.5	Very high	86.2	Confident	74 Å²	74	83.5 Å²	83.5	39%	0.387	40%	0.395	S	S	.	.	H	α-helix	trans	-68.3	-43	175.7	-66.8	174.5	0	0	0	112	L215 N216 Q217 Q221 R222 H223	L215-L219 HydrophobicContact CG-CD1 4.48Å; L215-L219 WeakPolarHBondContact O-CG 3.28Å; L215-L219 PolarHBondContact O-N 3.25Å; N216-L219 PolarHBondContact O-N 2.97Å; Q217-L219 VanDerWaalsContact C-N 3.33Å; Q217-L219 PolarHBondContact O-N 3.03Å; L219-Q221 VanDerWaalsContact C-N 3.31Å; L219-Q221 PolarHBondContact O-N 3.25Å; L219-R222 PolarHBondContact O-N 3.39Å; L219-H223 PolarHBondContact O-CD2 3.34Å; L219-H223 PolarHBondContact O-N 3Å
220	L	89	Confident	85.1	Confident	94 Å²	94	84 Å²	84	49%	0.492	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-42.3	174.7	-96.5	85.5	0	0	0	111.5	N216 Q217 H223 Y224	N216-L220 WeakPolarHBondContact O-CD1 3.42Å; N216-L220 PolarHBondContact O-N 3.32Å; Q217-L220 PolarHBondContact O-N 3.11Å; L220-H223 PolarHBondContact O-N 3Å; L220-Y224 WeakPolarHBondContact O-CB 3.28Å; L220-Y224 PolarHBondContact O-N 2.9Å
221	Q	87.1	Confident	84.4	Confident	70 Å²	70	87.1 Å²	87.1	33%	0.327	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-47.6	177.3	-178.8	177	-6.7	0	0	111.3	V191 Q217 L219 H223 Y224 E225	V191-Q221 HydrophobicContact CG1-CB 4.04Å; Q217-Q221 WeakPolarHBondContact O-CB 3.43Å; Q217-Q221 PolarHBondContact O-N 3.49Å; L219-Q221 VanDerWaalsContact C-N 3.31Å; L219-Q221 PolarHBondContact O-N 3.25Å; Q221-H223 PolarHBondContact O-N 3.05Å; Q221-Y224 PolarHBondContact O-N 2.96Å; Q221-E225 HydrophobicContact CG-CG 4.46Å; Q221-E225 VanDerWaalsContact CG-OE1 3.31Å; Q221-E225 WeakPolarHBondContact CG-OE1 3.47Å; Q221-E225 PolarHBondContact NE2-OE1 2.73Å; Q221-E225 WeakPolarHBondContact O-CB 3.42Å; Q221-E225 WeakPolarHBondContact O-CG 3.4Å; Q221-E225 PolarHBondContact O-N 2.95Å
222	R	81	Confident	84	Confident	149 Å²	149	83.3 Å²	83.3	56%	0.562	41%	0.411	S	S	*	.	H	α-helix	trans	-59.4	-45.1	176	-73.8	177.9	-179.6	172.1	1	112.4	Q218 L219 Y224 E225 E226	Q218-R222 WeakPolarHBondContact O-CG 3.43Å; Q218-R222 PolarHBondContact O-N 3.05Å; Q218-R222 VanDerWaalsContact O-N 3.1Å; L219-R222 PolarHBondContact O-N 3.39Å; R222-Y224 VanDerWaalsContact C-N 3.3Å; R222-Y224 PolarHBondContact O-N 3.13Å; R222-E225 PolarHBondContact O-N 2.73Å; R222-E226 WeakPolarHBondContact O-CB 3.31Å; R222-E226 VanDerWaalsContact O-CG 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.4Å; R222-E226 PolarHBondContact O-N 3.07Å
223	H	79.9	Confident	83.8	Confident	109 Å²	109	84.5 Å²	84.5	51%	0.505	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-36	177	-80.4	-46.4	0	0	0	112.8	L219 L220 Q221 E226 Q227	L219-H223 PolarHBondContact O-CD2 3.34Å; L219-H223 PolarHBondContact O-N 3Å; L220-H223 PolarHBondContact O-N 3Å; Q221-H223 PolarHBondContact O-N 3.05Å; H223-E226 IonicContact CE1-OE2 3.82Å; H223-E226 IonicContact ND1-OE2 2.81Å; H223-E226 PolarHBondContact ND1-OE2 3.48Å; H223-E226 VanDerWaalsContact ND1-OE2 3.09Å; H223-Q227 WeakPolarHBondContact O-CB 3.44Å; H223-Q227 VanDerWaalsContact O-CG 3.25Å; H223-Q227 WeakPolarHBondContact O-CG 3.27Å; H223-Q227 PolarHBondContact O-N 3.23Å
224	Y	79	Confident	83.5	Confident	139 Å²	139	84.6 Å²	84.6	55%	0.545	41%	0.407	S	S	.	.	H	α-helix	trans	-67.5	-42.7	174.9	-170.1	-91.4	0	0	0	111.2	L220 Q221 R222 Q227 N228	L220-Y224 WeakPolarHBondContact O-CB 3.28Å; L220-Y224 PolarHBondContact O-N 2.9Å; Q221-Y224 PolarHBondContact O-N 2.96Å; R222-Y224 VanDerWaalsContact C-N 3.3Å; R222-Y224 PolarHBondContact O-N 3.13Å; Y224-Q227 PolarHBondContact O-N 2.94Å; Y224-N228 VanDerWaalsContact O-CB 3.27Å; Y224-N228 WeakPolarHBondContact O-CB 3.44Å; Y224-N228 PolarHBondContact O-N 3.44Å
225	E	77.1	Confident	83.1	Confident	89 Å²	89	89.5 Å²	89.5	42%	0.416	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-49.4	174.1	-72.5	167	-177.6	0	0	111	Q221 R222 Q227 N228 E229	Q221-E225 HydrophobicContact CG-CG 4.46Å; Q221-E225 VanDerWaalsContact CG-OE1 3.31Å; Q221-E225 WeakPolarHBondContact CG-OE1 3.47Å; Q221-E225 PolarHBondContact NE2-OE1 2.73Å; Q221-E225 WeakPolarHBondContact O-CB 3.42Å; Q221-E225 WeakPolarHBondContact O-CG 3.4Å; Q221-E225 PolarHBondContact O-N 2.95Å; R222-E225 PolarHBondContact O-N 2.73Å; E225-Q227 PolarHBondContact O-N 3.1Å; E225-N228 PolarHBondContact O-N 2.82Å; E225-E229 WeakPolarHBondContact O-CB 3.49Å; E225-E229 WeakPolarHBondContact O-CG 3.34Å; E225-E229 PolarHBondContact O-N 3.27Å
226	E	75	Confident	82.9	Confident	95 Å²	95	87.5 Å²	87.5	44%	0.444	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-43.1	175.7	-73.4	169	178.4	0	0	112.4	R222 H223 N228 N230	R222-E226 WeakPolarHBondContact O-CB 3.31Å; R222-E226 VanDerWaalsContact O-CG 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.4Å; R222-E226 PolarHBondContact O-N 3.07Å; H223-E226 IonicContact CE1-OE2 3.82Å; H223-E226 IonicContact ND1-OE2 2.81Å; H223-E226 PolarHBondContact ND1-OE2 3.48Å; H223-E226 VanDerWaalsContact ND1-OE2 3.09Å; E226-N228 VanDerWaalsContact C-N 3.34Å; E226-N230 WeakPolarHBondContact O-CB 3.27Å; E226-N230 VanDerWaalsContact O-CG 3.23Å; E226-N230 PolarHBondContact O-N 3.34Å; E226-N230 PolarHBondContact O-ND2 3.46Å
227	Q	75.4	Confident	82.8	Confident	136 Å²	136	84 Å²	84	64%	0.636	41%	0.414	S	S	*	.	H	α-helix	trans	-65.5	-40.3	176.4	-79.3	-178.6	-4.7	0	0	111.6	H223 Y224 E225 N230 A231	H223-Q227 WeakPolarHBondContact O-CB 3.44Å; H223-Q227 VanDerWaalsContact O-CG 3.25Å; H223-Q227 WeakPolarHBondContact O-CG 3.27Å; H223-Q227 PolarHBondContact O-N 3.23Å; Y224-Q227 PolarHBondContact O-N 2.94Å; E225-Q227 PolarHBondContact O-N 3.1Å; Q227-N230 PolarHBondContact O-N 3.3Å; Q227-A231 VanDerWaalsContact O-CB 3.27Å; Q227-A231 WeakPolarHBondContact O-CB 3.45Å; Q227-A231 PolarHBondContact O-N 2.82Å
228	N	74.1	Confident	82.7	Confident	69 Å²	69	87.7 Å²	87.7	37%	0.369	43%	0.434	S	S	.	.	H	α-helix	trans	-69.1	-42.3	178.6	-159.7	42	0	0	0	110.7	Y224 E225 E226 N230 A231 M232	Y224-N228 VanDerWaalsContact O-CB 3.27Å; Y224-N228 WeakPolarHBondContact O-CB 3.44Å; Y224-N228 PolarHBondContact O-N 3.44Å; E225-N228 PolarHBondContact O-N 2.82Å; E226-N228 VanDerWaalsContact C-N 3.34Å; N228-N230 VanDerWaalsContact C-N 3.35Å; N228-N230 PolarHBondContact O-N 3.2Å; N228-A231 CarbonylContact O-C 3.57Å; N228-A231 PolarHBondContact O-N 2.79Å; N228-M232 VanDerWaalsContact ND2-CE 3.27Å; N228-M232 WeakPolarHBondContact ND2-CE 3.27Å; N228-M232 WeakPolarHBondContact O-CB 3.42Å; N228-M232 WeakPolarHBondContact O-CG 3.34Å; N228-M232 PolarHBondContact O-N 2.87Å
229	E	68.3	Low	82.9	Confident	116 Å²	116	84.4 Å²	84.4	54%	0.542	42%	0.419	S	S	.	.	H	α-helix	trans	-58.2	-45.3	172.9	-76.5	-175.6	173.9	0	0	111.8	E225 M232 R233	E225-E229 WeakPolarHBondContact O-CB 3.49Å; E225-E229 WeakPolarHBondContact O-CG 3.34Å; E225-E229 PolarHBondContact O-N 3.27Å; E229-M232 CarbonylContact O-C 3.52Å; E229-M232 WeakPolarHBondContact O-CB 3.38Å; E229-M232 PolarHBondContact O-N 2.85Å; E229-R233 WeakPolarHBondContact O-CG 3.44Å; E229-R233 PolarHBondContact O-N 2.93Å
230	N	71.6	Confident	83.1	Confident	113 Å²	113	81.5 Å²	81.5	60%	0.604	41%	0.405	S	S	*	.	H	α-helix	trans	-66.1	-39.3	175.9	-74.2	-34.5	0	0	0	112.1	E226 Q227 N228 M232 R233	E226-N230 WeakPolarHBondContact O-CB 3.27Å; E226-N230 VanDerWaalsContact O-CG 3.23Å; E226-N230 PolarHBondContact O-N 3.34Å; E226-N230 PolarHBondContact O-ND2 3.46Å; Q227-N230 PolarHBondContact O-N 3.3Å; N228-N230 VanDerWaalsContact C-N 3.35Å; N228-N230 PolarHBondContact O-N 3.2Å; N230-M232 PolarHBondContact O-N 3.47Å; N230-R233 PolarHBondContact O-N 2.95Å
231	A	79.6	Confident	83.3	Confident	68 Å²	68	78.4 Å²	78.4	56%	0.562	39%	0.389	S	S	*	.	H	α-helix	trans	-67.8	-26	174.2	0	0	0	0	0	112.4	Q227 N228 R233 N241	Q227-A231 VanDerWaalsContact O-CB 3.27Å; Q227-A231 WeakPolarHBondContact O-CB 3.45Å; Q227-A231 PolarHBondContact O-N 2.82Å; N228-A231 CarbonylContact O-C 3.57Å; N228-A231 PolarHBondContact O-N 2.79Å; A231-R233 VanDerWaalsContact C-N 3.29Å; A231-N241 PolarHBondContact O-ND2 3.17Å
232	M	84.3	Confident	83.6	Confident	22 Å²	22	79.8 Å²	79.8	11%	0.108	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	3.5	177.2	-81.9	179.7	178	0	0	113.7	N228 E229 N230 N241 L244 E247	N228-M232 VanDerWaalsContact ND2-CE 3.27Å; N228-M232 WeakPolarHBondContact ND2-CE 3.27Å; N228-M232 WeakPolarHBondContact O-CB 3.42Å; N228-M232 WeakPolarHBondContact O-CG 3.34Å; N228-M232 PolarHBondContact O-N 2.87Å; E229-M232 CarbonylContact O-C 3.52Å; E229-M232 WeakPolarHBondContact O-CB 3.38Å; E229-M232 PolarHBondContact O-N 2.85Å; N230-M232 PolarHBondContact O-N 3.47Å; M232-N241 VanDerWaalsContact CA-ND2 3.32Å; M232-N241 WeakPolarHBondContact CA-ND2 3.35Å; M232-N241 WeakPolarHBondContact O-CB 3.44Å; M232-N241 PolarHBondContact O-N 3.03Å; M232-N241 PolarHBondContact O-OD1 2.85Å; M232-N241 VanDerWaalsContact O-OD1 3.11Å; M232-L244 HydrophobicContact CB-CB 4.05Å; M232-L244 HydrophobicContact CB-CD2 4.33Å; M232-L244 HydrophobicContact CG-CB 4.46Å; M232-L244 HydrophobicContact SD-CD1 4.3Å; M232-E247 WeakPolarHBondContact CE-OE1 3.42Å
233	R	89.3	Confident	84.1	Confident	87 Å²	87	75 Å²	75	33%	0.328	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-125.2	157.2	179.3	-72.2	173.1	175.5	-106.6	3.5	111.9	E229 N230 A231 D238 L239	E229-R233 WeakPolarHBondContact O-CG 3.44Å; E229-R233 PolarHBondContact O-N 2.93Å; N230-R233 PolarHBondContact O-N 2.95Å; A231-R233 VanDerWaalsContact C-N 3.29Å; R233-D238 WeakPolarHBondContact CD-OD1 3.45Å; R233-D238 PolarHBondContact NH1-O 3.41Å; R233-D238 IonicContact NH1-OD1 3.48Å; R233-D238 IonicContact NH1-OD2 2.87Å; R233-L239 CarbonylContact C-O 3.57Å; R233-L239 VanDerWaalsContact CA-O 3.28Å; R233-L239 WeakPolarHBondContact CA-O 3.33Å
234	F	88.9	Confident	84.7	Confident	51 Å²	51	71 Å²	71	22%	0.224	37%	0.368	C	S	.	.			trans	-79.5	128.9	171.9	-87.7	-96.6	0	0	0	110	V236 S237 D238 L239 N241 Q304	F234-V236 VanDerWaalsContact C-N 3.28Å; F234-V236 PolarHBondContact O-N 3.4Å; F234-S237 WeakPolarHBondContact CB-OG 3.36Å; F234-D238 VanDerWaalsContact O-CA 3.26Å; F234-D238 WeakPolarHBondContact O-CA 3.33Å; F234-D238 PolarHBondContact O-N 2.9Å; F234-L239 PolarHBondContact N-O 3.42Å; F234-N241 HydrophobicContact CD2-CB 3.69Å; F234-N241 HydrophobicContact CE2-CB 3.59Å; F234-Q304 HydrophobicContact CD1-CG 4.12Å; F234-Q304 HydrophobicContact CD2-CB 3.61Å; F234-Q304 HydrophobicContact CD2-CG 3.81Å; F234-Q304 HydrophobicContact CE1-CG 4.11Å; F234-Q304 HydrophobicContact CE2-CB 3.87Å; F234-Q304 HydrophobicContact CE2-CG 3.81Å; F234-Q304 WeakPolarHBondContact CE2-O 3.43Å; F234-Q304 HydrophobicContact CG-CB 4.07Å; F234-Q304 HydrophobicContact CG-CG 3.97Å; F234-Q304 HydrophobicContact CZ-CG 3.95Å
235	P	85	Confident	85.4	Confident	128 Å²	128	64.4 Å²	64.4	83%	0.831	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.5	-169.6	24.8	-34.8	0	0	0	114.2
236	V	89.2	Confident	86.3	Confident	56 Å²	56	61.7 Å²	61.7	34%	0.339	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-52.3	-179.1	179.7	0	0	0	0	111	F234 E282 L285 L286	F234-V236 VanDerWaalsContact C-N 3.28Å; F234-V236 PolarHBondContact O-N 3.4Å; V236-E282 HydrophobicContact CG1-CB 4.14Å; V236-E282 HydrophobicContact CG1-CG 4.04Å; V236-E282 HydrophobicContact CG2-CG 4.31Å; V236-L285 HydrophobicContact CB-CD2 4.47Å; V236-L285 HydrophobicContact CG1-CD2 4.31Å; V236-L286 HydrophobicContact CG1-CD1 4.3Å; V236-L286 HydrophobicContact CG1-CD2 4.19Å; V236-L286 HydrophobicContact CG1-CG 4.13Å; V236-L286 WeakPolarHBondContact O-CD2 3.25Å
237	S	91.5	Very high	87.1	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.042	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-12	-173.4	60.7	0	0	0	0	114.3	F234 L239 Q304	F234-S237 WeakPolarHBondContact CB-OG 3.36Å; S237-L239 PolarHBondContact O-N 3.49Å; S237-L239 VanDerWaalsContact O-N 3.08Å; S237-L239 PolarHBondContact OG-N 3.49Å; S237-Q304 PolarHBondContact OG-OE1 3.08Å
238	D	90.6	Very high	88	Confident	95 Å²	95	56.8 Å²	56.8	51%	0.508	31%	0.308	S	S	.	.			trans	55	18.9	-172.1	-169.2	40.4	0	0	0	113.8	R233 F234	R233-D238 WeakPolarHBondContact CD-OD1 3.45Å; R233-D238 PolarHBondContact NH1-O 3.41Å; R233-D238 IonicContact NH1-OD1 3.48Å; R233-D238 IonicContact NH1-OD2 2.87Å; F234-D238 VanDerWaalsContact O-CA 3.26Å; F234-D238 WeakPolarHBondContact O-CA 3.33Å; F234-D238 PolarHBondContact O-N 2.9Å
239	L	94.9	Very high	89	Confident	7 Å²	7	53.5 Å²	53.5	4%	0.037	29%	0.29	C	S	.	.			trans	-81.4	148	178	-67.5	179.7	0	0	0	111.1	R233 F234 S237 N241 V289 L302 Q304 F310	R233-L239 CarbonylContact C-O 3.57Å; R233-L239 VanDerWaalsContact CA-O 3.28Å; R233-L239 WeakPolarHBondContact CA-O 3.33Å; F234-L239 PolarHBondContact N-O 3.42Å; S237-L239 PolarHBondContact O-N 3.49Å; S237-L239 VanDerWaalsContact O-N 3.08Å; S237-L239 PolarHBondContact OG-N 3.49Å; L239-N241 PolarHBondContact O-N 2.85Å; L239-V289 HydrophobicContact CD1-CB 4.47Å; L239-V289 HydrophobicContact CD1-CG1 3.85Å; L239-V289 HydrophobicContact CD1-CG2 3.75Å; L239-V289 HydrophobicContact CD2-CG1 4.22Å; L239-V289 HydrophobicContact CG-CG1 4.15Å; L239-L302 HydrophobicContact CD1-CD2 3.99Å; L239-L302 HydrophobicContact CD1-CG 3.94Å; L239-L302 HydrophobicContact CD2-CB 4.37Å; L239-L302 HydrophobicContact CD2-CD2 4.03Å; L239-L302 HydrophobicContact CD2-CG 4.05Å; L239-Q304 HydrophobicContact CB-CB 3.98Å; L239-Q304 HydrophobicContact CD1-CB 4.07Å; L239-F310 HydrophobicContact CD1-CD1 4.12Å; L239-F310 HydrophobicContact CD1-CE1 4.26Å
240	P	94.8	Very high	90.2	Very high	12 Å²	12	53.6 Å²	53.6	8%	0.078	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-47.2	131.9	166.3	-27.8	34.6	0	0	0	111.1	L244 M248 L302 A303 Q304	P240-L244 HydrophobicContact CB-CB 4.08Å; P240-L244 HydrophobicContact CB-CD2 3.77Å; P240-L244 HydrophobicContact CB-CG 3.97Å; P240-L244 HydrophobicContact CG-CD2 4.12Å; P240-M248 HydrophobicContact CG-CE 4.39Å; P240-L302 WeakPolarHBondContact CD-O 3.28Å; P240-A303 HydrophobicContact CB-CB 3.96Å; P240-A303 CarbonylContact O-C 3.34Å; P240-A303 WeakPolarHBondContact O-CA 3.46Å; P240-A303 WeakPolarHBondContact O-CB 3.5Å; P240-Q304 PolarHBondContact O-N 2.9Å; P240-Q304 VanDerWaalsContact O-O 3.11Å
241	N	93.7	Very high	91.2	Very high	29 Å²	29	53.4 Å²	53.4	16%	0.155	29%	0.286	C	S	.	.			trans	-81.4	-177.8	174	79	9.4	0	0	0	110.8	A231 M232 F234 L239 A243 L244 L245 Q304	A231-N241 PolarHBondContact O-ND2 3.17Å; M232-N241 VanDerWaalsContact CA-ND2 3.32Å; M232-N241 WeakPolarHBondContact CA-ND2 3.35Å; M232-N241 WeakPolarHBondContact O-CB 3.44Å; M232-N241 PolarHBondContact O-N 3.03Å; M232-N241 PolarHBondContact O-OD1 2.85Å; M232-N241 VanDerWaalsContact O-OD1 3.11Å; F234-N241 HydrophobicContact CD2-CB 3.69Å; F234-N241 HydrophobicContact CE2-CB 3.59Å; L239-N241 PolarHBondContact O-N 2.85Å; N241-A243 VanDerWaalsContact C-N 3.29Å; N241-A243 PolarHBondContact O-N 3.44Å; N241-A243 WeakPolarHBondContact OD1-CA 3.17Å; N241-A243 WeakPolarHBondContact OD1-CB 3.13Å; N241-A243 PolarHBondContact OD1-N 2.71Å; N241-L244 PolarHBondContact O-N 2.97Å; N241-L244 PolarHBondContact OD1-N 3.49Å; N241-L244 VanDerWaalsContact OD1-N 3.14Å; N241-L245 WeakPolarHBondContact O-CB 3.33Å; N241-L245 PolarHBondContact O-N 2.89Å; N241-Q304 CarbonylContact C-O 3.51Å; N241-Q304 VanDerWaalsContact CA-O 3.29Å; N241-Q304 WeakPolarHBondContact CA-O 3.29Å
242	K	93.2	Very high	91.8	Very high	99 Å²	99	50.9 Å²	50.9	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-57.5	-38.1	178.3	-172.2	-177.6	176.7	-174.8	0	113.5	M246 Q304 I305 Y366	K242-M246 VanDerWaalsContact O-CG 3.29Å; K242-M246 WeakPolarHBondContact O-CG 3.46Å; K242-M246 PolarHBondContact O-N 3.34Å; K242-Q304 PolarHBondContact N-O 3.21Å; K242-I305 HydrophobicContact CB-CG2 4.33Å; K242-I305 HydrophobicContact CD-CG2 4.18Å; K242-I305 HydrophobicContact CG-CG2 4.32Å; K242-Y366 WeakPolarHBondContact CE-OH 3.42Å
243	A	90.1	Very high	92.1	Very high	50 Å²	50	51.1 Å²	51.1	41%	0.413	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-48.9	-179.2	0	0	0	0	0	110.9	N241 L245 M246 E247	N241-A243 VanDerWaalsContact C-N 3.29Å; N241-A243 PolarHBondContact O-N 3.44Å; N241-A243 WeakPolarHBondContact OD1-CA 3.17Å; N241-A243 WeakPolarHBondContact OD1-CB 3.13Å; N241-A243 PolarHBondContact OD1-N 2.71Å; A243-L245 PolarHBondContact O-N 3.21Å; A243-M246 PolarHBondContact O-N 3.28Å; A243-M246 VanDerWaalsContact O-N 3.15Å; A243-E247 PolarHBondContact O-N 3.41Å; A243-E247 VanDerWaalsContact O-N 3.11Å
244	L	92.5	Very high	92.3	Very high	24 Å²	24	51 Å²	51	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-66.2	-37.4	177.8	-173.3	53.5	0	0	0	112.6	M232 P240 N241 M246 E247 M248	M232-L244 HydrophobicContact CB-CB 4.05Å; M232-L244 HydrophobicContact CB-CD2 4.33Å; M232-L244 HydrophobicContact CG-CB 4.46Å; M232-L244 HydrophobicContact SD-CD1 4.3Å; P240-L244 HydrophobicContact CB-CB 4.08Å; P240-L244 HydrophobicContact CB-CD2 3.77Å; P240-L244 HydrophobicContact CB-CG 3.97Å; P240-L244 HydrophobicContact CG-CD2 4.12Å; N241-L244 PolarHBondContact O-N 2.97Å; N241-L244 PolarHBondContact OD1-N 3.49Å; N241-L244 VanDerWaalsContact OD1-N 3.14Å; L244-M246 VanDerWaalsContact C-N 3.3Å; L244-M246 PolarHBondContact O-N 3.27Å; L244-E247 PolarHBondContact O-N 2.8Å; L244-M248 HydrophobicContact CD1-CE 3.9Å; L244-M248 HydrophobicContact CD2-CE 3.95Å; L244-M248 HydrophobicContact CG-CE 3.68Å; L244-M248 HydrophobicContact CG-SD 4.18Å; L244-M248 WeakPolarHBondContact O-CB 3.36Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.18Å; L244-M248 PolarHBondContact O-N 2.85Å
245	L	95.2	Very high	92.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-44.2	171.6	173.2	68.6	0	0	0	111.6	N241 A243 M248 L249 A303 I305 A311 I313 Y366	N241-L245 WeakPolarHBondContact O-CB 3.33Å; N241-L245 PolarHBondContact O-N 2.89Å; A243-L245 PolarHBondContact O-N 3.21Å; L245-M248 PolarHBondContact O-N 2.88Å; L245-L249 HydrophobicContact CD1-CD1 4.31Å; L245-L249 HydrophobicContact CD1-CG 4.3Å; L245-L249 HydrophobicContact CG-CD1 4.11Å; L245-L249 HydrophobicContact CG-CG 4.47Å; L245-L249 WeakPolarHBondContact O-CB 3.11Å; L245-L249 WeakPolarHBondContact O-CG 3.26Å; L245-L249 PolarHBondContact O-N 2.88Å; L245-A303 HydrophobicContact CB-CB 4.02Å; L245-A303 HydrophobicContact CD1-CB 3.9Å; L245-A303 HydrophobicContact CD2-CB 4.36Å; L245-A303 HydrophobicContact CG-CB 4.31Å; L245-I305 HydrophobicContact CD2-CD1 4.12Å; L245-I305 HydrophobicContact CD2-CG1 3.91Å; L245-A311 HydrophobicContact CD1-CB 4.02Å; L245-A311 HydrophobicContact CD2-CB 3.49Å; L245-A311 VanDerWaalsContact CD2-CB 3.49Å; L245-A311 HydrophobicContact CG-CB 4.42Å; L245-I313 HydrophobicContact CD1-CD1 3.87Å; L245-I313 HydrophobicContact CD1-CG1 3.89Å; L245-Y366 HydrophobicContact CD2-CD2 4.27Å; L245-Y366 HydrophobicContact CD2-CE2 3.99Å
246	M	95.1	Very high	92.3	Very high	32 Å²	32	57.3 Å²	57.3	16%	0.158	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-43	179.9	-72.4	-57.3	-57.2	0	0	111.7	K242 A243 L244 M248 L249 E250 A362 E363 Y366	K242-M246 VanDerWaalsContact O-CG 3.29Å; K242-M246 WeakPolarHBondContact O-CG 3.46Å; K242-M246 PolarHBondContact O-N 3.34Å; A243-M246 PolarHBondContact O-N 3.28Å; A243-M246 VanDerWaalsContact O-N 3.15Å; L244-M246 VanDerWaalsContact C-N 3.3Å; L244-M246 PolarHBondContact O-N 3.27Å; M246-M248 VanDerWaalsContact C-N 3.33Å; M246-M248 PolarHBondContact O-N 2.93Å; M246-L249 PolarHBondContact O-N 3.29Å; M246-L249 HydrophobicContact SD-CD1 4.17Å; M246-E250 WeakPolarHBondContact O-CG 3.26Å; M246-E250 PolarHBondContact O-N 3.06Å; M246-A362 HydrophobicContact CE-CB 4.12Å; M246-E363 HydrophobicContact CE-CG 3.95Å; M246-Y366 HydrophobicContact SD-CD1 4.5Å; M246-Y366 HydrophobicContact SD-CD2 4.05Å; M246-Y366 HydrophobicContact SD-CG 3.95Å
247	E	92.6	Very high	92.2	Very high	86 Å²	86	60.2 Å²	60.2	40%	0.402	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-42.6	173.9	-69.4	-177.1	-175	0	0	111.7	M232 A243 L244 E250 Q251	M232-E247 WeakPolarHBondContact CE-OE1 3.42Å; A243-E247 PolarHBondContact O-N 3.41Å; A243-E247 VanDerWaalsContact O-N 3.11Å; L244-E247 PolarHBondContact O-N 2.8Å; E247-E250 PolarHBondContact O-N 3.11Å; E247-Q251 WeakPolarHBondContact O-CG 3.32Å; E247-Q251 PolarHBondContact O-N 3.21Å
248	M	94	Very high	92.1	Very high	43 Å²	43	61.6 Å²	61.6	21%	0.212	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-39.4	175.6	-70.6	172.2	173.1	0	0	112	P240 L244 L245 M246 Q251 V252 I301 I313	P240-M248 HydrophobicContact CG-CE 4.39Å; L244-M248 HydrophobicContact CD1-CE 3.9Å; L244-M248 HydrophobicContact CD2-CE 3.95Å; L244-M248 HydrophobicContact CG-CE 3.68Å; L244-M248 HydrophobicContact CG-SD 4.18Å; L244-M248 WeakPolarHBondContact O-CB 3.36Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.18Å; L244-M248 PolarHBondContact O-N 2.85Å; L245-M248 PolarHBondContact O-N 2.88Å; M246-M248 VanDerWaalsContact C-N 3.33Å; M246-M248 PolarHBondContact O-N 2.93Å; M248-Q251 WeakPolarHBondContact O-CB 3.36Å; M248-Q251 PolarHBondContact O-N 2.93Å; M248-V252 WeakPolarHBondContact O-CG2 3.33Å; M248-V252 PolarHBondContact O-N 2.71Å; M248-V252 VanDerWaalsContact O-N 3.08Å; M248-I301 HydrophobicContact CB-CD1 4.47Å; M248-I301 HydrophobicContact SD-CD1 4.01Å; M248-I301 HydrophobicContact SD-CG2 3.75Å; M248-I313 HydrophobicContact CB-CD1 3.96Å
249	L	94.2	Very high	92.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-39.4	175.3	-77.8	174.1	0	0	0	112.1	L245 M246 Q251 V252 V253 L261 I313 A362 L365 Y366	L245-L249 HydrophobicContact CD1-CD1 4.31Å; L245-L249 HydrophobicContact CD1-CG 4.3Å; L245-L249 HydrophobicContact CG-CD1 4.11Å; L245-L249 HydrophobicContact CG-CG 4.47Å; L245-L249 WeakPolarHBondContact O-CB 3.11Å; L245-L249 WeakPolarHBondContact O-CG 3.26Å; L245-L249 PolarHBondContact O-N 2.88Å; M246-L249 PolarHBondContact O-N 3.29Å; M246-L249 HydrophobicContact SD-CD1 4.17Å; L249-Q251 VanDerWaalsContact C-N 3.28Å; L249-Q251 PolarHBondContact O-N 3.49Å; L249-V252 PolarHBondContact O-N 2.87Å; L249-V253 WeakPolarHBondContact O-CG2 3.28Å; L249-V253 PolarHBondContact O-N 3.34Å; L249-L261 HydrophobicContact CD1-CD2 3.92Å; L249-L261 HydrophobicContact CD2-CD1 4.27Å; L249-L261 HydrophobicContact CD2-CD2 4.26Å; L249-I313 HydrophobicContact CD2-CD1 3.79Å; L249-I313 HydrophobicContact CD2-CG1 3.89Å; L249-I313 HydrophobicContact CG-CD1 3.99Å; L249-I313 HydrophobicContact CG-CG1 4.44Å; L249-A362 HydrophobicContact CB-CB 3.91Å; L249-L365 HydrophobicContact CD2-CD2 4.18Å; L249-Y366 HydrophobicContact CD1-CD2 4.32Å
250	E	94.2	Very high	92.3	Very high	117 Å²	117	56.8 Å²	56.8	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-59.2	-41	174.3	-75.1	-179.3	-178	0	0	111.5	M246 E247 V253 A254 A362	M246-E250 WeakPolarHBondContact O-CG 3.26Å; M246-E250 PolarHBondContact O-N 3.06Å; E247-E250 PolarHBondContact O-N 3.11Å; E250-V253 PolarHBondContact O-N 3.49Å; E250-A254 WeakPolarHBondContact O-CB 3.17Å; E250-A254 PolarHBondContact O-N 3.08Å; E250-A362 HydrophobicContact CG-CB 3.8Å
251	Q	92.8	Very high	92.5	Very high	110 Å²	110	56.3 Å²	56.3	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-40.5	175.2	-66.1	178.6	14.7	0	0	112.5	E247 M248 L249 A254 R255	E247-Q251 WeakPolarHBondContact O-CG 3.32Å; E247-Q251 PolarHBondContact O-N 3.21Å; M248-Q251 WeakPolarHBondContact O-CB 3.36Å; M248-Q251 PolarHBondContact O-N 2.93Å; L249-Q251 VanDerWaalsContact C-N 3.28Å; L249-Q251 PolarHBondContact O-N 3.49Å; Q251-A254 PolarHBondContact O-N 3.07Å; Q251-R255 WeakPolarHBondContact O-CG 3.27Å; Q251-R255 PolarHBondContact O-N 3.35Å; Q251-R255 VanDerWaalsContact O-N 3.17Å
252	V	91	Very high	92.7	Very high	14 Å²	14	55 Å²	55	9%	0.085	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-45.2	177.3	171.8	0	0	0	0	111	M248 L249 A254 R255 K256 T259 I313	M248-V252 WeakPolarHBondContact O-CG2 3.33Å; M248-V252 PolarHBondContact O-N 2.71Å; M248-V252 VanDerWaalsContact O-N 3.08Å; L249-V252 PolarHBondContact O-N 2.87Å; V252-A254 VanDerWaalsContact C-N 3.34Å; V252-A254 PolarHBondContact O-N 2.83Å; V252-R255 PolarHBondContact O-N 2.96Å; V252-K256 PolarHBondContact O-N 3.22Å; V252-T259 HydrophobicContact CG1-CG2 3.53Å; V252-I313 HydrophobicContact CG2-CG2 4.11Å
253	V	92.2	Very high	92.9	Very high	28 Å²	28	50.3 Å²	50.3	17%	0.17	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-42.1	177.1	169.3	0	0	0	0	111.1	L249 E250 R255 K256 F356 L360 A362	L249-V253 WeakPolarHBondContact O-CG2 3.28Å; L249-V253 PolarHBondContact O-N 3.34Å; E250-V253 PolarHBondContact O-N 3.49Å; V253-R255 VanDerWaalsContact C-N 3.26Å; V253-R255 PolarHBondContact O-N 2.91Å; V253-K256 PolarHBondContact O-N 3.4Å; V253-F356 HydrophobicContact CB-CE2 4.45Å; V253-F356 HydrophobicContact CB-CZ 4.09Å; V253-F356 HydrophobicContact CG1-CE2 4.29Å; V253-F356 HydrophobicContact CG1-CZ 4.09Å; V253-F356 HydrophobicContact CG2-CD2 4.44Å; V253-F356 HydrophobicContact CG2-CE1 4.49Å; V253-F356 HydrophobicContact CG2-CE2 3.92Å; V253-F356 HydrophobicContact CG2-CZ 3.94Å; V253-L360 WeakPolarHBondContact CG1-O 3.49Å; V253-A362 HydrophobicContact CG2-CB 4.28Å
254	A	91.7	Very high	93.2	Very high	83 Å²	83	47.9 Å²	47.9	69%	0.686	24%	0.236	S	C	*	.	H	α-helix	trans	-61.5	-33.4	177.2	0	0	0	0	0	112.9	E250 Q251 V252 K256	E250-A254 WeakPolarHBondContact O-CB 3.17Å; E250-A254 PolarHBondContact O-N 3.08Å; Q251-A254 PolarHBondContact O-N 3.07Å; V252-A254 VanDerWaalsContact C-N 3.34Å; V252-A254 PolarHBondContact O-N 2.83Å; A254-K256 VanDerWaalsContact C-N 3.27Å; A254-K256 PolarHBondContact O-N 3.4Å
255	R	89.9	Confident	93.4	Very high	161 Å²	161	47.3 Å²	47.3	61%	0.608	23%	0.233	S	C	*	.	H	α-helix	trans	-75.1	-14.1	175.8	-69.1	174	-173.4	-174.4	4.6	113.4	Q251 V252 V253 Q257	Q251-R255 WeakPolarHBondContact O-CG 3.27Å; Q251-R255 PolarHBondContact O-N 3.35Å; Q251-R255 VanDerWaalsContact O-N 3.17Å; V252-R255 PolarHBondContact O-N 2.96Å; V253-R255 VanDerWaalsContact C-N 3.26Å; V253-R255 PolarHBondContact O-N 2.91Å; R255-Q257 HydrophobicContact CB-CG 4.09Å; R255-Q257 PolarHBondContact O-N 3.03Å; R255-Q257 VanDerWaalsContact O-N 3.09Å
256	K	85.8	Confident	93.3	Very high	152 Å²	152	47.3 Å²	47.3	66%	0.661	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	29.2	-175	-60.2	-171.1	175.3	-168.8	0	113.8	V252 V253 A254	V252-K256 PolarHBondContact O-N 3.22Å; V253-K256 PolarHBondContact O-N 3.4Å; A254-K256 VanDerWaalsContact C-N 3.27Å; A254-K256 PolarHBondContact O-N 3.4Å
257	Q	85.2	Confident	93.1	Very high	116 Å²	116	46.2 Å²	46.2	54%	0.542	23%	0.227	S	C	.	.			trans	-84.3	128.6	176.7	-73.2	178.2	-9.2	0	0	109	R255 T259 F356	R255-Q257 HydrophobicContact CB-CG 4.09Å; R255-Q257 PolarHBondContact O-N 3.03Å; R255-Q257 VanDerWaalsContact O-N 3.09Å; Q257-T259 PolarHBondContact O-N 2.9Å; Q257-F356 VanDerWaalsContact O-CD1 3.24Å; Q257-F356 WeakPolarHBondContact O-CD1 3.42Å; Q257-F356 WeakPolarHBondContact O-CE1 3.15Å
258	T	91.2	Very high	92.9	Very high	35 Å²	35	42.6 Å²	42.6	22%	0.215	21%	0.211	C	C	.	.			trans	-60	131.6	175.6	-61.8	0	0	0	0	110.1	Q318 F356 Y357	T258-Q318 WeakPolarHBondContact CG2-O 3.3Å; T258-Q318 PolarHBondContact O-NE2 3.29Å; T258-F356 WeakPolarHBondContact CA-O 3.05Å; T258-F356 WeakPolarHBondContact CG2-O 3.29Å; T258-Y357 HydrophobicContact CG2-CD1 3.59Å; T258-Y357 HydrophobicContact CG2-CE1 3.73Å
259	T	94.4	Very high	92.7	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	171.3	-177.3	-164.7	0	0	0	0	110	V252 Q257 A314 N315 V317 F356	V252-T259 HydrophobicContact CG1-CG2 3.53Å; Q257-T259 PolarHBondContact O-N 2.9Å; T259-A314 PolarHBondContact OG1-O 2.85Å; T259-N315 PolarHBondContact OG1-OD1 3.48Å; T259-V317 CarbonylContact C-O 3.44Å; T259-V317 WeakPolarHBondContact CA-O 3.44Å; T259-F356 HydrophobicContact CG2-CB 3.93Å; T259-F356 HydrophobicContact CG2-CD1 4.05Å; T259-F356 HydrophobicContact CG2-CG 4.41Å; T259-F356 PolarHBondContact N-O 2.63Å; T259-F356 PolarHBondContact O-N 3.48Å
260	A	95.5	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.4	167.9	0	0	0	0	0	110.7	A314 V317 A323 V353 M355	A260-A314 HydrophobicContact CB-CB 4.25Å; A260-A314 WeakPolarHBondContact O-CB 3.26Å; A260-A314 PolarHBondContact O-N 2.84Å; A260-V317 HydrophobicContact CB-CB 4.09Å; A260-V317 HydrophobicContact CB-CG1 3.67Å; A260-A323 HydrophobicContact CB-CB 4.17Å; A260-V353 HydrophobicContact CB-CG1 4.31Å; A260-M355 HydrophobicContact CB-CE 4.31Å; A260-M355 HydrophobicContact CB-SD 3.64Å
261	L	97.4	Very high	92.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.4	166.1	178.1	60.9	0	0	0	108.6	L249 A311 I313 A354 L365 Y366 A369	L249-L261 HydrophobicContact CD1-CD2 3.92Å; L249-L261 HydrophobicContact CD2-CD1 4.27Å; L249-L261 HydrophobicContact CD2-CD2 4.26Å; L261-A311 HydrophobicContact CD1-CB 4.28Å; L261-I313 HydrophobicContact CD1-CG1 4.31Å; L261-A354 PolarHBondContact N-O 3.34Å; L261-A354 PolarHBondContact O-N 2.79Å; L261-L365 HydrophobicContact CB-CD1 4.28Å; L261-L365 HydrophobicContact CB-CD2 4.33Å; L261-L365 HydrophobicContact CB-CG 4.09Å; L261-L365 HydrophobicContact CD2-CG 4.07Å; L261-Y366 HydrophobicContact CD2-CD2 4.38Å; L261-A369 HydrophobicContact CB-CB 4.28Å; L261-A369 HydrophobicContact CD2-CB 3.85Å; L261-A369 HydrophobicContact CG-CB 3.85Å
262	M	98	Very high	91.8	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.8	177.3	-54.1	175.3	69	0	0	109.9	A311 V312 A314 L326 I351 G352 V353	M262-A311 CarbonylContact O-C 3.54Å; M262-A311 VanDerWaalsContact O-CA 3.26Å; M262-A311 WeakPolarHBondContact O-CA 3.19Å; M262-V312 HydrophobicContact CB-CB 4.27Å; M262-V312 PolarHBondContact N-O 3.19Å; M262-V312 PolarHBondContact O-N 3.22Å; M262-A314 HydrophobicContact SD-CB 4.43Å; M262-L326 HydrophobicContact CE-CG 4.49Å; M262-L326 HydrophobicContact SD-CB 4.48Å; M262-L326 HydrophobicContact SD-CD2 3.68Å; M262-L326 HydrophobicContact SD-CG 4.03Å; M262-I351 HydrophobicContact CB-CG2 4.32Å; M262-I351 HydrophobicContact CE-CG2 3.64Å; M262-G352 CarbonylContact C-O 3.5Å; M262-G352 VanDerWaalsContact CA-O 3.27Å; M262-G352 WeakPolarHBondContact CA-O 3.32Å; M262-V353 HydrophobicContact CE-CG2 4.31Å; M262-V353 HydrophobicContact CG-CG1 4.42Å; M262-V353 HydrophobicContact CG-CG2 4.21Å
263	I	97.7	Very high	91.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.3	171.4	-60.4	-62	0	0	0	107.8	I305 F310 A311 I351 G352 Y366 A369 I370 A373	I263-I305 HydrophobicContact CD1-CD1 3.53Å; I263-F310 CarbonylContact C-O 3.57Å; I263-F310 WeakPolarHBondContact CA-O 3.03Å; I263-A311 HydrophobicContact CD1-CB 3.86Å; I263-I351 CarbonylContact O-C 3.5Å; I263-I351 VanDerWaalsContact O-CA 3.3Å; I263-I351 WeakPolarHBondContact O-CA 3.3Å; I263-G352 PolarHBondContact N-O 3.11Å; I263-G352 PolarHBondContact O-N 2.94Å; I263-Y366 HydrophobicContact CD1-CE2 4.32Å; I263-A369 HydrophobicContact CD1-CB 4.4Å; I263-A369 HydrophobicContact CG1-CB 3.55Å; I263-I370 HydrophobicContact CD1-CD1 4.08Å; I263-I370 HydrophobicContact CD1-CG1 4.39Å; I263-I370 HydrophobicContact CG1-CD1 4.06Å; I263-I370 HydrophobicContact CG1-CG1 4.21Å; I263-I370 HydrophobicContact CG2-CD1 3.92Å; I263-A373 HydrophobicContact CB-CB 3.86Å; I263-A373 HydrophobicContact CG2-CB 3.64Å
264	I	97.5	Very high	90.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	107.5	-179.2	-54.6	161.6	0	0	0	107.4	L292 D309 F310 V312 V330 C349 I351	I264-L292 HydrophobicContact CD1-CD2 3.83Å; I264-D309 WeakPolarHBondContact O-CA 3.37Å; I264-F310 HydrophobicContact CB-CB 4.32Å; I264-F310 PolarHBondContact N-O 3.44Å; I264-F310 PolarHBondContact O-N 2.8Å; I264-V312 HydrophobicContact CD1-CG2 3.7Å; I264-V330 HydrophobicContact CD1-CG1 3.84Å; I264-V330 HydrophobicContact CG1-CG1 4.35Å; I264-V330 HydrophobicContact CG2-CG1 4.43Å; I264-C349 HydrophobicContact CG2-CB 4.01Å; I264-I351 HydrophobicContact CG1-CD1 4.46Å; I264-I351 HydrophobicContact CG1-CG1 4.24Å; I264-I351 HydrophobicContact CG2-CG1 4.42Å
265	T	94.9	Very high	90.4	Very high	11 Å²	11	45 Å²	45	7%	0.067	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.3	174.9	-60.3	0	0	0	0	108.6	Y308 D309 C349 S350	T265-Y308 HydrophobicContact CG2-CD2 4.49Å; T265-D309 WeakPolarHBondContact CG2-OD1 3.17Å; T265-D309 PolarHBondContact OG1-OD1 2.81Å; T265-C349 CarbonylContact O-C 3.58Å; T265-C349 WeakPolarHBondContact O-CA 3.48Å; T265-C349 WeakPolarHBondContact O-CB 3.44Å; T265-S350 PolarHBondContact N-O 3.38Å; T265-S350 PolarHBondContact O-N 2.8Å
266	C	94	Very high	90.2	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.			trans	-93.3	99.9	175	-176.1	0	0	0	0	110.5	T268 L269 Y308 F310 M334 C349	C266-T268 PolarHBondContact O-N 2.87Å; C266-L269 HydrophobicContact CB-CB 4.29Å; C266-L269 HydrophobicContact CB-CD1 4.04Å; C266-L269 HydrophobicContact CB-CG 4.26Å; C266-L269 PolarHBondContact O-N 3.41Å; C266-Y308 PolarHBondContact N-O 3.39Å; C266-F310 HydrophobicContact CB-CE2 4.45Å; C266-M334 HydrophobicContact CB-CE 4.44Å; C266-C349 HydrophobicContact CB-CB 4.44Å
267	E	90.5	Very high	90.3	Very high	9 Å²	9	38.3 Å²	38.3	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-31	179.3	-66.4	78.3	-168.9	0	0	111.9	L269 R270 D271 H348 C349 S350 R377	E267-L269 PolarHBondContact O-N 3.24Å; E267-R270 CarbonylContact O-C 3.6Å; E267-R270 WeakPolarHBondContact O-CA 3.46Å; E267-R270 WeakPolarHBondContact O-CB 3.36Å; E267-R270 PolarHBondContact O-N 3.48Å; E267-D271 WeakPolarHBondContact O-CB 3.46Å; E267-D271 PolarHBondContact O-N 3.02Å; E267-H348 PolarHBondContact N-O 3.37Å; E267-H348 IonicContact OE2-CD2 3.4Å; E267-C349 WeakPolarHBondContact OE2-CA 3.18Å; E267-S350 VanDerWaalsContact OE1-CB 3.24Å; E267-S350 WeakPolarHBondContact OE1-CB 3.27Å; E267-S350 PolarHBondContact OE1-OG 2.89Å; E267-S350 PolarHBondContact OE2-N 3.08Å; E267-R377 HydrophobicContact CG-CG 4.32Å; E267-R377 WeakPolarHBondContact OE1-CD 3.31Å; E267-R377 WeakPolarHBondContact OE1-CG 3.4Å; E267-R377 IonicContact OE1-NE 2.64Å
268	T	89.4	Confident	90.3	Very high	10 Å²	10	37.9 Å²	37.9	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-36.1	178.6	-54.5	0	0	0	0	112.9	C266 R270 D271 T272 P347 H348	C266-T268 PolarHBondContact O-N 2.87Å; T268-R270 PolarHBondContact O-N 3.13Å; T268-D271 PolarHBondContact O-N 3.5Å; T268-T272 HydrophobicContact CG2-CG2 4.19Å; T268-T272 WeakPolarHBondContact O-CB 3.4Å; T268-T272 WeakPolarHBondContact O-CG2 3.37Å; T268-T272 PolarHBondContact O-N 2.84Å; T268-T272 PolarHBondContact O-OG1 2.64Å; T268-P347 HydrophobicContact CG2-CB 4.3Å; T268-P347 VanDerWaalsContact OG1-CA 3.31Å; T268-P347 WeakPolarHBondContact OG1-CA 3.32Å; T268-H348 PolarHBondContact OG1-CE1 3.3Å; T268-H348 PolarHBondContact OG1-N 2.89Å; T268-H348 PolarHBondContact OG1-ND1 3.01Å
269	L	90.2	Very high	90.2	Very high	2 Å²	2	39 Å²	39	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-30.5	172.9	-80.3	174.7	0	0	0	112.1	C266 E267 T272 L284 L285 L288 F310	C266-L269 HydrophobicContact CB-CB 4.29Å; C266-L269 HydrophobicContact CB-CD1 4.04Å; C266-L269 HydrophobicContact CB-CG 4.26Å; C266-L269 PolarHBondContact O-N 3.41Å; E267-L269 PolarHBondContact O-N 3.24Å; L269-T272 PolarHBondContact O-OG1 3.07Å; L269-L284 HydrophobicContact CD2-CB 4.41Å; L269-L284 HydrophobicContact CD2-CD2 3.81Å; L269-L284 HydrophobicContact CD2-CG 3.8Å; L269-L285 HydrophobicContact CD1-CD1 4.07Å; L269-L285 HydrophobicContact CD2-CB 4.38Å; L269-L288 HydrophobicContact CD1-CD1 3.78Å; L269-L288 HydrophobicContact CD2-CD1 4.07Å; L269-L288 HydrophobicContact CG-CD1 3.72Å; L269-F310 HydrophobicContact CD1-CE2 3.92Å; L269-F310 HydrophobicContact CD1-CZ 3.94Å
270	R	87.7	Confident	90	Very high	79 Å²	79	39.9 Å²	39.9	30%	0.298	24%	0.236	S	C	.	.	H	α-helix	trans	-76.2	-48.4	175	-172.5	-171.8	-65.1	-145.4	6.7	111.7	E267 T268 T272 A273 Y308 R377	E267-R270 CarbonylContact O-C 3.6Å; E267-R270 WeakPolarHBondContact O-CA 3.46Å; E267-R270 WeakPolarHBondContact O-CB 3.36Å; E267-R270 PolarHBondContact O-N 3.48Å; T268-R270 PolarHBondContact O-N 3.13Å; R270-T272 PolarHBondContact O-N 3.4Å; R270-A273 WeakPolarHBondContact O-CB 3.49Å; R270-A273 PolarHBondContact O-N 2.79Å; R270-Y308 HydrophobicContact CB-CD1 3.91Å; R270-Y308 HydrophobicContact CB-CE1 4.45Å; R270-Y308 HydrophobicContact CB-CG 4.03Å; R270-Y308 HydrophobicContact CG-CD1 4.11Å; R270-Y308 HydrophobicContact CG-CE1 4.17Å; R270-Y308 VanDerWaalsContact CZ-CE2 3.5Å; R270-Y308 VanDerWaalsContact CZ-CZ 3.47Å; R270-Y308 PolarHBondContact NH2-OH 2.72Å; R270-R377 VanDerWaalsContact NH2-NH1 3.14Å
271	D	86.9	Confident	89.7	Confident	97 Å²	97	42.4 Å²	42.4	52%	0.519	25%	0.246	S	C	.	.	H	α-helix	trans	-67.7	-27	-176.1	-65.7	-14.4	0	0	0	112.2	E267 T268 A273	E267-D271 WeakPolarHBondContact O-CB 3.46Å; E267-D271 PolarHBondContact O-N 3.02Å; T268-D271 PolarHBondContact O-N 3.5Å; D271-A273 VanDerWaalsContact C-N 3.26Å; D271-A273 PolarHBondContact O-N 3.3Å
272	T	86.2	Confident	89.4	Confident	11 Å²	11	46 Å²	46	7%	0.067	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.9	174.7	52.8	0	0	0	0	113.5	T268 L269 R270 G274 V275 L276 L284 L345	T268-T272 HydrophobicContact CG2-CG2 4.19Å; T268-T272 WeakPolarHBondContact O-CB 3.4Å; T268-T272 WeakPolarHBondContact O-CG2 3.37Å; T268-T272 PolarHBondContact O-N 2.84Å; T268-T272 PolarHBondContact O-OG1 2.64Å; L269-T272 PolarHBondContact O-OG1 3.07Å; R270-T272 PolarHBondContact O-N 3.4Å; T272-G274 PolarHBondContact O-N 3.05Å; T272-G274 VanDerWaalsContact O-N 3.11Å; T272-V275 PolarHBondContact O-N 3.3Å; T272-L276 HydrophobicContact CG2-CD1 3.75Å; T272-L276 HydrophobicContact CG2-CG 4.14Å; T272-L276 PolarHBondContact O-N 3.08Å; T272-L276 VanDerWaalsContact O-N 3.13Å; T272-L284 HydrophobicContact CG2-CD2 4.4Å; T272-L345 HydrophobicContact CG2-CD1 4.2Å
273	A	79.6	Confident	89.1	Confident	64 Å²	64	49.9 Å²	49.9	53%	0.529	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-64	111.5	174.2	0	0	0	0	0	110	R270 D271	R270-A273 WeakPolarHBondContact O-CB 3.49Å; R270-A273 PolarHBondContact O-N 2.79Å; D271-A273 VanDerWaalsContact C-N 3.26Å; D271-A273 PolarHBondContact O-N 3.3Å
274	G	80.5	Confident	88.8	Confident	81 Å²	81	49.9 Å²	49.9	84%	0.835	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	-13.7	-176.4	0	0	0	0	0	115.1	T272	T272-G274 PolarHBondContact O-N 3.05Å; T272-G274 VanDerWaalsContact O-N 3.11Å
275	V	85.7	Confident	88.6	Confident	111 Å²	111	50.9 Å²	50.9	67%	0.673	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-43.9	173.7	-178.9	0	0	0	0	110.9	T272	T272-V275 PolarHBondContact O-N 3.3Å
276	L	86.4	Confident	88.6	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-94.4	149.9	178.8	-63.6	-177.9	0	0	0	111.3	T272 Q280 R281 L284 I343 L345	T272-L276 HydrophobicContact CG2-CD1 3.75Å; T272-L276 HydrophobicContact CG2-CG 4.14Å; T272-L276 PolarHBondContact O-N 3.08Å; T272-L276 VanDerWaalsContact O-N 3.13Å; L276-Q280 HydrophobicContact CB-CB 4.12Å; L276-Q280 HydrophobicContact CD2-CB 4.5Å; L276-R281 HydrophobicContact CB-CG 3.78Å; L276-R281 HydrophobicContact CD1-CG 4.49Å; L276-L284 HydrophobicContact CD1-CD2 4.18Å; L276-I343 HydrophobicContact CD2-CD1 3.73Å; L276-L345 HydrophobicContact CD1-CD1 3.99Å
277	K	87.7	Confident	88.6	Confident	159 Å²	159	56.5 Å²	56.5	69%	0.691	32%	0.319	S	S	*	.			trans	-70.7	159.9	168.8	-63.6	179.9	-178.3	177.1	0	110.5	A279 Q280 R281	K277-A279 PolarHBondContact O-N 3.35Å; K277-Q280 HydrophobicContact CB-CG 4.47Å; K277-Q280 WeakPolarHBondContact O-CB 3.41Å; K277-Q280 PolarHBondContact O-N 2.92Å; K277-R281 PolarHBondContact O-N 2.57Å
278	E	85.9	Confident	88.7	Confident	107 Å²	107	56 Å²	56	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-56.5	-48.2	-177.3	-164.4	59.1	-156.6	0	0	113	Q280 R281 E282	E278-Q280 VanDerWaalsContact C-N 3.27Å; E278-Q280 PolarHBondContact O-N 3.29Å; E278-R281 WeakPolarHBondContact O-CA 3.5Å; E278-R281 WeakPolarHBondContact O-CB 3.36Å; E278-R281 PolarHBondContact O-N 2.89Å; E278-R281 IonicContact OE1-NH1 3.76Å; E278-R281 PolarHBondContact OE1-NH1 3.24Å; E278-R281 IonicContact OE2-CZ 2.65Å; E278-R281 IonicContact OE2-NH1 3.4Å; E278-R281 PolarHBondContact OE2-NH1 2.84Å; E278-E282 PolarHBondContact O-N 2.96Å
279	A	88.3	Confident	89	Confident	59 Å²	59	55.8 Å²	55.8	49%	0.488	32%	0.315	S	S	.	.	H	α-helix	trans	-58.1	-37	177.1	0	0	0	0	0	113.2	K277 E282 I283	K277-A279 PolarHBondContact O-N 3.35Å; A279-E282 PolarHBondContact O-N 3.46Å; A279-I283 VanDerWaalsContact O-CG1 3.28Å; A279-I283 WeakPolarHBondContact O-CG1 3.34Å; A279-I283 PolarHBondContact O-N 3.49Å; A279-I283 VanDerWaalsContact O-N 3.11Å
280	Q	89.9	Confident	89.3	Confident	20 Å²	20	61.4 Å²	61.4	9%	0.093	34%	0.341	C	S	.	.	H	α-helix	trans	-69.9	-35.8	176.4	-67.9	172.1	-37.4	0	0	111.6	L276 K277 E278 L284 I340 E341	L276-Q280 HydrophobicContact CB-CB 4.12Å; L276-Q280 HydrophobicContact CD2-CB 4.5Å; K277-Q280 HydrophobicContact CB-CG 4.47Å; K277-Q280 WeakPolarHBondContact O-CB 3.41Å; K277-Q280 PolarHBondContact O-N 2.92Å; E278-Q280 VanDerWaalsContact C-N 3.27Å; E278-Q280 PolarHBondContact O-N 3.29Å; Q280-L284 WeakPolarHBondContact O-CB 3.24Å; Q280-L284 PolarHBondContact O-N 3.11Å; Q280-I340 HydrophobicContact CB-CG2 3.95Å; Q280-I340 HydrophobicContact CG-CG2 4.25Å; Q280-E341 PolarHBondContact NE2-OE2 2.92Å
281	R	89.1	Confident	89.6	Confident	54 Å²	54	59.1 Å²	59.1	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-67.9	-40.1	175	-71.1	-177	57	-110.8	-12.6	111.9	L276 K277 E278 L284 L285	L276-R281 HydrophobicContact CB-CG 3.78Å; L276-R281 HydrophobicContact CD1-CG 4.49Å; K277-R281 PolarHBondContact O-N 2.57Å; E278-R281 WeakPolarHBondContact O-CA 3.5Å; E278-R281 WeakPolarHBondContact O-CB 3.36Å; E278-R281 PolarHBondContact O-N 2.89Å; E278-R281 IonicContact OE1-NH1 3.76Å; E278-R281 PolarHBondContact OE1-NH1 3.24Å; E278-R281 IonicContact OE2-CZ 2.65Å; E278-R281 IonicContact OE2-NH1 3.4Å; E278-R281 PolarHBondContact OE2-NH1 2.84Å; R281-L284 PolarHBondContact O-N 2.95Å; R281-L285 WeakPolarHBondContact O-CB 3.19Å; R281-L285 PolarHBondContact O-N 3.35Å
282	E	90.6	Very high	90	Very high	77 Å²	77	54.5 Å²	54.5	36%	0.36	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-45.1	175.2	-70.5	-179	173.1	0	0	111.4	V236 E278 A279 L284 L285 L286	V236-E282 HydrophobicContact CG1-CB 4.14Å; V236-E282 HydrophobicContact CG1-CG 4.04Å; V236-E282 HydrophobicContact CG2-CG 4.31Å; E278-E282 PolarHBondContact O-N 2.96Å; A279-E282 PolarHBondContact O-N 3.46Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.43Å; E282-L285 PolarHBondContact O-N 3.14Å; E282-L286 WeakPolarHBondContact O-CB 3.36Å; E282-L286 WeakPolarHBondContact O-CG 3.47Å; E282-L286 PolarHBondContact O-N 2.81Å
283	I	91.6	Very high	90.5	Very high	82 Å²	82	58.4 Å²	58.4	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-59.2	-45.7	174.7	-67	165.1	0	0	0	110.8	A279 L286 T287 I340	A279-I283 VanDerWaalsContact O-CG1 3.28Å; A279-I283 WeakPolarHBondContact O-CG1 3.34Å; A279-I283 PolarHBondContact O-N 3.49Å; A279-I283 VanDerWaalsContact O-N 3.11Å; I283-L286 PolarHBondContact O-N 2.93Å; I283-T287 WeakPolarHBondContact O-CB 3.4Å; I283-T287 PolarHBondContact O-N 3.47Å; I283-T287 PolarHBondContact O-OG1 3.37Å; I283-I340 HydrophobicContact CG2-CD1 3.99Å
284	L	91.9	Very high	91.2	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-47.4	177.1	177.8	60.7	0	0	0	111.4	L269 T272 L276 Q280 R281 E282 T287 L288 L338 I340 L345	L269-L284 HydrophobicContact CD2-CB 4.41Å; L269-L284 HydrophobicContact CD2-CD2 3.81Å; L269-L284 HydrophobicContact CD2-CG 3.8Å; T272-L284 HydrophobicContact CG2-CD2 4.4Å; L276-L284 HydrophobicContact CD1-CD2 4.18Å; Q280-L284 WeakPolarHBondContact O-CB 3.24Å; Q280-L284 PolarHBondContact O-N 3.11Å; R281-L284 PolarHBondContact O-N 2.95Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.43Å; L284-T287 PolarHBondContact O-N 2.82Å; L284-L288 HydrophobicContact CD1-CD1 4.05Å; L284-L288 HydrophobicContact CD1-CG 4.25Å; L284-L288 HydrophobicContact CG-CD1 4.09Å; L284-L288 VanDerWaalsContact O-CG 3.26Å; L284-L288 WeakPolarHBondContact O-CG 3.46Å; L284-L288 PolarHBondContact O-N 3.15Å; L284-L338 HydrophobicContact CD1-CD1 3.66Å; L284-I340 HydrophobicContact CB-CD1 4.08Å; L284-I340 HydrophobicContact CB-CG1 4.48Å; L284-I340 HydrophobicContact CD1-CD1 4.23Å; L284-I340 HydrophobicContact CD1-CG1 4.34Å; L284-L345 HydrophobicContact CD2-CD1 4.04Å
285	L	93.6	Very high	91.7	Very high	21 Å²	21	57.2 Å²	57.2	11%	0.11	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-52.5	177.5	172.3	62	0	0	0	111.4	V236 L269 R281 E282 T287 L288 V289 F310	V236-L285 HydrophobicContact CB-CD2 4.47Å; V236-L285 HydrophobicContact CG1-CD2 4.31Å; L269-L285 HydrophobicContact CD1-CD1 4.07Å; L269-L285 HydrophobicContact CD2-CB 4.38Å; R281-L285 WeakPolarHBondContact O-CB 3.19Å; R281-L285 PolarHBondContact O-N 3.35Å; E282-L285 PolarHBondContact O-N 3.14Å; L285-T287 VanDerWaalsContact C-N 3.31Å; L285-T287 PolarHBondContact O-N 3.03Å; L285-L288 PolarHBondContact O-N 2.98Å; L285-V289 HydrophobicContact CD1-CG2 4.09Å; L285-V289 WeakPolarHBondContact O-CG2 3.24Å; L285-V289 PolarHBondContact O-N 3.45Å; L285-F310 HydrophobicContact CD1-CE1 3.87Å; L285-F310 HydrophobicContact CD1-CZ 3.52Å
286	L	94.2	Very high	92.2	Very high	81 Å²	81	53 Å²	53	42%	0.424	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-39.7	-178.8	-71.3	174.9	0	0	0	112.1	V236 E282 I283 L288 V289 E290	V236-L286 HydrophobicContact CG1-CD1 4.3Å; V236-L286 HydrophobicContact CG1-CD2 4.19Å; V236-L286 HydrophobicContact CG1-CG 4.13Å; V236-L286 WeakPolarHBondContact O-CD2 3.25Å; E282-L286 WeakPolarHBondContact O-CB 3.36Å; E282-L286 WeakPolarHBondContact O-CG 3.47Å; E282-L286 PolarHBondContact O-N 2.81Å; I283-L286 PolarHBondContact O-N 2.93Å; L286-L288 PolarHBondContact O-N 2.82Å; L286-V289 PolarHBondContact O-N 3.35Å; L286-E290 PolarHBondContact O-N 2.84Å
287	T	93.7	Very high	92.3	Very high	48 Å²	48	54.5 Å²	54.5	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-41.9	176.9	-54.9	0	0	0	0	111.6	I283 L284 L285 K291 L338	I283-T287 WeakPolarHBondContact O-CB 3.4Å; I283-T287 PolarHBondContact O-N 3.47Å; I283-T287 PolarHBondContact O-OG1 3.37Å; L284-T287 PolarHBondContact O-N 2.82Å; L285-T287 VanDerWaalsContact C-N 3.31Å; L285-T287 PolarHBondContact O-N 3.03Å; T287-K291 WeakPolarHBondContact O-CB 3.29Å; T287-K291 WeakPolarHBondContact O-CG 3.25Å; T287-K291 PolarHBondContact O-N 3.24Å; T287-K291 VanDerWaalsContact O-N 3.08Å; T287-L338 HydrophobicContact CG2-CD1 4.05Å; T287-L338 HydrophobicContact CG2-CD2 3.66Å; T287-L338 HydrophobicContact CG2-CG 4.47Å
288	L	94.5	Very high	92.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-40.2	176.5	-68.2	171.5	0	0	0	111.9	L269 L284 L285 L286 E290 K291 L292 M334 L338 P347	L269-L288 HydrophobicContact CD1-CD1 3.78Å; L269-L288 HydrophobicContact CD2-CD1 4.07Å; L269-L288 HydrophobicContact CG-CD1 3.72Å; L284-L288 HydrophobicContact CD1-CD1 4.05Å; L284-L288 HydrophobicContact CD1-CG 4.25Å; L284-L288 HydrophobicContact CG-CD1 4.09Å; L284-L288 VanDerWaalsContact O-CG 3.26Å; L284-L288 WeakPolarHBondContact O-CG 3.46Å; L284-L288 PolarHBondContact O-N 3.15Å; L285-L288 PolarHBondContact O-N 2.98Å; L286-L288 PolarHBondContact O-N 2.82Å; L288-E290 VanDerWaalsContact C-N 3.35Å; L288-E290 PolarHBondContact O-N 3.46Å; L288-K291 WeakPolarHBondContact O-CB 3.31Å; L288-K291 PolarHBondContact O-N 2.68Å; L288-L292 WeakPolarHBondContact O-CG 3.21Å; L288-L292 PolarHBondContact O-N 3.31Å; L288-M334 HydrophobicContact CB-CE 4.18Å; L288-M334 HydrophobicContact CB-SD 4.21Å; L288-M334 HydrophobicContact CD1-CE 4.4Å; L288-M334 HydrophobicContact CD2-CE 3.74Å; L288-M334 HydrophobicContact CD2-SD 3.73Å; L288-M334 HydrophobicContact CG-CE 4.32Å; L288-L338 HydrophobicContact CD2-CD1 3.76Å; L288-L338 HydrophobicContact CG-CD1 4.21Å; L288-P347 HydrophobicContact CD2-CB 4.03Å; L288-P347 HydrophobicContact CD2-CG 3.9Å
289	V	95.5	Very high	92.5	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-43.9	175.8	167.2	0	0	0	0	111.1	L239 L285 L286 L292 K293 L302 F310	L239-V289 HydrophobicContact CD1-CB 4.47Å; L239-V289 HydrophobicContact CD1-CG1 3.85Å; L239-V289 HydrophobicContact CD1-CG2 3.75Å; L239-V289 HydrophobicContact CD2-CG1 4.22Å; L239-V289 HydrophobicContact CG-CG1 4.15Å; L285-V289 HydrophobicContact CD1-CG2 4.09Å; L285-V289 WeakPolarHBondContact O-CG2 3.24Å; L285-V289 PolarHBondContact O-N 3.45Å; L286-V289 PolarHBondContact O-N 3.35Å; V289-L292 PolarHBondContact O-N 3.35Å; V289-K293 HydrophobicContact CG1-CD 4.29Å; V289-K293 WeakPolarHBondContact O-CG 3.37Å; V289-K293 PolarHBondContact O-N 3.03Å; V289-L302 HydrophobicContact CG1-CD2 4.35Å; V289-F310 HydrophobicContact CG2-CE1 3.69Å; V289-F310 HydrophobicContact CG2-CZ 4.24Å
290	E	95.1	Very high	92.9	Very high	121 Å²	121	57.3 Å²	57.3	57%	0.565	29%	0.293	S	S	*	.	H	α-helix	trans	-64.7	-42.2	178.1	-168.1	60.8	-163.6	0	0	111.8	L286 L288 L292 K293 S294	L286-E290 PolarHBondContact O-N 2.84Å; L288-E290 VanDerWaalsContact C-N 3.35Å; L288-E290 PolarHBondContact O-N 3.46Å; E290-L292 PolarHBondContact O-N 3.26Å; E290-K293 PolarHBondContact O-N 2.86Å; E290-S294 PolarHBondContact O-N 2.85Å
291	K	94.7	Very high	93.2	Very high	31 Å²	31	58.6 Å²	58.6	14%	0.135	30%	0.3	C	S	.	.	H	α-helix	trans	-58.8	-44.8	172.9	-79.9	-178.5	161.7	-61	0	112.4	T287 L288 S294 I333 E336 L338	T287-K291 WeakPolarHBondContact O-CB 3.29Å; T287-K291 WeakPolarHBondContact O-CG 3.25Å; T287-K291 PolarHBondContact O-N 3.24Å; T287-K291 VanDerWaalsContact O-N 3.08Å; L288-K291 WeakPolarHBondContact O-CB 3.31Å; L288-K291 PolarHBondContact O-N 2.68Å; K291-S294 PolarHBondContact O-N 3.29Å; K291-S294 PolarHBondContact O-OG 3.15Å; K291-I333 HydrophobicContact CB-CG1 3.85Å; K291-I333 HydrophobicContact CD-CG1 4.35Å; K291-I333 HydrophobicContact CG-CG1 4.02Å; K291-E336 IonicContact NZ-OE2 3.73Å; K291-E336 PolarHBondContact NZ-OE2 2.75Å; K291-L338 HydrophobicContact CD-CD2 4.13Å; K291-L338 VanDerWaalsContact CE-CD2 3.42Å
292	L	95.8	Very high	93.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60	-49.7	174.6	-74	171.6	0	0	0	110.8	I264 L288 V289 E290 S294 V295 L296 L302 F310 V330 M334	I264-L292 HydrophobicContact CD1-CD2 3.83Å; L288-L292 WeakPolarHBondContact O-CG 3.21Å; L288-L292 PolarHBondContact O-N 3.31Å; V289-L292 PolarHBondContact O-N 3.35Å; E290-L292 PolarHBondContact O-N 3.26Å; L292-S294 VanDerWaalsContact C-N 3.25Å; L292-S294 PolarHBondContact O-N 3.29Å; L292-V295 PolarHBondContact O-N 3.25Å; L292-V295 VanDerWaalsContact O-N 3.15Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.36Å; L292-L296 PolarHBondContact O-N 3.09Å; L292-L302 HydrophobicContact CB-CD1 4.4Å; L292-L302 HydrophobicContact CB-CD2 3.83Å; L292-L302 HydrophobicContact CD1-CD1 4.15Å; L292-L302 HydrophobicContact CD1-CD2 4.5Å; L292-F310 HydrophobicContact CD1-CB 4.4Å; L292-F310 HydrophobicContact CD1-CD1 4.33Å; L292-F310 HydrophobicContact CD1-CD2 4.07Å; L292-F310 HydrophobicContact CD1-CE2 4.45Å; L292-F310 HydrophobicContact CD1-CG 4Å; L292-V330 HydrophobicContact CD2-CG1 3.64Å; L292-V330 HydrophobicContact CD2-CG2 4.39Å; L292-M334 HydrophobicContact CD1-CE 4.43Å; L292-M334 HydrophobicContact CD1-SD 4.26Å; L292-M334 HydrophobicContact CD2-CG 4.02Å; L292-M334 HydrophobicContact CD2-SD 3.82Å; L292-M334 HydrophobicContact CG-CE 4.49Å; L292-M334 HydrophobicContact CG-SD 3.72Å
293	K	95.3	Very high	93.9	Very high	93 Å²	93	53 Å²	53	40%	0.404	28%	0.277	S	S	.	.	H	α-helix	trans	-56.9	-36.8	178.4	-73.5	178.7	-179.1	176.4	0	112.9	V289 E290 V295 L296 L302	V289-K293 HydrophobicContact CG1-CD 4.29Å; V289-K293 WeakPolarHBondContact O-CG 3.37Å; V289-K293 PolarHBondContact O-N 3.03Å; E290-K293 PolarHBondContact O-N 2.86Å; K293-V295 VanDerWaalsContact C-N 3.25Å; K293-V295 PolarHBondContact O-N 3.34Å; K293-L296 PolarHBondContact O-N 3.27Å; K293-L302 HydrophobicContact CG-CD2 3.84Å
294	S	94.2	Very high	94.1	Very high	84 Å²	84	49.3 Å²	49.3	59%	0.587	26%	0.258	S	S	*	.	H	α-helix	trans	-65.7	-22.9	-179.8	71.6	0	0	0	0	115.1	E290 K291 L292	E290-S294 PolarHBondContact O-N 2.85Å; K291-S294 PolarHBondContact O-N 3.29Å; K291-S294 PolarHBondContact O-OG 3.15Å; L292-S294 VanDerWaalsContact C-N 3.25Å; L292-S294 PolarHBondContact O-N 3.29Å
295	V	92.7	Very high	94.2	Very high	36 Å²	36	50.4 Å²	50.4	22%	0.218	26%	0.263	C	S	.	.	H	α-helix	trans	-93.6	-25.1	178.6	174.3	0	0	0	0	111.5	L292 K293 L326 Q329 V330 I333	L292-V295 PolarHBondContact O-N 3.25Å; L292-V295 VanDerWaalsContact O-N 3.15Å; K293-V295 VanDerWaalsContact C-N 3.25Å; K293-V295 PolarHBondContact O-N 3.34Å; V295-L326 HydrophobicContact CG1-CD1 4.15Å; V295-Q329 HydrophobicContact CG1-CB 3.57Å; V295-V330 HydrophobicContact CG1-CG2 4.23Å; V295-I333 HydrophobicContact CG2-CB 3.94Å; V295-I333 HydrophobicContact CG2-CG1 4.22Å; V295-I333 HydrophobicContact CG2-CG2 3.62Å
296	L	94.5	Very high	94	Very high	22 Å²	22	50.7 Å²	50.7	12%	0.115	27%	0.267	C	S	.	.	S	Bend	trans	-83.7	137.7	-175.5	-62.7	176.1	0	0	0	111.6	L292 K293 M300 L302 V312 L326	L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.36Å; L292-L296 PolarHBondContact O-N 3.09Å; K293-L296 PolarHBondContact O-N 3.27Å; L296-M300 HydrophobicContact CB-CB 4.37Å; L296-M300 HydrophobicContact CB-SD 4.37Å; L296-M300 HydrophobicContact CD2-SD 3.88Å; L296-L302 HydrophobicContact CD1-CB 3.8Å; L296-L302 HydrophobicContact CD1-CD1 4.1Å; L296-L302 HydrophobicContact CD1-CD2 4.35Å; L296-L302 HydrophobicContact CD1-CG 4.3Å; L296-V312 HydrophobicContact CD1-CG1 4.15Å; L296-V312 HydrophobicContact CD1-CG2 3.82Å; L296-V312 HydrophobicContact CD2-CG1 3.65Å; L296-V312 HydrophobicContact CD2-CG2 4.19Å; L296-L326 HydrophobicContact CD2-CD1 4.19Å
297	S	90.1	Very high	93.7	Very high	46 Å²	46	48.5 Å²	48.5	32%	0.322	26%	0.264	S	S	.	.			trans	-71.8	156.1	173.8	79.1	0	0	0	0	111.5	R299 M300	S297-R299 PolarHBondContact O-N 3.03Å; S297-M300 WeakPolarHBondContact O-CB 3.36Å; S297-M300 PolarHBondContact O-N 3.39Å; S297-M300 WeakPolarHBondContact OG-CG 3.49Å
298	P	87.2	Confident	93.6	Very high	141 Å²	141	49.4 Å²	49.4	92%	0.916	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-15.7	178.3	-25.2	34.4	0	0	0	115.4
299	R	90.9	Very high	93.6	Very high	206 Å²	206	50.5 Å²	50.5	78%	0.777	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-15.5	176.8	-63.6	-178.3	-179.4	176.3	0.9	112.7	S297 N315	S297-R299 PolarHBondContact O-N 3.03Å; R299-N315 WeakPolarHBondContact O-CB 3.44Å; R299-N315 PolarHBondContact O-ND2 3.03Å
300	M	95.6	Very high	93.7	Very high	37 Å²	37	50.3 Å²	50.3	18%	0.182	27%	0.267	C	S	.	.	S	Bend	trans	-88.6	150.6	-179.6	-62	171.7	176.2	0	0	110.1	L296 S297 V312 I313 V317 L326	L296-M300 HydrophobicContact CB-CB 4.37Å; L296-M300 HydrophobicContact CB-SD 4.37Å; L296-M300 HydrophobicContact CD2-SD 3.88Å; S297-M300 WeakPolarHBondContact O-CB 3.36Å; S297-M300 PolarHBondContact O-N 3.39Å; S297-M300 WeakPolarHBondContact OG-CG 3.49Å; M300-V312 HydrophobicContact CB-CG1 4.42Å; M300-I313 WeakPolarHBondContact CA-O 3.13Å; M300-V317 HydrophobicContact CE-CG2 4.15Å; M300-L326 HydrophobicContact CE-CD2 3.84Å; M300-L326 HydrophobicContact SD-CD2 3.98Å
301	I	95.4	Very high	93.8	Very high	46 Å²	46	44.5 Å²	44.5	24%	0.236	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.6	-179.5	-58.7	170	0	0	0	108	M248 V312 I313	M248-I301 HydrophobicContact CB-CD1 4.47Å; M248-I301 HydrophobicContact SD-CD1 4.01Å; M248-I301 HydrophobicContact SD-CG2 3.75Å; I301-V312 CarbonylContact O-C 3.57Å; I301-V312 VanDerWaalsContact O-CA 3.24Å; I301-V312 WeakPolarHBondContact O-CA 3.46Å; I301-I313 HydrophobicContact CB-CB 4.13Å; I301-I313 HydrophobicContact CB-CD1 4.42Å; I301-I313 HydrophobicContact CB-CG1 4.45Å; I301-I313 HydrophobicContact CD1-CD1 4.14Å; I301-I313 PolarHBondContact N-O 2.92Å; I301-I313 VanDerWaalsContact N-O 3.09Å; I301-I313 PolarHBondContact O-N 2.85Å
302	L	97.7	Very high	94	Very high	15 Å²	15	43.1 Å²	43.1	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	127.7	169.2	179.8	63	0	0	0	109.1	L239 P240 V289 L292 K293 L296 F310 V312	L239-L302 HydrophobicContact CD1-CD2 3.99Å; L239-L302 HydrophobicContact CD1-CG 3.94Å; L239-L302 HydrophobicContact CD2-CB 4.37Å; L239-L302 HydrophobicContact CD2-CD2 4.03Å; L239-L302 HydrophobicContact CD2-CG 4.05Å; P240-L302 WeakPolarHBondContact CD-O 3.28Å; V289-L302 HydrophobicContact CG1-CD2 4.35Å; L292-L302 HydrophobicContact CB-CD1 4.4Å; L292-L302 HydrophobicContact CB-CD2 3.83Å; L292-L302 HydrophobicContact CD1-CD1 4.15Å; L292-L302 HydrophobicContact CD1-CD2 4.5Å; K293-L302 HydrophobicContact CG-CD2 3.84Å; L296-L302 HydrophobicContact CD1-CB 3.8Å; L296-L302 HydrophobicContact CD1-CD1 4.1Å; L296-L302 HydrophobicContact CD1-CD2 4.35Å; L296-L302 HydrophobicContact CD1-CG 4.3Å; L302-F310 HydrophobicContact CD1-CB 4.2Å; L302-V312 HydrophobicContact CD1-CG2 3.79Å
303	A	97	Very high	94	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	155.4	175.9	0	0	0	0	0	110.2	P240 L245 F310 A311	P240-A303 HydrophobicContact CB-CB 3.96Å; P240-A303 CarbonylContact O-C 3.34Å; P240-A303 WeakPolarHBondContact O-CA 3.46Å; P240-A303 WeakPolarHBondContact O-CB 3.5Å; L245-A303 HydrophobicContact CB-CB 4.02Å; L245-A303 HydrophobicContact CD1-CB 3.9Å; L245-A303 HydrophobicContact CD2-CB 4.36Å; L245-A303 HydrophobicContact CG-CB 4.31Å; A303-F310 CarbonylContact O-C 3.48Å; A303-F310 VanDerWaalsContact O-CA 3.25Å; A303-F310 WeakPolarHBondContact O-CA 3.43Å; A303-F310 WeakPolarHBondContact O-CB 3.48Å; A303-A311 HydrophobicContact CB-CB 4.38Å; A303-A311 PolarHBondContact N-O 3.35Å; A303-A311 PolarHBondContact O-N 3.34Å
304	Q	96.5	Very high	94.1	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.019	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.8	170.9	-176.7	170	-6.9	0	0	108.5	F234 S237 L239 P240 N241 K242 S306 F310	F234-Q304 HydrophobicContact CD1-CG 4.12Å; F234-Q304 HydrophobicContact CD2-CB 3.61Å; F234-Q304 HydrophobicContact CD2-CG 3.81Å; F234-Q304 HydrophobicContact CE1-CG 4.11Å; F234-Q304 HydrophobicContact CE2-CB 3.87Å; F234-Q304 HydrophobicContact CE2-CG 3.81Å; F234-Q304 WeakPolarHBondContact CE2-O 3.43Å; F234-Q304 HydrophobicContact CG-CB 4.07Å; F234-Q304 HydrophobicContact CG-CG 3.97Å; F234-Q304 HydrophobicContact CZ-CG 3.95Å; S237-Q304 PolarHBondContact OG-OE1 3.08Å; L239-Q304 HydrophobicContact CB-CB 3.98Å; L239-Q304 HydrophobicContact CD1-CB 4.07Å; P240-Q304 PolarHBondContact O-N 2.9Å; P240-Q304 VanDerWaalsContact O-O 3.11Å; N241-Q304 CarbonylContact C-O 3.51Å; N241-Q304 VanDerWaalsContact CA-O 3.29Å; N241-Q304 WeakPolarHBondContact CA-O 3.29Å; K242-Q304 PolarHBondContact N-O 3.21Å; Q304-S306 WeakPolarHBondContact CG-O 3.24Å; Q304-S306 PolarHBondContact NE2-O 3.31Å; Q304-F310 HydrophobicContact CB-CD1 4.13Å; Q304-F310 HydrophobicContact CB-CE1 4.36Å; Q304-F310 HydrophobicContact CG-CD1 4.19Å; Q304-F310 HydrophobicContact CG-CE1 4.1Å
305	I	93.6	Very high	93.9	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.118	20%	0.197	C	C	.	.			trans	-102.6	-39.9	-178.1	-63.1	165.1	0	0	0	110.4	K242 L245 I263 D309 A311 Y366	K242-I305 HydrophobicContact CB-CG2 4.33Å; K242-I305 HydrophobicContact CD-CG2 4.18Å; K242-I305 HydrophobicContact CG-CG2 4.32Å; L245-I305 HydrophobicContact CD2-CD1 4.12Å; L245-I305 HydrophobicContact CD2-CG1 3.91Å; I263-I305 HydrophobicContact CD1-CD1 3.53Å; I305-D309 HydrophobicContact CB-CB 4.15Å; I305-D309 PolarHBondContact N-O 2.98Å; I305-A311 HydrophobicContact CD1-CB 3.66Å; I305-A311 HydrophobicContact CG1-CB 4.12Å; I305-Y366 HydrophobicContact CD1-CE2 3.83Å; I305-Y366 HydrophobicContact CG1-CE2 4.45Å; I305-Y366 VanDerWaalsContact CG2-OH 3.28Å; I305-Y366 WeakPolarHBondContact CG2-OH 3.45Å
306	S	90.7	Very high	93.5	Very high	26 Å²	26	37.6 Å²	37.6	18%	0.182	21%	0.214	C	C	.	.	S	Bend	trans	-143	-172.8	-176.9	82.8	0	0	0	0	110.3	Q304 Y308 D309	Q304-S306 WeakPolarHBondContact CG-O 3.24Å; Q304-S306 PolarHBondContact NE2-O 3.31Å; S306-Y308 PolarHBondContact O-N 3.45Å; S306-Y308 VanDerWaalsContact O-N 3.13Å; S306-Y308 WeakPolarHBondContact OG-CE2 3.33Å; S306-Y308 PolarHBondContact OG-N 2.95Å; S306-D309 WeakPolarHBondContact CB-OD2 3.3Å; S306-D309 PolarHBondContact N-O 3.38Å; S306-D309 VanDerWaalsContact OG-CB 3.3Å; S306-D309 WeakPolarHBondContact OG-CB 3.44Å; S306-D309 PolarHBondContact OG-N 3.18Å; S306-D309 VanDerWaalsContact OG-N 3.07Å; S306-D309 PolarHBondContact OG-OD2 3Å
307	G	86.5	Confident	93.3	Very high	35 Å²	35	36.9 Å²	36.9	36%	0.361	21%	0.21	S	C	.	.	S	Bend	trans	-64.6	-11.4	176.2	0	0	0	0	0	115.1
308	Y	91.3	Very high	93	Very high	68 Å²	68	38.7 Å²	38.7	27%	0.267	21%	0.214	S	C	.	.	S	Bend	trans	-145.6	-0.8	-177.1	50.6	-106	0	0	0	113.8	T265 C266 R270 S306	T265-Y308 HydrophobicContact CG2-CD2 4.49Å; C266-Y308 PolarHBondContact N-O 3.39Å; R270-Y308 HydrophobicContact CB-CD1 3.91Å; R270-Y308 HydrophobicContact CB-CE1 4.45Å; R270-Y308 HydrophobicContact CB-CG 4.03Å; R270-Y308 HydrophobicContact CG-CD1 4.11Å; R270-Y308 HydrophobicContact CG-CE1 4.17Å; R270-Y308 VanDerWaalsContact CZ-CE2 3.5Å; R270-Y308 VanDerWaalsContact CZ-CZ 3.47Å; R270-Y308 PolarHBondContact NH2-OH 2.72Å; S306-Y308 PolarHBondContact O-N 3.45Å; S306-Y308 VanDerWaalsContact O-N 3.13Å; S306-Y308 WeakPolarHBondContact OG-CE2 3.33Å; S306-Y308 PolarHBondContact OG-N 2.95Å
309	D	94.9	Very high	92.9	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.118	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.9	178.6	-55	-46.4	0	0	0	110.7	I264 T265 I305 S306	I264-D309 WeakPolarHBondContact O-CA 3.37Å; T265-D309 WeakPolarHBondContact CG2-OD1 3.17Å; T265-D309 PolarHBondContact OG1-OD1 2.81Å; I305-D309 HydrophobicContact CB-CB 4.15Å; I305-D309 PolarHBondContact N-O 2.98Å; S306-D309 WeakPolarHBondContact CB-OD2 3.3Å; S306-D309 PolarHBondContact N-O 3.38Å; S306-D309 VanDerWaalsContact OG-CB 3.3Å; S306-D309 WeakPolarHBondContact OG-CB 3.44Å; S306-D309 PolarHBondContact OG-N 3.18Å; S306-D309 VanDerWaalsContact OG-N 3.07Å; S306-D309 PolarHBondContact OG-OD2 3Å
310	F	97.7	Very high	92.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.5	173.7	-52.1	-87.7	0	0	0	110.2	L239 I263 I264 C266 L269 L285 V289 L292 L302 A303 Q304	L239-F310 HydrophobicContact CD1-CD1 4.12Å; L239-F310 HydrophobicContact CD1-CE1 4.26Å; I263-F310 CarbonylContact C-O 3.57Å; I263-F310 WeakPolarHBondContact CA-O 3.03Å; I264-F310 HydrophobicContact CB-CB 4.32Å; I264-F310 PolarHBondContact N-O 3.44Å; I264-F310 PolarHBondContact O-N 2.8Å; C266-F310 HydrophobicContact CB-CE2 4.45Å; L269-F310 HydrophobicContact CD1-CE2 3.92Å; L269-F310 HydrophobicContact CD1-CZ 3.94Å; L285-F310 HydrophobicContact CD1-CE1 3.87Å; L285-F310 HydrophobicContact CD1-CZ 3.52Å; V289-F310 HydrophobicContact CG2-CE1 3.69Å; V289-F310 HydrophobicContact CG2-CZ 4.24Å; L292-F310 HydrophobicContact CD1-CB 4.4Å; L292-F310 HydrophobicContact CD1-CD1 4.33Å; L292-F310 HydrophobicContact CD1-CD2 4.07Å; L292-F310 HydrophobicContact CD1-CE2 4.45Å; L292-F310 HydrophobicContact CD1-CG 4Å; L302-F310 HydrophobicContact CD1-CB 4.2Å; A303-F310 CarbonylContact O-C 3.48Å; A303-F310 VanDerWaalsContact O-CA 3.25Å; A303-F310 WeakPolarHBondContact O-CA 3.43Å; A303-F310 WeakPolarHBondContact O-CB 3.48Å; Q304-F310 HydrophobicContact CB-CD1 4.13Å; Q304-F310 HydrophobicContact CB-CE1 4.36Å; Q304-F310 HydrophobicContact CG-CD1 4.19Å; Q304-F310 HydrophobicContact CG-CE1 4.1Å
311	A	98	Very high	92	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.7	170.2	0	0	0	0	0	110.5	L245 L261 M262 I263 A303 I305	L245-A311 HydrophobicContact CD1-CB 4.02Å; L245-A311 HydrophobicContact CD2-CB 3.49Å; L245-A311 VanDerWaalsContact CD2-CB 3.49Å; L245-A311 HydrophobicContact CG-CB 4.42Å; L261-A311 HydrophobicContact CD1-CB 4.28Å; M262-A311 CarbonylContact O-C 3.54Å; M262-A311 VanDerWaalsContact O-CA 3.26Å; M262-A311 WeakPolarHBondContact O-CA 3.19Å; I263-A311 HydrophobicContact CD1-CB 3.86Å; A303-A311 HydrophobicContact CB-CB 4.38Å; A303-A311 PolarHBondContact N-O 3.35Å; A303-A311 PolarHBondContact O-N 3.34Å; I305-A311 HydrophobicContact CD1-CB 3.66Å; I305-A311 HydrophobicContact CG1-CB 4.12Å
312	V	98	Very high	91.6	Very high	1 Å²	1	27 Å²	27	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.1	171.1	179.5	0	0	0	0	108.8	M262 I264 L296 M300 I301 L302 A314	M262-V312 HydrophobicContact CB-CB 4.27Å; M262-V312 PolarHBondContact N-O 3.19Å; M262-V312 PolarHBondContact O-N 3.22Å; I264-V312 HydrophobicContact CD1-CG2 3.7Å; L296-V312 HydrophobicContact CD1-CG1 4.15Å; L296-V312 HydrophobicContact CD1-CG2 3.82Å; L296-V312 HydrophobicContact CD2-CG1 3.65Å; L296-V312 HydrophobicContact CD2-CG2 4.19Å; M300-V312 HydrophobicContact CB-CG1 4.42Å; I301-V312 CarbonylContact O-C 3.57Å; I301-V312 VanDerWaalsContact O-CA 3.24Å; I301-V312 WeakPolarHBondContact O-CA 3.46Å; L302-V312 HydrophobicContact CD1-CG2 3.79Å; V312-A314 HydrophobicContact CG1-CB 4.28Å; V312-A314 PolarHBondContact O-N 3.36Å
313	I	97.2	Very high	91.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	103.6	162.4	-55.1	177.5	0	0	0	106.6	L245 M248 L249 V252 L261 M300 I301 N315	L245-I313 HydrophobicContact CD1-CD1 3.87Å; L245-I313 HydrophobicContact CD1-CG1 3.89Å; M248-I313 HydrophobicContact CB-CD1 3.96Å; L249-I313 HydrophobicContact CD2-CD1 3.79Å; L249-I313 HydrophobicContact CD2-CG1 3.89Å; L249-I313 HydrophobicContact CG-CD1 3.99Å; L249-I313 HydrophobicContact CG-CG1 4.44Å; V252-I313 HydrophobicContact CG2-CG2 4.11Å; L261-I313 HydrophobicContact CD1-CG1 4.31Å; M300-I313 WeakPolarHBondContact CA-O 3.13Å; I301-I313 HydrophobicContact CB-CB 4.13Å; I301-I313 HydrophobicContact CB-CD1 4.42Å; I301-I313 HydrophobicContact CB-CG1 4.45Å; I301-I313 HydrophobicContact CD1-CD1 4.14Å; I301-I313 PolarHBondContact N-O 2.92Å; I301-I313 VanDerWaalsContact N-O 3.09Å; I301-I313 PolarHBondContact O-N 2.85Å; I313-N315 VanDerWaalsContact C-N 3.32Å; I313-N315 WeakPolarHBondContact CG2-OD1 3.15Å; I313-N315 PolarHBondContact O-N 2.79Å; I313-N315 VanDerWaalsContact O-N 3.1Å
314	A	95.7	Very high	90.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	65.7	-173.1	0	0	0	0	0	111.3	T259 A260 M262 V312 G316 V317 L326	T259-A314 PolarHBondContact OG1-O 2.85Å; A260-A314 HydrophobicContact CB-CB 4.25Å; A260-A314 WeakPolarHBondContact O-CB 3.26Å; A260-A314 PolarHBondContact O-N 2.84Å; M262-A314 HydrophobicContact SD-CB 4.43Å; V312-A314 HydrophobicContact CG1-CB 4.28Å; V312-A314 PolarHBondContact O-N 3.36Å; A314-G316 PolarHBondContact O-N 3.39Å; A314-V317 HydrophobicContact CB-CB 4.08Å; A314-V317 HydrophobicContact CB-CG2 3.63Å; A314-V317 VanDerWaalsContact O-CB 3.23Å; A314-V317 WeakPolarHBondContact O-CB 3.43Å; A314-V317 WeakPolarHBondContact O-CG2 3.14Å; A314-V317 PolarHBondContact O-N 3.44Å; A314-L326 HydrophobicContact CB-CD2 3.84Å
315	N	91.3	Very high	90.3	Very high	41 Å²	41	28.5 Å²	28.5	22%	0.219	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	133.1	177.3	-64.4	-40.2	0	0	0	110.9	T259 R299 I313	T259-N315 PolarHBondContact OG1-OD1 3.48Å; R299-N315 WeakPolarHBondContact O-CB 3.44Å; R299-N315 PolarHBondContact O-ND2 3.03Å; I313-N315 VanDerWaalsContact C-N 3.32Å; I313-N315 WeakPolarHBondContact CG2-OD1 3.15Å; I313-N315 PolarHBondContact O-N 2.79Å; I313-N315 VanDerWaalsContact O-N 3.1Å
316	G	84.6	Confident	90.2	Very high	56 Å²	56	27.9 Å²	27.9	58%	0.577	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.4	-12.8	-173.9	0	0	0	0	0	114.1	A314 Q318	A314-G316 PolarHBondContact O-N 3.39Å; G316-Q318 PolarHBondContact O-N 3Å
317	V	88.6	Confident	90.3	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.042	15%	0.152	C	C	.	.			trans	-80.9	100.7	172.2	176.9	0	0	0	0	109.3	T259 A260 M300 A314 H322 A323 L326 M355	T259-V317 CarbonylContact C-O 3.44Å; T259-V317 WeakPolarHBondContact CA-O 3.44Å; A260-V317 HydrophobicContact CB-CB 4.09Å; A260-V317 HydrophobicContact CB-CG1 3.67Å; M300-V317 HydrophobicContact CE-CG2 4.15Å; A314-V317 HydrophobicContact CB-CB 4.08Å; A314-V317 HydrophobicContact CB-CG2 3.63Å; A314-V317 VanDerWaalsContact O-CB 3.23Å; A314-V317 WeakPolarHBondContact O-CB 3.43Å; A314-V317 WeakPolarHBondContact O-CG2 3.14Å; A314-V317 PolarHBondContact O-N 3.44Å; V317-H322 HydrophobicContact CG1-CB 3.83Å; V317-A323 HydrophobicContact CG1-CB 3.71Å; V317-L326 HydrophobicContact CG2-CD2 4.21Å; V317-M355 HydrophobicContact CG1-CE 4.42Å
318	Q	85.7	Confident	90.5	Very high	85 Å²	85	29.4 Å²	29.4	40%	0.397	16%	0.155	S	C	.	.			trans	-92.2	-28.2	-176.2	-61.4	-59.3	-47.4	0	0	113.4	T258 G316	T258-Q318 WeakPolarHBondContact CG2-O 3.3Å; T258-Q318 PolarHBondContact O-NE2 3.29Å; G316-Q318 PolarHBondContact O-N 3Å
319	E	83.8	Confident	90.4	Very high	70 Å²	70	30.8 Å²	30.8	33%	0.327	16%	0.164	S	C	.	.	S	Bend	trans	-123.4	148.7	-169.7	-67.9	-71.9	152.8	0	0	110.1	W321 H322 R398	E319-W321 VanDerWaalsContact C-N 3.28Å; E319-W321 VanDerWaalsContact CB-CD1 3.42Å; E319-W321 HydrophobicContact CB-CG 4.4Å; E319-W321 PolarHBondContact O-N 3.44Å; E319-H322 WeakPolarHBondContact O-CB 3.32Å; E319-H322 PolarHBondContact O-N 3.38Å; E319-R398 IonicContact OE2-CZ 3.59Å; E319-R398 IonicContact OE2-NH1 3.58Å; E319-R398 PolarHBondContact OE2-NH1 2.98Å; E319-R398 IonicContact OE2-NH2 2.75Å
320	P	87.8	Confident	90.4	Very high	10 Å²	10	29.8 Å²	29.8	7%	0.065	16%	0.159	C	C	.	.	H	α-helix	trans	-55.3	-38.6	179.3	-29.2	37.3	0	0	0	114.2	H322 A323 I324 M355 F386 Q391 A395	P320-H322 PolarHBondContact O-N 3Å; P320-A323 WeakPolarHBondContact O-CB 3.38Å; P320-A323 PolarHBondContact O-N 2.61Å; P320-A323 VanDerWaalsContact O-N 3.12Å; P320-I324 PolarHBondContact O-N 2.98Å; P320-I324 VanDerWaalsContact O-N 3.14Å; P320-M355 HydrophobicContact CG-CG 4.23Å; P320-F386 HydrophobicContact CB-CE1 3.87Å; P320-F386 HydrophobicContact CB-CZ 4.14Å; P320-F386 VanDerWaalsContact O-CZ 3.26Å; P320-F386 WeakPolarHBondContact O-CZ 3.32Å; P320-Q391 HydrophobicContact CB-CB 4.4Å; P320-Q391 HydrophobicContact CG-CB 4.3Å; P320-Q391 HydrophobicContact CG-CG 4.46Å; P320-A395 HydrophobicContact CB-CB 3.9Å
321	W	80.5	Confident	90.1	Very high	37 Å²	37	30.7 Å²	30.7	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-66.8	-37.6	-179.1	70.1	-89.6	0	0	0	112.7	E319 A323 I324 T325 A395 R398	E319-W321 VanDerWaalsContact C-N 3.28Å; E319-W321 VanDerWaalsContact CB-CD1 3.42Å; E319-W321 HydrophobicContact CB-CG 4.4Å; E319-W321 PolarHBondContact O-N 3.44Å; W321-A323 PolarHBondContact O-N 3.33Å; W321-I324 WeakPolarHBondContact O-CA 3.48Å; W321-I324 WeakPolarHBondContact O-CB 3.3Å; W321-I324 PolarHBondContact O-N 3.33Å; W321-T325 PolarHBondContact O-N 3.41Å; W321-T325 PolarHBondContact O-OG1 3.12Å; W321-A395 HydrophobicContact CB-CB 4.25Å; W321-R398 HydrophobicContact CB-CB 4.41Å; W321-R398 VanDerWaalsContact CD1-NH1 3.34Å
322	H	86.8	Confident	89.6	Confident	67 Å²	67	35.3 Å²	35.3	31%	0.31	19%	0.192	S	C	.	.	H	α-helix	trans	-55.6	-37.6	172	-67.6	141.3	0	0	0	111.3	V317 E319 P320 L326	V317-H322 HydrophobicContact CG1-CB 3.83Å; E319-H322 WeakPolarHBondContact O-CB 3.32Å; E319-H322 PolarHBondContact O-N 3.38Å; P320-H322 PolarHBondContact O-N 3Å; H322-L326 WeakPolarHBondContact O-CB 3.24Å; H322-L326 PolarHBondContact O-N 3.45Å
323	A	91.7	Very high	89.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-32	177	0	0	0	0	0	112.5	A260 V317 P320 W321 G327 V353 M355 F386	A260-A323 HydrophobicContact CB-CB 4.17Å; V317-A323 HydrophobicContact CG1-CB 3.71Å; P320-A323 WeakPolarHBondContact O-CB 3.38Å; P320-A323 PolarHBondContact O-N 2.61Å; P320-A323 VanDerWaalsContact O-N 3.12Å; W321-A323 PolarHBondContact O-N 3.33Å; A323-G327 PolarHBondContact O-N 2.99Å; A323-V353 HydrophobicContact CB-CG1 3.77Å; A323-M355 HydrophobicContact CB-SD 4.26Å; A323-F386 HydrophobicContact CB-CE1 4.34Å; A323-F386 HydrophobicContact CB-CZ 3.96Å
324	I	87.7	Confident	88.9	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-48.7	171.2	-64.3	-172.1	0	0	0	110.5	P320 W321 L326 G327 Q328 I384 F386 M392 A395 Q396 L399	P320-I324 PolarHBondContact O-N 2.98Å; P320-I324 VanDerWaalsContact O-N 3.14Å; W321-I324 WeakPolarHBondContact O-CA 3.48Å; W321-I324 WeakPolarHBondContact O-CB 3.3Å; W321-I324 PolarHBondContact O-N 3.33Å; I324-L326 VanDerWaalsContact C-N 3.32Å; I324-L326 PolarHBondContact O-N 3.42Å; I324-G327 CarbonylContact O-C 3.58Å; I324-G327 WeakPolarHBondContact O-CA 3.4Å; I324-G327 PolarHBondContact O-N 2.93Å; I324-Q328 HydrophobicContact CG2-CG 4.09Å; I324-Q328 WeakPolarHBondContact O-CG 3.36Å; I324-Q328 PolarHBondContact O-N 2.94Å; I324-I384 HydrophobicContact CG2-CD1 4.34Å; I324-F386 HydrophobicContact CD1-CE2 3.97Å; I324-F386 HydrophobicContact CG1-CE2 3.52Å; I324-F386 HydrophobicContact CG1-CZ 3.93Å; I324-M392 HydrophobicContact CD1-SD 3.94Å; I324-A395 HydrophobicContact CD1-CB 3.29Å; I324-A395 HydrophobicContact CG1-CB 4.04Å; I324-Q396 HydrophobicContact CD1-CG 4.48Å; I324-L399 HydrophobicContact CB-CD1 3.84Å; I324-L399 HydrophobicContact CD1-CD1 4.16Å; I324-L399 HydrophobicContact CG2-CD1 3.35Å
325	T	84.9	Confident	88.6	Confident	44 Å²	44	37.3 Å²	37.3	27%	0.27	20%	0.203	S	C	.	.	H	α-helix	trans	-56.9	-48.2	179.3	-53.4	0	0	0	0	110.7	W321 G327 Q328 Q329	W321-T325 PolarHBondContact O-N 3.41Å; W321-T325 PolarHBondContact O-OG1 3.12Å; T325-G327 VanDerWaalsContact C-N 3.33Å; T325-G327 PolarHBondContact O-N 3.2Å; T325-Q328 PolarHBondContact O-N 3.3Å; T325-Q329 WeakPolarHBondContact O-CG 3.05Å; T325-Q329 PolarHBondContact O-N 3.43Å
326	L	91.5	Very high	88.5	Confident	10 Å²	10	39.7 Å²	39.7	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-43	174.1	-177.7	59.9	0	0	0	111.8	M262 V295 L296 M300 A314 V317 H322 I324 Q328 Q329 V330	M262-L326 HydrophobicContact CE-CG 4.49Å; M262-L326 HydrophobicContact SD-CB 4.48Å; M262-L326 HydrophobicContact SD-CD2 3.68Å; M262-L326 HydrophobicContact SD-CG 4.03Å; V295-L326 HydrophobicContact CG1-CD1 4.15Å; L296-L326 HydrophobicContact CD2-CD1 4.19Å; M300-L326 HydrophobicContact CE-CD2 3.84Å; M300-L326 HydrophobicContact SD-CD2 3.98Å; A314-L326 HydrophobicContact CB-CD2 3.84Å; V317-L326 HydrophobicContact CG2-CD2 4.21Å; H322-L326 WeakPolarHBondContact O-CB 3.24Å; H322-L326 PolarHBondContact O-N 3.45Å; I324-L326 VanDerWaalsContact C-N 3.32Å; I324-L326 PolarHBondContact O-N 3.42Å; L326-Q328 PolarHBondContact O-N 3.48Å; L326-Q329 PolarHBondContact O-N 3.35Å; L326-V330 WeakPolarHBondContact O-CG2 3.47Å; L326-V330 PolarHBondContact O-N 3.32Å
327	G	93.2	Very high	88.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-39.9	176.6	0	0	0	0	0	113.1	A323 I324 T325 V330 L331 I351 I384	A323-G327 PolarHBondContact O-N 2.99Å; I324-G327 CarbonylContact O-C 3.58Å; I324-G327 WeakPolarHBondContact O-CA 3.4Å; I324-G327 PolarHBondContact O-N 2.93Å; T325-G327 VanDerWaalsContact C-N 3.33Å; T325-G327 PolarHBondContact O-N 3.2Å; G327-V330 PolarHBondContact O-N 3.02Å; G327-L331 WeakPolarHBondContact O-CG 3.38Å; G327-L331 PolarHBondContact O-N 3.46Å; G327-I351 WeakPolarHBondContact O-CD1 3.25Å; G327-I384 VanDerWaalsContact C-CD1 3.47Å
328	Q	89.3	Confident	88.6	Confident	93 Å²	93	45.2 Å²	45.2	44%	0.435	22%	0.216	S	C	.	.	H	α-helix	trans	-67.5	-40.4	177	-73.6	175.2	-15.6	0	0	111.6	I324 T325 L326 V330 L331 T332 I384	I324-Q328 HydrophobicContact CG2-CG 4.09Å; I324-Q328 WeakPolarHBondContact O-CG 3.36Å; I324-Q328 PolarHBondContact O-N 2.94Å; T325-Q328 PolarHBondContact O-N 3.3Å; L326-Q328 PolarHBondContact O-N 3.48Å; Q328-V330 VanDerWaalsContact C-N 3.34Å; Q328-L331 PolarHBondContact O-N 3.1Å; Q328-T332 WeakPolarHBondContact O-CB 3.4Å; Q328-T332 PolarHBondContact O-N 3.4Å; Q328-T332 PolarHBondContact O-OG1 3.44Å; Q328-I384 HydrophobicContact CG-CD1 3.86Å
329	Q	90.5	Very high	88.5	Confident	97 Å²	97	45.7 Å²	45.7	45%	0.453	23%	0.227	S	C	.	.	H	α-helix	trans	-60.5	-45.2	173	-68.7	172.3	-18.6	0	0	110.9	V295 T325 L326 T332 I333	V295-Q329 HydrophobicContact CG1-CB 3.57Å; T325-Q329 WeakPolarHBondContact O-CG 3.05Å; T325-Q329 PolarHBondContact O-N 3.43Å; L326-Q329 PolarHBondContact O-N 3.35Å; Q329-T332 PolarHBondContact O-N 2.96Å; Q329-I333 PolarHBondContact O-N 3.19Å
330	V	93.7	Very high	88.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-48.6	174.5	168	0	0	0	0	111.5	I264 L292 V295 L326 G327 Q328 T332 I333 M334 I351	I264-V330 HydrophobicContact CD1-CG1 3.84Å; I264-V330 HydrophobicContact CG1-CG1 4.35Å; I264-V330 HydrophobicContact CG2-CG1 4.43Å; L292-V330 HydrophobicContact CD2-CG1 3.64Å; L292-V330 HydrophobicContact CD2-CG2 4.39Å; V295-V330 HydrophobicContact CG1-CG2 4.23Å; L326-V330 WeakPolarHBondContact O-CG2 3.47Å; L326-V330 PolarHBondContact O-N 3.32Å; G327-V330 PolarHBondContact O-N 3.02Å; Q328-V330 VanDerWaalsContact C-N 3.34Å; V330-T332 VanDerWaalsContact C-N 3.29Å; V330-T332 PolarHBondContact O-N 3.34Å; V330-I333 VanDerWaalsContact O-CG2 3.3Å; V330-I333 WeakPolarHBondContact O-CG2 3.44Å; V330-M334 HydrophobicContact CG1-CG 4.15Å; V330-M334 WeakPolarHBondContact O-CB 3.43Å; V330-M334 WeakPolarHBondContact O-CG 3.49Å; V330-M334 PolarHBondContact O-N 3.17Å; V330-I351 HydrophobicContact CB-CD1 4Å; V330-I351 HydrophobicContact CG1-CD1 3.69Å
331	L	91.2	Very high	88.1	Confident	19 Å²	19	48.5 Å²	48.5	10%	0.099	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-40.7	178.1	-74	-176	0	0	0	112	G327 Q328 S335 C349 I351 N382 I384	G327-L331 WeakPolarHBondContact O-CG 3.38Å; G327-L331 PolarHBondContact O-N 3.46Å; Q328-L331 PolarHBondContact O-N 3.1Å; L331-S335 WeakPolarHBondContact O-CB 3.34Å; L331-S335 PolarHBondContact O-N 3.41Å; L331-S335 PolarHBondContact O-OG 2.92Å; L331-C349 WeakPolarHBondContact CD2-O 3.34Å; L331-C349 WeakPolarHBondContact CD2-SG 3.4Å; L331-I351 HydrophobicContact CD2-CD1 3.81Å; L331-I351 HydrophobicContact CD2-CG1 3.98Å; L331-I351 HydrophobicContact CG-CD1 3.81Å; L331-I351 HydrophobicContact CG-CG1 4.43Å; L331-N382 HydrophobicContact CD1-CB 4.28Å; L331-N382 WeakPolarHBondContact CD1-O 3.42Å; L331-N382 HydrophobicContact CD2-CB 4.27Å; L331-I384 HydrophobicContact CD1-CD1 3.93Å; L331-I384 HydrophobicContact CD1-CG1 3.63Å; L331-I384 HydrophobicContact CG-CG1 4.33Å
332	T	87.9	Confident	88	Confident	98 Å²	98	58.6 Å²	58.6	60%	0.601	28%	0.277	S	S	*	.	H	α-helix	trans	-62.9	-53.5	-179.2	-59.7	0	0	0	0	110.7	Q328 Q329 V330 M334 S335	Q328-T332 WeakPolarHBondContact O-CB 3.4Å; Q328-T332 PolarHBondContact O-N 3.4Å; Q328-T332 PolarHBondContact O-OG1 3.44Å; Q329-T332 PolarHBondContact O-N 2.96Å; V330-T332 VanDerWaalsContact C-N 3.29Å; V330-T332 PolarHBondContact O-N 3.34Å; T332-M334 VanDerWaalsContact C-N 3.32Å; T332-M334 PolarHBondContact O-N 2.84Å; T332-S335 PolarHBondContact O-N 2.9Å
333	I	90.8	Very high	87.7	Confident	28 Å²	28	58.7 Å²	58.7	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-36.1	-178.7	-164.4	66.2	0	0	0	112	K291 V295 Q329 V330 S335 E336	K291-I333 HydrophobicContact CB-CG1 3.85Å; K291-I333 HydrophobicContact CD-CG1 4.35Å; K291-I333 HydrophobicContact CG-CG1 4.02Å; V295-I333 HydrophobicContact CG2-CB 3.94Å; V295-I333 HydrophobicContact CG2-CG1 4.22Å; V295-I333 HydrophobicContact CG2-CG2 3.62Å; Q329-I333 PolarHBondContact O-N 3.19Å; V330-I333 VanDerWaalsContact O-CG2 3.3Å; V330-I333 WeakPolarHBondContact O-CG2 3.44Å; I333-S335 VanDerWaalsContact C-N 3.34Å; I333-E336 WeakPolarHBondContact CD1-OE1 3.35Å
334	M	90.3	Very high	87.5	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-73.2	-27.9	-179.5	-70.4	-72.4	-75.2	0	0	112.3	C266 L288 L292 V330 T332 E336 P347	C266-M334 HydrophobicContact CB-CE 4.44Å; L288-M334 HydrophobicContact CB-CE 4.18Å; L288-M334 HydrophobicContact CB-SD 4.21Å; L288-M334 HydrophobicContact CD1-CE 4.4Å; L288-M334 HydrophobicContact CD2-CE 3.74Å; L288-M334 HydrophobicContact CD2-SD 3.73Å; L288-M334 HydrophobicContact CG-CE 4.32Å; L292-M334 HydrophobicContact CD1-CE 4.43Å; L292-M334 HydrophobicContact CD1-SD 4.26Å; L292-M334 HydrophobicContact CD2-CG 4.02Å; L292-M334 HydrophobicContact CD2-SD 3.82Å; L292-M334 HydrophobicContact CG-CE 4.49Å; L292-M334 HydrophobicContact CG-SD 3.72Å; V330-M334 HydrophobicContact CG1-CG 4.15Å; V330-M334 WeakPolarHBondContact O-CB 3.43Å; V330-M334 WeakPolarHBondContact O-CG 3.49Å; V330-M334 PolarHBondContact O-N 3.17Å; T332-M334 VanDerWaalsContact C-N 3.32Å; T332-M334 PolarHBondContact O-N 2.84Å; M334-E336 VanDerWaalsContact C-N 3.28Å; M334-E336 PolarHBondContact O-N 3.45Å; M334-P347 WeakPolarHBondContact O-CB 3.34Å
335	S	88.5	Confident	87.5	Confident	13 Å²	13	65.8 Å²	65.8	9%	0.091	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.8	-179.1	-62	0	0	0	0	114.3	L331 T332 I333 R346 P347 N382	L331-S335 WeakPolarHBondContact O-CB 3.34Å; L331-S335 PolarHBondContact O-N 3.41Å; L331-S335 PolarHBondContact O-OG 2.92Å; T332-S335 PolarHBondContact O-N 2.9Å; I333-S335 VanDerWaalsContact C-N 3.34Å; S335-R346 VanDerWaalsContact O-CG 3.24Å; S335-R346 WeakPolarHBondContact O-CG 3.35Å; S335-R346 PolarHBondContact O-NE 2.79Å; S335-P347 WeakPolarHBondContact CA-O 3.34Å; S335-N382 PolarHBondContact OG-ND2 3.47Å
336	E	88.8	Confident	87.6	Confident	91 Å²	91	71.8 Å²	71.8	43%	0.425	33%	0.331	S	S	.	.	S	Bend	trans	-67.9	150.5	174.4	-70.2	-173	-174.3	0	0	111.9	K291 I333 M334 L338 P347	K291-E336 IonicContact NZ-OE2 3.73Å; K291-E336 PolarHBondContact NZ-OE2 2.75Å; I333-E336 WeakPolarHBondContact CD1-OE1 3.35Å; M334-E336 VanDerWaalsContact C-N 3.28Å; M334-E336 PolarHBondContact O-N 3.45Å; E336-L338 PolarHBondContact O-N 2.89Å; E336-P347 WeakPolarHBondContact O-CD 3.4Å
337	R	87.7	Confident	87.6	Confident	170 Å²	170	71.4 Å²	71.4	64%	0.642	33%	0.329	S	S	*	.			trans	-70.8	126.5	177.9	-68.8	179.5	178.5	-122	2.9	109.9	L345	R337-L345 CarbonylContact C-O 3.53Å; R337-L345 WeakPolarHBondContact CA-O 3.45Å
338	L	87.8	Confident	87.4	Confident	9 Å²	9	72.5 Å²	72.5	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.5	177.4	-64.3	-176.1	0	0	0	110.4	L284 T287 L288 K291 E336 I340 L345 P347	L284-L338 HydrophobicContact CD1-CD1 3.66Å; T287-L338 HydrophobicContact CG2-CD1 4.05Å; T287-L338 HydrophobicContact CG2-CD2 3.66Å; T287-L338 HydrophobicContact CG2-CG 4.47Å; L288-L338 HydrophobicContact CD2-CD1 3.76Å; L288-L338 HydrophobicContact CG-CD1 4.21Å; K291-L338 HydrophobicContact CD-CD2 4.13Å; K291-L338 VanDerWaalsContact CE-CD2 3.42Å; E336-L338 PolarHBondContact O-N 2.89Å; L338-I340 PolarHBondContact O-N 3.34Å; L338-L345 PolarHBondContact N-O 2.83Å; L338-L345 PolarHBondContact O-N 3.43Å; L338-P347 HydrophobicContact CD1-CG 3.61Å; L338-P347 HydrophobicContact CG-CG 4.07Å
339	P	83.8	Confident	87.5	Confident	96 Å²	96	68 Å²	68	62%	0.623	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	113.7	168.9	30.8	-30.4	0	0	0	109.6
340	I	82.1	Confident	87.7	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	97.7	169.8	-54.9	-62.7	0	0	0	107.4	Q280 I283 L284 L338 R342 I343 L345	Q280-I340 HydrophobicContact CB-CG2 3.95Å; Q280-I340 HydrophobicContact CG-CG2 4.25Å; I283-I340 HydrophobicContact CG2-CD1 3.99Å; L284-I340 HydrophobicContact CB-CD1 4.08Å; L284-I340 HydrophobicContact CB-CG1 4.48Å; L284-I340 HydrophobicContact CD1-CD1 4.23Å; L284-I340 HydrophobicContact CD1-CG1 4.34Å; L338-I340 PolarHBondContact O-N 3.34Å; I340-R342 PolarHBondContact O-N 2.93Å; I340-I343 PolarHBondContact N-O 2.84Å; I340-I343 PolarHBondContact O-N 2.9Å; I340-L345 HydrophobicContact CG1-CD1 4.07Å
341	E	80.9	Confident	87.8	Confident	136 Å²	136	63.4 Å²	63.4	64%	0.636	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	-101.6	-174.3	-60	177.2	-177.3	0	0	112.9	Q280	Q280-E341 PolarHBondContact NE2-OE2 2.92Å
342	R	78.8	Confident	88.1	Confident	248 Å²	248	62.5 Å²	62.5	94%	0.936	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.5	-178.8	-60.8	-174	-177.8	-158.2	0.1	113.6	I340	I340-R342 PolarHBondContact O-N 2.93Å
343	I	81.8	Confident	88.6	Confident	69 Å²	69	57.8 Å²	57.8	35%	0.354	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.7	-176	-54.7	172.6	0	0	0	108.6	L276 I340 L345	L276-I343 HydrophobicContact CD2-CD1 3.73Å; I340-I343 PolarHBondContact N-O 2.84Å; I340-I343 PolarHBondContact O-N 2.9Å; I343-L345 HydrophobicContact CG2-CD2 3.74Å; I343-L345 HydrophobicContact CG2-CG 3.95Å
344	Q	86.2	Confident	88.8	Confident	124 Å²	124	56.6 Å²	56.6	58%	0.579	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.1	164.7	-75.6	-152.6	0.8	0	0	109.7
345	L	87.7	Confident	89	Confident	31 Å²	31	56.9 Å²	56.9	16%	0.162	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.2	174.9	-64.5	174.7	0	0	0	109.6	T272 L276 L284 R337 L338 I340 I343	T272-L345 HydrophobicContact CG2-CD1 4.2Å; L276-L345 HydrophobicContact CD1-CD1 3.99Å; L284-L345 HydrophobicContact CD2-CD1 4.04Å; R337-L345 CarbonylContact C-O 3.53Å; R337-L345 WeakPolarHBondContact CA-O 3.45Å; L338-L345 PolarHBondContact N-O 2.83Å; L338-L345 PolarHBondContact O-N 3.43Å; I340-L345 HydrophobicContact CG1-CD1 4.07Å; I343-L345 HydrophobicContact CG2-CD2 3.74Å; I343-L345 HydrophobicContact CG2-CG 3.95Å
346	R	88	Confident	89.3	Confident	170 Å²	170	56.2 Å²	56.2	64%	0.642	25%	0.249	S	C	*	.			trans	-113.3	96.8	165.3	-168	177.4	-171.5	173.9	-1.4	107.3	S335	S335-R346 VanDerWaalsContact O-CG 3.24Å; S335-R346 WeakPolarHBondContact O-CG 3.35Å; S335-R346 PolarHBondContact O-NE 2.79Å
347	P	90.3	Very high	89.4	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.013	25%	0.248	C	C	.	.			trans	-62.6	153.4	179.5	-14.3	28.3	0	0	0	110.5	T268 L288 M334 S335 E336 L338	T268-P347 HydrophobicContact CG2-CB 4.3Å; T268-P347 VanDerWaalsContact OG1-CA 3.31Å; T268-P347 WeakPolarHBondContact OG1-CA 3.32Å; L288-P347 HydrophobicContact CD2-CB 4.03Å; L288-P347 HydrophobicContact CD2-CG 3.9Å; M334-P347 WeakPolarHBondContact O-CB 3.34Å; S335-P347 WeakPolarHBondContact CA-O 3.34Å; E336-P347 WeakPolarHBondContact O-CD 3.4Å; L338-P347 HydrophobicContact CD1-CG 3.61Å; L338-P347 HydrophobicContact CG-CG 4.07Å
348	H	88.8	Confident	89.4	Confident	23 Å²	23	49.4 Å²	49.4	11%	0.106	23%	0.225	C	C	.	.			trans	-137.1	152.9	168.4	60.3	-73.3	0	0	0	108.2	E267 T268 K381 N382	E267-H348 PolarHBondContact N-O 3.37Å; E267-H348 IonicContact OE2-CD2 3.4Å; T268-H348 PolarHBondContact OG1-CE1 3.3Å; T268-H348 PolarHBondContact OG1-N 2.89Å; T268-H348 PolarHBondContact OG1-ND1 3.01Å; H348-K381 HydrophobicContact CB-CB 4.4Å; H348-N382 WeakPolarHBondContact CA-OD1 3.42Å; H348-N382 VanDerWaalsContact CB-OD1 3.25Å; H348-N382 WeakPolarHBondContact CB-OD1 3.27Å
349	C	93.2	Very high	89.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.26	C	S	.	.			trans	-141.5	158.3	179.7	51.7	0	0	0	0	111.3	I264 T265 C266 E267 L331 N382	I264-C349 HydrophobicContact CG2-CB 4.01Å; T265-C349 CarbonylContact O-C 3.58Å; T265-C349 WeakPolarHBondContact O-CA 3.48Å; T265-C349 WeakPolarHBondContact O-CB 3.44Å; C266-C349 HydrophobicContact CB-CB 4.44Å; E267-C349 WeakPolarHBondContact OE2-CA 3.18Å; L331-C349 WeakPolarHBondContact CD2-O 3.34Å; L331-C349 WeakPolarHBondContact CD2-SG 3.4Å; C349-N382 PolarHBondContact N-OD1 3.19Å; C349-N382 WeakPolarHBondContact O-CA 3.38Å; C349-N382 PolarHBondContact O-N 3.23Å; C349-N382 PolarHBondContact O-OD1 3.49Å
350	S	93.7	Very high	89.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.5	170.1	-55.3	0	0	0	0	109.5	T265 E267 R377	T265-S350 PolarHBondContact N-O 3.38Å; T265-S350 PolarHBondContact O-N 2.8Å; E267-S350 VanDerWaalsContact OE1-CB 3.24Å; E267-S350 WeakPolarHBondContact OE1-CB 3.27Å; E267-S350 PolarHBondContact OE1-OG 2.89Å; E267-S350 PolarHBondContact OE2-N 3.08Å; S350-R377 VanDerWaalsContact OG-CA 3.3Å; S350-R377 WeakPolarHBondContact OG-CA 3.29Å
351	I	96.9	Very high	90.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.5	-176.6	-54.8	-176.9	0	0	0	110	M262 I263 I264 G327 V330 L331 V353 A376 Q383 I384 Q385	M262-I351 HydrophobicContact CB-CG2 4.32Å; M262-I351 HydrophobicContact CE-CG2 3.64Å; I263-I351 CarbonylContact O-C 3.5Å; I263-I351 VanDerWaalsContact O-CA 3.3Å; I263-I351 WeakPolarHBondContact O-CA 3.3Å; I264-I351 HydrophobicContact CG1-CD1 4.46Å; I264-I351 HydrophobicContact CG1-CG1 4.24Å; I264-I351 HydrophobicContact CG2-CG1 4.42Å; G327-I351 WeakPolarHBondContact O-CD1 3.25Å; V330-I351 HydrophobicContact CB-CD1 4Å; V330-I351 HydrophobicContact CG1-CD1 3.69Å; L331-I351 HydrophobicContact CD2-CD1 3.81Å; L331-I351 HydrophobicContact CD2-CG1 3.98Å; L331-I351 HydrophobicContact CG-CD1 3.81Å; L331-I351 HydrophobicContact CG-CG1 4.43Å; I351-V353 HydrophobicContact CG2-CG2 4.04Å; I351-A376 WeakPolarHBondContact O-CB 3.47Å; I351-Q383 PolarHBondContact N-O 3.25Å; I351-I384 HydrophobicContact CB-CG1 4.26Å; I351-I384 HydrophobicContact CB-CG2 4.45Å; I351-I384 HydrophobicContact CD1-CG1 4.45Å; I351-I384 HydrophobicContact CG2-CG2 4.43Å; I351-I384 CarbonylContact O-C 3.55Å; I351-I384 WeakPolarHBondContact O-CA 3.2Å; I351-Q385 PolarHBondContact O-N 2.95Å
352	G	96.7	Very high	90.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.1	166.9	0	0	0	0	0	111.1	M262 I263 A373 Q385	M262-G352 CarbonylContact C-O 3.5Å; M262-G352 VanDerWaalsContact CA-O 3.27Å; M262-G352 WeakPolarHBondContact CA-O 3.32Å; I263-G352 PolarHBondContact N-O 3.11Å; I263-G352 PolarHBondContact O-N 2.94Å; G352-A373 VanDerWaalsContact CA-CA 3.47Å; G352-Q385 CarbonylContact C-O 3.54Å; G352-Q385 WeakPolarHBondContact CA-O 3.29Å
353	V	97.2	Very high	91.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.4	179.4	-172.5	0	0	0	0	110	A260 M262 A323 I351 M355 I384 Q385 F386 F387	A260-V353 HydrophobicContact CB-CG1 4.31Å; M262-V353 HydrophobicContact CE-CG2 4.31Å; M262-V353 HydrophobicContact CG-CG1 4.42Å; M262-V353 HydrophobicContact CG-CG2 4.21Å; A323-V353 HydrophobicContact CB-CG1 3.77Å; I351-V353 HydrophobicContact CG2-CG2 4.04Å; V353-M355 HydrophobicContact CG1-SD 4.38Å; V353-I384 HydrophobicContact CG2-CG2 3.91Å; V353-Q385 PolarHBondContact N-O 3.38Å; V353-F386 HydrophobicContact CB-CD1 3.95Å; V353-F386 HydrophobicContact CB-CD2 4.32Å; V353-F386 HydrophobicContact CB-CE1 3.84Å; V353-F386 HydrophobicContact CB-CE2 4.2Å; V353-F386 HydrophobicContact CB-CG 4.18Å; V353-F386 HydrophobicContact CB-CZ 3.96Å; V353-F386 HydrophobicContact CG1-CD1 3.9Å; V353-F386 HydrophobicContact CG1-CE1 3.42Å; V353-F386 VanDerWaalsContact CG1-CE1 3.42Å; V353-F386 HydrophobicContact CG1-CE2 4.48Å; V353-F386 HydrophobicContact CG1-CZ 3.76Å; V353-F386 HydrophobicContact CG2-CE2 4.36Å; V353-F386 HydrophobicContact CG2-CZ 4.32Å; V353-F386 CarbonylContact O-C 3.56Å; V353-F386 VanDerWaalsContact O-CA 3.31Å; V353-F386 WeakPolarHBondContact O-CA 3.36Å; V353-F387 PolarHBondContact O-N 2.96Å
354	A	95.8	Very high	92.3	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.5	165.4	0	0	0	0	0	109.9	L261 L365 R368 A369	L261-A354 PolarHBondContact N-O 3.34Å; L261-A354 PolarHBondContact O-N 2.79Å; A354-L365 HydrophobicContact CB-CD1 3.8Å; A354-R368 HydrophobicContact CB-CB 3.8Å; A354-A369 HydrophobicContact CB-CB 3.78Å
355	M	94.7	Very high	92.7	Very high	7 Å²	7	39.5 Å²	39.5	3%	0.034	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	141.1	173.6	-60.2	-58.7	-64.2	0	0	110.2	A260 V317 P320 A323 V353 Y357 F386	A260-M355 HydrophobicContact CB-CE 4.31Å; A260-M355 HydrophobicContact CB-SD 3.64Å; V317-M355 HydrophobicContact CG1-CE 4.42Å; P320-M355 HydrophobicContact CG-CG 4.23Å; A323-M355 HydrophobicContact CB-SD 4.26Å; V353-M355 HydrophobicContact CG1-SD 4.38Å; M355-Y357 HydrophobicContact CB-CD2 4.27Å; M355-Y357 HydrophobicContact CB-CE2 3.5Å; M355-Y357 HydrophobicContact CE-CE1 4.45Å; M355-Y357 HydrophobicContact CG-CE2 4.37Å; M355-F386 HydrophobicContact CG-CD1 4.23Å; M355-F386 HydrophobicContact CG-CE1 3.94Å; M355-F386 HydrophobicContact SD-CE1 4.03Å
356	F	94.1	Very high	93.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.6	172.4	175.4	-111	0	0	0	109.6	V253 Q257 T258 T259 L360 L365	V253-F356 HydrophobicContact CB-CE2 4.45Å; V253-F356 HydrophobicContact CB-CZ 4.09Å; V253-F356 HydrophobicContact CG1-CE2 4.29Å; V253-F356 HydrophobicContact CG1-CZ 4.09Å; V253-F356 HydrophobicContact CG2-CD2 4.44Å; V253-F356 HydrophobicContact CG2-CE1 4.49Å; V253-F356 HydrophobicContact CG2-CE2 3.92Å; V253-F356 HydrophobicContact CG2-CZ 3.94Å; Q257-F356 VanDerWaalsContact O-CD1 3.24Å; Q257-F356 WeakPolarHBondContact O-CD1 3.42Å; Q257-F356 WeakPolarHBondContact O-CE1 3.15Å; T258-F356 WeakPolarHBondContact CA-O 3.05Å; T258-F356 WeakPolarHBondContact CG2-O 3.29Å; T259-F356 HydrophobicContact CG2-CB 3.93Å; T259-F356 HydrophobicContact CG2-CD1 4.05Å; T259-F356 HydrophobicContact CG2-CG 4.41Å; T259-F356 PolarHBondContact N-O 2.63Å; T259-F356 PolarHBondContact O-N 3.48Å; F356-L360 HydrophobicContact CD2-CB 4.02Å; F356-L360 HydrophobicContact CE2-CB 4.21Å; F356-L360 VanDerWaalsContact CE2-O 3.29Å; F356-L360 WeakPolarHBondContact CE2-O 3.49Å; F356-L365 HydrophobicContact CB-CD1 3.93Å; F356-L365 HydrophobicContact CB-CD2 3.78Å; F356-L365 HydrophobicContact CD2-CD2 4.28Å; F356-L365 HydrophobicContact CG-CD2 4.12Å
357	Y	91	Very high	93.4	Very high	101 Å²	101	34.8 Å²	34.8	40%	0.396	18%	0.182	S	C	.	.			trans	-120.7	18.2	179.5	-60.9	-69.4	0	0	0	113	T258 M355	T258-Y357 HydrophobicContact CG2-CD1 3.59Å; T258-Y357 HydrophobicContact CG2-CE1 3.73Å; M355-Y357 HydrophobicContact CB-CD2 4.27Å; M355-Y357 HydrophobicContact CB-CE2 3.5Å; M355-Y357 HydrophobicContact CE-CE1 4.45Å; M355-Y357 HydrophobicContact CG-CE2 4.37Å
358	G	87.4	Confident	93.7	Very high	16 Å²	16	39.1 Å²	39.1	17%	0.165	20%	0.198	C	C	.	.	S	Bend	trans	103.4	-11.1	179.4	0	0	0	0	0	116.1
359	D	88.1	Confident	94	Very high	145 Å²	145	38 Å²	38	78%	0.775	19%	0.193	S	C	*	.			trans	-105.5	1.4	-167	-61.1	-23.6	0	0	0	115.2
360	L	90.9	Very high	94.1	Very high	20 Å²	20	41 Å²	41	11%	0.105	21%	0.208	C	C	.	.	S	Bend	trans	-113.8	145.9	-176.1	-55.9	175.6	0	0	0	111.8	V253 F356 Q364 L365 R368	V253-L360 WeakPolarHBondContact CG1-O 3.49Å; F356-L360 HydrophobicContact CD2-CB 4.02Å; F356-L360 HydrophobicContact CE2-CB 4.21Å; F356-L360 VanDerWaalsContact CE2-O 3.29Å; F356-L360 WeakPolarHBondContact CE2-O 3.49Å; L360-Q364 HydrophobicContact CB-CB 4.28Å; L360-Q364 HydrophobicContact CD2-CB 4.48Å; L360-L365 HydrophobicContact CB-CB 4.45Å; L360-L365 HydrophobicContact CD1-CD1 4.24Å; L360-R368 VanDerWaalsContact CD2-CZ 3.41Å
361	T	94.1	Very high	94	Very high	69 Å²	69	43.5 Å²	43.5	42%	0.423	23%	0.226	S	C	.	.			trans	-72.7	161.1	164.5	70.6	0	0	0	0	110.7	E363 Q364 L365	T361-E363 VanDerWaalsContact C-N 3.27Å; T361-E363 PolarHBondContact O-N 2.95Å; T361-Q364 PolarHBondContact O-N 3.17Å; T361-Q364 VanDerWaalsContact O-N 3.17Å; T361-Q364 VanDerWaalsContact OG1-CG 3.29Å; T361-Q364 WeakPolarHBondContact OG1-CG 3.49Å; T361-Q364 PolarHBondContact OG1-N 3.26Å; T361-Q364 PolarHBondContact OG1-OE1 3.44Å; T361-L365 PolarHBondContact O-N 3.49Å
362	A	94.6	Very high	93.9	Very high	7 Å²	7	43.6 Å²	43.6	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-56.6	-42.1	177.1	0	0	0	0	0	111.9	M246 L249 E250 V253 L365 Y366	M246-A362 HydrophobicContact CE-CB 4.12Å; L249-A362 HydrophobicContact CB-CB 3.91Å; E250-A362 HydrophobicContact CG-CB 3.8Å; V253-A362 HydrophobicContact CG2-CB 4.28Å; A362-L365 PolarHBondContact O-N 3.11Å; A362-Y366 WeakPolarHBondContact O-CB 3.37Å; A362-Y366 PolarHBondContact O-N 3.45Å
363	E	94	Very high	93.8	Very high	142 Å²	142	43.7 Å²	43.7	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-63.7	-42.1	176.6	-65.2	-173.1	158.4	0	0	112.9	M246 T361 S367	M246-E363 HydrophobicContact CE-CG 3.95Å; T361-E363 VanDerWaalsContact C-N 3.27Å; T361-E363 PolarHBondContact O-N 2.95Å; E363-S367 VanDerWaalsContact O-CB 3.25Å; E363-S367 WeakPolarHBondContact O-CB 3.5Å; E363-S367 PolarHBondContact O-N 3.28Å
364	Q	94.7	Very high	93.5	Very high	94 Å²	94	49.5 Å²	49.5	44%	0.439	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-45.2	177.7	-74.4	171.5	-22.9	0	0	111.1	L360 T361 S367 R368	L360-Q364 HydrophobicContact CB-CB 4.28Å; L360-Q364 HydrophobicContact CD2-CB 4.48Å; T361-Q364 PolarHBondContact O-N 3.17Å; T361-Q364 VanDerWaalsContact O-N 3.17Å; T361-Q364 VanDerWaalsContact OG1-CG 3.29Å; T361-Q364 WeakPolarHBondContact OG1-CG 3.49Å; T361-Q364 PolarHBondContact OG1-N 3.26Å; T361-Q364 PolarHBondContact OG1-OE1 3.44Å; Q364-S367 PolarHBondContact O-N 2.97Å; Q364-R368 WeakPolarHBondContact O-CB 3.38Å; Q364-R368 VanDerWaalsContact O-CG 3.27Å; Q364-R368 WeakPolarHBondContact O-CG 3.35Å; Q364-R368 PolarHBondContact O-N 3.33Å
365	L	95.3	Very high	93.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-47.6	177.4	179.6	60.6	0	0	0	111.2	L249 L261 A354 F356 L360 T361 A362 R368 A369	L249-L365 HydrophobicContact CD2-CD2 4.18Å; L261-L365 HydrophobicContact CB-CD1 4.28Å; L261-L365 HydrophobicContact CB-CD2 4.33Å; L261-L365 HydrophobicContact CB-CG 4.09Å; L261-L365 HydrophobicContact CD2-CG 4.07Å; A354-L365 HydrophobicContact CB-CD1 3.8Å; F356-L365 HydrophobicContact CB-CD1 3.93Å; F356-L365 HydrophobicContact CB-CD2 3.78Å; F356-L365 HydrophobicContact CD2-CD2 4.28Å; F356-L365 HydrophobicContact CG-CD2 4.12Å; L360-L365 HydrophobicContact CB-CB 4.45Å; L360-L365 HydrophobicContact CD1-CD1 4.24Å; T361-L365 PolarHBondContact O-N 3.49Å; A362-L365 PolarHBondContact O-N 3.11Å; L365-R368 PolarHBondContact O-N 3.39Å; L365-A369 PolarHBondContact O-N 3.14Å; L365-A369 VanDerWaalsContact O-N 3.08Å
366	Y	96.3	Very high	93.1	Very high	27 Å²	27	51.8 Å²	51.8	11%	0.106	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-47.7	176.1	179.7	-92.1	0	0	0	112.3	K242 L245 M246 L249 L261 I263 I305 A362 R368 A369 I370	K242-Y366 WeakPolarHBondContact CE-OH 3.42Å; L245-Y366 HydrophobicContact CD2-CD2 4.27Å; L245-Y366 HydrophobicContact CD2-CE2 3.99Å; M246-Y366 HydrophobicContact SD-CD1 4.5Å; M246-Y366 HydrophobicContact SD-CD2 4.05Å; M246-Y366 HydrophobicContact SD-CG 3.95Å; L249-Y366 HydrophobicContact CD1-CD2 4.32Å; L261-Y366 HydrophobicContact CD2-CD2 4.38Å; I263-Y366 HydrophobicContact CD1-CE2 4.32Å; I305-Y366 HydrophobicContact CD1-CE2 3.83Å; I305-Y366 HydrophobicContact CG1-CE2 4.45Å; I305-Y366 VanDerWaalsContact CG2-OH 3.28Å; I305-Y366 WeakPolarHBondContact CG2-OH 3.45Å; A362-Y366 WeakPolarHBondContact O-CB 3.37Å; A362-Y366 PolarHBondContact O-N 3.45Å; Y366-R368 PolarHBondContact O-N 2.87Å; Y366-A369 PolarHBondContact O-N 3.47Å; Y366-I370 HydrophobicContact CD1-CG1 4.1Å; Y366-I370 HydrophobicContact CE1-CD1 4.18Å; Y366-I370 HydrophobicContact CE1-CG1 3.64Å; Y366-I370 HydrophobicContact CE2-CD1 4.41Å; Y366-I370 HydrophobicContact CE2-CG1 4.29Å; Y366-I370 WeakPolarHBondContact O-CG1 3.23Å; Y366-I370 PolarHBondContact O-N 2.95Å
367	S	93.8	Very high	92.7	Very high	75 Å²	75	55.8 Å²	55.8	52%	0.524	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-42.7	178.9	-176.1	0	0	0	0	112.3	E363 Q364 I370 S371	E363-S367 VanDerWaalsContact O-CB 3.25Å; E363-S367 WeakPolarHBondContact O-CB 3.5Å; E363-S367 PolarHBondContact O-N 3.28Å; Q364-S367 PolarHBondContact O-N 2.97Å; S367-I370 PolarHBondContact O-N 3.17Å; S367-S371 WeakPolarHBondContact O-CB 3.41Å; S367-S371 PolarHBondContact O-N 3.41Å
368	R	96.1	Very high	92.4	Very high	94 Å²	94	57.7 Å²	57.7	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-46.6	176	-74.4	-176.9	-176.1	-159.4	0.7	111.9	A354 L360 Q364 L365 Y366 I370 S371 A372 F387	A354-R368 HydrophobicContact CB-CB 3.8Å; L360-R368 VanDerWaalsContact CD2-CZ 3.41Å; Q364-R368 WeakPolarHBondContact O-CB 3.38Å; Q364-R368 VanDerWaalsContact O-CG 3.27Å; Q364-R368 WeakPolarHBondContact O-CG 3.35Å; Q364-R368 PolarHBondContact O-N 3.33Å; L365-R368 PolarHBondContact O-N 3.39Å; Y366-R368 PolarHBondContact O-N 2.87Å; R368-I370 PolarHBondContact O-N 3.36Å; R368-S371 PolarHBondContact O-N 3.25Å; R368-A372 WeakPolarHBondContact O-CB 3.24Å; R368-A372 PolarHBondContact O-N 3.26Å; R368-F387 HydrophobicContact CB-CB 3.93Å; R368-F387 HydrophobicContact CB-CD1 4.05Å; R368-F387 HydrophobicContact CB-CD2 3.7Å; R368-F387 HydrophobicContact CB-CE2 4.22Å; R368-F387 HydrophobicContact CB-CG 3.59Å; R368-F387 HydrophobicContact CG-CD1 3.67Å; R368-F387 HydrophobicContact CG-CD2 3.8Å; R368-F387 HydrophobicContact CG-CE1 3.73Å; R368-F387 HydrophobicContact CG-CE2 3.86Å; R368-F387 HydrophobicContact CG-CG 3.7Å; R368-F387 HydrophobicContact CG-CZ 3.82Å; R368-F387 WeakPolarHBondContact O-CD2 3.42Å
369	A	96.4	Very high	92.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-38.7	-179.5	0	0	0	0	0	112	L261 I263 A354 L365 Y366 A372 A373	L261-A369 HydrophobicContact CB-CB 4.28Å; L261-A369 HydrophobicContact CD2-CB 3.85Å; L261-A369 HydrophobicContact CG-CB 3.85Å; I263-A369 HydrophobicContact CD1-CB 4.4Å; I263-A369 HydrophobicContact CG1-CB 3.55Å; A354-A369 HydrophobicContact CB-CB 3.78Å; L365-A369 PolarHBondContact O-N 3.14Å; L365-A369 VanDerWaalsContact O-N 3.08Å; Y366-A369 PolarHBondContact O-N 3.47Å; A369-A372 PolarHBondContact O-N 3.01Å; A369-A373 PolarHBondContact O-N 3.32Å
370	I	94.4	Very high	91.6	Very high	61 Å²	61	57.5 Å²	57.5	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-45.7	174.3	-70	-77.3	0	0	0	111.3	I263 Y366 S367 R368 A372 A373 F374	I263-I370 HydrophobicContact CD1-CD1 4.08Å; I263-I370 HydrophobicContact CD1-CG1 4.39Å; I263-I370 HydrophobicContact CG1-CD1 4.06Å; I263-I370 HydrophobicContact CG1-CG1 4.21Å; I263-I370 HydrophobicContact CG2-CD1 3.92Å; Y366-I370 HydrophobicContact CD1-CG1 4.1Å; Y366-I370 HydrophobicContact CE1-CD1 4.18Å; Y366-I370 HydrophobicContact CE1-CG1 3.64Å; Y366-I370 HydrophobicContact CE2-CD1 4.41Å; Y366-I370 HydrophobicContact CE2-CG1 4.29Å; Y366-I370 WeakPolarHBondContact O-CG1 3.23Å; Y366-I370 PolarHBondContact O-N 2.95Å; S367-I370 PolarHBondContact O-N 3.17Å; R368-I370 PolarHBondContact O-N 3.36Å; I370-A372 VanDerWaalsContact C-N 3.29Å; I370-A372 PolarHBondContact O-N 3.09Å; I370-A373 PolarHBondContact O-N 3.03Å; I370-F374 PolarHBondContact O-N 3.46Å
371	S	92.5	Very high	91.3	Very high	54 Å²	54	63.4 Å²	63.4	38%	0.378	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-42.2	176.8	-173.1	0	0	0	0	111.2	S367 R368 A373 F374 T375	S367-S371 WeakPolarHBondContact O-CB 3.41Å; S367-S371 PolarHBondContact O-N 3.41Å; R368-S371 PolarHBondContact O-N 3.25Å; S371-A373 VanDerWaalsContact C-N 3.35Å; S371-A373 PolarHBondContact O-N 3.17Å; S371-F374 WeakPolarHBondContact O-CB 3.48Å; S371-F374 PolarHBondContact O-N 3.02Å; S371-T375 PolarHBondContact O-N 3.42Å; S371-T375 PolarHBondContact O-OG1 3.04Å; S371-T375 VanDerWaalsContact O-OG1 3.14Å
372	A	95	Very high	90.9	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-40.1	176.4	0	0	0	0	0	112.2	R368 A369 I370 F374 T375 A376 F387	R368-A372 WeakPolarHBondContact O-CB 3.24Å; R368-A372 PolarHBondContact O-N 3.26Å; A369-A372 PolarHBondContact O-N 3.01Å; I370-A372 VanDerWaalsContact C-N 3.29Å; I370-A372 PolarHBondContact O-N 3.09Å; A372-F374 VanDerWaalsContact C-N 3.35Å; A372-T375 PolarHBondContact O-N 3.36Å; A372-A376 WeakPolarHBondContact O-CB 3.38Å; A372-A376 PolarHBondContact O-N 3.21Å; A372-F387 HydrophobicContact CB-CB 4.25Å
373	A	94.1	Very high	90.6	Very high	2 Å²	2	65.7 Å²	65.7	2%	0.017	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-38.2	178.2	0	0	0	0	0	111.7	I263 G352 A369 I370 S371 A376 R377	I263-A373 HydrophobicContact CB-CB 3.86Å; I263-A373 HydrophobicContact CG2-CB 3.64Å; G352-A373 VanDerWaalsContact CA-CA 3.47Å; A369-A373 PolarHBondContact O-N 3.32Å; I370-A373 PolarHBondContact O-N 3.03Å; S371-A373 VanDerWaalsContact C-N 3.35Å; S371-A373 PolarHBondContact O-N 3.17Å; A373-A376 PolarHBondContact O-N 3.35Å; A373-R377 WeakPolarHBondContact O-CB 3.19Å; A373-R377 PolarHBondContact O-N 2.9Å
374	F	90.9	Very high	90.5	Very high	123 Å²	123	59.6 Å²	59.6	54%	0.539	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-44.8	173	-175.2	-99.7	0	0	0	111.7	I370 S371 A372 R377 H378	I370-F374 PolarHBondContact O-N 3.46Å; S371-F374 WeakPolarHBondContact O-CB 3.48Å; S371-F374 PolarHBondContact O-N 3.02Å; A372-F374 VanDerWaalsContact C-N 3.35Å; F374-R377 PolarHBondContact O-N 2.92Å; F374-H378 AromaticContact CD1-CD2 3.83Å; F374-H378 AromaticContact CE1-CD2 3.36Å; F374-H378 WeakPolarHBondContact CE1-CD2 3.5Å; F374-H378 AromaticContact CE1-NE2 3.47Å; F374-H378 WeakPolarHBondContact CE1-NE2 3.41Å; F374-H378 AromaticContact CE2-CD2 3.89Å; F374-H378 AromaticContact CE2-NE2 3.63Å; F374-H378 AromaticContact CZ-CD2 3.4Å; F374-H378 VanDerWaalsContact CZ-CD2 3.4Å; F374-H378 WeakPolarHBondContact CZ-CD2 3.41Å; F374-H378 AromaticContact CZ-NE2 3.05Å; F374-H378 WeakPolarHBondContact CZ-NE2 3.47Å; F374-H378 PolarHBondContact O-CD2 2.98Å; F374-H378 PolarHBondContact O-N 3.22Å; F374-H378 VanDerWaalsContact O-N 3.12Å
375	T	90.4	Very high	90.4	Very high	57 Å²	57	56 Å²	56	35%	0.35	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-42.7	174.3	-57.7	0	0	0	0	112.2	S371 A372 R377 H378 K379 Q385	S371-T375 PolarHBondContact O-N 3.42Å; S371-T375 PolarHBondContact O-OG1 3.04Å; S371-T375 VanDerWaalsContact O-OG1 3.14Å; A372-T375 PolarHBondContact O-N 3.36Å; T375-R377 VanDerWaalsContact C-N 3.33Å; T375-R377 PolarHBondContact O-N 2.97Å; T375-H378 PolarHBondContact O-N 2.85Å; T375-K379 PolarHBondContact O-N 2.96Å; T375-K379 VanDerWaalsContact O-N 3.17Å; T375-Q385 HydrophobicContact CG2-CG 4.4Å
376	A	91.1	Very high	90.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.8	-47.8	176.2	0	0	0	0	0	111.4	I351 A372 A373 H378 K379 G380 Q383 Q385	I351-A376 WeakPolarHBondContact O-CB 3.47Å; A372-A376 WeakPolarHBondContact O-CB 3.38Å; A372-A376 PolarHBondContact O-N 3.21Å; A373-A376 PolarHBondContact O-N 3.35Å; A376-H378 VanDerWaalsContact C-N 3.35Å; A376-H378 PolarHBondContact O-N 3.32Å; A376-K379 PolarHBondContact O-N 2.77Å; A376-K379 VanDerWaalsContact O-N 3.11Å; A376-G380 PolarHBondContact O-N 3.04Å; A376-Q383 HydrophobicContact CB-CB 4.1Å; A376-Q383 WeakPolarHBondContact O-CB 3.39Å; A376-Q385 VanDerWaalsContact CA-CG 3.46Å; A376-Q385 HydrophobicContact CB-CB 3.91Å; A376-Q385 HydrophobicContact CB-CG 3.69Å
377	R	85.9	Confident	89.9	Confident	84 Å²	84	59.2 Å²	59.2	32%	0.317	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-39.2	179	-177.4	174.3	177	-155.8	-1.6	113.6	E267 R270 S350 A373 F374 T375 K379 G380	E267-R377 HydrophobicContact CG-CG 4.32Å; E267-R377 WeakPolarHBondContact OE1-CD 3.31Å; E267-R377 WeakPolarHBondContact OE1-CG 3.4Å; E267-R377 IonicContact OE1-NE 2.64Å; R270-R377 VanDerWaalsContact NH2-NH1 3.14Å; S350-R377 VanDerWaalsContact OG-CA 3.3Å; S350-R377 WeakPolarHBondContact OG-CA 3.29Å; A373-R377 WeakPolarHBondContact O-CB 3.19Å; A373-R377 PolarHBondContact O-N 2.9Å; F374-R377 PolarHBondContact O-N 2.92Å; T375-R377 VanDerWaalsContact C-N 3.33Å; T375-R377 PolarHBondContact O-N 2.97Å; R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 3.14Å; R377-G380 PolarHBondContact O-N 3.12Å
378	H	84.1	Confident	89.6	Confident	140 Å²	140	58.3 Å²	58.3	65%	0.648	28%	0.282	S	S	*	.	H	α-helix	trans	-68.4	-26.9	176.5	-92.1	-73.2	0	0	0	113.5	F374 T375 A376 G380	F374-H378 AromaticContact CD1-CD2 3.83Å; F374-H378 AromaticContact CE1-CD2 3.36Å; F374-H378 WeakPolarHBondContact CE1-CD2 3.5Å; F374-H378 AromaticContact CE1-NE2 3.47Å; F374-H378 WeakPolarHBondContact CE1-NE2 3.41Å; F374-H378 AromaticContact CE2-CD2 3.89Å; F374-H378 AromaticContact CE2-NE2 3.63Å; F374-H378 AromaticContact CZ-CD2 3.4Å; F374-H378 VanDerWaalsContact CZ-CD2 3.4Å; F374-H378 WeakPolarHBondContact CZ-CD2 3.41Å; F374-H378 AromaticContact CZ-NE2 3.05Å; F374-H378 WeakPolarHBondContact CZ-NE2 3.47Å; F374-H378 PolarHBondContact O-CD2 2.98Å; F374-H378 PolarHBondContact O-N 3.22Å; F374-H378 VanDerWaalsContact O-N 3.12Å; T375-H378 PolarHBondContact O-N 2.85Å; A376-H378 VanDerWaalsContact C-N 3.35Å; A376-H378 PolarHBondContact O-N 3.32Å; H378-G380 VanDerWaalsContact C-N 3.34Å
379	K	83	Confident	88.8	Confident	125 Å²	125	58.6 Å²	58.6	54%	0.543	30%	0.296	S	S	.	.	H	α-helix	trans	-77.6	-16.8	178.3	-75.6	-174.7	174.9	-175.9	0	113.6	T375 A376 R377 Q383 Q385	T375-K379 PolarHBondContact O-N 2.96Å; T375-K379 VanDerWaalsContact O-N 3.17Å; A376-K379 PolarHBondContact O-N 2.77Å; A376-K379 VanDerWaalsContact O-N 3.11Å; R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 3.14Å; K379-Q383 HydrophobicContact CB-CG 4.13Å; K379-Q385 HydrophobicContact CD-CG 4.09Å
380	G	77	Confident	88.1	Confident	32 Å²	32	65.6 Å²	65.6	33%	0.33	33%	0.328	S	S	.	.			trans	140.5	-165.6	177.8	0	0	0	0	0	113.1	A376 R377 H378	A376-G380 PolarHBondContact O-N 3.04Å; R377-G380 PolarHBondContact O-N 3.12Å; H378-G380 VanDerWaalsContact C-N 3.34Å
381	K	83.2	Confident	87.3	Confident	145 Å²	145	64.4 Å²	64.4	63%	0.63	32%	0.322	S	S	*	.	S	Bend	trans	-85.7	146.1	178.4	-58.2	-174.8	174.7	-176.7	0	110.2	H348 Q383	H348-K381 HydrophobicContact CB-CB 4.4Å; K381-Q383 VanDerWaalsContact C-N 3.32Å; K381-Q383 PolarHBondContact O-N 3.22Å
382	N	85.5	Confident	86.7	Confident	54 Å²	54	63 Å²	63	29%	0.289	31%	0.309	S	S	.	.	S	Bend	trans	58.8	41.5	175.3	-65	-14.1	0	0	0	113.4	L331 S335 H348 C349	L331-N382 HydrophobicContact CD1-CB 4.28Å; L331-N382 WeakPolarHBondContact CD1-O 3.42Å; L331-N382 HydrophobicContact CD2-CB 4.27Å; S335-N382 PolarHBondContact OG-ND2 3.47Å; H348-N382 WeakPolarHBondContact CA-OD1 3.42Å; H348-N382 VanDerWaalsContact CB-OD1 3.25Å; H348-N382 WeakPolarHBondContact CB-OD1 3.27Å; C349-N382 PolarHBondContact N-OD1 3.19Å; C349-N382 WeakPolarHBondContact O-CA 3.38Å; C349-N382 PolarHBondContact O-N 3.23Å; C349-N382 PolarHBondContact O-OD1 3.49Å
383	Q	88.5	Confident	85.8	Confident	69 Å²	69	69.6 Å²	69.6	32%	0.322	34%	0.34	S	S	.	.			trans	-99.1	142.5	178.8	-64.4	-60.4	108.3	0	0	111.4	I351 A376 K379 K381	I351-Q383 PolarHBondContact N-O 3.25Å; A376-Q383 HydrophobicContact CB-CB 4.1Å; A376-Q383 WeakPolarHBondContact O-CB 3.39Å; K379-Q383 HydrophobicContact CB-CG 4.13Å; K381-Q383 VanDerWaalsContact C-N 3.32Å; K381-Q383 PolarHBondContact O-N 3.22Å
384	I	92.1	Very high	84.8	Confident	14 Å²	14	71.7 Å²	71.7	7%	0.072	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131	166.7	-52.4	168.6	0	0	0	107	I324 G327 Q328 L331 I351 V353	I324-I384 HydrophobicContact CG2-CD1 4.34Å; G327-I384 VanDerWaalsContact C-CD1 3.47Å; Q328-I384 HydrophobicContact CG-CD1 3.86Å; L331-I384 HydrophobicContact CD1-CD1 3.93Å; L331-I384 HydrophobicContact CD1-CG1 3.63Å; L331-I384 HydrophobicContact CG-CG1 4.33Å; I351-I384 HydrophobicContact CB-CG1 4.26Å; I351-I384 HydrophobicContact CB-CG2 4.45Å; I351-I384 HydrophobicContact CD1-CG1 4.45Å; I351-I384 HydrophobicContact CG2-CG2 4.43Å; I351-I384 CarbonylContact O-C 3.55Å; I351-I384 WeakPolarHBondContact O-CA 3.2Å; V353-I384 HydrophobicContact CG2-CG2 3.91Å
385	Q	92.9	Very high	83.9	Confident	18 Å²	18	65.9 Å²	65.9	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.7	173.5	-65.7	-64.4	-59.6	0	0	110.9	I351 G352 V353 T375 A376 K379	I351-Q385 PolarHBondContact O-N 2.95Å; G352-Q385 CarbonylContact C-O 3.54Å; G352-Q385 WeakPolarHBondContact CA-O 3.29Å; V353-Q385 PolarHBondContact N-O 3.38Å; T375-Q385 HydrophobicContact CG2-CG 4.4Å; A376-Q385 VanDerWaalsContact CA-CG 3.46Å; A376-Q385 HydrophobicContact CB-CB 3.91Å; A376-Q385 HydrophobicContact CB-CG 3.69Å; K379-Q385 HydrophobicContact CD-CG 4.09Å
386	F	93.2	Very high	83.3	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.035	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	155.4	168.8	-74.7	-107.9	0	0	0	109.9	P320 A323 I324 V353 M355 D388 Q391 M392	P320-F386 HydrophobicContact CB-CE1 3.87Å; P320-F386 HydrophobicContact CB-CZ 4.14Å; P320-F386 VanDerWaalsContact O-CZ 3.26Å; P320-F386 WeakPolarHBondContact O-CZ 3.32Å; A323-F386 HydrophobicContact CB-CE1 4.34Å; A323-F386 HydrophobicContact CB-CZ 3.96Å; I324-F386 HydrophobicContact CD1-CE2 3.97Å; I324-F386 HydrophobicContact CG1-CE2 3.52Å; I324-F386 HydrophobicContact CG1-CZ 3.93Å; V353-F386 HydrophobicContact CB-CD1 3.95Å; V353-F386 HydrophobicContact CB-CD2 4.32Å; V353-F386 HydrophobicContact CB-CE1 3.84Å; V353-F386 HydrophobicContact CB-CE2 4.2Å; V353-F386 HydrophobicContact CB-CG 4.18Å; V353-F386 HydrophobicContact CB-CZ 3.96Å; V353-F386 HydrophobicContact CG1-CD1 3.9Å; V353-F386 HydrophobicContact CG1-CE1 3.42Å; V353-F386 VanDerWaalsContact CG1-CE1 3.42Å; V353-F386 HydrophobicContact CG1-CE2 4.48Å; V353-F386 HydrophobicContact CG1-CZ 3.76Å; V353-F386 HydrophobicContact CG2-CE2 4.36Å; V353-F386 HydrophobicContact CG2-CZ 4.32Å; V353-F386 CarbonylContact O-C 3.56Å; V353-F386 VanDerWaalsContact O-CA 3.31Å; V353-F386 WeakPolarHBondContact O-CA 3.36Å; M355-F386 HydrophobicContact CG-CD1 4.23Å; M355-F386 HydrophobicContact CG-CE1 3.94Å; M355-F386 HydrophobicContact SD-CE1 4.03Å; F386-D388 VanDerWaalsContact C-N 3.3Å; F386-D388 WeakPolarHBondContact CB-O 3.49Å; F386-Q391 HydrophobicContact CB-CB 4.32Å; F386-Q391 HydrophobicContact CD1-CB 3.94Å; F386-Q391 HydrophobicContact CG-CB 4.23Å; F386-M392 HydrophobicContact CB-CB 4.3Å; F386-M392 HydrophobicContact CD2-CB 4.15Å; F386-M392 HydrophobicContact CD2-SD 3.71Å; F386-M392 HydrophobicContact CE2-SD 4.11Å
387	F	88.6	Confident	82.5	Confident	88 Å²	88	74.6 Å²	74.6	39%	0.386	37%	0.366	S	S	.	.	S	Bend	trans	-61.4	-42.8	168.4	178.7	-98.1	0	0	0	111.4	V353 R368 A372 P389	V353-F387 PolarHBondContact O-N 2.96Å; R368-F387 HydrophobicContact CB-CB 3.93Å; R368-F387 HydrophobicContact CB-CD1 4.05Å; R368-F387 HydrophobicContact CB-CD2 3.7Å; R368-F387 HydrophobicContact CB-CE2 4.22Å; R368-F387 HydrophobicContact CB-CG 3.59Å; R368-F387 HydrophobicContact CG-CD1 3.67Å; R368-F387 HydrophobicContact CG-CD2 3.8Å; R368-F387 HydrophobicContact CG-CE1 3.73Å; R368-F387 HydrophobicContact CG-CE2 3.86Å; R368-F387 HydrophobicContact CG-CG 3.7Å; R368-F387 HydrophobicContact CG-CZ 3.82Å; R368-F387 WeakPolarHBondContact O-CD2 3.42Å; A372-F387 HydrophobicContact CB-CB 4.25Å; F387-P389 WeakPolarHBondContact O-CD 3.49Å
388	D	86.5	Confident	82	Confident	56 Å²	56	74.5 Å²	74.5	30%	0.299	37%	0.366	S	S	.	.	S	Bend	trans	-94.1	117.6	176.4	-172	-16.8	0	0	0	110.5	F386 Q390 Q391 M392	F386-D388 VanDerWaalsContact C-N 3.3Å; F386-D388 WeakPolarHBondContact CB-O 3.49Å; D388-Q390 PolarHBondContact O-N 2.92Å; D388-Q390 WeakPolarHBondContact OD1-CB 3.26Å; D388-Q390 PolarHBondContact OD1-N 3.34Å; D388-Q391 HydrophobicContact CB-CB 4.24Å; D388-Q391 HydrophobicContact CB-CG 3.85Å; D388-Q391 WeakPolarHBondContact O-CB 3.39Å; D388-Q391 PolarHBondContact O-N 3.01Å; D388-M392 PolarHBondContact O-N 3.22Å
389	P	80	Confident	81.5	Confident	100 Å²	100	69.5 Å²	69.5	65%	0.649	34%	0.344	S	S	*	.	H	α-helix	trans	-57.6	-32.8	176.1	-24.7	35	0	0	0	114.2	F387 Q391 M392 E393	F387-P389 WeakPolarHBondContact O-CD 3.49Å; P389-Q391 VanDerWaalsContact C-N 3.31Å; P389-Q391 PolarHBondContact O-N 3.05Å; P389-M392 WeakPolarHBondContact O-CB 3.19Å; P389-M392 PolarHBondContact O-N 3.38Å; P389-E393 PolarHBondContact O-N 3.29Å
390	Q	80.8	Confident	81.2	Confident	146 Å²	146	67.2 Å²	67.2	68%	0.682	34%	0.341	S	S	*	.	H	α-helix	trans	-67.2	-35	179.9	-65.3	-177	-3.9	0	0	111.6	D388 M392 E393 A394	D388-Q390 PolarHBondContact O-N 2.92Å; D388-Q390 WeakPolarHBondContact OD1-CB 3.26Å; D388-Q390 PolarHBondContact OD1-N 3.34Å; Q390-M392 VanDerWaalsContact C-N 3.33Å; Q390-E393 PolarHBondContact O-N 2.9Å; Q390-A394 WeakPolarHBondContact O-CB 3.44Å; Q390-A394 PolarHBondContact O-N 2.69Å
391	Q	78.3	Confident	81.4	Confident	37 Å²	37	67.9 Å²	67.9	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-65.9	-38.4	174.9	-67.2	177.7	-10.1	0	0	111.3	P320 F386 D388 P389 A395	P320-Q391 HydrophobicContact CB-CB 4.4Å; P320-Q391 HydrophobicContact CG-CB 4.3Å; P320-Q391 HydrophobicContact CG-CG 4.46Å; F386-Q391 HydrophobicContact CB-CB 4.32Å; F386-Q391 HydrophobicContact CD1-CB 3.94Å; F386-Q391 HydrophobicContact CG-CB 4.23Å; D388-Q391 HydrophobicContact CB-CB 4.24Å; D388-Q391 HydrophobicContact CB-CG 3.85Å; D388-Q391 WeakPolarHBondContact O-CB 3.39Å; D388-Q391 PolarHBondContact O-N 3.01Å; P389-Q391 VanDerWaalsContact C-N 3.31Å; P389-Q391 PolarHBondContact O-N 3.05Å; Q391-A395 WeakPolarHBondContact O-CB 3.46Å; Q391-A395 PolarHBondContact O-N 3.43Å
392	M	78.7	Confident	81.2	Confident	25 Å²	25	63.2 Å²	63.2	12%	0.123	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-47.7	175.3	-176.2	64	179.3	0	0	111.3	I324 F386 D388 P389 Q390 A395 Q396	I324-M392 HydrophobicContact CD1-SD 3.94Å; F386-M392 HydrophobicContact CB-CB 4.3Å; F386-M392 HydrophobicContact CD2-CB 4.15Å; F386-M392 HydrophobicContact CD2-SD 3.71Å; F386-M392 HydrophobicContact CE2-SD 4.11Å; D388-M392 PolarHBondContact O-N 3.22Å; P389-M392 WeakPolarHBondContact O-CB 3.19Å; P389-M392 PolarHBondContact O-N 3.38Å; Q390-M392 VanDerWaalsContact C-N 3.33Å; M392-A395 PolarHBondContact O-N 3.45Å; M392-Q396 HydrophobicContact CE-CG 3.98Å; M392-Q396 WeakPolarHBondContact O-CG 3.43Å; M392-Q396 PolarHBondContact O-N 3.21Å; M392-Q396 HydrophobicContact SD-CG 4.44Å
393	E	77.2	Confident	80.9	Confident	139 Å²	139	63.2 Å²	63.2	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-63.3	-45.7	180	-173.7	174.7	-167	0	0	111.8	P389 Q390 A395 Q396 K397	P389-E393 PolarHBondContact O-N 3.29Å; Q390-E393 PolarHBondContact O-N 2.9Å; E393-A395 VanDerWaalsContact C-N 3.32Å; E393-A395 PolarHBondContact O-N 3.42Å; E393-Q396 PolarHBondContact O-N 3.04Å; E393-K397 WeakPolarHBondContact O-CB 3.49Å; E393-K397 PolarHBondContact O-N 3.05Å
394	A	73.8	Confident	80.7	Confident	46 Å²	46	64.4 Å²	64.4	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-40.7	176.5	0	0	0	0	0	112.2	Q390 R398	Q390-A394 WeakPolarHBondContact O-CB 3.44Å; Q390-A394 PolarHBondContact O-N 2.69Å; A394-R398 WeakPolarHBondContact O-CG 3.45Å; A394-R398 PolarHBondContact O-N 2.98Å; A394-R398 VanDerWaalsContact O-N 3.13Å
395	A	71.9	Confident	80.5	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-69.1	-42.3	178.5	0	0	0	0	0	112.5	P320 W321 I324 Q391 M392 E393 R398 L399	P320-A395 HydrophobicContact CB-CB 3.9Å; W321-A395 HydrophobicContact CB-CB 4.25Å; I324-A395 HydrophobicContact CD1-CB 3.29Å; I324-A395 HydrophobicContact CG1-CB 4.04Å; Q391-A395 WeakPolarHBondContact O-CB 3.46Å; Q391-A395 PolarHBondContact O-N 3.43Å; M392-A395 PolarHBondContact O-N 3.45Å; E393-A395 VanDerWaalsContact C-N 3.32Å; E393-A395 PolarHBondContact O-N 3.42Å; A395-R398 PolarHBondContact O-N 3.28Å; A395-L399 WeakPolarHBondContact O-CG 3.46Å; A395-L399 PolarHBondContact O-N 3.23Å
396	Q	75.9	Confident	80.2	Confident	104 Å²	104	65.8 Å²	65.8	49%	0.486	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-44.9	175.1	-75.4	-175.2	-55.7	0	0	111.7	I324 M392 E393 R398 L399 T400	I324-Q396 HydrophobicContact CD1-CG 4.48Å; M392-Q396 HydrophobicContact CE-CG 3.98Å; M392-Q396 WeakPolarHBondContact O-CG 3.43Å; M392-Q396 PolarHBondContact O-N 3.21Å; M392-Q396 HydrophobicContact SD-CG 4.44Å; E393-Q396 PolarHBondContact O-N 3.04Å; Q396-R398 VanDerWaalsContact C-N 3.29Å; Q396-R398 PolarHBondContact O-N 3.26Å; Q396-L399 PolarHBondContact O-N 3.05Å; Q396-T400 PolarHBondContact O-N 2.85Å; Q396-T400 PolarHBondContact O-OG1 3.1Å; Q396-T400 VanDerWaalsContact O-OG1 3.1Å
397	K	75.7	Confident	79.9	Confident	135 Å²	135	68.7 Å²	68.7	59%	0.587	35%	0.352	S	S	*	.	H	α-helix	trans	-56.3	-45.2	176.3	-176.1	177.6	174.9	-177.8	0	111.3	E393 T400 E401	E393-K397 WeakPolarHBondContact O-CB 3.49Å; E393-K397 PolarHBondContact O-N 3.05Å; K397-T400 PolarHBondContact O-N 3.28Å; K397-E401 WeakPolarHBondContact CE-OE1 3.37Å; K397-E401 WeakPolarHBondContact O-CG 3.43Å; K397-E401 PolarHBondContact O-N 3.38Å
398	R	74.4	Confident	80	Confident	83 Å²	83	64.7 Å²	64.7	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-42	177.4	-74.7	-176.6	-173	175.2	7.4	113.3	E319 W321 A394 A395 Q396 T400 E401 E402	E319-R398 IonicContact OE2-CZ 3.59Å; E319-R398 IonicContact OE2-NH1 3.58Å; E319-R398 PolarHBondContact OE2-NH1 2.98Å; E319-R398 IonicContact OE2-NH2 2.75Å; W321-R398 HydrophobicContact CB-CB 4.41Å; W321-R398 VanDerWaalsContact CD1-NH1 3.34Å; A394-R398 WeakPolarHBondContact O-CG 3.45Å; A394-R398 PolarHBondContact O-N 2.98Å; A394-R398 VanDerWaalsContact O-N 3.13Å; A395-R398 PolarHBondContact O-N 3.28Å; Q396-R398 VanDerWaalsContact C-N 3.29Å; Q396-R398 PolarHBondContact O-N 3.26Å; R398-T400 VanDerWaalsContact C-N 3.33Å; R398-T400 PolarHBondContact O-N 2.7Å; R398-E401 PolarHBondContact O-N 3.5Å; R398-E402 WeakPolarHBondContact O-CB 3.4Å; R398-E402 PolarHBondContact O-N 3.35Å
399	L	74	Confident	80.1	Confident	34 Å²	34	63.1 Å²	63.1	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-37.6	176.8	-73.7	170.5	0	0	0	112.4	I324 A395 Q396 S403	I324-L399 HydrophobicContact CB-CD1 3.84Å; I324-L399 HydrophobicContact CD1-CD1 4.16Å; I324-L399 HydrophobicContact CG2-CD1 3.35Å; A395-L399 WeakPolarHBondContact O-CG 3.46Å; A395-L399 PolarHBondContact O-N 3.23Å; Q396-L399 PolarHBondContact O-N 3.05Å; L399-S403 WeakPolarHBondContact O-CB 3.39Å; L399-S403 PolarHBondContact O-N 2.93Å
400	T	77.7	Confident	80.5	Confident	78 Å²	78	65.1 Å²	65.1	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-46.4	172.9	-55	0	0	0	0	110.5	Q396 K397 R398 E402 S403 D404	Q396-T400 PolarHBondContact O-N 2.85Å; Q396-T400 PolarHBondContact O-OG1 3.1Å; Q396-T400 VanDerWaalsContact O-OG1 3.1Å; K397-T400 PolarHBondContact O-N 3.28Å; R398-T400 VanDerWaalsContact C-N 3.33Å; R398-T400 PolarHBondContact O-N 2.7Å; T400-E402 PolarHBondContact O-N 3.37Å; T400-S403 PolarHBondContact O-N 3.37Å; T400-D404 WeakPolarHBondContact O-CB 3.34Å; T400-D404 PolarHBondContact O-N 3.41Å
401	E	80.4	Confident	80.9	Confident	45 Å²	45	63.1 Å²	63.1	21%	0.21	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-44.2	177.3	-73.5	172.1	176.7	0	0	112.4	K397 R398 D404 I405	K397-E401 WeakPolarHBondContact CE-OE1 3.37Å; K397-E401 WeakPolarHBondContact O-CG 3.43Å; K397-E401 PolarHBondContact O-N 3.38Å; R398-E401 PolarHBondContact O-N 3.5Å; E401-D404 PolarHBondContact O-N 2.96Å; E401-I405 WeakPolarHBondContact O-CD1 3.39Å; E401-I405 VanDerWaalsContact O-CG1 3.26Å; E401-I405 WeakPolarHBondContact O-CG1 3.21Å; E401-I405 PolarHBondContact O-N 3.26Å
402	E	79.3	Confident	81.4	Confident	47 Å²	47	68.7 Å²	68.7	22%	0.22	35%	0.347	C	S	.	.	H	α-helix	trans	-59.2	-48.4	175.1	-174	-171.3	167.3	0	0	111	R398 T400 D404 I405 L406 C458 L460	R398-E402 WeakPolarHBondContact O-CB 3.4Å; R398-E402 PolarHBondContact O-N 3.35Å; T400-E402 PolarHBondContact O-N 3.37Å; E402-D404 VanDerWaalsContact C-N 3.35Å; E402-D404 PolarHBondContact O-N 3.13Å; E402-I405 PolarHBondContact O-N 3.5Å; E402-L406 HydrophobicContact CG-CD1 4.29Å; E402-L406 WeakPolarHBondContact O-CG 3.17Å; E402-L406 PolarHBondContact O-N 2.8Å; E402-C458 HydrophobicContact CB-CB 4.22Å; E402-C458 HydrophobicContact CG-CB 4.37Å; E402-L460 HydrophobicContact CB-CD1 4.47Å; E402-L460 HydrophobicContact CG-CD1 3.83Å; E402-L460 HydrophobicContact CG-CD2 4.27Å; E402-L460 HydrophobicContact CG-CG 4.17Å
403	S	78.5	Confident	82.1	Confident	55 Å²	55	70.8 Å²	70.8	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-62.3	-41.1	177.9	-174.4	0	0	0	0	112	L399 T400 L406 N407	L399-S403 WeakPolarHBondContact O-CB 3.39Å; L399-S403 PolarHBondContact O-N 2.93Å; T400-S403 PolarHBondContact O-N 3.37Å; S403-L406 PolarHBondContact O-N 3.38Å; S403-N407 WeakPolarHBondContact O-CB 3.48Å; S403-N407 PolarHBondContact O-N 3.4Å; S403-N407 PolarHBondContact O-ND2 2.97Å; S403-N407 PolarHBondContact OG-ND2 3.33Å
404	D	85.7	Confident	82.9	Confident	94 Å²	94	64.5 Å²	64.5	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-41	179.6	-71.5	-18.8	0	0	0	111	T400 E401 E402 A408	T400-D404 WeakPolarHBondContact O-CB 3.34Å; T400-D404 PolarHBondContact O-N 3.41Å; E401-D404 PolarHBondContact O-N 2.96Å; E402-D404 VanDerWaalsContact C-N 3.35Å; E402-D404 PolarHBondContact O-N 3.13Å; D404-A408 VanDerWaalsContact O-CB 3.29Å; D404-A408 WeakPolarHBondContact O-CB 3.18Å; D404-A408 PolarHBondContact O-N 3.39Å
405	I	87.6	Confident	83.9	Confident	9 Å²	9	63.4 Å²	63.4	5%	0.046	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-47.9	176.2	-67.1	162.6	0	0	0	110.8	E401 E402 A408 L409 F414 L451 I455 L460 V464	E401-I405 WeakPolarHBondContact O-CD1 3.39Å; E401-I405 VanDerWaalsContact O-CG1 3.26Å; E401-I405 WeakPolarHBondContact O-CG1 3.21Å; E401-I405 PolarHBondContact O-N 3.26Å; E402-I405 PolarHBondContact O-N 3.5Å; I405-A408 PolarHBondContact O-N 3Å; I405-L409 PolarHBondContact O-N 3.15Å; I405-F414 HydrophobicContact CG2-CE2 4.49Å; I405-F414 HydrophobicContact CG2-CZ 4.27Å; I405-L451 HydrophobicContact CD1-CD1 4.47Å; I405-L451 HydrophobicContact CG1-CD1 4.33Å; I405-I455 HydrophobicContact CD1-CG1 3.88Å; I405-I455 HydrophobicContact CG1-CG1 4.45Å; I405-I455 HydrophobicContact CG2-CG1 4.14Å; I405-L460 HydrophobicContact CB-CD1 3.75Å; I405-L460 HydrophobicContact CD1-CD1 4.28Å; I405-L460 HydrophobicContact CG2-CD1 3.56Å; I405-V464 HydrophobicContact CG2-CG2 4.07Å
406	L	85.5	Confident	85.1	Confident	51 Å²	51	63.8 Å²	63.8	27%	0.267	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-44	178.8	-73.2	175.7	0	0	0	111.6	E402 S403 A408 L409 E410 L460 T463	E402-L406 HydrophobicContact CG-CD1 4.29Å; E402-L406 WeakPolarHBondContact O-CG 3.17Å; E402-L406 PolarHBondContact O-N 2.8Å; S403-L406 PolarHBondContact O-N 3.38Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 2.95Å; L406-L409 WeakPolarHBondContact O-CB 3.44Å; L406-L409 PolarHBondContact O-N 3.02Å; L406-L409 VanDerWaalsContact O-N 3.13Å; L406-E410 WeakPolarHBondContact O-CG 3.26Å; L406-E410 PolarHBondContact O-N 2.99Å; L406-L460 HydrophobicContact CD1-CD2 4.28Å; L406-L460 HydrophobicContact CD2-CD1 4.25Å; L406-L460 HydrophobicContact CD2-CD2 3.78Å; L406-L460 HydrophobicContact CG-CD1 3.97Å; L406-L460 HydrophobicContact CG-CD2 4.06Å; L406-T463 HydrophobicContact CD2-CG2 4.41Å
407	N	88.5	Confident	86.1	Confident	69 Å²	69	61.1 Å²	61.1	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-60.8	-41.2	175.6	-74.5	-29.9	0	0	0	111.4	S403 L409 E410 N411	S403-N407 WeakPolarHBondContact O-CB 3.48Å; S403-N407 PolarHBondContact O-N 3.4Å; S403-N407 PolarHBondContact O-ND2 2.97Å; S403-N407 PolarHBondContact OG-ND2 3.33Å; N407-L409 VanDerWaalsContact C-N 3.29Å; N407-L409 PolarHBondContact O-N 3.01Å; N407-E410 PolarHBondContact O-N 3.36Å; N407-N411 VanDerWaalsContact O-CB 3.23Å; N407-N411 WeakPolarHBondContact O-CB 3.19Å; N407-N411 VanDerWaalsContact O-CG 3.27Å; N407-N411 PolarHBondContact O-N 3.09Å; N407-N411 PolarHBondContact O-ND2 3.39Å
408	A	89.1	Confident	87.1	Confident	5 Å²	5	54.7 Å²	54.7	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-35.7	176.2	0	0	0	0	0	112.1	D404 I405 L406 Q413 F414 I438	D404-A408 VanDerWaalsContact O-CB 3.29Å; D404-A408 WeakPolarHBondContact O-CB 3.18Å; D404-A408 PolarHBondContact O-N 3.39Å; I405-A408 PolarHBondContact O-N 3Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 2.95Å; A408-Q413 HydrophobicContact CB-CB 4.08Å; A408-Q413 WeakPolarHBondContact O-CA 3.24Å; A408-Q413 WeakPolarHBondContact O-CB 3.46Å; A408-Q413 PolarHBondContact O-N 2.87Å; A408-F414 HydrophobicContact CB-CD2 4.04Å; A408-F414 HydrophobicContact CB-CE2 3.58Å; A408-F414 HydrophobicContact CB-CZ 4.43Å; A408-I438 HydrophobicContact CB-CD1 3.89Å; A408-I438 HydrophobicContact CB-CG1 4.5Å
409	L	88.9	Confident	88.1	Confident	23 Å²	23	51.6 Å²	51.6	12%	0.12	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-47.6	175	-165	66.9	0	0	0	111.9	I405 L406 N407 N411 H412 F414 T463 W467	I405-L409 PolarHBondContact O-N 3.15Å; L406-L409 WeakPolarHBondContact O-CB 3.44Å; L406-L409 PolarHBondContact O-N 3.02Å; L406-L409 VanDerWaalsContact O-N 3.13Å; N407-L409 VanDerWaalsContact C-N 3.29Å; N407-L409 PolarHBondContact O-N 3.01Å; L409-N411 PolarHBondContact O-N 2.91Å; L409-H412 PolarHBondContact O-N 3.15Å; L409-F414 HydrophobicContact CB-CD2 4.02Å; L409-F414 HydrophobicContact CB-CE2 4.15Å; L409-F414 HydrophobicContact CD1-CB 4.29Å; L409-F414 HydrophobicContact CD1-CD2 3.81Å; L409-F414 HydrophobicContact CD1-CE2 4.41Å; L409-F414 HydrophobicContact CD1-CG 4.22Å; L409-T463 HydrophobicContact CD2-CG2 4.05Å; L409-W467 HydrophobicContact CD1-CB 4.04Å; L409-W467 HydrophobicContact CD1-CD2 3.67Å; L409-W467 HydrophobicContact CD1-CE3 4.13Å; L409-W467 HydrophobicContact CD1-CG 3.6Å; L409-W467 HydrophobicContact CG-CG 4.46Å
410	E	88.3	Confident	89.2	Confident	141 Å²	141	50 Å²	50	66%	0.659	26%	0.259	S	S	*	.	H	α-helix	trans	-66	-36	178.8	-71.6	-178.9	-177.9	0	0	112.8	L406 N407 H412	L406-E410 WeakPolarHBondContact O-CG 3.26Å; L406-E410 PolarHBondContact O-N 2.99Å; N407-E410 PolarHBondContact O-N 3.36Å; E410-H412 PolarHBondContact O-N 3.25Å
411	N	89.9	Confident	90.1	Very high	105 Å²	105	46.3 Å²	46.3	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	14	179.6	-67.6	-51.7	0	0	0	113.7	N407 L409 Q413	N407-N411 VanDerWaalsContact O-CB 3.23Å; N407-N411 WeakPolarHBondContact O-CB 3.19Å; N407-N411 VanDerWaalsContact O-CG 3.27Å; N407-N411 PolarHBondContact O-N 3.09Å; N407-N411 PolarHBondContact O-ND2 3.39Å; L409-N411 PolarHBondContact O-N 2.91Å; N411-Q413 HydrophobicContact CB-CG 4.02Å; N411-Q413 PolarHBondContact O-N 3.12Å
412	H	88.4	Confident	90.7	Very high	153 Å²	153	44.3 Å²	44.3	71%	0.708	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	31.9	-178.6	-53.5	-63.6	0	0	0	114	L409 E410 F414	L409-H412 PolarHBondContact O-N 3.15Å; E410-H412 PolarHBondContact O-N 3.25Å; H412-F414 VanDerWaalsContact C-N 3.28Å
413	Q	93.3	Very high	91.4	Very high	70 Å²	70	45.8 Å²	45.8	33%	0.327	23%	0.234	S	C	.	.			trans	-86.8	-1.8	176.4	-58.8	-177.4	-55	0	0	112.2	A408 N411 I438 Q439 W445	A408-Q413 HydrophobicContact CB-CB 4.08Å; A408-Q413 WeakPolarHBondContact O-CA 3.24Å; A408-Q413 WeakPolarHBondContact O-CB 3.46Å; A408-Q413 PolarHBondContact O-N 2.87Å; N411-Q413 HydrophobicContact CB-CG 4.02Å; N411-Q413 PolarHBondContact O-N 3.12Å; Q413-I438 CarbonylContact O-C 3.52Å; Q413-I438 VanDerWaalsContact O-CA 3.31Å; Q413-I438 WeakPolarHBondContact O-CA 3.42Å; Q413-I438 WeakPolarHBondContact O-CG1 3.23Å; Q413-Q439 HydrophobicContact CB-CB 4.19Å; Q413-Q439 PolarHBondContact O-N 3.46Å; Q413-W445 WeakPolarHBondContact O-CZ3 3.47Å
414	F	94.2	Very high	91.8	Very high	7 Å²	7	44 Å²	44	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.1	165.1	-74.6	-85.7	0	0	0	110.5	I405 A408 L409 H412 L436 R437 I438 L451 W467	I405-F414 HydrophobicContact CG2-CE2 4.49Å; I405-F414 HydrophobicContact CG2-CZ 4.27Å; A408-F414 HydrophobicContact CB-CD2 4.04Å; A408-F414 HydrophobicContact CB-CE2 3.58Å; A408-F414 HydrophobicContact CB-CZ 4.43Å; L409-F414 HydrophobicContact CB-CD2 4.02Å; L409-F414 HydrophobicContact CB-CE2 4.15Å; L409-F414 HydrophobicContact CD1-CB 4.29Å; L409-F414 HydrophobicContact CD1-CD2 3.81Å; L409-F414 HydrophobicContact CD1-CE2 4.41Å; L409-F414 HydrophobicContact CD1-CG 4.22Å; H412-F414 VanDerWaalsContact C-N 3.28Å; F414-L436 HydrophobicContact CB-CD1 4.34Å; F414-L436 HydrophobicContact CD1-CD1 3.61Å; F414-L436 HydrophobicContact CD1-CD2 4.08Å; F414-L436 HydrophobicContact CD1-CG 3.95Å; F414-L436 HydrophobicContact CE1-CD1 4.39Å; F414-L436 HydrophobicContact CE1-CD2 4.02Å; F414-L436 HydrophobicContact CE1-CG 4.32Å; F414-L436 HydrophobicContact CG-CD1 4.38Å; F414-R437 WeakPolarHBondContact CA-O 3.2Å; F414-I438 HydrophobicContact CD1-CB 4.05Å; F414-I438 HydrophobicContact CD1-CG1 4.29Å; F414-I438 HydrophobicContact CE1-CB 3.97Å; F414-I438 HydrophobicContact CE1-CD1 3.99Å; F414-I438 HydrophobicContact CE1-CG1 4.14Å; F414-I438 HydrophobicContact CE2-CD1 4.12Å; F414-I438 HydrophobicContact CZ-CD1 3.74Å; F414-I438 HydrophobicContact CZ-CG1 4.28Å; F414-L451 HydrophobicContact CE1-CD2 4.36Å; F414-W467 VanDerWaalsContact C-CH2 3.5Å; F414-W467 HydrophobicContact CB-CE3 4.4Å; F414-W467 HydrophobicContact CB-CH2 3.65Å; F414-W467 HydrophobicContact CB-CZ2 4.14Å; F414-W467 HydrophobicContact CB-CZ3 3.8Å; F414-W467 WeakPolarHBondContact O-CH2 2.99Å; F414-W467 WeakPolarHBondContact O-CZ2 3.27Å
415	A	94.9	Very high	91.8	Very high	23 Å²	23	45 Å²	45	19%	0.19	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152	173	0	0	0	0	0	109.4	R437 W445	A415-R437 PolarHBondContact N-O 3.09Å; A415-R437 PolarHBondContact O-N 2.84Å; A415-R437 VanDerWaalsContact O-O 3.13Å; A415-W445 HydrophobicContact CB-CE3 3.83Å; A415-W445 HydrophobicContact CB-CH2 3.78Å; A415-W445 HydrophobicContact CB-CZ3 3.37Å
416	I	96.4	Very high	91.7	Very high	9 Å²	9	47.9 Å²	47.9	5%	0.046	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.6	166.2	60.8	171	0	0	0	109.1	V434 W467 V468 E471 L475 I640	I416-V434 HydrophobicContact CB-CG1 3.83Å; I416-V434 HydrophobicContact CD1-CG1 4.44Å; I416-V434 HydrophobicContact CG2-CG1 3.73Å; I416-W467 HydrophobicContact CG2-CH2 4.4Å; I416-W467 HydrophobicContact CG2-CZ3 4.03Å; I416-V468 HydrophobicContact CG2-CG1 4.23Å; I416-E471 HydrophobicContact CD1-CB 3.91Å; I416-E471 HydrophobicContact CG1-CB 4.46Å; I416-E471 HydrophobicContact CG2-CB 4.45Å; I416-L475 HydrophobicContact CD1-CD2 4.21Å; I416-I640 HydrophobicContact CD1-CD1 4.26Å; I416-I640 HydrophobicContact CG1-CD1 3.88Å
417	W	96.9	Very high	91.7	Very high	48 Å²	48	47.9 Å²	47.9	18%	0.182	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	155.3	172.7	-77.4	35.8	0	0	0	108.7	L435 R437 W445 P637 L638 P639	W417-L435 PolarHBondContact N-O 3.28Å; W417-L435 PolarHBondContact O-N 2.85Å; W417-R437 HydrophobicContact CB-CG 3.94Å; W417-R437 HydrophobicContact CD2-CG 3.83Å; W417-R437 HydrophobicContact CG-CB 4.3Å; W417-R437 HydrophobicContact CG-CG 3.53Å; W417-W445 HydrophobicContact CH2-CB 4.06Å; W417-W445 HydrophobicContact CZ2-CB 3.38Å; W417-W445 AromaticContact CZ2-CG 3.78Å; W417-W445 HydrophobicContact CZ2-CG 3.78Å; W417-P637 HydrophobicContact CB-CB 4.43Å; W417-P637 HydrophobicContact CE3-CB 4.35Å; W417-P637 VanDerWaalsContact CE3-O 3.31Å; W417-L638 CarbonylContact C-O 3.59Å; W417-L638 WeakPolarHBondContact CA-O 3.45Å; W417-L638 WeakPolarHBondContact CB-O 3.26Å; W417-P639 HydrophobicContact CD2-CG 4.27Å; W417-P639 HydrophobicContact CE3-CG 4.38Å; W417-P639 HydrophobicContact CH2-CG 3.82Å; W417-P639 HydrophobicContact CZ2-CG 3.67Å; W417-P639 HydrophobicContact CZ3-CG 4.17Å
418	L	97.6	Very high	91.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.2	-174.2	-60.5	-179.5	0	0	0	110.7	A432 E433 V434 L475 W479 L488 P637 L638 I640 F643	L418-A432 HydrophobicContact CB-CB 4.37Å; L418-E433 CarbonylContact C-O 3.58Å; L418-E433 WeakPolarHBondContact CA-O 3.38Å; L418-V434 HydrophobicContact CD2-CG2 3.83Å; L418-L475 HydrophobicContact CD1-CD2 4.03Å; L418-L475 HydrophobicContact CD2-CD2 4.23Å; L418-W479 HydrophobicContact CD1-CH2 3.57Å; L418-W479 HydrophobicContact CD1-CZ2 3.7Å; L418-L488 HydrophobicContact CD2-CD2 3.89Å; L418-P637 WeakPolarHBondContact O-CA 3.39Å; L418-L638 PolarHBondContact N-O 3.32Å; L418-L638 PolarHBondContact O-N 3.45Å; L418-I640 HydrophobicContact CD1-CG1 4.42Å; L418-I640 HydrophobicContact CG-CG1 4.43Å; L418-F643 HydrophobicContact CB-CB 4.24Å; L418-F643 HydrophobicContact CB-CD1 4.44Å; L418-F643 HydrophobicContact CB-CD2 3.58Å; L418-F643 HydrophobicContact CB-CE2 4.01Å; L418-F643 HydrophobicContact CB-CG 3.83Å; L418-F643 HydrophobicContact CD1-CB 4.07Å; L418-F643 HydrophobicContact CD1-CD1 3.56Å; L418-F643 HydrophobicContact CD1-CD2 4.2Å; L418-F643 HydrophobicContact CD1-CE1 4.03Å; L418-F643 HydrophobicContact CD1-CG 3.67Å; L418-F643 HydrophobicContact CG-CG 4.42Å
419	Q	95.9	Very high	92.1	Very high	17 Å²	17	53 Å²	53	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.2	168.9	-163.6	172.9	9.6	0	0	110.4	A432 E433 L435 Q630 A635 P637	Q419-A432 CarbonylContact O-C 3.58Å; Q419-A432 VanDerWaalsContact O-CA 3.23Å; Q419-A432 WeakPolarHBondContact O-CA 3.32Å; Q419-E433 PolarHBondContact N-O 2.99Å; Q419-E433 PolarHBondContact O-N 3.13Å; Q419-L435 HydrophobicContact CB-CD1 3.98Å; Q419-Q630 HydrophobicContact CB-CG 4.49Å; Q419-Q630 VanDerWaalsContact CD-NE2 3.28Å; Q419-Q630 HydrophobicContact CG-CG 3.81Å; Q419-A635 PolarHBondContact NE2-O 3.32Å; Q419-P637 HydrophobicContact CB-CB 4.41Å; Q419-P637 HydrophobicContact CB-CG 4.16Å; Q419-P637 HydrophobicContact CG-CG 4.23Å
420	P	96.1	Very high	92.4	Very high	1 Å²	1	54 Å²	54	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	137	-177.9	26.6	-33.3	0	0	0	111.9	V422 L429 A635 F643 Y647	P420-V422 HydrophobicContact CB-CG1 4.42Å; P420-L429 HydrophobicContact CB-CD1 3.44Å; P420-L429 VanDerWaalsContact CB-CD1 3.44Å; P420-A635 HydrophobicContact CG-CB 3.55Å; P420-F643 HydrophobicContact CB-CE2 3.85Å; P420-F643 HydrophobicContact CG-CE2 4.4Å; P420-Y647 HydrophobicContact CB-CE1 4.26Å; P420-Y647 HydrophobicContact CB-CE2 4.21Å; P420-Y647 HydrophobicContact CG-CE1 4.47Å; P420-Y647 HydrophobicContact CG-CE2 3.98Å
421	Q	96.1	Very high	92.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.2	169.3	-66.7	171.1	-11.4	0	0	108.2	V430 S431 I628 A629 Q630	Q421-V430 PolarHBondContact O-N 3.3Å; Q421-S431 WeakPolarHBondContact CB-O 3.49Å; Q421-S431 PolarHBondContact N-O 2.89Å; Q421-S431 PolarHBondContact O-N 2.83Å; Q421-S431 PolarHBondContact OE1-OG 3.47Å; Q421-I628 HydrophobicContact CB-CG2 3.99Å; Q421-A629 CarbonylContact C-O 3.36Å; Q421-A629 WeakPolarHBondContact CA-O 3.26Å; Q421-Q630 HydrophobicContact CG-CB 4.12Å; Q421-Q630 HydrophobicContact CG-CG 4.4Å
422	V	94.7	Very high	93	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	149.5	-171.2	-57.2	0	0	0	0	112.6	P420 M424 K428 L429 I628 A629 F634	P420-V422 HydrophobicContact CB-CG1 4.42Å; V422-M424 PolarHBondContact O-N 3.5Å; V422-K428 CarbonylContact C-O 3.48Å; V422-K428 WeakPolarHBondContact CA-O 3.4Å; V422-L429 HydrophobicContact CG1-CD1 4.44Å; V422-I628 CarbonylContact O-C 3.59Å; V422-I628 VanDerWaalsContact O-CA 3.31Å; V422-I628 WeakPolarHBondContact O-CA 3.43Å; V422-A629 HydrophobicContact CG2-CB 4.44Å; V422-A629 PolarHBondContact N-O 2.87Å; V422-A629 PolarHBondContact O-N 3.46Å; V422-F634 HydrophobicContact CG2-CB 4.39Å; V422-F634 HydrophobicContact CG2-CD1 3.39Å; V422-F634 HydrophobicContact CG2-CD2 4.09Å; V422-F634 HydrophobicContact CG2-CE1 3.47Å; V422-F634 VanDerWaalsContact CG2-CE1 3.47Å; V422-F634 HydrophobicContact CG2-CE2 4.19Å; V422-F634 HydrophobicContact CG2-CG 3.69Å; V422-F634 HydrophobicContact CG2-CZ 3.88Å
423	E	93.5	Very high	93.4	Very high	78 Å²	78	35.6 Å²	35.6	36%	0.364	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	123.5	171	-174.4	176.7	-121.6	0	0	109.6	T425 S426 G427 K428 V430 G627	E423-T425 PolarHBondContact O-N 3.34Å; E423-S426 VanDerWaalsContact OE2-CB 3.24Å; E423-S426 WeakPolarHBondContact OE2-CB 3.35Å; E423-S426 PolarHBondContact OE2-OG 3.49Å; E423-G427 VanDerWaalsContact O-CA 3.32Å; E423-G427 WeakPolarHBondContact O-CA 3.11Å; E423-G427 PolarHBondContact O-N 3.27Å; E423-K428 PolarHBondContact N-O 3.27Å; E423-V430 HydrophobicContact CB-CG2 3.75Å; E423-G627 CarbonylContact C-O 3.56Å; E423-G627 WeakPolarHBondContact CA-O 3.49Å
424	M	86.6	Confident	93.6	Very high	16 Å²	16	32.4 Å²	32.4	8%	0.079	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-34.9	-175.1	-75.7	-78.8	-165.4	0	0	113.4	V422 A609 V612 R618 L621 A622 V626 G627 A629 F634	V422-M424 PolarHBondContact O-N 3.5Å; M424-A609 HydrophobicContact CE-CB 4.28Å; M424-V612 HydrophobicContact CE-CG2 4.21Å; M424-R618 HydrophobicContact SD-CB 4.44Å; M424-R618 HydrophobicContact SD-CG 3.55Å; M424-R618 VanDerWaalsContact SD-CG 3.55Å; M424-L621 HydrophobicContact CE-CB 3.78Å; M424-L621 HydrophobicContact CE-CD1 3.77Å; M424-L621 HydrophobicContact CE-CG 4.43Å; M424-A622 HydrophobicContact CB-CB 4.36Å; M424-V626 HydrophobicContact CE-CG1 4.5Å; M424-V626 WeakPolarHBondContact CG-O 3.32Å; M424-G627 PolarHBondContact N-O 3.2Å; M424-A629 HydrophobicContact CE-CB 3.16Å; M424-A629 HydrophobicContact CG-CB 4.05Å; M424-A629 HydrophobicContact SD-CB 3.43Å; M424-A629 WeakPolarHBondContact SD-CB 3.43Å; M424-F634 HydrophobicContact SD-CZ 4.48Å
425	T	84.8	Confident	93.6	Very high	117 Å²	117	33.4 Å²	33.4	72%	0.718	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-39.4	-172.3	51.7	0	0	0	0	113.3	E423	E423-T425 PolarHBondContact O-N 3.34Å
426	S	86.7	Confident	93.6	Very high	69 Å²	69	33.3 Å²	33.3	48%	0.483	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-18.6	-176.4	69.3	0	0	0	0	113.6	E423 K428	E423-S426 VanDerWaalsContact OE2-CB 3.24Å; E423-S426 WeakPolarHBondContact OE2-CB 3.35Å; E423-S426 PolarHBondContact OE2-OG 3.49Å; S426-K428 PolarHBondContact O-N 2.97Å; S426-K428 WeakPolarHBondContact OG-CB 3.35Å; S426-K428 PolarHBondContact OG-N 2.95Å; S426-K428 VanDerWaalsContact OG-N 3.13Å
427	G	86.1	Confident	93.6	Very high	50 Å²	50	34.5 Å²	34.5	52%	0.515	19%	0.191	S	C	.	.			trans	70.7	5.8	-169.5	0	0	0	0	0	113.7	E423	E423-G427 VanDerWaalsContact O-CA 3.32Å; E423-G427 WeakPolarHBondContact O-CA 3.11Å; E423-G427 PolarHBondContact O-N 3.27Å
428	K	91	Very high	93.4	Very high	152 Å²	152	33.3 Å²	33.3	66%	0.661	19%	0.188	S	C	*	.			trans	-71.2	141.1	-179.5	-172.2	-179.3	174.9	-178.4	0	110.6	V422 E423 S426 V430	V422-K428 CarbonylContact C-O 3.48Å; V422-K428 WeakPolarHBondContact CA-O 3.4Å; E423-K428 PolarHBondContact N-O 3.27Å; S426-K428 PolarHBondContact O-N 2.97Å; S426-K428 WeakPolarHBondContact OG-CB 3.35Å; S426-K428 PolarHBondContact OG-N 2.95Å; S426-K428 VanDerWaalsContact OG-N 3.13Å; K428-V430 PolarHBondContact O-N 3.42Å
429	L	93.7	Very high	93.2	Very high	29 Å²	29	36.9 Å²	36.9	15%	0.152	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	128.8	171.5	-175.2	67	0	0	0	111.1	P420 V422 S431 L486 F643 Y647	P420-L429 HydrophobicContact CB-CD1 3.44Å; P420-L429 VanDerWaalsContact CB-CD1 3.44Å; V422-L429 HydrophobicContact CG1-CD1 4.44Å; L429-S431 VanDerWaalsContact CD1-O 3.28Å; L429-S431 WeakPolarHBondContact CD1-O 3.29Å; L429-L486 HydrophobicContact CD2-CD1 3.89Å; L429-L486 HydrophobicContact CD2-CD2 3.67Å; L429-L486 HydrophobicContact CD2-CG 4.46Å; L429-L486 HydrophobicContact CG-CD1 3.86Å; L429-L486 HydrophobicContact CG-CD2 4.4Å; L429-F643 HydrophobicContact CD1-CZ 4.21Å; L429-F643 HydrophobicContact CD2-CE1 4.14Å; L429-F643 HydrophobicContact CD2-CZ 3.7Å; L429-Y647 HydrophobicContact CB-CD1 4.28Å; L429-Y647 HydrophobicContact CD1-CD1 4.43Å; L429-Y647 HydrophobicContact CD2-CD1 4.12Å; L429-Y647 HydrophobicContact CD2-CG 3.99Å
430	V	94.5	Very high	92.9	Very high	44 Å²	44	38.6 Å²	38.6	27%	0.267	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-42.3	-179.8	178.7	0	0	0	0	111.8	Q421 E423 K428 P487 I628	Q421-V430 PolarHBondContact O-N 3.3Å; E423-V430 HydrophobicContact CB-CG2 3.75Å; K428-V430 PolarHBondContact O-N 3.42Å; V430-P487 WeakPolarHBondContact O-CD 3.45Å; V430-I628 HydrophobicContact CB-CD1 4.3Å; V430-I628 HydrophobicContact CG1-CD1 3.7Å; V430-I628 HydrophobicContact CG1-CG1 4.48Å; V430-I628 HydrophobicContact CG2-CD1 4.44Å; V430-I628 HydrophobicContact CG2-CG1 4.38Å
431	S	95.8	Very high	92.3	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.028	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	177.8	-178.8	39.2	0	0	0	0	109.7	Q421 L429 P487	Q421-S431 WeakPolarHBondContact CB-O 3.49Å; Q421-S431 PolarHBondContact N-O 2.89Å; Q421-S431 PolarHBondContact O-N 2.83Å; Q421-S431 PolarHBondContact OE1-OG 3.47Å; L429-S431 VanDerWaalsContact CD1-O 3.28Å; L429-S431 WeakPolarHBondContact CD1-O 3.29Å; S431-P487 VanDerWaalsContact CA-O 3.29Å; S431-P487 WeakPolarHBondContact CA-O 3.33Å; S431-P487 VanDerWaalsContact CB-O 3.29Å; S431-P487 WeakPolarHBondContact CB-O 3.45Å
432	A	96.9	Very high	92	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.5	170.4	0	0	0	0	0	111.8	L418 Q419 P487 L488 S489 F643	L418-A432 HydrophobicContact CB-CB 4.37Å; Q419-A432 CarbonylContact O-C 3.58Å; Q419-A432 VanDerWaalsContact O-CA 3.23Å; Q419-A432 WeakPolarHBondContact O-CA 3.32Å; A432-P487 PolarHBondContact N-O 3.1Å; A432-L488 HydrophobicContact CB-CD2 3.84Å; A432-L488 CarbonylContact O-C 3.53Å; A432-L488 WeakPolarHBondContact O-CA 3.44Å; A432-S489 PolarHBondContact O-N 2.96Å; A432-F643 HydrophobicContact CB-CE1 4.4Å; A432-F643 HydrophobicContact CB-CE2 3.81Å; A432-F643 HydrophobicContact CB-CZ 3.56Å
433	E	96.4	Very high	91.6	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.047	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.4	174	-168.2	-177.9	159.2	0	0	111.2	L418 Q419 L435 N491 K577 Q630	L418-E433 CarbonylContact C-O 3.58Å; L418-E433 WeakPolarHBondContact CA-O 3.38Å; Q419-E433 PolarHBondContact N-O 2.99Å; Q419-E433 PolarHBondContact O-N 3.13Å; E433-L435 HydrophobicContact CG-CD2 4.23Å; E433-L435 HydrophobicContact CG-CG 4.49Å; E433-L435 WeakPolarHBondContact OE1-CD2 3.4Å; E433-N491 PolarHBondContact OE1-ND2 2.92Å; E433-K577 IonicContact OE1-NZ 2.72Å; E433-K577 PolarHBondContact OE1-NZ 3.42Å; E433-K577 IonicContact OE2-NZ 3.36Å; E433-K577 PolarHBondContact OE2-NZ 2.93Å; E433-Q630 PolarHBondContact OE2-NE2 2.9Å; E433-Q630 PolarHBondContact OE2-OE1 3.3Å
434	V	97.2	Very high	91.6	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.012	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	120.2	174.1	172.7	0	0	0	0	109.7	I416 L418 V468 L488 S489 V490 N491	I416-V434 HydrophobicContact CB-CG1 3.83Å; I416-V434 HydrophobicContact CD1-CG1 4.44Å; I416-V434 HydrophobicContact CG2-CG1 3.73Å; L418-V434 HydrophobicContact CD2-CG2 3.83Å; V434-V468 HydrophobicContact CG1-CG1 3.93Å; V434-L488 HydrophobicContact CG2-CB 4.34Å; V434-L488 HydrophobicContact CG2-CD1 4.16Å; V434-L488 HydrophobicContact CG2-CD2 4.39Å; V434-S489 VanDerWaalsContact CB-O 3.28Å; V434-S489 WeakPolarHBondContact CB-O 3.33Å; V434-S489 WeakPolarHBondContact CG2-O 3.03Å; V434-S489 PolarHBondContact N-O 2.63Å; V434-V490 HydrophobicContact CB-CG2 4.17Å; V434-V490 HydrophobicContact CG2-CG2 4Å; V434-N491 PolarHBondContact O-ND2 3.39Å
435	L	94.8	Very high	91.9	Very high	29 Å²	29	54.7 Å²	54.7	15%	0.152	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.5	179.7	-63.2	174.5	0	0	0	110.1	W417 Q419 E433 P637	W417-L435 PolarHBondContact N-O 3.28Å; W417-L435 PolarHBondContact O-N 2.85Å; Q419-L435 HydrophobicContact CB-CD1 3.98Å; E433-L435 HydrophobicContact CG-CD2 4.23Å; E433-L435 HydrophobicContact CG-CG 4.49Å; E433-L435 WeakPolarHBondContact OE1-CD2 3.4Å; L435-P637 HydrophobicContact CD1-CB 3.79Å; L435-P637 HydrophobicContact CD1-CG 3.34Å
436	L	94.8	Very high	92.1	Very high	20 Å²	20	53.4 Å²	53.4	11%	0.105	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135.5	177.5	-173.8	61.9	0	0	0	110.7	F414 L447 I452 I455 V464 W467 V468	F414-L436 HydrophobicContact CB-CD1 4.34Å; F414-L436 HydrophobicContact CD1-CD1 3.61Å; F414-L436 HydrophobicContact CD1-CD2 4.08Å; F414-L436 HydrophobicContact CD1-CG 3.95Å; F414-L436 HydrophobicContact CE1-CD1 4.39Å; F414-L436 HydrophobicContact CE1-CD2 4.02Å; F414-L436 HydrophobicContact CE1-CG 4.32Å; F414-L436 HydrophobicContact CG-CD1 4.38Å; L436-L447 HydrophobicContact CB-CD1 4.26Å; L436-L447 HydrophobicContact CD2-CD1 4.27Å; L436-L447 HydrophobicContact CG-CD1 4.19Å; L436-I452 HydrophobicContact CD2-CD1 4.37Å; L436-I455 HydrophobicContact CD2-CD1 4.49Å; L436-V464 HydrophobicContact CD2-CG1 3.91Å; L436-W467 HydrophobicContact CD1-CE3 4.44Å; L436-W467 HydrophobicContact CD1-CZ3 3.8Å; L436-V468 HydrophobicContact CD1-CG2 3.83Å
437	R	95	Very high	92.3	Very high	34 Å²	34	52.4 Å²	52.4	13%	0.128	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.3	171.9	-66.4	-66.1	178.6	-90.8	3.8	109.8	F414 A415 W417 W445	F414-R437 WeakPolarHBondContact CA-O 3.2Å; A415-R437 PolarHBondContact N-O 3.09Å; A415-R437 PolarHBondContact O-N 2.84Å; A415-R437 VanDerWaalsContact O-O 3.13Å; W417-R437 HydrophobicContact CB-CG 3.94Å; W417-R437 HydrophobicContact CD2-CG 3.83Å; W417-R437 HydrophobicContact CG-CB 4.3Å; W417-R437 HydrophobicContact CG-CG 3.53Å; R437-W445 HydrophobicContact CB-CB 4.34Å; R437-W445 HydrophobicContact CB-CE3 4.03Å
438	I	93.4	Very high	92.4	Very high	24 Å²	24	51.9 Å²	51.9	12%	0.123	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.8	172.7	-170.7	178.2	0	0	0	109.3	A408 Q413 F414 Q440 D446 P448 L451	A408-I438 HydrophobicContact CB-CD1 3.89Å; A408-I438 HydrophobicContact CB-CG1 4.5Å; Q413-I438 CarbonylContact O-C 3.52Å; Q413-I438 VanDerWaalsContact O-CA 3.31Å; Q413-I438 WeakPolarHBondContact O-CA 3.42Å; Q413-I438 WeakPolarHBondContact O-CG1 3.23Å; F414-I438 HydrophobicContact CD1-CB 4.05Å; F414-I438 HydrophobicContact CD1-CG1 4.29Å; F414-I438 HydrophobicContact CE1-CB 3.97Å; F414-I438 HydrophobicContact CE1-CD1 3.99Å; F414-I438 HydrophobicContact CE1-CG1 4.14Å; F414-I438 HydrophobicContact CE2-CD1 4.12Å; F414-I438 HydrophobicContact CZ-CD1 3.74Å; F414-I438 HydrophobicContact CZ-CG1 4.28Å; I438-Q440 PolarHBondContact O-N 3.46Å; I438-Q440 PolarHBondContact O-NE2 3.35Å; I438-D446 VanDerWaalsContact CG2-O 3.26Å; I438-D446 WeakPolarHBondContact CG2-O 3.46Å; I438-D446 PolarHBondContact N-O 2.97Å; I438-D446 PolarHBondContact O-N 3.02Å; I438-P448 HydrophobicContact CG2-CG 4.27Å; I438-L451 HydrophobicContact CB-CD2 4.39Å; I438-L451 HydrophobicContact CD1-CD2 4.42Å; I438-L451 HydrophobicContact CG2-CD2 3.76Å
439	Q	92.9	Very high	92.1	Very high	75 Å²	75	52.3 Å²	52.3	35%	0.35	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	123.1	176.5	-166.8	177.5	33	0	0	109.6	Q413 W445	Q413-Q439 HydrophobicContact CB-CB 4.19Å; Q413-Q439 PolarHBondContact O-N 3.46Å; Q439-W445 HydrophobicContact CB-CD2 4.25Å; Q439-W445 HydrophobicContact CB-CE3 4.09Å; Q439-W445 HydrophobicContact CB-CH2 3.8Å; Q439-W445 HydrophobicContact CB-CZ2 3.94Å; Q439-W445 HydrophobicContact CB-CZ3 3.86Å; Q439-W445 HydrophobicContact CG-CH2 4.48Å; Q439-W445 HydrophobicContact CG-CZ2 4.14Å
440	Q	89.4	Confident	91.4	Very high	52 Å²	52	52.3 Å²	52.3	24%	0.243	30%	0.298	C	S	.	.			trans	-82.6	159.4	176.2	-60.9	-56.7	-49.6	0	0	110.8	I438 D442 G443 S444 D446	I438-Q440 PolarHBondContact O-N 3.46Å; I438-Q440 PolarHBondContact O-NE2 3.35Å; Q440-D442 VanDerWaalsContact CB-OD1 3.24Å; Q440-D442 WeakPolarHBondContact CB-OD1 3.42Å; Q440-D442 PolarHBondContact O-N 2.87Å; Q440-D442 VanDerWaalsContact O-N 3.13Å; Q440-G443 WeakPolarHBondContact O-CA 3.26Å; Q440-G443 PolarHBondContact O-N 3.27Å; Q440-S444 WeakPolarHBondContact CB-O 3.45Å; Q440-S444 WeakPolarHBondContact CB-OG 3.25Å; Q440-S444 PolarHBondContact N-O 3.13Å; Q440-D446 HydrophobicContact CG-CB 4.48Å
441	P	84.5	Confident	91.1	Very high	139 Å²	139	50.6 Å²	50.6	90%	0.903	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.6	177.7	-26.1	35.2	0	0	0	114.9
442	D	89.1	Confident	90.5	Very high	131 Å²	131	53.7 Å²	53.7	70%	0.701	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.4	175.4	68.3	-2.7	0	0	0	113.4	Q440 S444	Q440-D442 VanDerWaalsContact CB-OD1 3.24Å; Q440-D442 WeakPolarHBondContact CB-OD1 3.42Å; Q440-D442 PolarHBondContact O-N 2.87Å; Q440-D442 VanDerWaalsContact O-N 3.13Å; D442-S444 VanDerWaalsContact OD1-CB 3.25Å; D442-S444 WeakPolarHBondContact OD1-CB 3.38Å; D442-S444 PolarHBondContact OD1-N 2.83Å; D442-S444 PolarHBondContact OD1-OG 3.45Å; D442-S444 PolarHBondContact OD2-OG 3.34Å
443	G	87.1	Confident	89.6	Confident	40 Å²	40	58.6 Å²	58.6	41%	0.412	33%	0.329	S	S	.	.	S	Bend	trans	87.4	-3.6	-178.1	0	0	0	0	0	114.6	Q440	Q440-G443 WeakPolarHBondContact O-CA 3.26Å; Q440-G443 PolarHBondContact O-N 3.27Å
444	S	92	Very high	88.7	Confident	51 Å²	51	61.8 Å²	61.8	36%	0.357	34%	0.341	S	S	.	.			trans	-72.8	161.5	173.9	69.9	0	0	0	0	111.7	Q440 D442	Q440-S444 WeakPolarHBondContact CB-O 3.45Å; Q440-S444 WeakPolarHBondContact CB-OG 3.25Å; Q440-S444 PolarHBondContact N-O 3.13Å; D442-S444 VanDerWaalsContact OD1-CB 3.25Å; D442-S444 WeakPolarHBondContact OD1-CB 3.38Å; D442-S444 PolarHBondContact OD1-N 2.83Å; D442-S444 PolarHBondContact OD1-OG 3.45Å; D442-S444 PolarHBondContact OD2-OG 3.34Å
445	W	92.9	Very high	88.1	Confident	77 Å²	77	61.7 Å²	61.7	29%	0.292	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.1	176.9	-71.4	90.4	0	0	0	108.9	Q413 A415 W417 R437 Q439	Q413-W445 WeakPolarHBondContact O-CZ3 3.47Å; A415-W445 HydrophobicContact CB-CE3 3.83Å; A415-W445 HydrophobicContact CB-CH2 3.78Å; A415-W445 HydrophobicContact CB-CZ3 3.37Å; W417-W445 HydrophobicContact CH2-CB 4.06Å; W417-W445 HydrophobicContact CZ2-CB 3.38Å; W417-W445 AromaticContact CZ2-CG 3.78Å; W417-W445 HydrophobicContact CZ2-CG 3.78Å; R437-W445 HydrophobicContact CB-CB 4.34Å; R437-W445 HydrophobicContact CB-CE3 4.03Å; Q439-W445 HydrophobicContact CB-CD2 4.25Å; Q439-W445 HydrophobicContact CB-CE3 4.09Å; Q439-W445 HydrophobicContact CB-CH2 3.8Å; Q439-W445 HydrophobicContact CB-CZ2 3.94Å; Q439-W445 HydrophobicContact CB-CZ3 3.86Å; Q439-W445 HydrophobicContact CG-CH2 4.48Å; Q439-W445 HydrophobicContact CG-CZ2 4.14Å
446	D	90.9	Very high	87.2	Confident	90 Å²	90	63 Å²	63	48%	0.481	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	168.1	178	-158.3	5.6	0	0	0	110.3	I438 Q440	I438-D446 VanDerWaalsContact CG2-O 3.26Å; I438-D446 WeakPolarHBondContact CG2-O 3.46Å; I438-D446 PolarHBondContact N-O 2.97Å; I438-D446 PolarHBondContact O-N 3.02Å; Q440-D446 HydrophobicContact CG-CB 4.48Å
447	L	90.5	Very high	85.9	Confident	48 Å²	48	66 Å²	66	25%	0.251	37%	0.367	S	S	.	.			trans	-110.3	100.6	171	-170.7	76.7	0	0	0	108.8	L436 L451 I452	L436-L447 HydrophobicContact CB-CD1 4.26Å; L436-L447 HydrophobicContact CD2-CD1 4.27Å; L436-L447 HydrophobicContact CG-CD1 4.19Å; L447-L451 HydrophobicContact CD1-CB 4.5Å; L447-L451 HydrophobicContact CD1-CD2 3.78Å; L447-L451 HydrophobicContact CD1-CG 4.47Å; L447-I452 HydrophobicContact CD1-CD1 4.42Å; L447-I452 HydrophobicContact CD2-CD1 4.22Å; L447-I452 HydrophobicContact CD2-CG1 4.09Å
448	P	88	Confident	84.8	Confident	38 Å²	38	64.8 Å²	64.8	25%	0.247	36%	0.364	C	S	.	.			trans	-58.2	141.2	-179.1	-24.9	33.1	0	0	0	112.6	I438 G450 L451	I438-P448 HydrophobicContact CG2-CG 4.27Å; P448-G450 PolarHBondContact O-N 2.84Å; P448-L451 VanDerWaalsContact O-CB 3.26Å; P448-L451 WeakPolarHBondContact O-CB 3.47Å; P448-L451 PolarHBondContact O-N 3.48Å
449	D	84.2	Confident	83.7	Confident	162 Å²	162	66.1 Å²	66.1	87%	0.866	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	133.9	174.3	-70.1	-26.2	0	0	0	111.2	L451 R454	D449-L451 VanDerWaalsContact C-N 3.27Å; D449-L451 PolarHBondContact O-N 2.95Å; D449-R454 PolarHBondContact O-NH1 3.3Å
450	G	80.2	Confident	83.2	Confident	29 Å²	29	63 Å²	63	30%	0.299	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	6.1	-178.3	0	0	0	0	0	115.6	P448 I452 D453 R454	P448-G450 PolarHBondContact O-N 2.84Å; G450-I452 VanDerWaalsContact C-N 3.35Å; G450-D453 PolarHBondContact O-N 3.49Å; G450-R454 VanDerWaalsContact C-NH1 3.29Å; G450-R454 WeakPolarHBondContact O-CG 3.43Å; G450-R454 PolarHBondContact O-N 2.98Å; G450-R454 PolarHBondContact O-NH1 3.32Å
451	L	86.8	Confident	82.9	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-41.4	174.9	179.4	59.4	0	0	0	111.8	I405 F414 I438 L447 P448 D449 D453 R454 I455	I405-L451 HydrophobicContact CD1-CD1 4.47Å; I405-L451 HydrophobicContact CG1-CD1 4.33Å; F414-L451 HydrophobicContact CE1-CD2 4.36Å; I438-L451 HydrophobicContact CB-CD2 4.39Å; I438-L451 HydrophobicContact CD1-CD2 4.42Å; I438-L451 HydrophobicContact CG2-CD2 3.76Å; L447-L451 HydrophobicContact CD1-CB 4.5Å; L447-L451 HydrophobicContact CD1-CD2 3.78Å; L447-L451 HydrophobicContact CD1-CG 4.47Å; P448-L451 VanDerWaalsContact O-CB 3.26Å; P448-L451 WeakPolarHBondContact O-CB 3.47Å; P448-L451 PolarHBondContact O-N 3.48Å; D449-L451 VanDerWaalsContact C-N 3.27Å; D449-L451 PolarHBondContact O-N 2.95Å; L451-D453 VanDerWaalsContact C-N 3.33Å; L451-D453 PolarHBondContact O-N 2.75Å; L451-R454 PolarHBondContact O-N 3.06Å; L451-I455 HydrophobicContact CD1-CD1 4.24Å; L451-I455 HydrophobicContact CD1-CG1 4.25Å; L451-I455 HydrophobicContact CG-CD1 3.92Å; L451-I455 HydrophobicContact CG-CG1 4.41Å; L451-I455 VanDerWaalsContact O-CG1 3.32Å; L451-I455 WeakPolarHBondContact O-CG1 3.38Å; L451-I455 PolarHBondContact O-N 3.27Å
452	I	84.3	Confident	82.9	Confident	69 Å²	69	57 Å²	57	35%	0.354	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-44.8	175.5	-58.3	-58.5	0	0	0	110.5	L436 L447 G450 R454 I455 E456	L436-I452 HydrophobicContact CD2-CD1 4.37Å; L447-I452 HydrophobicContact CD1-CD1 4.42Å; L447-I452 HydrophobicContact CD2-CD1 4.22Å; L447-I452 HydrophobicContact CD2-CG1 4.09Å; G450-I452 VanDerWaalsContact C-N 3.35Å; I452-R454 VanDerWaalsContact C-N 3.29Å; I452-R454 PolarHBondContact O-N 3.5Å; I452-I455 HydrophobicContact CD1-CD1 4.41Å; I452-I455 PolarHBondContact O-N 3.05Å; I452-E456 WeakPolarHBondContact O-CB 3.3Å; I452-E456 PolarHBondContact O-N 2.96Å
453	D	76.9	Confident	82.8	Confident	103 Å²	103	53.9 Å²	53.9	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-59.9	-39	174.9	-63	-37	0	0	0	111.9	G450 L451 C457	G450-D453 PolarHBondContact O-N 3.49Å; L451-D453 VanDerWaalsContact C-N 3.33Å; L451-D453 PolarHBondContact O-N 2.75Å; D453-C457 VanDerWaalsContact O-CB 3.26Å; D453-C457 WeakPolarHBondContact O-CB 3.42Å; D453-C457 PolarHBondContact O-N 2.88Å; D453-C457 PolarHBondContact O-SG 3.29Å
454	R	78.7	Confident	82.9	Confident	77 Å²	77	52.2 Å²	52.2	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-44.5	175.7	-72.9	-170.1	-56.8	-82.9	7.2	111.9	D449 G450 L451 I452 E456 C457 C458	D449-R454 PolarHBondContact O-NH1 3.3Å; G450-R454 VanDerWaalsContact C-NH1 3.29Å; G450-R454 WeakPolarHBondContact O-CG 3.43Å; G450-R454 PolarHBondContact O-N 2.98Å; G450-R454 PolarHBondContact O-NH1 3.32Å; L451-R454 PolarHBondContact O-N 3.06Å; I452-R454 VanDerWaalsContact C-N 3.29Å; I452-R454 PolarHBondContact O-N 3.5Å; R454-E456 VanDerWaalsContact C-N 3.31Å; R454-E456 PolarHBondContact O-N 2.99Å; R454-C457 PolarHBondContact O-N 3.19Å; R454-C458 WeakPolarHBondContact O-CB 3.47Å; R454-C458 PolarHBondContact O-N 3.1Å; R454-C458 PolarHBondContact O-SG 3.44Å
455	I	83.1	Confident	82.9	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-45.5	175.4	-71.3	165.1	0	0	0	110.1	I405 L436 L451 I452 C458 G459 L460 M461 V464	I405-I455 HydrophobicContact CD1-CG1 3.88Å; I405-I455 HydrophobicContact CG1-CG1 4.45Å; I405-I455 HydrophobicContact CG2-CG1 4.14Å; L436-I455 HydrophobicContact CD2-CD1 4.49Å; L451-I455 HydrophobicContact CD1-CD1 4.24Å; L451-I455 HydrophobicContact CD1-CG1 4.25Å; L451-I455 HydrophobicContact CG-CD1 3.92Å; L451-I455 HydrophobicContact CG-CG1 4.41Å; L451-I455 VanDerWaalsContact O-CG1 3.32Å; L451-I455 WeakPolarHBondContact O-CG1 3.38Å; L451-I455 PolarHBondContact O-N 3.27Å; I452-I455 HydrophobicContact CD1-CD1 4.41Å; I452-I455 PolarHBondContact O-N 3.05Å; I455-C458 PolarHBondContact O-N 3.04Å; I455-G459 PolarHBondContact O-N 2.96Å; I455-L460 HydrophobicContact CG2-CB 4.11Å; I455-L460 PolarHBondContact O-N 3.18Å; I455-M461 HydrophobicContact CG2-CB 4.25Å; I455-M461 HydrophobicContact CG2-SD 3.96Å; I455-V464 HydrophobicContact CD1-CG1 4.26Å; I455-V464 HydrophobicContact CD1-CG2 4.43Å; I455-V464 HydrophobicContact CG2-CB 4.18Å; I455-V464 HydrophobicContact CG2-CG2 4.07Å
456	E	76.8	Confident	82.8	Confident	56 Å²	56	49.3 Å²	49.3	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-49.6	175	168.8	163.3	177.3	0	0	111.6	I452 R454 C458 G459 L495 R529	I452-E456 WeakPolarHBondContact O-CB 3.3Å; I452-E456 PolarHBondContact O-N 2.96Å; R454-E456 VanDerWaalsContact C-N 3.31Å; R454-E456 PolarHBondContact O-N 2.99Å; E456-C458 VanDerWaalsContact C-N 3.25Å; E456-C458 PolarHBondContact O-N 3.23Å; E456-G459 PolarHBondContact O-N 3.38Å; E456-L495 HydrophobicContact CB-CD1 4.45Å; E456-L495 VanDerWaalsContact CD-CD1 3.48Å; E456-L495 HydrophobicContact CG-CD1 3.45Å; E456-L495 VanDerWaalsContact CG-CD1 3.45Å; E456-L495 WeakPolarHBondContact OE1-CD1 3.31Å; E456-R529 IonicContact OE1-CZ 3.74Å; E456-R529 IonicContact OE1-NH1 3.85Å; E456-R529 PolarHBondContact OE1-NH1 3.27Å
457	C	67.9	Low	83	Confident	83 Å²	83	47 Å²	47	56%	0.561	27%	0.27	S	S	*	.	H	α-helix	trans	-64	-28.5	179.6	-71.7	0	0	0	0	113.4	D453 R454 G459	D453-C457 VanDerWaalsContact O-CB 3.26Å; D453-C457 WeakPolarHBondContact O-CB 3.42Å; D453-C457 PolarHBondContact O-N 2.88Å; D453-C457 PolarHBondContact O-SG 3.29Å; R454-C457 PolarHBondContact O-N 3.19Å; C457-G459 VanDerWaalsContact C-N 3.29Å
458	C	70.2	Confident	83.3	Confident	8 Å²	8	45.5 Å²	45.5	5%	0.054	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.1	174.4	-62.6	0	0	0	0	112.9	E402 R454 I455 E456 L460	E402-C458 HydrophobicContact CB-CB 4.22Å; E402-C458 HydrophobicContact CG-CB 4.37Å; R454-C458 WeakPolarHBondContact O-CB 3.47Å; R454-C458 PolarHBondContact O-N 3.1Å; R454-C458 PolarHBondContact O-SG 3.44Å; I455-C458 PolarHBondContact O-N 3.04Å; E456-C458 VanDerWaalsContact C-N 3.25Å; E456-C458 PolarHBondContact O-N 3.23Å; C458-L460 HydrophobicContact CB-CD1 4.11Å; C458-L460 HydrophobicContact CB-CG 3.97Å; C458-L460 PolarHBondContact O-N 3.09Å
459	G	71.1	Confident	83.7	Confident	53 Å²	53	43.9 Å²	43.9	55%	0.546	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	12.5	-175.6	0	0	0	0	0	114.1	I455 E456 C457 M461	I455-G459 PolarHBondContact O-N 2.96Å; E456-G459 PolarHBondContact O-N 3.38Å; C457-G459 VanDerWaalsContact C-N 3.29Å; G459-M461 VanDerWaalsContact C-N 3.3Å; G459-M461 PolarHBondContact O-N 3.43Å
460	L	81.9	Confident	84.2	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.052	22%	0.218	C	C	.	.			trans	-86.9	1.3	-178.5	-65.8	-179.3	0	0	0	113.1	E402 I405 L406 I455 C458 V462 T463 V464	E402-L460 HydrophobicContact CB-CD1 4.47Å; E402-L460 HydrophobicContact CG-CD1 3.83Å; E402-L460 HydrophobicContact CG-CD2 4.27Å; E402-L460 HydrophobicContact CG-CG 4.17Å; I405-L460 HydrophobicContact CB-CD1 3.75Å; I405-L460 HydrophobicContact CD1-CD1 4.28Å; I405-L460 HydrophobicContact CG2-CD1 3.56Å; L406-L460 HydrophobicContact CD1-CD2 4.28Å; L406-L460 HydrophobicContact CD2-CD1 4.25Å; L406-L460 HydrophobicContact CD2-CD2 3.78Å; L406-L460 HydrophobicContact CG-CD1 3.97Å; L406-L460 HydrophobicContact CG-CD2 4.06Å; I455-L460 HydrophobicContact CG2-CB 4.11Å; I455-L460 PolarHBondContact O-N 3.18Å; C458-L460 HydrophobicContact CB-CD1 4.11Å; C458-L460 HydrophobicContact CB-CG 3.97Å; C458-L460 PolarHBondContact O-N 3.09Å; L460-V462 VanDerWaalsContact C-N 3.27Å; L460-V462 PolarHBondContact O-N 2.72Å; L460-T463 PolarHBondContact O-N 3.05Å; L460-T463 VanDerWaalsContact O-N 3.09Å; L460-V464 HydrophobicContact CB-CG2 4.4Å; L460-V464 PolarHBondContact O-N 2.91Å
461	M	83.6	Confident	85	Confident	23 Å²	23	38.2 Å²	38.2	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-36.6	-176.7	-168.2	61.1	-151	0	0	112.9	I455 G459 G465 S493	I455-M461 HydrophobicContact CG2-CB 4.25Å; I455-M461 HydrophobicContact CG2-SD 3.96Å; G459-M461 VanDerWaalsContact C-N 3.3Å; G459-M461 PolarHBondContact O-N 3.43Å; M461-G465 WeakPolarHBondContact O-CA 3.42Å; M461-G465 PolarHBondContact O-N 2.79Å; M461-S493 WeakPolarHBondContact CG-OG 3.05Å
462	V	85.1	Confident	85.5	Confident	40 Å²	40	37.9 Å²	37.9	24%	0.242	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-42.1	175.8	-178.9	0	0	0	0	110.8	L460 H466 H499	L460-V462 VanDerWaalsContact C-N 3.27Å; L460-V462 PolarHBondContact O-N 2.72Å; V462-H466 WeakPolarHBondContact O-CB 3.47Å; V462-H466 PolarHBondContact O-N 3.48Å; V462-H499 HydrophobicContact CG2-CB 4.18Å
463	T	85.6	Confident	86.1	Confident	67 Å²	67	34.6 Å²	34.6	41%	0.411	19%	0.194	S	C	.	.	H	α-helix	trans	-65	-53.8	179.9	-52.6	0	0	0	0	111.8	L406 L409 L460 H466 W467	L406-T463 HydrophobicContact CD2-CG2 4.41Å; L409-T463 HydrophobicContact CD2-CG2 4.05Å; L460-T463 PolarHBondContact O-N 3.05Å; L460-T463 VanDerWaalsContact O-N 3.09Å; T463-H466 PolarHBondContact O-N 3.4Å; T463-W467 PolarHBondContact O-N 3.13Å; T463-W467 VanDerWaalsContact O-N 3.12Å
464	V	89.8	Confident	87.1	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.024	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-42.1	179.2	178.2	0	0	0	0	110.2	I405 L436 I455 L460 H466 W467 V468	I405-V464 HydrophobicContact CG2-CG2 4.07Å; L436-V464 HydrophobicContact CD2-CG1 3.91Å; I455-V464 HydrophobicContact CD1-CG1 4.26Å; I455-V464 HydrophobicContact CD1-CG2 4.43Å; I455-V464 HydrophobicContact CG2-CB 4.18Å; I455-V464 HydrophobicContact CG2-CG2 4.07Å; L460-V464 HydrophobicContact CB-CG2 4.4Å; L460-V464 PolarHBondContact O-N 2.91Å; V464-H466 VanDerWaalsContact C-N 3.34Å; V464-H466 PolarHBondContact O-N 3.15Å; V464-W467 WeakPolarHBondContact O-CB 3.28Å; V464-W467 PolarHBondContact O-N 2.81Å; V464-V468 WeakPolarHBondContact O-CG2 3.2Å; V464-V468 PolarHBondContact O-N 2.91Å
465	G	91.8	Very high	88	Confident	5 Å²	5	32 Å²	32	5%	0.052	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-36.8	176.9	0	0	0	0	0	113.4	M461 V468 L469 Q496	M461-G465 WeakPolarHBondContact O-CA 3.42Å; M461-G465 PolarHBondContact O-N 2.79Å; G465-V468 PolarHBondContact O-N 3.42Å; G465-L469 VanDerWaalsContact O-CG 3.28Å; G465-L469 WeakPolarHBondContact O-CG 3.4Å; G465-L469 PolarHBondContact O-N 3.26Å; G465-Q496 VanDerWaalsContact C-NE2 3.27Å; G465-Q496 PolarHBondContact O-NE2 3.17Å
466	H	92.4	Very high	88.6	Confident	63 Å²	63	32 Å²	32	29%	0.292	18%	0.177	S	C	.	.	H	α-helix	trans	-64.7	-43.9	173.2	-175.1	85.5	0	0	0	111.4	V462 T463 V464 V468 L469 E470	V462-H466 WeakPolarHBondContact O-CB 3.47Å; V462-H466 PolarHBondContact O-N 3.48Å; T463-H466 PolarHBondContact O-N 3.4Å; V464-H466 VanDerWaalsContact C-N 3.34Å; V464-H466 PolarHBondContact O-N 3.15Å; H466-V468 PolarHBondContact O-N 2.69Å; H466-L469 PolarHBondContact O-N 2.88Å; H466-E470 WeakPolarHBondContact O-CB 3.49Å; H466-E470 PolarHBondContact O-N 3.27Å
467	W	94.8	Very high	89.6	Confident	41 Å²	41	29.9 Å²	29.9	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-46.7	175.4	178.3	87.6	0	0	0	111.7	L409 F414 I416 L436 T463 V464 L469 E470 E471	L409-W467 HydrophobicContact CD1-CB 4.04Å; L409-W467 HydrophobicContact CD1-CD2 3.67Å; L409-W467 HydrophobicContact CD1-CE3 4.13Å; L409-W467 HydrophobicContact CD1-CG 3.6Å; L409-W467 HydrophobicContact CG-CG 4.46Å; F414-W467 VanDerWaalsContact C-CH2 3.5Å; F414-W467 HydrophobicContact CB-CE3 4.4Å; F414-W467 HydrophobicContact CB-CH2 3.65Å; F414-W467 HydrophobicContact CB-CZ2 4.14Å; F414-W467 HydrophobicContact CB-CZ3 3.8Å; F414-W467 WeakPolarHBondContact O-CH2 2.99Å; F414-W467 WeakPolarHBondContact O-CZ2 3.27Å; I416-W467 HydrophobicContact CG2-CH2 4.4Å; I416-W467 HydrophobicContact CG2-CZ3 4.03Å; L436-W467 HydrophobicContact CD1-CE3 4.44Å; L436-W467 HydrophobicContact CD1-CZ3 3.8Å; T463-W467 PolarHBondContact O-N 3.13Å; T463-W467 VanDerWaalsContact O-N 3.12Å; V464-W467 WeakPolarHBondContact O-CB 3.28Å; V464-W467 PolarHBondContact O-N 2.81Å; W467-L469 VanDerWaalsContact C-N 3.34Å; W467-L469 PolarHBondContact O-N 3.24Å; W467-E470 PolarHBondContact O-N 3.4Å; W467-E471 HydrophobicContact CD2-CG 3.94Å; W467-E471 HydrophobicContact CE3-CG 4.33Å; W467-E471 HydrophobicContact CH2-CG 4Å; W467-E471 HydrophobicContact CZ2-CG 3.6Å; W467-E471 HydrophobicContact CZ3-CG 4.35Å; W467-E471 WeakPolarHBondContact O-CG 3.34Å; W467-E471 PolarHBondContact O-N 3.43Å
468	V	95.8	Very high	90.9	Very high	16 Å²	16	28 Å²	28	10%	0.097	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-43.6	176.6	175.3	0	0	0	0	111.5	I416 V434 L436 V464 G465 H466 S472 V490	I416-V468 HydrophobicContact CG2-CG1 4.23Å; V434-V468 HydrophobicContact CG1-CG1 3.93Å; L436-V468 HydrophobicContact CD1-CG2 3.83Å; V464-V468 WeakPolarHBondContact O-CG2 3.2Å; V464-V468 PolarHBondContact O-N 2.91Å; G465-V468 PolarHBondContact O-N 3.42Å; H466-V468 PolarHBondContact O-N 2.69Å; V468-S472 WeakPolarHBondContact O-CB 3.29Å; V468-S472 PolarHBondContact O-N 3.36Å; V468-S472 PolarHBondContact O-OG 3.49Å; V468-V490 HydrophobicContact CG1-CG1 3.72Å
469	L	95.8	Very high	92.1	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-42.7	177.4	-74.2	170.2	0	0	0	112.1	G465 H466 W467 S472 C473 V490 M502 M506 L509 L522	G465-L469 VanDerWaalsContact O-CG 3.28Å; G465-L469 WeakPolarHBondContact O-CG 3.4Å; G465-L469 PolarHBondContact O-N 3.26Å; H466-L469 PolarHBondContact O-N 2.88Å; W467-L469 VanDerWaalsContact C-N 3.34Å; W467-L469 PolarHBondContact O-N 3.24Å; L469-S472 PolarHBondContact O-N 3.01Å; L469-C473 WeakPolarHBondContact O-CB 3.44Å; L469-C473 PolarHBondContact O-N 3.43Å; L469-C473 PolarHBondContact O-SG 2.88Å; L469-V490 HydrophobicContact CD2-CB 4.34Å; L469-V490 HydrophobicContact CD2-CG1 3.91Å; L469-M502 HydrophobicContact CD1-CE 4.03Å; L469-M506 HydrophobicContact CD1-SD 4.01Å; L469-M506 HydrophobicContact CD2-CE 4.47Å; L469-M506 HydrophobicContact CD2-SD 4.11Å; L469-L509 HydrophobicContact CB-CD1 4.02Å; L469-L522 HydrophobicContact CD2-CD2 3.63Å
470	E	96.6	Very high	93.3	Very high	36 Å²	36	26.5 Å²	26.5	17%	0.168	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-45.6	178.5	178.8	158.6	-142.5	0	0	111.7	H466 W467 S472 C473 R474 L509 R512 Y513	H466-E470 WeakPolarHBondContact O-CB 3.49Å; H466-E470 PolarHBondContact O-N 3.27Å; W467-E470 PolarHBondContact O-N 3.4Å; E470-S472 VanDerWaalsContact C-N 3.3Å; E470-S472 PolarHBondContact O-N 3.02Å; E470-C473 PolarHBondContact O-N 3.48Å; E470-R474 WeakPolarHBondContact O-CB 3.47Å; E470-R474 PolarHBondContact O-N 2.95Å; E470-L509 HydrophobicContact CB-CD1 4.39Å; E470-L509 HydrophobicContact CB-CD2 3.92Å; E470-L509 HydrophobicContact CG-CD2 3.99Å; E470-R512 IonicContact OE1-NH1 3.47Å; E470-R512 PolarHBondContact OE1-NH1 3.43Å; E470-R512 VanDerWaalsContact OE1-NH1 3.15Å; E470-Y513 HydrophobicContact CG-CE2 3.86Å; E470-Y513 WeakPolarHBondContact CG-OH 3.18Å; E470-Y513 PolarHBondContact OE1-OH 3.44Å
471	E	96.4	Very high	93.9	Very high	37 Å²	37	34.3 Å²	34.3	17%	0.173	17%	0.174	C	C	.	.	H	α-helix	trans	-60.7	-40.4	174.8	-69	-55.2	137.3	0	0	111.7	I416 W467 R474 L475	I416-E471 HydrophobicContact CD1-CB 3.91Å; I416-E471 HydrophobicContact CG1-CB 4.46Å; I416-E471 HydrophobicContact CG2-CB 4.45Å; W467-E471 HydrophobicContact CD2-CG 3.94Å; W467-E471 HydrophobicContact CE3-CG 4.33Å; W467-E471 HydrophobicContact CH2-CG 4Å; W467-E471 HydrophobicContact CZ2-CG 3.6Å; W467-E471 HydrophobicContact CZ3-CG 4.35Å; W467-E471 WeakPolarHBondContact O-CG 3.34Å; W467-E471 PolarHBondContact O-N 3.43Å; E471-R474 PolarHBondContact O-N 3.47Å; E471-R474 IonicContact OE1-CZ 3.54Å; E471-R474 IonicContact OE1-NH1 3.09Å; E471-R474 PolarHBondContact OE1-NH1 3.43Å; E471-R474 IonicContact OE1-NH2 2.73Å; E471-R474 PolarHBondContact OE1-NH2 3.13Å; E471-R474 IonicContact OE2-CZ 2.6Å; E471-R474 IonicContact OE2-NH1 3.83Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.96Å; E471-L475 WeakPolarHBondContact O-CB 3.42Å; E471-L475 PolarHBondContact O-N 3.22Å
472	S	97.4	Very high	94.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-41.7	176.4	-56.2	0	0	0	0	112.1	V468 L469 E470 L475 L476 V490	V468-S472 WeakPolarHBondContact O-CB 3.29Å; V468-S472 PolarHBondContact O-N 3.36Å; V468-S472 PolarHBondContact O-OG 3.49Å; L469-S472 PolarHBondContact O-N 3.01Å; E470-S472 VanDerWaalsContact C-N 3.3Å; E470-S472 PolarHBondContact O-N 3.02Å; S472-L475 PolarHBondContact O-N 3.31Å; S472-L476 WeakPolarHBondContact O-CB 3.35Å; S472-L476 WeakPolarHBondContact O-CG 3.36Å; S472-L476 PolarHBondContact O-N 3.25Å; S472-V490 WeakPolarHBondContact OG-CG2 3.08Å
473	C	97.4	Very high	94.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-42	174.9	-69.7	0	0	0	0	111.3	L469 E470 L475 L476 A477 Y513 I515	L469-C473 WeakPolarHBondContact O-CB 3.44Å; L469-C473 PolarHBondContact O-N 3.43Å; L469-C473 PolarHBondContact O-SG 2.88Å; E470-C473 PolarHBondContact O-N 3.48Å; C473-L475 VanDerWaalsContact C-N 3.33Å; C473-L475 PolarHBondContact O-N 2.92Å; C473-L476 PolarHBondContact O-N 3.32Å; C473-A477 WeakPolarHBondContact O-CB 3.29Å; C473-A477 PolarHBondContact O-N 2.65Å; C473-Y513 HydrophobicContact CB-CD2 3.73Å; C473-Y513 HydrophobicContact CB-CE2 4.38Å; C473-Y513 HydrophobicContact CB-CG 4.01Å; C473-I515 HydrophobicContact CB-CD1 4.01Å; C473-I515 HydrophobicContact CB-CG1 4.2Å; C473-I515 WeakPolarHBondContact O-CD1 3.4Å
474	R	96.9	Very high	95.1	Very high	108 Å²	108	38.1 Å²	38.1	41%	0.408	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-44	176.7	-169.2	-173.6	-56.9	145.4	11.2	111.4	E470 E471 A477 A478 Y513	E470-R474 WeakPolarHBondContact O-CB 3.47Å; E470-R474 PolarHBondContact O-N 2.95Å; E471-R474 PolarHBondContact O-N 3.47Å; E471-R474 IonicContact OE1-CZ 3.54Å; E471-R474 IonicContact OE1-NH1 3.09Å; E471-R474 PolarHBondContact OE1-NH1 3.43Å; E471-R474 IonicContact OE1-NH2 2.73Å; E471-R474 PolarHBondContact OE1-NH2 3.13Å; E471-R474 IonicContact OE2-CZ 2.6Å; E471-R474 IonicContact OE2-NH1 3.83Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.96Å; R474-A477 PolarHBondContact O-N 3.21Å; R474-A478 PolarHBondContact O-N 3.5Å; R474-Y513 HydrophobicContact CB-CD1 4.34Å; R474-Y513 HydrophobicContact CB-CE1 3.85Å; R474-Y513 HydrophobicContact CG-CE1 3.99Å
475	L	96.8	Very high	95.3	Very high	16 Å²	16	43 Å²	43	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-47	176.9	-177.6	57.2	0	0	0	112	I416 L418 E471 S472 C473 A477 A478 W479 L488 I640	I416-L475 HydrophobicContact CD1-CD2 4.21Å; L418-L475 HydrophobicContact CD1-CD2 4.03Å; L418-L475 HydrophobicContact CD2-CD2 4.23Å; E471-L475 WeakPolarHBondContact O-CB 3.42Å; E471-L475 PolarHBondContact O-N 3.22Å; S472-L475 PolarHBondContact O-N 3.31Å; C473-L475 VanDerWaalsContact C-N 3.33Å; C473-L475 PolarHBondContact O-N 2.92Å; L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.18Å; L475-A478 PolarHBondContact O-N 2.85Å; L475-W479 HydrophobicContact CD1-CD2 4.4Å; L475-W479 HydrophobicContact CD1-CZ2 4Å; L475-W479 HydrophobicContact CD2-CH2 4.24Å; L475-W479 HydrophobicContact CD2-CZ2 4.01Å; L475-W479 HydrophobicContact CG-CD2 4.32Å; L475-W479 HydrophobicContact CG-CH2 4.41Å; L475-W479 HydrophobicContact CG-CZ2 3.99Å; L475-W479 PolarHBondContact O-N 3.17Å; L475-L488 HydrophobicContact CB-CD1 4.4Å; L475-L488 HydrophobicContact CD2-CD1 3.87Å; L475-L488 HydrophobicContact CG-CD1 4.18Å; L475-I640 HydrophobicContact CD1-CD1 4.49Å; L475-I640 HydrophobicContact CD1-CG2 3.78Å; L475-I640 HydrophobicContact CD2-CD1 4.01Å; L475-I640 HydrophobicContact CD2-CG1 4.08Å; L475-I640 HydrophobicContact CD2-CG2 4.36Å
476	L	97.3	Very high	95.5	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-43.5	175.2	-80.8	173	0	0	0	112.2	S472 C473 W479 Q480 L486 L488 I515 L520	S472-L476 WeakPolarHBondContact O-CB 3.35Å; S472-L476 WeakPolarHBondContact O-CG 3.36Å; S472-L476 PolarHBondContact O-N 3.25Å; C473-L476 PolarHBondContact O-N 3.32Å; L476-W479 HydrophobicContact CD2-CE3 4.39Å; L476-W479 PolarHBondContact O-N 2.88Å; L476-Q480 WeakPolarHBondContact O-CB 3.47Å; L476-Q480 WeakPolarHBondContact O-CG 3.48Å; L476-Q480 PolarHBondContact O-N 3.22Å; L476-L486 WeakPolarHBondContact CD2-O 3.47Å; L476-L488 HydrophobicContact CD1-CB 4.33Å; L476-L488 HydrophobicContact CD2-CB 4.14Å; L476-L488 HydrophobicContact CD2-CD1 4.11Å; L476-L488 HydrophobicContact CD2-CG 3.84Å; L476-L488 HydrophobicContact CG-CB 4.26Å; L476-L488 HydrophobicContact CG-CD1 3.89Å; L476-L488 HydrophobicContact CG-CG 4.1Å; L476-I515 HydrophobicContact CB-CD1 3.89Å; L476-I515 HydrophobicContact CD1-CG2 4.09Å; L476-L520 HydrophobicContact CD1-CB 3.95Å; L476-L520 HydrophobicContact CD1-CD1 3.93Å
477	A	96.7	Very high	95.7	Very high	13 Å²	13	41.4 Å²	41.4	11%	0.107	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-45	177.5	0	0	0	0	0	111.6	C473 R474 L475 W479 Q480 E481 Y513 I515	C473-A477 WeakPolarHBondContact O-CB 3.29Å; C473-A477 PolarHBondContact O-N 2.65Å; R474-A477 PolarHBondContact O-N 3.21Å; L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.18Å; A477-W479 VanDerWaalsContact C-N 3.34Å; A477-W479 PolarHBondContact O-N 2.85Å; A477-Q480 PolarHBondContact O-N 3.35Å; A477-E481 WeakPolarHBondContact O-CG 3.42Å; A477-E481 PolarHBondContact O-N 3.43Å; A477-Y513 HydrophobicContact CB-CD1 4.32Å; A477-Y513 WeakPolarHBondContact CB-O 3.5Å; A477-I515 HydrophobicContact CB-CD1 4.3Å
478	A	95.9	Very high	95.8	Very high	42 Å²	42	39.5 Å²	39.5	35%	0.347	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-39.8	177.3	0	0	0	0	0	112.6	R474 L475 R482	R474-A478 PolarHBondContact O-N 3.5Å; L475-A478 PolarHBondContact O-N 2.85Å; A478-R482 WeakPolarHBondContact O-CG 3.32Å; A478-R482 PolarHBondContact O-N 3.11Å
479	W	95.6	Very high	95.9	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-65.4	-43.8	173	-73.8	-4.2	0	0	0	112.4	L418 L475 L476 A477 E481 R482 G483 I484 L486 L488 F643 E644 L648	L418-W479 HydrophobicContact CD1-CH2 3.57Å; L418-W479 HydrophobicContact CD1-CZ2 3.7Å; L475-W479 HydrophobicContact CD1-CD2 4.4Å; L475-W479 HydrophobicContact CD1-CZ2 4Å; L475-W479 HydrophobicContact CD2-CH2 4.24Å; L475-W479 HydrophobicContact CD2-CZ2 4.01Å; L475-W479 HydrophobicContact CG-CD2 4.32Å; L475-W479 HydrophobicContact CG-CH2 4.41Å; L475-W479 HydrophobicContact CG-CZ2 3.99Å; L475-W479 PolarHBondContact O-N 3.17Å; L476-W479 HydrophobicContact CD2-CE3 4.39Å; L476-W479 PolarHBondContact O-N 2.88Å; A477-W479 VanDerWaalsContact C-N 3.34Å; A477-W479 PolarHBondContact O-N 2.85Å; W479-E481 VanDerWaalsContact C-N 3.33Å; W479-E481 PolarHBondContact O-N 2.92Å; W479-R482 CarbonylContact O-C 3.53Å; W479-R482 WeakPolarHBondContact O-CA 3.21Å; W479-R482 WeakPolarHBondContact O-CB 3.48Å; W479-R482 PolarHBondContact O-N 2.95Å; W479-G483 PolarHBondContact O-N 3.27Å; W479-I484 CarbonylContact C-O 3.52Å; W479-I484 HydrophobicContact CB-CB 3.97Å; W479-I484 HydrophobicContact CB-CG2 4.16Å; W479-I484 HydrophobicContact CG-CG2 4.39Å; W479-I484 WeakPolarHBondContact O-CA 3.36Å; W479-I484 WeakPolarHBondContact O-CB 3.36Å; W479-I484 PolarHBondContact O-N 3.32Å; W479-L486 HydrophobicContact CE3-CB 4.16Å; W479-L486 HydrophobicContact CE3-CD2 4.43Å; W479-L486 HydrophobicContact CH2-CD2 3.96Å; W479-L486 HydrophobicContact CZ3-CB 4.13Å; W479-L486 HydrophobicContact CZ3-CD2 3.69Å; W479-L486 HydrophobicContact CZ3-CG 4.22Å; W479-L488 HydrophobicContact CE3-CG 4.48Å; W479-L488 HydrophobicContact CH2-CD1 4.37Å; W479-L488 HydrophobicContact CH2-CD2 3.72Å; W479-L488 HydrophobicContact CH2-CG 4.29Å; W479-L488 HydrophobicContact CZ3-CD1 4.01Å; W479-L488 HydrophobicContact CZ3-CD2 3.5Å; W479-L488 HydrophobicContact CZ3-CG 3.69Å; W479-F643 HydrophobicContact CH2-CD1 4.29Å; W479-F643 AromaticContact CH2-CE1 3.95Å; W479-F643 HydrophobicContact CH2-CE1 3.95Å; W479-F643 HydrophobicContact CZ2-CD1 4.18Å; W479-F643 HydrophobicContact CZ2-CE1 4.24Å; W479-E644 HydrophobicContact CZ2-CG 4.47Å; W479-E644 PolarHBondContact NE1-OE1 2.88Å; W479-L648 HydrophobicContact CD2-CD1 4.02Å; W479-L648 HydrophobicContact CG-CD1 4.48Å; W479-L648 HydrophobicContact CH2-CD1 4.25Å; W479-L648 HydrophobicContact CZ2-CD1 3.66Å
480	Q	95.7	Very high	95.9	Very high	29 Å²	29	38.5 Å²	38.5	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-34.8	-179.6	-72.6	169.2	12.5	0	0	112.3	L476 A477 R482 G483 I484 M485 Q516 T519	L476-Q480 WeakPolarHBondContact O-CB 3.47Å; L476-Q480 WeakPolarHBondContact O-CG 3.48Å; L476-Q480 PolarHBondContact O-N 3.22Å; A477-Q480 PolarHBondContact O-N 3.35Å; Q480-R482 PolarHBondContact O-N 3.33Å; Q480-G483 PolarHBondContact O-N 3.09Å; Q480-I484 PolarHBondContact N-O 2.92Å; Q480-M485 HydrophobicContact CG-SD 3.97Å; Q480-Q516 HydrophobicContact CG-CG 4.37Å; Q480-Q516 VanDerWaalsContact OE1-N 3.11Å; Q480-T519 PolarHBondContact NE2-OG1 3.35Å
481	E	94.4	Very high	95.8	Very high	174 Å²	174	39.5 Å²	39.5	81%	0.813	21%	0.206	S	C	*	.	H	α-helix	trans	-61.9	-32.1	170.8	-75.6	-179.6	179.1	0	0	112.4	A477 W479 G483	A477-E481 WeakPolarHBondContact O-CG 3.42Å; A477-E481 PolarHBondContact O-N 3.43Å; W479-E481 VanDerWaalsContact C-N 3.33Å; W479-E481 PolarHBondContact O-N 2.92Å; E481-G483 VanDerWaalsContact C-N 3.27Å; E481-G483 PolarHBondContact O-N 3.33Å
482	R	93.7	Very high	95.4	Very high	122 Å²	122	37.9 Å²	37.9	46%	0.46	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	0.7	172.9	-66.2	162.7	61.8	178.3	2.2	113.4	A478 W479 Q480 I484 E644	A478-R482 WeakPolarHBondContact O-CG 3.32Å; A478-R482 PolarHBondContact O-N 3.11Å; W479-R482 CarbonylContact O-C 3.53Å; W479-R482 WeakPolarHBondContact O-CA 3.21Å; W479-R482 WeakPolarHBondContact O-CB 3.48Å; W479-R482 PolarHBondContact O-N 2.95Å; Q480-R482 PolarHBondContact O-N 3.33Å; R482-I484 VanDerWaalsContact C-N 3.32Å; R482-I484 HydrophobicContact CB-CD1 4.1Å; R482-I484 HydrophobicContact CB-CG1 4.33Å; R482-E644 IonicContact CZ-OE2 3.51Å; R482-E644 IonicContact NH1-OE1 3.73Å; R482-E644 IonicContact NH1-OE2 2.57Å; R482-E644 PolarHBondContact NH1-OE2 3.46Å; R482-E644 IonicContact NH2-OE2 3.55Å
483	G	93.4	Very high	94.7	Very high	59 Å²	59	38.8 Å²	38.8	61%	0.608	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	9.4	-176.4	0	0	0	0	0	114.7	W479 Q480 E481	W479-G483 PolarHBondContact O-N 3.27Å; Q480-G483 PolarHBondContact O-N 3.09Å; E481-G483 VanDerWaalsContact C-N 3.27Å; E481-G483 PolarHBondContact O-N 3.33Å
484	I	93.2	Very high	93.8	Very high	30 Å²	30	39.6 Å²	39.6	15%	0.154	21%	0.212	C	C	.	.			trans	-87.5	120.3	178.7	-59.9	164.5	0	0	0	108.7	W479 Q480 R482 L486 L648	W479-I484 CarbonylContact C-O 3.52Å; W479-I484 HydrophobicContact CB-CB 3.97Å; W479-I484 HydrophobicContact CB-CG2 4.16Å; W479-I484 HydrophobicContact CG-CG2 4.39Å; W479-I484 WeakPolarHBondContact O-CA 3.36Å; W479-I484 WeakPolarHBondContact O-CB 3.36Å; W479-I484 PolarHBondContact O-N 3.32Å; Q480-I484 PolarHBondContact N-O 2.92Å; R482-I484 VanDerWaalsContact C-N 3.32Å; R482-I484 HydrophobicContact CB-CD1 4.1Å; R482-I484 HydrophobicContact CB-CG1 4.33Å; I484-L486 HydrophobicContact CG2-CB 3.97Å; I484-L648 HydrophobicContact CD1-CB 4.16Å; I484-L648 HydrophobicContact CD1-CD1 4.29Å; I484-L648 HydrophobicContact CG2-CD1 4.24Å; I484-L648 HydrophobicContact CG2-CD2 3.78Å
485	M	94.1	Very high	92.7	Very high	106 Å²	106	38.1 Å²	38.1	52%	0.522	21%	0.211	S	C	.	.			trans	-108.4	34.5	-177.1	-63.5	-69.2	-73.7	0	0	112.2	Q480 P487 Q516 T519	Q480-M485 HydrophobicContact CG-SD 3.97Å; M485-P487 WeakPolarHBondContact O-CD 3.37Å; M485-Q516 HydrophobicContact CE-CB 3.67Å; M485-Q516 HydrophobicContact CE-CG 3.82Å; M485-Q516 HydrophobicContact SD-CB 4.46Å; M485-Q516 HydrophobicContact SD-CG 4.18Å; M485-T519 HydrophobicContact CE-CG2 4.13Å
486	L	95.5	Very high	91.9	Very high	17 Å²	17	37.5 Å²	37.5	9%	0.089	21%	0.208	C	C	.	.			trans	-73	123.8	-178.9	-176.1	72.2	0	0	0	110.6	L429 L476 W479 I484 F643 L648	L429-L486 HydrophobicContact CD2-CD1 3.89Å; L429-L486 HydrophobicContact CD2-CD2 3.67Å; L429-L486 HydrophobicContact CD2-CG 4.46Å; L429-L486 HydrophobicContact CG-CD1 3.86Å; L429-L486 HydrophobicContact CG-CD2 4.4Å; L476-L486 WeakPolarHBondContact CD2-O 3.47Å; W479-L486 HydrophobicContact CE3-CB 4.16Å; W479-L486 HydrophobicContact CE3-CD2 4.43Å; W479-L486 HydrophobicContact CH2-CD2 3.96Å; W479-L486 HydrophobicContact CZ3-CB 4.13Å; W479-L486 HydrophobicContact CZ3-CD2 3.69Å; W479-L486 HydrophobicContact CZ3-CG 4.22Å; I484-L486 HydrophobicContact CG2-CB 3.97Å; L486-F643 HydrophobicContact CD2-CE1 3.8Å; L486-F643 HydrophobicContact CD2-CZ 3.97Å; L486-L648 HydrophobicContact CD2-CD2 4.18Å
487	P	96.7	Very high	91.3	Very high	18 Å²	18	37.5 Å²	37.5	12%	0.117	21%	0.208	C	C	.	.			trans	-69.8	140.7	176	-18.4	32.1	0	0	0	113.5	V430 S431 A432 M485 T519 I521 R549	V430-P487 WeakPolarHBondContact O-CD 3.45Å; S431-P487 VanDerWaalsContact CA-O 3.29Å; S431-P487 WeakPolarHBondContact CA-O 3.33Å; S431-P487 VanDerWaalsContact CB-O 3.29Å; S431-P487 WeakPolarHBondContact CB-O 3.45Å; A432-P487 PolarHBondContact N-O 3.1Å; M485-P487 WeakPolarHBondContact O-CD 3.37Å; P487-T519 CarbonylContact C-O 3.45Å; P487-T519 WeakPolarHBondContact CA-O 3.45Å; P487-I521 HydrophobicContact CB-CD1 4.06Å; P487-I521 HydrophobicContact CB-CG1 4.32Å; P487-R549 VanDerWaalsContact CG-NH2 3.34Å
488	L	97.7	Very high	90.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.4	170.4	-72	-173.3	0	0	0	111.5	L418 A432 V434 L475 L476 W479 T519 I521	L418-L488 HydrophobicContact CD2-CD2 3.89Å; A432-L488 HydrophobicContact CB-CD2 3.84Å; A432-L488 CarbonylContact O-C 3.53Å; A432-L488 WeakPolarHBondContact O-CA 3.44Å; V434-L488 HydrophobicContact CG2-CB 4.34Å; V434-L488 HydrophobicContact CG2-CD1 4.16Å; V434-L488 HydrophobicContact CG2-CD2 4.39Å; L475-L488 HydrophobicContact CB-CD1 4.4Å; L475-L488 HydrophobicContact CD2-CD1 3.87Å; L475-L488 HydrophobicContact CG-CD1 4.18Å; L476-L488 HydrophobicContact CD1-CB 4.33Å; L476-L488 HydrophobicContact CD2-CB 4.14Å; L476-L488 HydrophobicContact CD2-CD1 4.11Å; L476-L488 HydrophobicContact CD2-CG 3.84Å; L476-L488 HydrophobicContact CG-CB 4.26Å; L476-L488 HydrophobicContact CG-CD1 3.89Å; L476-L488 HydrophobicContact CG-CG 4.1Å; W479-L488 HydrophobicContact CE3-CG 4.48Å; W479-L488 HydrophobicContact CH2-CD1 4.37Å; W479-L488 HydrophobicContact CH2-CD2 3.72Å; W479-L488 HydrophobicContact CH2-CG 4.29Å; W479-L488 HydrophobicContact CZ3-CD1 4.01Å; W479-L488 HydrophobicContact CZ3-CD2 3.5Å; W479-L488 HydrophobicContact CZ3-CG 3.69Å; L488-T519 PolarHBondContact N-O 2.77Å; L488-I521 PolarHBondContact O-N 2.91Å
489	S	97	Very high	89.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.9	168	-89	0	0	0	0	111	A432 V434 I521 E523	A432-S489 PolarHBondContact O-N 2.96Å; V434-S489 VanDerWaalsContact CB-O 3.28Å; V434-S489 WeakPolarHBondContact CB-O 3.33Å; V434-S489 WeakPolarHBondContact CG2-O 3.03Å; V434-S489 PolarHBondContact N-O 2.63Å; S489-I521 CarbonylContact C-O 3.57Å; S489-I521 WeakPolarHBondContact CA-O 3.27Å; S489-E523 VanDerWaalsContact CB-CD 3.46Å; S489-E523 WeakPolarHBondContact CB-OE1 3.37Å; S489-E523 PolarHBondContact OG-OE1 3.07Å
490	V	96.5	Very high	88.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.6	179.5	-172.1	0	0	0	0	110.1	V434 V468 L469 S472 L492 L520 I521 E523	V434-V490 HydrophobicContact CB-CG2 4.17Å; V434-V490 HydrophobicContact CG2-CG2 4Å; V468-V490 HydrophobicContact CG1-CG1 3.72Å; L469-V490 HydrophobicContact CD2-CB 4.34Å; L469-V490 HydrophobicContact CD2-CG1 3.91Å; S472-V490 WeakPolarHBondContact OG-CG2 3.08Å; V490-L492 PolarHBondContact O-N 3.22Å; V490-L520 HydrophobicContact CG2-CD1 3.69Å; V490-I521 PolarHBondContact N-O 2.86Å; V490-E523 PolarHBondContact O-N 3.39Å
491	N	92.7	Very high	88.4	Confident	57 Å²	57	50.6 Å²	50.6	31%	0.305	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	128.2	176.2	-79.8	-77.1	0	0	0	112.1	E433 V434	E433-N491 PolarHBondContact OE1-ND2 2.92Å; V434-N491 PolarHBondContact O-ND2 3.39Å
492	L	89.7	Confident	88.1	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	112.4	-179.5	-178.7	66.8	0	0	0	110.5	V490 Q496 L497 M502 L522 E523 V524	V490-L492 PolarHBondContact O-N 3.22Å; L492-Q496 HydrophobicContact CD1-CB 3.84Å; L492-Q496 HydrophobicContact CD1-CG 3.61Å; L492-L497 HydrophobicContact CD2-CB 4.26Å; L492-L497 HydrophobicContact CD2-CD1 3.84Å; L492-L497 HydrophobicContact CG-CB 4.48Å; L492-M502 HydrophobicContact CD1-CE 3.58Å; L492-M502 HydrophobicContact CD1-SD 4.3Å; L492-M502 HydrophobicContact CD2-CE 3.81Å; L492-M502 HydrophobicContact CG-CE 4.39Å; L492-L522 HydrophobicContact CD2-CB 4.45Å; L492-L522 HydrophobicContact CD2-CD1 4.21Å; L492-E523 WeakPolarHBondContact CA-O 3.5Å; L492-E523 PolarHBondContact N-O 3.16Å; L492-V524 HydrophobicContact CD2-CG2 4.35Å
493	S	82.9	Confident	87.9	Confident	18 Å²	18	38.5 Å²	38.5	13%	0.126	23%	0.225	C	C	.	.			trans	-66.5	153.4	176.2	69.7	0	0	0	0	112.8	M461 L495 Q496 L497	M461-S493 WeakPolarHBondContact CG-OG 3.05Å; S493-L495 VanDerWaalsContact C-N 3.26Å; S493-L495 PolarHBondContact O-N 3.33Å; S493-Q496 PolarHBondContact O-N 2.85Å; S493-Q496 VanDerWaalsContact OG-CB 3.29Å; S493-Q496 WeakPolarHBondContact OG-CB 3.33Å; S493-Q496 PolarHBondContact OG-N 3.35Å; S493-Q496 VanDerWaalsContact OG-N 3.13Å; S493-L497 PolarHBondContact O-N 3.07Å
494	A	78	Confident	87.8	Confident	18 Å²	18	38.5 Å²	38.5	15%	0.149	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-34.9	173.3	0	0	0	0	0	113.1	L497 M498	A494-L497 PolarHBondContact O-N 3.44Å; A494-M498 WeakPolarHBondContact O-CB 3.39Å; A494-M498 VanDerWaalsContact O-CG 3.27Å; A494-M498 WeakPolarHBondContact O-CG 3.19Å; A494-M498 PolarHBondContact O-N 2.94Å
495	L	72.9	Confident	87.7	Confident	76 Å²	76	39.3 Å²	39.3	40%	0.398	22%	0.224	S	C	.	.	H	α-helix	trans	-65.9	-41.9	177.5	-73.4	175.3	0	0	0	112.1	E456 S493 M498 H499	E456-L495 HydrophobicContact CB-CD1 4.45Å; E456-L495 VanDerWaalsContact CD-CD1 3.48Å; E456-L495 HydrophobicContact CG-CD1 3.45Å; E456-L495 VanDerWaalsContact CG-CD1 3.45Å; E456-L495 WeakPolarHBondContact OE1-CD1 3.31Å; S493-L495 VanDerWaalsContact C-N 3.26Å; S493-L495 PolarHBondContact O-N 3.33Å; L495-M498 PolarHBondContact O-N 3.41Å; L495-H499 PolarHBondContact O-N 2.96Å
496	Q	81.2	Confident	87.7	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.019	20%	0.2	C	C	.	.	H	α-helix	trans	-69	-41.2	176.1	-172	-179.8	-4.9	0	0	111.1	G465 L492 S493 M498 H499 M502	G465-Q496 VanDerWaalsContact C-NE2 3.27Å; G465-Q496 PolarHBondContact O-NE2 3.17Å; L492-Q496 HydrophobicContact CD1-CB 3.84Å; L492-Q496 HydrophobicContact CD1-CG 3.61Å; S493-Q496 PolarHBondContact O-N 2.85Å; S493-Q496 VanDerWaalsContact OG-CB 3.29Å; S493-Q496 WeakPolarHBondContact OG-CB 3.33Å; S493-Q496 PolarHBondContact OG-N 3.35Å; S493-Q496 VanDerWaalsContact OG-N 3.13Å; Q496-M498 VanDerWaalsContact C-N 3.29Å; Q496-M498 PolarHBondContact O-N 3.45Å; Q496-H499 VanDerWaalsContact O-CB 3.24Å; Q496-H499 WeakPolarHBondContact O-CB 3.47Å; Q496-H499 PolarHBondContact O-N 2.91Å; Q496-H499 VanDerWaalsContact O-N 3.09Å; Q496-M502 HydrophobicContact CG-SD 3.92Å; Q496-M502 WeakPolarHBondContact O-CB 3.26Å; Q496-M502 WeakPolarHBondContact O-CG 3.48Å
497	L	83.8	Confident	87.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-56.4	-44.9	175.3	-176.9	67.2	0	0	0	111.4	L492 S493 A494 H499 V524 I530 A536 I539 L540	L492-L497 HydrophobicContact CD2-CB 4.26Å; L492-L497 HydrophobicContact CD2-CD1 3.84Å; L492-L497 HydrophobicContact CG-CB 4.48Å; S493-L497 PolarHBondContact O-N 3.07Å; A494-L497 PolarHBondContact O-N 3.44Å; L497-H499 PolarHBondContact O-N 2.68Å; L497-V524 HydrophobicContact CD2-CG1 4.11Å; L497-I530 HydrophobicContact CD2-CD1 4.11Å; L497-A536 HydrophobicContact CD2-CB 4.47Å; L497-I539 HydrophobicContact CD1-CB 4.41Å; L497-I539 HydrophobicContact CD1-CG2 3.53Å; L497-I539 HydrophobicContact CG-CG2 4.21Å; L497-I539 WeakPolarHBondContact O-CD1 3.29Å; L497-L540 HydrophobicContact CD1-CD2 3.74Å; L497-L540 HydrophobicContact CD1-CG 4.27Å
498	M	79	Confident	87.6	Confident	87 Å²	87	40.6 Å²	40.6	43%	0.429	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-1.8	-179.3	-65.1	-60.6	-66.2	0	0	114.1	A494 L495 Q496 A535 I539	A494-M498 WeakPolarHBondContact O-CB 3.39Å; A494-M498 VanDerWaalsContact O-CG 3.27Å; A494-M498 WeakPolarHBondContact O-CG 3.19Å; A494-M498 PolarHBondContact O-N 2.94Å; L495-M498 PolarHBondContact O-N 3.41Å; Q496-M498 VanDerWaalsContact C-N 3.29Å; Q496-M498 PolarHBondContact O-N 3.45Å; M498-A535 HydrophobicContact CE-CB 4.02Å; M498-A535 HydrophobicContact SD-CB 4.48Å; M498-I539 HydrophobicContact SD-CD1 3.93Å
499	H	81.2	Confident	87.5	Confident	66 Å²	66	40.8 Å²	40.8	31%	0.306	23%	0.229	S	C	.	.	S	Bend	trans	-65.5	131.6	178.6	-171.9	-98.3	0	0	0	110.4	V462 L495 Q496 L497 N501 M502	V462-H499 HydrophobicContact CG2-CB 4.18Å; L495-H499 PolarHBondContact O-N 2.96Å; Q496-H499 VanDerWaalsContact O-CB 3.24Å; Q496-H499 WeakPolarHBondContact O-CB 3.47Å; Q496-H499 PolarHBondContact O-N 2.91Å; Q496-H499 VanDerWaalsContact O-N 3.09Å; L497-H499 PolarHBondContact O-N 2.68Å; H499-N501 PolarHBondContact ND1-N 3.32Å; H499-N501 PolarHBondContact O-N 2.99Å; H499-M502 HydrophobicContact CB-CB 4.37Å; H499-M502 VanDerWaalsContact O-CB 3.26Å; H499-M502 WeakPolarHBondContact O-CB 3.26Å; H499-M502 PolarHBondContact O-N 2.73Å
500	P	77.8	Confident	87.4	Confident	119 Å²	119	41.5 Å²	41.5	77%	0.773	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.8	-173.1	-29	35.3	0	0	0	115.2
501	N	85.2	Confident	87.4	Confident	88 Å²	88	46.6 Å²	46.6	47%	0.471	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-1.8	-178	-63.6	-14	0	0	0	114	H499 V503 A504 D505	H499-N501 PolarHBondContact ND1-N 3.32Å; H499-N501 PolarHBondContact O-N 2.99Å; N501-V503 VanDerWaalsContact C-N 3.3Å; N501-V503 PolarHBondContact O-N 2.82Å; N501-V503 VanDerWaalsContact O-N 3.15Å; N501-A504 PolarHBondContact O-N 2.81Å; N501-D505 WeakPolarHBondContact CB-OD2 3.31Å; N501-D505 VanDerWaalsContact O-CG 3.26Å; N501-D505 PolarHBondContact O-N 3.38Å
502	M	87.2	Confident	87.6	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.034	27%	0.273	C	S	.	.	H	α-helix	trans	-51.2	-46.5	-172.1	177.2	58.5	-166.2	0	0	113.2	L469 L492 Q496 H499 M506	L469-M502 HydrophobicContact CD1-CE 4.03Å; L492-M502 HydrophobicContact CD1-CE 3.58Å; L492-M502 HydrophobicContact CD1-SD 4.3Å; L492-M502 HydrophobicContact CD2-CE 3.81Å; L492-M502 HydrophobicContact CG-CE 4.39Å; Q496-M502 HydrophobicContact CG-SD 3.92Å; Q496-M502 WeakPolarHBondContact O-CB 3.26Å; Q496-M502 WeakPolarHBondContact O-CG 3.48Å; H499-M502 HydrophobicContact CB-CB 4.37Å; H499-M502 VanDerWaalsContact O-CB 3.26Å; H499-M502 WeakPolarHBondContact O-CB 3.26Å; H499-M502 PolarHBondContact O-N 2.73Å; M502-M506 HydrophobicContact CE-CB 4.39Å; M502-M506 HydrophobicContact CE-SD 4.49Å; M502-M506 WeakPolarHBondContact O-CB 3.48Å; M502-M506 PolarHBondContact O-N 3Å
503	V	89.5	Confident	87.9	Confident	34 Å²	34	52 Å²	52	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-43.1	179.4	179.2	0	0	0	0	111.4	N501 L507 I539 P542 L543	N501-V503 VanDerWaalsContact C-N 3.3Å; N501-V503 PolarHBondContact O-N 2.82Å; N501-V503 VanDerWaalsContact O-N 3.15Å; V503-L507 HydrophobicContact CG1-CD1 3.83Å; V503-L507 HydrophobicContact CG1-CG 4.3Å; V503-L507 WeakPolarHBondContact O-CB 3.15Å; V503-L507 WeakPolarHBondContact O-CG 3.46Å; V503-L507 PolarHBondContact O-N 2.88Å; V503-I539 HydrophobicContact CG2-CB 4.36Å; V503-I539 HydrophobicContact CG2-CG2 3.78Å; V503-P542 HydrophobicContact CG1-CB 3.73Å; V503-P542 HydrophobicContact CG1-CG 4.32Å; V503-L543 HydrophobicContact CG1-CD2 4.38Å
504	A	92.2	Very high	88.4	Confident	60 Å²	60	60.8 Å²	60.8	50%	0.496	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-48.9	-178.8	0	0	0	0	0	111.1	N501 M506 L507 E508	N501-A504 PolarHBondContact O-N 2.81Å; A504-M506 VanDerWaalsContact C-N 3.3Å; A504-M506 PolarHBondContact O-N 3.36Å; A504-L507 PolarHBondContact O-N 3.24Å; A504-E508 PolarHBondContact O-N 3.13Å
505	D	92.1	Very high	89.3	Confident	47 Å²	47	60.8 Å²	60.8	25%	0.251	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-41.8	-179.5	-59.1	-21.1	0	0	0	110.7	N501 E508 L509	N501-D505 WeakPolarHBondContact CB-OD2 3.31Å; N501-D505 VanDerWaalsContact O-CG 3.26Å; N501-D505 PolarHBondContact O-N 3.38Å; D505-E508 PolarHBondContact O-N 2.89Å; D505-L509 WeakPolarHBondContact O-CG 3.24Å; D505-L509 PolarHBondContact O-N 3.31Å
506	M	94.1	Very high	90.4	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-68.2	-44.8	179.1	-168.7	64.7	-149.8	0	0	112.4	L469 M502 A504 E508 L509 L510 L520 L543	L469-M506 HydrophobicContact CD1-SD 4.01Å; L469-M506 HydrophobicContact CD2-CE 4.47Å; L469-M506 HydrophobicContact CD2-SD 4.11Å; M502-M506 HydrophobicContact CE-CB 4.39Å; M502-M506 HydrophobicContact CE-SD 4.49Å; M502-M506 WeakPolarHBondContact O-CB 3.48Å; M502-M506 PolarHBondContact O-N 3Å; A504-M506 VanDerWaalsContact C-N 3.3Å; A504-M506 PolarHBondContact O-N 3.36Å; M506-E508 PolarHBondContact O-N 2.78Å; M506-L509 PolarHBondContact O-N 3.36Å; M506-L510 HydrophobicContact CE-CD1 4.39Å; M506-L510 HydrophobicContact CE-CD2 3.8Å; M506-L510 HydrophobicContact CE-CG 3.92Å; M506-L510 HydrophobicContact CG-CD1 4.45Å; M506-L510 VanDerWaalsContact O-CG 3.29Å; M506-L510 WeakPolarHBondContact O-CG 3.42Å; M506-L510 PolarHBondContact O-N 2.87Å; M506-L520 HydrophobicContact CE-CD2 3.06Å; M506-L543 HydrophobicContact CB-CD2 3.71Å; M506-L543 HydrophobicContact CG-CD2 3.64Å
507	L	93.6	Very high	91	Very high	62 Å²	62	65.7 Å²	65.7	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-35	176.3	-70.9	175	0	0	0	111.8	V503 A504 L510 T511 A546	V503-L507 HydrophobicContact CG1-CD1 3.83Å; V503-L507 HydrophobicContact CG1-CG 4.3Å; V503-L507 WeakPolarHBondContact O-CB 3.15Å; V503-L507 WeakPolarHBondContact O-CG 3.46Å; V503-L507 PolarHBondContact O-N 2.88Å; A504-L507 PolarHBondContact O-N 3.24Å; L507-L510 HydrophobicContact CD2-CD1 4.4Å; L507-T511 WeakPolarHBondContact O-CB 3.45Å; L507-T511 PolarHBondContact O-N 3.38Å; L507-T511 PolarHBondContact O-OG1 3.38Å; L507-A546 HydrophobicContact CD2-CB 3.4Å
508	E	95.6	Very high	91.4	Very high	104 Å²	104	66.7 Å²	66.7	49%	0.486	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-48.1	173.2	-171.1	-178.5	163.2	0	0	111.3	A504 D505 M506 L510 T511 R512	A504-E508 PolarHBondContact O-N 3.13Å; D505-E508 PolarHBondContact O-N 2.89Å; M506-E508 PolarHBondContact O-N 2.78Å; E508-L510 PolarHBondContact O-N 3.27Å; E508-T511 PolarHBondContact O-N 3.19Å; E508-R512 WeakPolarHBondContact O-CB 3.49Å; E508-R512 PolarHBondContact O-N 3Å; E508-R512 IonicContact OE1-CZ 3.16Å; E508-R512 IonicContact OE1-NH2 3.72Å; E508-R512 PolarHBondContact OE1-NH2 3.36Å
509	L	95.5	Very high	92.2	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-48.3	176.5	-74.4	177.4	0	0	0	112	L469 E470 D505 M506 T511 R512 Y513	L469-L509 HydrophobicContact CB-CD1 4.02Å; E470-L509 HydrophobicContact CB-CD1 4.39Å; E470-L509 HydrophobicContact CB-CD2 3.92Å; E470-L509 HydrophobicContact CG-CD2 3.99Å; D505-L509 WeakPolarHBondContact O-CG 3.24Å; D505-L509 PolarHBondContact O-N 3.31Å; M506-L509 PolarHBondContact O-N 3.36Å; L509-T511 VanDerWaalsContact C-N 3.27Å; L509-T511 PolarHBondContact O-N 3.01Å; L509-R512 PolarHBondContact O-N 2.92Å; L509-Y513 HydrophobicContact CD2-CD2 4.26Å; L509-Y513 HydrophobicContact CD2-CE2 3.85Å; L509-Y513 WeakPolarHBondContact O-CD2 3.37Å; L509-Y513 PolarHBondContact O-N 2.99Å
510	L	95.7	Very high	93	Very high	16 Å²	16	59.7 Å²	59.7	8%	0.084	32%	0.315	C	S	.	.	H	α-helix	trans	-57.9	-41.6	178	-66.5	170.9	0	0	0	111.8	M506 L507 E508 R514 I515 L520 A546 V548	M506-L510 HydrophobicContact CE-CD1 4.39Å; M506-L510 HydrophobicContact CE-CD2 3.8Å; M506-L510 HydrophobicContact CE-CG 3.92Å; M506-L510 HydrophobicContact CG-CD1 4.45Å; M506-L510 VanDerWaalsContact O-CG 3.29Å; M506-L510 WeakPolarHBondContact O-CG 3.42Å; M506-L510 PolarHBondContact O-N 2.87Å; L507-L510 HydrophobicContact CD2-CD1 4.4Å; E508-L510 PolarHBondContact O-N 3.27Å; L510-R514 VanDerWaalsContact O-CA 3.32Å; L510-R514 WeakPolarHBondContact O-CA 3.33Å; L510-R514 PolarHBondContact O-N 2.89Å; L510-I515 HydrophobicContact CD2-CB 3.83Å; L510-I515 HydrophobicContact CD2-CG1 4.1Å; L510-I515 HydrophobicContact CD2-CG2 4.06Å; L510-I515 PolarHBondContact O-N 3.5Å; L510-L520 HydrophobicContact CD2-CD2 3.99Å; L510-A546 HydrophobicContact CD1-CB 3.99Å; L510-V548 HydrophobicContact CD1-CG2 3.45Å; L510-V548 VanDerWaalsContact CD1-CG2 3.45Å; L510-V548 HydrophobicContact CD2-CG2 4.01Å; L510-V548 HydrophobicContact CG-CG2 4.34Å
511	T	95.4	Very high	93.9	Very high	106 Å²	106	54.1 Å²	54.1	65%	0.65	28%	0.278	S	S	*	.	H	α-helix	trans	-71.8	-44.8	179.7	-56	0	0	0	0	111.6	L507 E508 L509 Y513 R514	L507-T511 WeakPolarHBondContact O-CB 3.45Å; L507-T511 PolarHBondContact O-N 3.38Å; L507-T511 PolarHBondContact O-OG1 3.38Å; E508-T511 PolarHBondContact O-N 3.19Å; L509-T511 VanDerWaalsContact C-N 3.27Å; L509-T511 PolarHBondContact O-N 3.01Å; T511-Y513 PolarHBondContact O-N 3.21Å; T511-R514 PolarHBondContact O-N 3.43Å
512	R	96.6	Very high	94.3	Very high	127 Å²	127	50 Å²	50	48%	0.479	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-47.1	-179.2	-177.4	-172.6	-65.4	175.5	-0.5	111.3	E470 E508 L509	E470-R512 IonicContact OE1-NH1 3.47Å; E470-R512 PolarHBondContact OE1-NH1 3.43Å; E470-R512 VanDerWaalsContact OE1-NH1 3.15Å; E508-R512 WeakPolarHBondContact O-CB 3.49Å; E508-R512 PolarHBondContact O-N 3Å; E508-R512 IonicContact OE1-CZ 3.16Å; E508-R512 IonicContact OE1-NH2 3.72Å; E508-R512 PolarHBondContact OE1-NH2 3.36Å; L509-R512 PolarHBondContact O-N 2.92Å
513	Y	96.4	Very high	94.5	Very high	47 Å²	47	49.6 Å²	49.6	18%	0.184	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	0.7	-178.9	-67.7	-77.7	0	0	0	113.6	E470 C473 R474 A477 L509 T511 I515	E470-Y513 HydrophobicContact CG-CE2 3.86Å; E470-Y513 WeakPolarHBondContact CG-OH 3.18Å; E470-Y513 PolarHBondContact OE1-OH 3.44Å; C473-Y513 HydrophobicContact CB-CD2 3.73Å; C473-Y513 HydrophobicContact CB-CE2 4.38Å; C473-Y513 HydrophobicContact CB-CG 4.01Å; R474-Y513 HydrophobicContact CB-CD1 4.34Å; R474-Y513 HydrophobicContact CB-CE1 3.85Å; R474-Y513 HydrophobicContact CG-CE1 3.99Å; A477-Y513 HydrophobicContact CB-CD1 4.32Å; A477-Y513 WeakPolarHBondContact CB-O 3.5Å; L509-Y513 HydrophobicContact CD2-CD2 4.26Å; L509-Y513 HydrophobicContact CD2-CE2 3.85Å; L509-Y513 WeakPolarHBondContact O-CD2 3.37Å; L509-Y513 PolarHBondContact O-N 2.99Å; T511-Y513 PolarHBondContact O-N 3.21Å; Y513-I515 VanDerWaalsContact C-N 3.25Å; Y513-I515 PolarHBondContact O-N 2.93Å
514	R	94.5	Very high	94.3	Very high	203 Å²	203	48.4 Å²	48.4	77%	0.766	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	42	178.4	-58.2	179.9	178.7	173.8	0.9	113.5	L510 T511 Q516	L510-R514 VanDerWaalsContact O-CA 3.32Å; L510-R514 WeakPolarHBondContact O-CA 3.33Å; L510-R514 PolarHBondContact O-N 2.89Å; T511-R514 PolarHBondContact O-N 3.43Å; R514-Q516 PolarHBondContact O-N 2.89Å
515	I	95.9	Very high	93.5	Very high	17 Å²	17	47.8 Å²	47.8	9%	0.087	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.1	125.7	-175.1	-54.8	-55.6	0	0	0	110	C473 L476 A477 L510 Y513 L520	C473-I515 HydrophobicContact CB-CD1 4.01Å; C473-I515 HydrophobicContact CB-CG1 4.2Å; C473-I515 WeakPolarHBondContact O-CD1 3.4Å; L476-I515 HydrophobicContact CB-CD1 3.89Å; L476-I515 HydrophobicContact CD1-CG2 4.09Å; A477-I515 HydrophobicContact CB-CD1 4.3Å; L510-I515 HydrophobicContact CD2-CB 3.83Å; L510-I515 HydrophobicContact CD2-CG1 4.1Å; L510-I515 HydrophobicContact CD2-CG2 4.06Å; L510-I515 PolarHBondContact O-N 3.5Å; Y513-I515 VanDerWaalsContact C-N 3.25Å; Y513-I515 PolarHBondContact O-N 2.93Å; I515-L520 HydrophobicContact CG2-CB 4.39Å
516	Q	95.4	Very high	92.2	Very high	92 Å²	92	47.5 Å²	47.5	43%	0.43	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-66.1	138.9	176.9	-64.4	-59.4	-51.3	0	0	112	Q480 M485 R514 G518 T519	Q480-Q516 HydrophobicContact CG-CG 4.37Å; Q480-Q516 VanDerWaalsContact OE1-N 3.11Å; M485-Q516 HydrophobicContact CE-CB 3.67Å; M485-Q516 HydrophobicContact CE-CG 3.82Å; M485-Q516 HydrophobicContact SD-CB 4.46Å; M485-Q516 HydrophobicContact SD-CG 4.18Å; R514-Q516 PolarHBondContact O-N 2.89Å; Q516-G518 PolarHBondContact O-N 3.38Å; Q516-T519 HydrophobicContact CB-CG2 4.13Å; Q516-T519 PolarHBondContact O-N 3.42Å; Q516-T519 PolarHBondContact O-OG1 3Å
517	P	94.1	Very high	90.1	Very high	91 Å²	91	48.9 Å²	48.9	59%	0.591	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	136.1	173.7	-29.7	37.3	0	0	0	112.9
518	G	92.6	Very high	87.9	Confident	22 Å²	22	55.9 Å²	55.9	23%	0.227	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	-12.1	176	0	0	0	0	0	115.5	Q516 G547 R549	Q516-G518 PolarHBondContact O-N 3.38Å; G518-G547 PolarHBondContact N-O 2.86Å; G518-R549 PolarHBondContact O-NE 2.85Å; G518-R549 PolarHBondContact O-NH2 3.19Å; G518-R549 VanDerWaalsContact O-NH2 3.11Å
519	T	95.8	Very high	85.6	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.031	27%	0.271	C	S	.	.	S	Bend	trans	-90.4	-11.9	-177.5	68.5	0	0	0	0	113.9	Q480 M485 P487 L488 Q516	Q480-T519 PolarHBondContact NE2-OG1 3.35Å; M485-T519 HydrophobicContact CE-CG2 4.13Å; P487-T519 CarbonylContact C-O 3.45Å; P487-T519 WeakPolarHBondContact CA-O 3.45Å; L488-T519 PolarHBondContact N-O 2.77Å; Q516-T519 HydrophobicContact CB-CG2 4.13Å; Q516-T519 PolarHBondContact O-N 3.42Å; Q516-T519 PolarHBondContact O-OG1 3Å
520	L	97.3	Very high	83.4	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.3	171.8	-176.4	69	0	0	0	109.6	L476 V490 M506 L510 I515 L522 V548 R549	L476-L520 HydrophobicContact CD1-CB 3.95Å; L476-L520 HydrophobicContact CD1-CD1 3.93Å; V490-L520 HydrophobicContact CG2-CD1 3.69Å; M506-L520 HydrophobicContact CE-CD2 3.06Å; L510-L520 HydrophobicContact CD2-CD2 3.99Å; I515-L520 HydrophobicContact CG2-CB 4.39Å; L520-L522 HydrophobicContact CD2-CD2 4.34Å; L520-L522 HydrophobicContact CG-CD2 4.47Å; L520-V548 HydrophobicContact CD2-CG1 4.45Å; L520-V548 HydrophobicContact CD2-CG2 4.48Å; L520-V548 HydrophobicContact CG-CG1 4.48Å; L520-R549 PolarHBondContact O-N 3.42Å
521	I	96.4	Very high	81.4	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.3	176.9	-44.4	179.6	0	0	0	107.2	P487 L488 S489 V490 R549 A551	P487-I521 HydrophobicContact CB-CD1 4.06Å; P487-I521 HydrophobicContact CB-CG1 4.32Å; L488-I521 PolarHBondContact O-N 2.91Å; S489-I521 CarbonylContact C-O 3.57Å; S489-I521 WeakPolarHBondContact CA-O 3.27Å; V490-I521 PolarHBondContact N-O 2.86Å; I521-R549 CarbonylContact C-O 3.58Å; I521-R549 VanDerWaalsContact CA-O 3.31Å; I521-R549 WeakPolarHBondContact CA-O 3.31Å; I521-R549 HydrophobicContact CB-CB 4.41Å; I521-R549 HydrophobicContact CG1-CB 4.13Å; I521-R549 HydrophobicContact CG2-CB 4.2Å; I521-A551 HydrophobicContact CG2-CB 3.64Å
522	L	94.2	Very high	79.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.5	173.8	-63.2	176.2	0	0	0	109	L469 L492 L520 L543 V548 R549 A551	L469-L522 HydrophobicContact CD2-CD2 3.63Å; L492-L522 HydrophobicContact CD2-CB 4.45Å; L492-L522 HydrophobicContact CD2-CD1 4.21Å; L520-L522 HydrophobicContact CD2-CD2 4.34Å; L520-L522 HydrophobicContact CG-CD2 4.47Å; L522-L543 HydrophobicContact CD1-CD1 3.93Å; L522-V548 HydrophobicContact CB-CG1 4.44Å; L522-V548 HydrophobicContact CD1-CG1 3.65Å; L522-V548 HydrophobicContact CG-CG1 3.61Å; L522-R549 PolarHBondContact N-O 2.63Å; L522-A551 PolarHBondContact O-N 3.03Å
523	E	92.1	Very high	78.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	113.5	177.5	-61.3	-170.1	163.3	0	0	108.9	S489 V490 L492 A551 D553 K577	S489-E523 VanDerWaalsContact CB-CD 3.46Å; S489-E523 WeakPolarHBondContact CB-OE1 3.37Å; S489-E523 PolarHBondContact OG-OE1 3.07Å; V490-E523 PolarHBondContact O-N 3.39Å; L492-E523 WeakPolarHBondContact CA-O 3.5Å; L492-E523 PolarHBondContact N-O 3.16Å; E523-A551 WeakPolarHBondContact CA-O 3.36Å; E523-A551 HydrophobicContact CB-CB 4.46Å; E523-A551 HydrophobicContact CG-CB 3.84Å; E523-D553 HydrophobicContact CB-CB 4.38Å; E523-K577 VanDerWaalsContact CD-CD 3.42Å; E523-K577 VanDerWaalsContact CD-CE 3.4Å; E523-K577 VanDerWaalsContact CD-NZ 3.28Å; E523-K577 HydrophobicContact CG-CD 4.17Å; E523-K577 VanDerWaalsContact OE1-CD 3.23Å; E523-K577 WeakPolarHBondContact OE1-CD 3.37Å; E523-K577 WeakPolarHBondContact OE1-CE 3.46Å; E523-K577 IonicContact OE1-NZ 2.94Å; E523-K577 PolarHBondContact OE1-NZ 3.15Å; E523-K577 WeakPolarHBondContact OE2-CE 3.32Å; E523-K577 IonicContact OE2-NZ 3.32Å; E523-K577 PolarHBondContact OE2-NZ 3.26Å
524	V	85.8	Confident	77	Confident	9 Å²	9	64.6 Å²	64.6	6%	0.055	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.2	178.5	-174.2	0	0	0	0	107.5	L492 L497 L540 V550 A551 D553	L492-V524 HydrophobicContact CD2-CG2 4.35Å; L497-V524 HydrophobicContact CD2-CG1 4.11Å; V524-L540 HydrophobicContact CG2-CD2 4.46Å; V524-V550 HydrophobicContact CG2-CG1 4.27Å; V524-A551 PolarHBondContact N-O 2.87Å; V524-D553 PolarHBondContact O-N 3.16Å
525	T	73.8	Confident	76	Confident	46 Å²	46	56.2 Å²	56.2	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	147.7	174.6	51.7	0	0	0	0	111	S527 D553	T525-S527 VanDerWaalsContact C-N 3.28Å; T525-S527 PolarHBondContact O-N 3.42Å; T525-D553 HydrophobicContact CG2-CB 4.28Å
526	E	65	Low	74.9	Confident	41 Å²	41	55.4 Å²	55.4	19%	0.192	28%	0.28	C	S	.	.			trans	-60	88	174.4	-167.6	-174.8	170	0	0	110.5	R528 D553 G556 G558	E526-R528 PolarHBondContact O-N 3.26Å; E526-D553 PolarHBondContact N-O 2.82Å; E526-G556 PolarHBondContact OE2-N 2.82Å; E526-G558 PolarHBondContact OE2-N 3.14Å
527	S	50.5	Low	74	Confident	31 Å²	31	51.6 Å²	51.6	22%	0.217	26%	0.263	C	S	.	.			trans	-74.2	123.7	-166	67.7	0	0	0	0	111.9	T525 R529 I530	T525-S527 VanDerWaalsContact C-N 3.28Å; T525-S527 PolarHBondContact O-N 3.42Å; S527-R529 PolarHBondContact O-N 3.49Å; S527-I530 VanDerWaalsContact OG-CB 3.31Å; S527-I530 WeakPolarHBondContact OG-CB 3.28Å; S527-I530 WeakPolarHBondContact OG-CD1 3.41Å; S527-I530 WeakPolarHBondContact OG-CG1 3.49Å; S527-I530 PolarHBondContact OG-N 3.35Å
528	R	46.2	Very low	73.4	Confident	209 Å²	209	50.4 Å²	50.4	79%	0.789	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-5.1	164.1	-75.1	-177.5	179.5	142	2.5	114	E526	E526-R528 PolarHBondContact O-N 3.26Å
529	R	47.6	Very low	73	Confident	157 Å²	157	50.7 Å²	50.7	59%	0.592	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	-4	-166.9	-72.7	-165	-179	139.4	0.1	116.3	E456 S527 D531	E456-R529 IonicContact OE1-CZ 3.74Å; E456-R529 IonicContact OE1-NH1 3.85Å; E456-R529 PolarHBondContact OE1-NH1 3.27Å; S527-R529 PolarHBondContact O-N 3.49Å; R529-D531 PolarHBondContact O-N 2.99Å
530	I	50.7	Low	72.5	Confident	39 Å²	39	50.7 Å²	50.7	20%	0.2	26%	0.256	C	S	.	.			trans	-75.9	81.1	165.5	-65.8	164.8	0	0	0	106.7	L497 S527 D532 A536	L497-I530 HydrophobicContact CD2-CD1 4.11Å; S527-I530 VanDerWaalsContact OG-CB 3.31Å; S527-I530 WeakPolarHBondContact OG-CB 3.28Å; S527-I530 WeakPolarHBondContact OG-CD1 3.41Å; S527-I530 WeakPolarHBondContact OG-CG1 3.49Å; S527-I530 PolarHBondContact OG-N 3.35Å; I530-D532 VanDerWaalsContact CG2-C 3.46Å; I530-D532 WeakPolarHBondContact CG2-O 3.34Å; I530-D532 PolarHBondContact O-N 2.98Å; I530-A536 HydrophobicContact CD1-CB 3.88Å; I530-A536 HydrophobicContact CG1-CB 4.47Å; I530-A536 HydrophobicContact CG2-CB 3.89Å
531	D	52.4	Low	71.9	Confident	157 Å²	157	57.5 Å²	57.5	84%	0.84	28%	0.282	S	S	*	.	S	Bend	trans	-63.1	-24.1	173	-73.4	-29.7	0	0	0	111.1	R529	R529-D531 PolarHBondContact O-N 2.99Å
532	D	61.9	Low	71.6	Confident	79 Å²	79	59.6 Å²	59.6	42%	0.422	30%	0.296	S	S	.	.			trans	-123	98.1	177.2	-175.2	9.6	0	0	0	112.7	I530 H534 A535	I530-D532 VanDerWaalsContact CG2-C 3.46Å; I530-D532 WeakPolarHBondContact CG2-O 3.34Å; I530-D532 PolarHBondContact O-N 2.98Å; D532-H534 PolarHBondContact O-N 2.83Å; D532-H534 VanDerWaalsContact O-N 3.15Å; D532-H534 VanDerWaalsContact OD1-CB 3.26Å; D532-H534 WeakPolarHBondContact OD1-CB 3.34Å; D532-H534 IonicContact OD1-CD2 3.79Å; D532-H534 IonicContact OD1-CG 3.43Å; D532-H534 PolarHBondContact OD1-N 2.81Å; D532-A535 HydrophobicContact CB-CB 4.18Å; D532-A535 WeakPolarHBondContact O-CB 3.25Å; D532-A535 PolarHBondContact O-N 3.15Å; D532-A535 VanDerWaalsContact O-N 3.13Å
533	P	63.8	Low	71.4	Confident	27 Å²	27	59.6 Å²	59.6	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-55.8	-28.8	173.7	-23.6	32.5	0	0	0	113.5	A535 A536 V537 H567	P533-A535 VanDerWaalsContact C-N 3.35Å; P533-A536 PolarHBondContact O-N 2.86Å; P533-V537 WeakPolarHBondContact O-CG2 3.4Å; P533-V537 PolarHBondContact O-N 2.96Å; P533-H567 HydrophobicContact CB-CB 4.1Å; P533-H567 HydrophobicContact CG-CB 4.18Å
534	H	71.3	Confident	71.2	Confident	128 Å²	128	65.1 Å²	65.1	59%	0.593	32%	0.317	S	S	*	.	H	α-helix	trans	-69	-34.3	179.8	-65.8	-69.9	0	0	0	112.2	D532 V537 A538	D532-H534 PolarHBondContact O-N 2.83Å; D532-H534 VanDerWaalsContact O-N 3.15Å; D532-H534 VanDerWaalsContact OD1-CB 3.26Å; D532-H534 WeakPolarHBondContact OD1-CB 3.34Å; D532-H534 IonicContact OD1-CD2 3.79Å; D532-H534 IonicContact OD1-CG 3.43Å; D532-H534 PolarHBondContact OD1-N 2.81Å; H534-V537 PolarHBondContact O-N 2.83Å; H534-A538 WeakPolarHBondContact O-CB 3.39Å; H534-A538 PolarHBondContact O-N 3.04Å
535	A	73.4	Confident	71.4	Confident	26 Å²	26	71 Å²	71	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-44.8	174.7	0	0	0	0	0	111.2	M498 D532 P533 V537 A538 I539	M498-A535 HydrophobicContact CE-CB 4.02Å; M498-A535 HydrophobicContact SD-CB 4.48Å; D532-A535 HydrophobicContact CB-CB 4.18Å; D532-A535 WeakPolarHBondContact O-CB 3.25Å; D532-A535 PolarHBondContact O-N 3.15Å; D532-A535 VanDerWaalsContact O-N 3.13Å; P533-A535 VanDerWaalsContact C-N 3.35Å; A535-V537 PolarHBondContact O-N 3.47Å; A535-A538 WeakPolarHBondContact O-CB 3.23Å; A535-A538 PolarHBondContact O-N 3.36Å; A535-I539 WeakPolarHBondContact O-CD1 3.29Å; A535-I539 WeakPolarHBondContact O-CG1 3.34Å; A535-I539 PolarHBondContact O-N 3.43Å; A535-I539 VanDerWaalsContact O-N 3.1Å
536	A	72.7	Confident	72.2	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-62.7	-43.5	176.3	0	0	0	0	0	112.1	L497 I530 P533 A538 I539 L540 L571	L497-A536 HydrophobicContact CD2-CB 4.47Å; I530-A536 HydrophobicContact CD1-CB 3.88Å; I530-A536 HydrophobicContact CG1-CB 4.47Å; I530-A536 HydrophobicContact CG2-CB 3.89Å; P533-A536 PolarHBondContact O-N 2.86Å; A536-A538 VanDerWaalsContact C-N 3.29Å; A536-A538 PolarHBondContact O-N 3.22Å; A536-I539 PolarHBondContact O-N 2.81Å; A536-L540 WeakPolarHBondContact O-CB 3.39Å; A536-L540 VanDerWaalsContact O-CG 3.3Å; A536-L540 WeakPolarHBondContact O-CG 3.4Å; A536-L540 PolarHBondContact O-N 2.85Å; A536-L571 HydrophobicContact CB-CD2 4.26Å
537	V	77.2	Confident	73.5	Confident	12 Å²	12	69.8 Å²	69.8	7%	0.073	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-39.8	174.4	173.3	0	0	0	0	111.6	P533 H534 A535 I539 R541 L571	P533-V537 WeakPolarHBondContact O-CG2 3.4Å; P533-V537 PolarHBondContact O-N 2.96Å; H534-V537 PolarHBondContact O-N 2.83Å; A535-V537 PolarHBondContact O-N 3.47Å; V537-I539 VanDerWaalsContact C-N 3.29Å; V537-I539 PolarHBondContact O-N 3.49Å; V537-R541 VanDerWaalsContact O-CB 3.25Å; V537-R541 WeakPolarHBondContact O-CB 3.5Å; V537-R541 PolarHBondContact O-N 3.29Å; V537-R541 VanDerWaalsContact O-N 3.09Å; V537-L571 HydrophobicContact CG2-CD2 3.76Å; V537-L571 HydrophobicContact CG2-CG 4.45Å
538	A	81.4	Confident	75.6	Confident	66 Å²	66	68.4 Å²	68.4	55%	0.545	34%	0.341	S	S	.	.	H	α-helix	trans	-65	-32.7	178.8	0	0	0	0	0	112.6	H534 A535 A536 P542	H534-A538 WeakPolarHBondContact O-CB 3.39Å; H534-A538 PolarHBondContact O-N 3.04Å; A535-A538 WeakPolarHBondContact O-CB 3.23Å; A535-A538 PolarHBondContact O-N 3.36Å; A536-A538 VanDerWaalsContact C-N 3.29Å; A536-A538 PolarHBondContact O-N 3.22Å; A538-P542 WeakPolarHBondContact O-CD 3.36Å; A538-P542 WeakPolarHBondContact O-CG 3.31Å
539	I	83.5	Confident	77.9	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.149	32%	0.315	C	S	.	.	H	α-helix	trans	-81.3	-43.8	178.6	-66.3	158.5	0	0	0	111.4	L497 M498 V503 A535 A536 V537 P542	L497-I539 HydrophobicContact CD1-CB 4.41Å; L497-I539 HydrophobicContact CD1-CG2 3.53Å; L497-I539 HydrophobicContact CG-CG2 4.21Å; L497-I539 WeakPolarHBondContact O-CD1 3.29Å; M498-I539 HydrophobicContact SD-CD1 3.93Å; V503-I539 HydrophobicContact CG2-CB 4.36Å; V503-I539 HydrophobicContact CG2-CG2 3.78Å; A535-I539 WeakPolarHBondContact O-CD1 3.29Å; A535-I539 WeakPolarHBondContact O-CG1 3.34Å; A535-I539 PolarHBondContact O-N 3.43Å; A535-I539 VanDerWaalsContact O-N 3.1Å; A536-I539 PolarHBondContact O-N 2.81Å; V537-I539 VanDerWaalsContact C-N 3.29Å; V537-I539 PolarHBondContact O-N 3.49Å; I539-P542 WeakPolarHBondContact O-CD 3.23Å
540	L	84.7	Confident	80	Confident	5 Å²	5	54 Å²	54	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-73.1	-31.8	-175.9	-67.9	172.6	0	0	0	113	L497 V524 A536 L543 R544 V550 L571 P572	L497-L540 HydrophobicContact CD1-CD2 3.74Å; L497-L540 HydrophobicContact CD1-CG 4.27Å; V524-L540 HydrophobicContact CG2-CD2 4.46Å; A536-L540 WeakPolarHBondContact O-CB 3.39Å; A536-L540 VanDerWaalsContact O-CG 3.3Å; A536-L540 WeakPolarHBondContact O-CG 3.4Å; A536-L540 PolarHBondContact O-N 2.85Å; L540-L543 PolarHBondContact O-N 3.48Å; L540-R544 PolarHBondContact O-N 2.9Å; L540-V550 HydrophobicContact CD1-CG1 4.32Å; L540-V550 HydrophobicContact CD2-CG1 4.23Å; L540-V550 HydrophobicContact CD2-CG2 4.05Å; L540-L571 HydrophobicContact CD1-CD2 4.34Å; L540-P572 HydrophobicContact CB-CG 3.69Å
541	R	86	Confident	81.9	Confident	145 Å²	145	52.1 Å²	52.1	55%	0.547	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-46.8	-176.5	-178.1	-176.6	-60	173.7	1.5	113.5	V537 L543 R544 N545	V537-R541 VanDerWaalsContact O-CB 3.25Å; V537-R541 WeakPolarHBondContact O-CB 3.5Å; V537-R541 PolarHBondContact O-N 3.29Å; V537-R541 VanDerWaalsContact O-N 3.09Å; R541-L543 VanDerWaalsContact C-N 3.33Å; R541-L543 PolarHBondContact O-N 2.77Å; R541-R544 PolarHBondContact O-N 2.83Å; R541-N545 VanDerWaalsContact O-CG 3.29Å; R541-N545 PolarHBondContact O-N 3.5Å
542	P	89.4	Confident	83.5	Confident	46 Å²	46	45.5 Å²	45.5	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-56.8	-42.3	172.3	-26.9	34.2	0	0	0	113.7	V503 A538 I539 R544 N545 A546	V503-P542 HydrophobicContact CG1-CB 3.73Å; V503-P542 HydrophobicContact CG1-CG 4.32Å; A538-P542 WeakPolarHBondContact O-CD 3.36Å; A538-P542 WeakPolarHBondContact O-CG 3.31Å; I539-P542 WeakPolarHBondContact O-CD 3.23Å; P542-R544 VanDerWaalsContact C-N 3.34Å; P542-R544 PolarHBondContact O-N 2.87Å; P542-N545 WeakPolarHBondContact O-CB 3.13Å; P542-N545 PolarHBondContact O-N 2.76Å; P542-A546 PolarHBondContact O-N 2.92Å
543	L	89.8	Confident	84.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-42.1	178.6	-61	-179.4	0	0	0	111.3	V503 M506 L522 L540 R541 A546 G547 V548	V503-L543 HydrophobicContact CG1-CD2 4.38Å; M506-L543 HydrophobicContact CB-CD2 3.71Å; M506-L543 HydrophobicContact CG-CD2 3.64Å; L522-L543 HydrophobicContact CD1-CD1 3.93Å; L540-L543 PolarHBondContact O-N 3.48Å; R541-L543 VanDerWaalsContact C-N 3.33Å; R541-L543 PolarHBondContact O-N 2.77Å; L543-A546 CarbonylContact O-C 3.55Å; L543-A546 WeakPolarHBondContact O-CA 3.23Å; L543-A546 WeakPolarHBondContact O-CB 3.25Å; L543-A546 PolarHBondContact O-N 2.95Å; L543-A546 VanDerWaalsContact O-N 3.11Å; L543-G547 PolarHBondContact O-N 3.23Å; L543-V548 HydrophobicContact CB-CB 4.32Å; L543-V548 WeakPolarHBondContact O-CB 3Å; L543-V548 PolarHBondContact O-N 2.89Å; L543-V548 VanDerWaalsContact O-N 3.1Å
544	R	88.8	Confident	85	Confident	116 Å²	116	43.3 Å²	43.3	44%	0.438	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-38.4	175.4	-167.3	172.7	-174.9	-84.4	2.2	113.1	L540 R541 P542 A546 G547 V548 D574	L540-R544 PolarHBondContact O-N 2.9Å; R541-R544 PolarHBondContact O-N 2.83Å; P542-R544 VanDerWaalsContact C-N 3.34Å; P542-R544 PolarHBondContact O-N 2.87Å; R544-A546 PolarHBondContact O-N 2.75Å; R544-G547 WeakPolarHBondContact O-CA 3.25Å; R544-G547 PolarHBondContact O-N 3.07Å; R544-V548 WeakPolarHBondContact CA-O 2.91Å; R544-D574 IonicContact CZ-OD1 3.91Å; R544-D574 IonicContact NE-OD1 3.34Å; R544-D574 PolarHBondContact NE-OD1 2.92Å; R544-D574 VanDerWaalsContact NE-OD1 3.16Å; R544-D574 IonicContact NE-OD2 2.73Å; R544-D574 IonicContact NH2-OD1 3.81Å; R544-D574 PolarHBondContact NH2-OD1 2.83Å
545	N	88.7	Confident	84.9	Confident	132 Å²	132	37.9 Å²	37.9	71%	0.706	20%	0.204	S	C	*	.	H	α-helix	trans	-62.6	-29.2	173.1	-71.1	-14.2	0	0	0	112.2	R541 P542 G547	R541-N545 VanDerWaalsContact O-CG 3.29Å; R541-N545 PolarHBondContact O-N 3.5Å; P542-N545 WeakPolarHBondContact O-CB 3.13Å; P542-N545 PolarHBondContact O-N 2.76Å; N545-G547 PolarHBondContact O-N 2.93Å
546	A	91.2	Very high	84.3	Confident	42 Å²	42	38.2 Å²	38.2	35%	0.347	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-0	172.1	0	0	0	0	0	113.6	L507 L510 P542 L543 R544	L507-A546 HydrophobicContact CD2-CB 3.4Å; L510-A546 HydrophobicContact CD1-CB 3.99Å; P542-A546 PolarHBondContact O-N 2.92Å; L543-A546 CarbonylContact O-C 3.55Å; L543-A546 WeakPolarHBondContact O-CA 3.23Å; L543-A546 WeakPolarHBondContact O-CB 3.25Å; L543-A546 PolarHBondContact O-N 2.95Å; L543-A546 VanDerWaalsContact O-N 3.11Å; R544-A546 PolarHBondContact O-N 2.75Å
547	G	92.4	Very high	83.5	Confident	19 Å²	19	41.9 Å²	41.9	20%	0.196	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	5.7	176.5	0	0	0	0	0	114.9	G518 L543 R544 N545	G518-G547 PolarHBondContact N-O 2.86Å; L543-G547 PolarHBondContact O-N 3.23Å; R544-G547 WeakPolarHBondContact O-CA 3.25Å; R544-G547 PolarHBondContact O-N 3.07Å; N545-G547 PolarHBondContact O-N 2.93Å
548	V	94.7	Very high	82.2	Confident	3 Å²	3	42 Å²	42	2%	0.018	23%	0.231	C	C	.	.			trans	-75	134.6	175	-177.3	0	0	0	0	109.9	L510 L520 L522 L543 R544	L510-V548 HydrophobicContact CD1-CG2 3.45Å; L510-V548 VanDerWaalsContact CD1-CG2 3.45Å; L510-V548 HydrophobicContact CD2-CG2 4.01Å; L510-V548 HydrophobicContact CG-CG2 4.34Å; L520-V548 HydrophobicContact CD2-CG1 4.45Å; L520-V548 HydrophobicContact CD2-CG2 4.48Å; L520-V548 HydrophobicContact CG-CG1 4.48Å; L522-V548 HydrophobicContact CB-CG1 4.44Å; L522-V548 HydrophobicContact CD1-CG1 3.65Å; L522-V548 HydrophobicContact CG-CG1 3.61Å; L543-V548 HydrophobicContact CB-CB 4.32Å; L543-V548 WeakPolarHBondContact O-CB 3Å; L543-V548 PolarHBondContact O-N 2.89Å; L543-V548 VanDerWaalsContact O-N 3.1Å; R544-V548 WeakPolarHBondContact CA-O 2.91Å
549	R	94.2	Very high	80.3	Confident	60 Å²	60	49.5 Å²	49.5	23%	0.226	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	151.4	171.7	-70	-165	-73.4	169.7	-2.4	110.6	P487 G518 L520 I521 L522 D574	P487-R549 VanDerWaalsContact CG-NH2 3.34Å; G518-R549 PolarHBondContact O-NE 2.85Å; G518-R549 PolarHBondContact O-NH2 3.19Å; G518-R549 VanDerWaalsContact O-NH2 3.11Å; L520-R549 PolarHBondContact O-N 3.42Å; I521-R549 CarbonylContact C-O 3.58Å; I521-R549 VanDerWaalsContact CA-O 3.31Å; I521-R549 WeakPolarHBondContact CA-O 3.31Å; I521-R549 HydrophobicContact CB-CB 4.41Å; I521-R549 HydrophobicContact CG1-CB 4.13Å; I521-R549 HydrophobicContact CG2-CB 4.2Å; L522-R549 PolarHBondContact N-O 2.63Å; R549-D574 WeakPolarHBondContact CA-OD2 3.36Å; R549-D574 HydrophobicContact CB-CB 4.45Å
550	V	91.2	Very high	78.5	Confident	2 Å²	2	50 Å²	50	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.6	178.7	-176.2	0	0	0	0	109.5	V524 L540 I573 D574 V575	V524-V550 HydrophobicContact CG2-CG1 4.27Å; L540-V550 HydrophobicContact CD1-CG1 4.32Å; L540-V550 HydrophobicContact CD2-CG1 4.23Å; L540-V550 HydrophobicContact CD2-CG2 4.05Å; V550-I573 HydrophobicContact CG1-CG1 4.43Å; V550-D574 PolarHBondContact N-OD2 3.41Å; V550-D574 PolarHBondContact O-N 2.88Å; V550-V575 PolarHBondContact O-N 3.11Å; V550-V575 VanDerWaalsContact O-N 3.15Å
551	A	90.3	Very high	76.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.6	173.1	0	0	0	0	0	109.5	I521 L522 E523 V524 V575	I521-A551 HydrophobicContact CG2-CB 3.64Å; L522-A551 PolarHBondContact O-N 3.03Å; E523-A551 WeakPolarHBondContact CA-O 3.36Å; E523-A551 HydrophobicContact CB-CB 4.46Å; E523-A551 HydrophobicContact CG-CB 3.84Å; V524-A551 PolarHBondContact N-O 2.87Å; A551-V575 CarbonylContact C-O 3.58Å; A551-V575 VanDerWaalsContact CA-O 3.27Å; A551-V575 WeakPolarHBondContact CA-O 3.42Å; A551-V575 HydrophobicContact CB-CB 3.84Å; A551-V575 HydrophobicContact CB-CG1 4.28Å
552	L	86.6	Confident	75	Confident	18 Å²	18	51.7 Å²	51.7	9%	0.094	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.9	170.3	-174	69.3	0	0	0	108.6	F555 M568 I573 V575 K577	L552-F555 HydrophobicContact CD2-CB 4.47Å; L552-F555 HydrophobicContact CD2-CD2 3.53Å; L552-F555 HydrophobicContact CD2-CE2 4.19Å; L552-F555 HydrophobicContact CD2-CG 4.33Å; L552-F555 HydrophobicContact CG-CD2 4.49Å; L552-M568 HydrophobicContact CD2-SD 3.84Å; L552-I573 HydrophobicContact CB-CD1 4.1Å; L552-I573 HydrophobicContact CB-CG2 4.07Å; L552-I573 HydrophobicContact CD1-CD1 4.43Å; L552-I573 HydrophobicContact CD2-CD1 4.13Å; L552-I573 HydrophobicContact CG-CD1 4.48Å; L552-V575 PolarHBondContact N-O 2.74Å; L552-K577 PolarHBondContact O-N 2.97Å
553	D	85.4	Confident	73	Confident	9 Å²	9	59.2 Å²	59.2	5%	0.048	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	158.1	-177.6	-161.8	12.4	0	0	0	112.1	E523 V524 T525 E526 F555 K577 E610	E523-D553 HydrophobicContact CB-CB 4.38Å; V524-D553 PolarHBondContact O-N 3.16Å; T525-D553 HydrophobicContact CG2-CB 4.28Å; E526-D553 PolarHBondContact N-O 2.82Å; D553-F555 PolarHBondContact O-N 2.73Å; D553-K577 HydrophobicContact CB-CD 4.19Å; D553-K577 IonicContact OD1-NZ 4Å; D553-K577 IonicContact OD2-NZ 3.56Å; D553-E610 VanDerWaalsContact OD1-OE1 3.09Å
554	D	72.7	Confident	71.3	Confident	51 Å²	51	64.5 Å²	64.5	27%	0.273	33%	0.33	S	S	.	.	S	Bend	trans	55.4	29.5	-178.7	-77.8	-32.2	0	0	0	115.1	G556 M557	D554-G556 PolarHBondContact O-N 2.89Å; D554-G556 VanDerWaalsContact O-N 3.15Å; D554-M557 HydrophobicContact CB-CB 4.35Å; D554-M557 HydrophobicContact CB-CG 4.25Å; D554-M557 WeakPolarHBondContact O-CB 3.47Å; D554-M557 PolarHBondContact O-N 3.05Å; D554-M557 VanDerWaalsContact O-N 3.11Å
555	F	67.9	Low	69.7	Low	15 Å²	15	61.6 Å²	61.6	7%	0.066	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	120.5	-173.6	-176.9	-102.5	0	0	0	112.6	L552 D553 L565 M568 L576 F582 I596 L599	L552-F555 HydrophobicContact CD2-CB 4.47Å; L552-F555 HydrophobicContact CD2-CD2 3.53Å; L552-F555 HydrophobicContact CD2-CE2 4.19Å; L552-F555 HydrophobicContact CD2-CG 4.33Å; L552-F555 HydrophobicContact CG-CD2 4.49Å; D553-F555 PolarHBondContact O-N 2.73Å; F555-L565 HydrophobicContact CZ-CD2 4.02Å; F555-M568 HydrophobicContact CD2-SD 4.31Å; F555-M568 HydrophobicContact CE2-CE 4.37Å; F555-M568 HydrophobicContact CE2-SD 3.62Å; F555-M568 HydrophobicContact CZ-CE 4.4Å; F555-M568 HydrophobicContact CZ-SD 4.23Å; F555-L576 HydrophobicContact CB-CD2 4.46Å; F555-L576 HydrophobicContact CB-CG 4.39Å; F555-L576 HydrophobicContact CD1-CD1 4.06Å; F555-L576 HydrophobicContact CD1-CD2 4.39Å; F555-L576 HydrophobicContact CE1-CD1 4.4Å; F555-L576 HydrophobicContact CG-CD1 4.1Å; F555-L576 HydrophobicContact CG-CG 4.45Å; F555-F582 VanDerWaalsContact O-CE2 3.29Å; F555-F582 WeakPolarHBondContact O-CE2 3.49Å; F555-I596 HydrophobicContact CD1-CB 4.45Å; F555-I596 HydrophobicContact CD1-CD1 4.37Å; F555-I596 HydrophobicContact CD1-CG1 4Å; F555-I596 HydrophobicContact CD1-CG2 3.77Å; F555-I596 HydrophobicContact CE1-CG1 4.03Å; F555-I596 HydrophobicContact CE1-CG2 4.16Å; F555-L599 HydrophobicContact CE1-CD2 3.69Å; F555-L599 HydrophobicContact CE2-CD2 4.44Å; F555-L599 HydrophobicContact CZ-CD2 3.36Å
556	G	61.7	Low	68.4	Low	33 Å²	33	62.4 Å²	62.4	34%	0.34	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.5	-7.4	-179.5	0	0	0	0	0	114.6	E526 D554 G558	E526-G556 PolarHBondContact OE2-N 2.82Å; D554-G556 PolarHBondContact O-N 2.89Å; D554-G556 VanDerWaalsContact O-N 3.15Å; G556-G558 VanDerWaalsContact C-N 3.33Å
557	M	54.9	Low	67	Low	76 Å²	76	63.7 Å²	63.7	37%	0.374	32%	0.321	S	S	.	.	S	Bend	trans	-75.2	-24.8	169	-73.4	-73.7	-148.9	0	0	112.4	D554 D579 M581	D554-M557 HydrophobicContact CB-CB 4.35Å; D554-M557 HydrophobicContact CB-CG 4.25Å; D554-M557 WeakPolarHBondContact O-CB 3.47Å; D554-M557 PolarHBondContact O-N 3.05Å; D554-M557 VanDerWaalsContact O-N 3.11Å; M557-D579 WeakPolarHBondContact CE-OD1 3.4Å; M557-M581 HydrophobicContact CE-CB 4.33Å; M557-M581 HydrophobicContact CE-CE 3.21Å; M557-M581 HydrophobicContact CE-CG 3.65Å; M557-M581 HydrophobicContact CE-SD 3.53Å; M557-M581 VanDerWaalsContact CE-SD 3.53Å; M557-M581 HydrophobicContact SD-CE 3.24Å; M557-M581 WeakPolarHBondContact SD-CE 3.35Å; M557-M581 HydrophobicContact SD-SD 4.31Å
558	G	51.2	Low	65.5	Low	15 Å²	15	63.5 Å²	63.5	16%	0.155	32%	0.315	C	S	.	.	S	Bend	trans	-74.9	152.1	171.6	0	0	0	0	0	111.9	E526 G556 A560	E526-G558 PolarHBondContact OE2-N 3.14Å; G556-G558 VanDerWaalsContact C-N 3.33Å; G558-A560 PolarHBondContact O-N 2.74Å
559	Y	41.1	Very low	64	Low	223 Å²	223	71.3 Å²	71.3	88%	0.875	35%	0.349	S	S	*	.			trans	-68.3	69.9	164.3	-74.4	-84	0	0	0	109.1	G561	Y559-G561 PolarHBondContact O-N 2.86Å
560	A	45.8	Very low	62.8	Low	41 Å²	41	71.1 Å²	71.1	34%	0.339	36%	0.357	S	S	.	.			trans	-68.1	96.3	179.4	0	0	0	0	0	109.2	G558	G558-A560 PolarHBondContact O-N 2.74Å
561	G	50	Low	61.8	Low	33 Å²	33	73.1 Å²	73.1	34%	0.34	37%	0.367	S	S	.	.			trans	-69.9	155.7	166.2	0	0	0	0	0	110.4	Y559 R563 Q564 L565	Y559-G561 PolarHBondContact O-N 2.86Å; G561-R563 PolarHBondContact O-N 2.7Å; G561-Q564 PolarHBondContact O-N 3.41Å; G561-L565 PolarHBondContact O-N 2.95Å
562	L	46.3	Very low	61.1	Low	151 Å²	151	74.3 Å²	74.3	79%	0.791	38%	0.375	S	S	*	.	H	α-helix	trans	-49.4	-24.9	172.4	-81	143.4	0	0	0	114.2
563	R	48.7	Very low	61	Low	204 Å²	204	74.5 Å²	74.5	77%	0.77	38%	0.376	S	S	*	.	H	α-helix	trans	-70.4	-40.8	174	-70.6	-172.4	-160.1	167.3	6.7	113.1	G561 L565 Q566 H567	G561-R563 PolarHBondContact O-N 2.7Å; R563-L565 VanDerWaalsContact C-N 3.3Å; R563-L565 PolarHBondContact O-N 3.32Å; R563-Q566 PolarHBondContact O-N 2.91Å; R563-H567 PolarHBondContact O-CD2 3.09Å; R563-H567 PolarHBondContact O-N 3.23Å
564	Q	54.3	Low	61.2	Low	111 Å²	111	75.6 Å²	75.6	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-38.2	175.6	-96.2	110.7	1.7	0	0	111.5	G561 Q566 H567 M568	G561-Q564 PolarHBondContact O-N 3.41Å; Q564-Q566 VanDerWaalsContact C-N 3.27Å; Q564-Q566 PolarHBondContact O-N 2.87Å; Q564-H567 PolarHBondContact O-N 3.18Å; Q564-M568 PolarHBondContact O-N 3.26Å
565	L	54.7	Low	62	Low	55 Å²	55	73.3 Å²	73.3	29%	0.288	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-34.6	176.1	-68.3	174.7	0	0	0	113	F555 G561 R563 M568 L599	F555-L565 HydrophobicContact CZ-CD2 4.02Å; G561-L565 PolarHBondContact O-N 2.95Å; R563-L565 VanDerWaalsContact C-N 3.3Å; R563-L565 PolarHBondContact O-N 3.32Å; L565-M568 HydrophobicContact CD2-CE 4.35Å; L565-M568 PolarHBondContact O-N 2.82Å; L565-L599 HydrophobicContact CD2-CD1 4.41Å; L565-L599 HydrophobicContact CD2-CD2 3.59Å
566	Q	61	Low	63.1	Low	149 Å²	149	72.6 Å²	72.6	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-67.7	-39.4	173.8	-74.1	-171.5	-17.8	0	0	112.1	R563 Q564 M568 K569	R563-Q566 PolarHBondContact O-N 2.91Å; Q564-Q566 VanDerWaalsContact C-N 3.27Å; Q564-Q566 PolarHBondContact O-N 2.87Å; Q566-M568 VanDerWaalsContact C-N 3.3Å; Q566-M568 PolarHBondContact O-N 3.41Å; Q566-K569 PolarHBondContact O-N 2.82Å
567	H	62.3	Low	64.5	Low	70 Å²	70	71 Å²	71	32%	0.324	35%	0.35	S	S	.	.	H	α-helix	trans	-69.5	-29.1	177.4	-64.9	-59.7	0	0	0	112.3	P533 R563 Q564 K569 S570 L571	P533-H567 HydrophobicContact CB-CB 4.1Å; P533-H567 HydrophobicContact CG-CB 4.18Å; R563-H567 PolarHBondContact O-CD2 3.09Å; R563-H567 PolarHBondContact O-N 3.23Å; Q564-H567 PolarHBondContact O-N 3.18Å; H567-K569 PolarHBondContact O-N 2.9Å; H567-S570 WeakPolarHBondContact O-CA 2.77Å; H567-S570 WeakPolarHBondContact O-CB 3.29Å; H567-S570 PolarHBondContact O-N 2.76Å; H567-S570 PolarHBondContact O-OG 2.94Å; H567-L571 PolarHBondContact O-N 3.36Å
568	M	61.3	Low	66.2	Low	15 Å²	15	67.4 Å²	67.4	7%	0.074	33%	0.332	C	S	.	.	H	α-helix	trans	-59.8	-32.9	176.6	-160.1	175.2	67	0	0	112.7	L552 F555 Q564 L565 Q566 S570 L571 I573 L599 L603	L552-M568 HydrophobicContact CD2-SD 3.84Å; F555-M568 HydrophobicContact CD2-SD 4.31Å; F555-M568 HydrophobicContact CE2-CE 4.37Å; F555-M568 HydrophobicContact CE2-SD 3.62Å; F555-M568 HydrophobicContact CZ-CE 4.4Å; F555-M568 HydrophobicContact CZ-SD 4.23Å; Q564-M568 PolarHBondContact O-N 3.26Å; L565-M568 HydrophobicContact CD2-CE 4.35Å; L565-M568 PolarHBondContact O-N 2.82Å; Q566-M568 VanDerWaalsContact C-N 3.3Å; Q566-M568 PolarHBondContact O-N 3.41Å; M568-S570 PolarHBondContact O-N 3.15Å; M568-S570 VanDerWaalsContact O-N 3.14Å; M568-L571 PolarHBondContact O-N 2.72Å; M568-L571 VanDerWaalsContact O-N 3.15Å; M568-I573 HydrophobicContact CG-CD1 4.07Å; M568-L599 HydrophobicContact CE-CD1 4.3Å; M568-L599 HydrophobicContact CE-CD2 3.6Å; M568-L599 HydrophobicContact CE-CG 3.96Å; M568-L603 HydrophobicContact CE-CD1 3.24Å
569	K	62.6	Low	67.9	Low	167 Å²	167	67 Å²	67	73%	0.726	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.3	171.5	-71.9	-169.7	175.3	-173.2	0	113.9	Q566 H567 L603	Q566-K569 PolarHBondContact O-N 2.82Å; H567-K569 PolarHBondContact O-N 2.9Å; K569-L603 HydrophobicContact CD-CD2 4.48Å; K569-L603 HydrophobicContact CG-CD2 3.79Å
570	S	68.4	Low	70.2	Confident	56 Å²	56	61.6 Å²	61.6	39%	0.392	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-18.1	180	73.3	0	0	0	0	113.5	H567 M568	H567-S570 WeakPolarHBondContact O-CA 2.77Å; H567-S570 WeakPolarHBondContact O-CB 3.29Å; H567-S570 PolarHBondContact O-N 2.76Å; H567-S570 PolarHBondContact O-OG 2.94Å; M568-S570 PolarHBondContact O-N 3.15Å; M568-S570 VanDerWaalsContact O-N 3.14Å
571	L	70.9	Confident	72.1	Confident	43 Å²	43	64.5 Å²	64.5	23%	0.225	32%	0.316	C	S	.	.	S	Bend	trans	-72.3	130	175.8	-72.7	170.3	0	0	0	109	A536 V537 L540 H567 M568 I573	A536-L571 HydrophobicContact CB-CD2 4.26Å; V537-L571 HydrophobicContact CG2-CD2 3.76Å; V537-L571 HydrophobicContact CG2-CG 4.45Å; L540-L571 HydrophobicContact CD1-CD2 4.34Å; H567-L571 PolarHBondContact O-N 3.36Å; M568-L571 PolarHBondContact O-N 2.72Å; M568-L571 VanDerWaalsContact O-N 3.15Å; L571-I573 HydrophobicContact CB-CD1 3.53Å; L571-I573 HydrophobicContact CB-CG1 3.83Å; L571-I573 HydrophobicContact CD1-CD1 3.94Å; L571-I573 HydrophobicContact CG-CD1 4.38Å; L571-I573 PolarHBondContact O-N 3.15Å
572	P	76	Confident	73.9	Confident	26 Å²	26	64.1 Å²	64.1	17%	0.169	30%	0.304	C	S	.	.			trans	-79	66.6	-179.5	34.9	-36.8	0	0	0	110.6	L540	L540-P572 HydrophobicContact CB-CG 3.69Å
573	I	83.7	Confident	75.9	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.108	27%	0.267	C	S	.	.			trans	-96	139.1	-178.4	-61.3	159.5	0	0	0	109.5	V550 L552 M568 L571 V575 L605	V550-I573 HydrophobicContact CG1-CG1 4.43Å; L552-I573 HydrophobicContact CB-CD1 4.1Å; L552-I573 HydrophobicContact CB-CG2 4.07Å; L552-I573 HydrophobicContact CD1-CD1 4.43Å; L552-I573 HydrophobicContact CD2-CD1 4.13Å; L552-I573 HydrophobicContact CG-CD1 4.48Å; M568-I573 HydrophobicContact CG-CD1 4.07Å; L571-I573 HydrophobicContact CB-CD1 3.53Å; L571-I573 HydrophobicContact CB-CG1 3.83Å; L571-I573 HydrophobicContact CD1-CD1 3.94Å; L571-I573 HydrophobicContact CG-CD1 4.38Å; L571-I573 PolarHBondContact O-N 3.15Å; I573-V575 WeakPolarHBondContact CG2-O 3.24Å; I573-L605 HydrophobicContact CG2-CD2 4.37Å; I573-L605 VanDerWaalsContact O-CD2 3.23Å; I573-L605 WeakPolarHBondContact O-CD2 3.47Å
574	D	89.1	Confident	77.8	Confident	33 Å²	33	52.8 Å²	52.8	18%	0.176	26%	0.256	C	S	.	.			trans	-109.6	-30.2	178.1	-50.6	-73	0	0	0	112.1	R544 R549 V550 Q606	R544-D574 IonicContact CZ-OD1 3.91Å; R544-D574 IonicContact NE-OD1 3.34Å; R544-D574 PolarHBondContact NE-OD1 2.92Å; R544-D574 VanDerWaalsContact NE-OD1 3.16Å; R544-D574 IonicContact NE-OD2 2.73Å; R544-D574 IonicContact NH2-OD1 3.81Å; R544-D574 PolarHBondContact NH2-OD1 2.83Å; R549-D574 WeakPolarHBondContact CA-OD2 3.36Å; R549-D574 HydrophobicContact CB-CB 4.45Å; V550-D574 PolarHBondContact N-OD2 3.41Å; V550-D574 PolarHBondContact O-N 2.88Å; D574-Q606 PolarHBondContact O-N 3.11Å; D574-Q606 VanDerWaalsContact O-N 3.16Å
575	V	90.9	Very high	79.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	140.5	-175.5	-175.6	0	0	0	0	110.8	V550 A551 L552 I573 Q606 I608	V550-V575 PolarHBondContact O-N 3.11Å; V550-V575 VanDerWaalsContact O-N 3.15Å; A551-V575 CarbonylContact C-O 3.58Å; A551-V575 VanDerWaalsContact CA-O 3.27Å; A551-V575 WeakPolarHBondContact CA-O 3.42Å; A551-V575 HydrophobicContact CB-CB 3.84Å; A551-V575 HydrophobicContact CB-CG1 4.28Å; L552-V575 PolarHBondContact N-O 2.74Å; I573-V575 WeakPolarHBondContact CG2-O 3.24Å; V575-Q606 CarbonylContact C-O 3.57Å; V575-Q606 VanDerWaalsContact CA-O 3.31Å; V575-Q606 WeakPolarHBondContact CA-O 3.33Å; V575-Q606 HydrophobicContact CG2-CB 4.31Å; V575-I608 HydrophobicContact CG1-CD1 3.65Å; V575-I608 HydrophobicContact CG1-CG1 3.81Å
576	L	90.3	Very high	80.9	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.2	170.9	-173.6	147.9	0	0	0	108.9	F555 I578 I596 A600 L605 Q606 M607 I608	F555-L576 HydrophobicContact CB-CD2 4.46Å; F555-L576 HydrophobicContact CB-CG 4.39Å; F555-L576 HydrophobicContact CD1-CD1 4.06Å; F555-L576 HydrophobicContact CD1-CD2 4.39Å; F555-L576 HydrophobicContact CE1-CD1 4.4Å; F555-L576 HydrophobicContact CG-CD1 4.1Å; F555-L576 HydrophobicContact CG-CG 4.45Å; L576-I578 HydrophobicContact CD2-CG1 3.98Å; L576-I596 HydrophobicContact CD2-CG2 3.63Å; L576-A600 HydrophobicContact CD1-CB 4.28Å; L576-L605 HydrophobicContact CB-CB 4.42Å; L576-L605 HydrophobicContact CB-CD1 4.22Å; L576-L605 HydrophobicContact CD1-CD1 4.2Å; L576-Q606 PolarHBondContact N-O 3.42Å; L576-M607 WeakPolarHBondContact O-CA 3.49Å; L576-I608 PolarHBondContact O-N 2.95Å
577	K	90.9	Very high	81.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.7	172.8	-58	175.9	92.6	-151.2	0	109.9	E433 E523 L552 D553 I608 E610	E433-K577 IonicContact OE1-NZ 2.72Å; E433-K577 PolarHBondContact OE1-NZ 3.42Å; E433-K577 IonicContact OE2-NZ 3.36Å; E433-K577 PolarHBondContact OE2-NZ 2.93Å; E523-K577 VanDerWaalsContact CD-CD 3.42Å; E523-K577 VanDerWaalsContact CD-CE 3.4Å; E523-K577 VanDerWaalsContact CD-NZ 3.28Å; E523-K577 HydrophobicContact CG-CD 4.17Å; E523-K577 VanDerWaalsContact OE1-CD 3.23Å; E523-K577 WeakPolarHBondContact OE1-CD 3.37Å; E523-K577 WeakPolarHBondContact OE1-CE 3.46Å; E523-K577 IonicContact OE1-NZ 2.94Å; E523-K577 PolarHBondContact OE1-NZ 3.15Å; E523-K577 WeakPolarHBondContact OE2-CE 3.32Å; E523-K577 IonicContact OE2-NZ 3.32Å; E523-K577 PolarHBondContact OE2-NZ 3.26Å; L552-K577 PolarHBondContact O-N 2.97Å; D553-K577 HydrophobicContact CB-CD 4.19Å; D553-K577 IonicContact OD1-NZ 4Å; D553-K577 IonicContact OD2-NZ 3.56Å; K577-I608 CarbonylContact C-O 3.51Å; K577-I608 WeakPolarHBondContact CA-O 3.31Å; K577-I608 HydrophobicContact CG-CB 4.34Å; K577-E610 VanDerWaalsContact CB-OE1 3.25Å; K577-E610 WeakPolarHBondContact CB-OE1 3.46Å; K577-E610 VanDerWaalsContact CD-OE1 3.25Å; K577-E610 WeakPolarHBondContact CD-OE1 3.44Å; K577-E610 WeakPolarHBondContact CE-OE1 3.29Å; K577-E610 IonicContact NZ-OE1 3.76Å; K577-E610 PolarHBondContact NZ-OE1 2.93Å
578	I	89.9	Confident	82.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.1	177	-53.7	173.2	0	0	0	106.8	L576 F582 V583 I593 I596 I597 I608 E610 V626	L576-I578 HydrophobicContact CD2-CG1 3.98Å; I578-F582 HydrophobicContact CG2-CB 4.11Å; I578-V583 HydrophobicContact CG2-CG2 4.31Å; I578-I593 HydrophobicContact CD1-CG1 4.5Å; I578-I593 HydrophobicContact CG2-CD1 3.77Å; I578-I593 HydrophobicContact CG2-CG1 4.07Å; I578-I596 HydrophobicContact CG1-CG2 4.07Å; I578-I597 HydrophobicContact CD1-CG1 3.98Å; I578-I608 PolarHBondContact N-O 3.44Å; I578-E610 WeakPolarHBondContact O-CB 3.26Å; I578-E610 PolarHBondContact O-N 2.97Å; I578-V626 HydrophobicContact CD1-CG2 4.15Å
579	D	88.4	Confident	84	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.043	27%	0.267	C	S	.	.			trans	-58.9	149.6	-178.6	172.4	-99	0	0	0	112.7	M557 M581 F582	M557-D579 WeakPolarHBondContact CE-OD1 3.4Å; D579-M581 PolarHBondContact O-N 3.38Å; D579-M581 WeakPolarHBondContact OD1-CB 3.47Å; D579-M581 WeakPolarHBondContact OD1-CG 3.45Å; D579-M581 PolarHBondContact OD1-N 3.06Å; D579-F582 HydrophobicContact CB-CD2 4.15Å; D579-F582 HydrophobicContact CB-CE2 4.41Å; D579-F582 PolarHBondContact O-N 3.04Å; D579-F582 VanDerWaalsContact O-N 3.14Å
580	K	88.3	Confident	85.1	Confident	108 Å²	108	41.3 Å²	41.3	47%	0.47	25%	0.247	S	C	.	.	H	α-helix	trans	-55.5	-33.3	-178.2	67.8	178.2	-178.3	178.3	0	113.6	F582 V583 E584	K580-F582 PolarHBondContact O-N 3.22Å; K580-V583 CarbonylContact O-C 3.58Å; K580-V583 WeakPolarHBondContact O-CA 3.28Å; K580-V583 PolarHBondContact O-N 3.23Å; K580-E584 WeakPolarHBondContact O-CG 3.42Å; K580-E584 PolarHBondContact O-N 2.85Å
581	M	86.7	Confident	85.9	Confident	103 Å²	103	42.5 Å²	42.5	51%	0.507	26%	0.255	S	S	.	.	H	α-helix	trans	-63	-30.4	-177.8	-67.3	-152.8	-38	0	0	112	M557 D579	M557-M581 HydrophobicContact CE-CB 4.33Å; M557-M581 HydrophobicContact CE-CE 3.21Å; M557-M581 HydrophobicContact CE-CG 3.65Å; M557-M581 HydrophobicContact CE-SD 3.53Å; M557-M581 VanDerWaalsContact CE-SD 3.53Å; M557-M581 HydrophobicContact SD-CE 3.24Å; M557-M581 WeakPolarHBondContact SD-CE 3.35Å; M557-M581 HydrophobicContact SD-SD 4.31Å; D579-M581 PolarHBondContact O-N 3.38Å; D579-M581 WeakPolarHBondContact OD1-CB 3.47Å; D579-M581 WeakPolarHBondContact OD1-CG 3.45Å; D579-M581 PolarHBondContact OD1-N 3.06Å
582	F	86.4	Confident	86.5	Confident	24 Å²	24	45.6 Å²	45.6	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-79	-21.9	175.1	-60.1	-68.9	0	0	0	112.6	F555 I578 D579 K580 M592 I593 I596	F555-F582 VanDerWaalsContact O-CE2 3.29Å; F555-F582 WeakPolarHBondContact O-CE2 3.49Å; I578-F582 HydrophobicContact CG2-CB 4.11Å; D579-F582 HydrophobicContact CB-CD2 4.15Å; D579-F582 HydrophobicContact CB-CE2 4.41Å; D579-F582 PolarHBondContact O-N 3.04Å; D579-F582 VanDerWaalsContact O-N 3.14Å; K580-F582 PolarHBondContact O-N 3.22Å; F582-M592 HydrophobicContact CD1-CB 3.95Å; F582-M592 HydrophobicContact CE1-CB 4.06Å; F582-M592 HydrophobicContact CE1-CE 4.47Å; F582-M592 HydrophobicContact CE1-SD 3.93Å; F582-I593 HydrophobicContact CB-CB 4.27Å; F582-I593 HydrophobicContact CB-CD1 4.31Å; F582-I596 HydrophobicContact CD1-CD1 4.25Å; F582-I596 HydrophobicContact CD2-CD1 3.92Å; F582-I596 HydrophobicContact CE1-CD1 4.34Å; F582-I596 HydrophobicContact CE2-CD1 4.03Å; F582-I596 HydrophobicContact CG-CD1 4.03Å; F582-I596 HydrophobicContact CZ-CD1 4.24Å
583	V	89.1	Confident	87.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-87.1	-34.5	179.1	177.7	0	0	0	0	111.7	I578 K580 G585 L586 I593 A609 E610 V612 Q617 L621	I578-V583 HydrophobicContact CG2-CG2 4.31Å; K580-V583 CarbonylContact O-C 3.58Å; K580-V583 WeakPolarHBondContact O-CA 3.28Å; K580-V583 PolarHBondContact O-N 3.23Å; V583-G585 PolarHBondContact O-N 3.13Å; V583-L586 WeakPolarHBondContact O-CB 3.41Å; V583-L586 PolarHBondContact O-N 3.26Å; V583-I593 HydrophobicContact CG2-CD1 3.97Å; V583-A609 HydrophobicContact CG2-CB 4.34Å; V583-E610 WeakPolarHBondContact CB-O 3.4Å; V583-E610 VanDerWaalsContact CG2-O 3.29Å; V583-E610 WeakPolarHBondContact CG2-O 3.38Å; V583-V612 HydrophobicContact CG1-CG2 4.15Å; V583-Q617 HydrophobicContact CG1-CB 4.27Å; V583-Q617 HydrophobicContact CG1-CG 4.27Å; V583-Q617 PolarHBondContact O-NE2 3.45Å; V583-L621 HydrophobicContact CG1-CD1 4.16Å
584	E	88.6	Confident	87.3	Confident	117 Å²	117	45.2 Å²	45.2	55%	0.547	27%	0.272	S	S	.	.	H	α-helix	trans	-53.3	-38.8	178.5	-80.5	178	-166.6	0	0	112.7	K580 L586	K580-E584 WeakPolarHBondContact O-CG 3.42Å; K580-E584 PolarHBondContact O-N 2.85Å; E584-L586 VanDerWaalsContact C-N 3.28Å; E584-L586 PolarHBondContact O-N 2.58Å
585	G	85.5	Confident	87.2	Confident	34 Å²	34	46.5 Å²	46.5	35%	0.351	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-11.1	-179.2	0	0	0	0	0	115.5	V583 G588 D589	V583-G585 PolarHBondContact O-N 3.13Å; G585-G588 WeakPolarHBondContact O-CA 3.34Å; G585-G588 PolarHBondContact O-N 3.32Å; G585-D589 PolarHBondContact O-N 2.93Å
586	L	88	Confident	86.9	Confident	12 Å²	12	47 Å²	47	6%	0.063	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	146.3	-174.5	-72.1	178.5	0	0	0	113.4	V583 E584 I593 Q617 W620 L621	V583-L586 WeakPolarHBondContact O-CB 3.41Å; V583-L586 PolarHBondContact O-N 3.26Å; E584-L586 VanDerWaalsContact C-N 3.28Å; E584-L586 PolarHBondContact O-N 2.58Å; L586-I593 HydrophobicContact CD1-CD1 3.93Å; L586-I593 HydrophobicContact CD2-CG2 3.89Å; L586-I593 HydrophobicContact CG-CG2 4.48Å; L586-Q617 HydrophobicContact CB-CG 4.03Å; L586-W620 HydrophobicContact CD1-CD2 4.03Å; L586-W620 HydrophobicContact CD1-CE3 3.34Å; L586-W620 HydrophobicContact CD1-CZ3 3.84Å; L586-W620 HydrophobicContact CD2-CD2 3.5Å; L586-W620 VanDerWaalsContact CD2-CD2 3.5Å; L586-W620 HydrophobicContact CD2-CE3 3.46Å; L586-W620 VanDerWaalsContact CD2-CE3 3.46Å; L586-W620 HydrophobicContact CD2-CG 4.14Å; L586-W620 HydrophobicContact CD2-CH2 3.97Å; L586-W620 HydrophobicContact CD2-CZ2 4.01Å; L586-W620 HydrophobicContact CD2-CZ3 3.69Å; L586-W620 HydrophobicContact CG-CD2 4.33Å; L586-W620 HydrophobicContact CG-CE3 4.02Å; L586-W620 HydrophobicContact CG-CZ3 4.4Å; L586-L621 HydrophobicContact CD1-CD1 4.33Å; L586-L621 HydrophobicContact CD1-CD2 3.77Å; L586-L621 HydrophobicContact CD1-CG 3.78Å
587	P	80.9	Confident	86.9	Confident	75 Å²	75	47.4 Å²	47.4	49%	0.487	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86.4	6.9	-0.7	34.7	-36.1	0	0	0	114.4	W620	P587-W620 HydrophobicContact CB-CB 4.42Å; P587-W620 HydrophobicContact CB-CG 4.2Å
588	G	84.1	Confident	86.8	Confident	73 Å²	73	53.8 Å²	53.8	75%	0.753	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-55.4	-171.7	0	0	0	0	0	114.4	G585	G585-G588 WeakPolarHBondContact O-CA 3.34Å; G585-G588 PolarHBondContact O-N 3.32Å
589	D	85.6	Confident	86.6	Confident	90 Å²	90	55.7 Å²	55.7	48%	0.481	33%	0.333	S	S	.	.			trans	-103.5	103.9	173.6	-171.3	1.8	0	0	0	109.9	G585 S591	G585-D589 PolarHBondContact O-N 2.93Å; D589-S591 PolarHBondContact OD1-N 3.42Å; D589-S591 PolarHBondContact OD1-OG 2.68Å; D589-S591 VanDerWaalsContact OD1-OG 3.11Å
590	S	86.2	Confident	86.5	Confident	42 Å²	42	55.3 Å²	55.3	29%	0.294	33%	0.331	S	S	.	.			trans	-116.2	0.4	-176	50.1	0	0	0	0	114	I593 A594	S590-I593 VanDerWaalsContact O-CG2 3.27Å; S590-I593 WeakPolarHBondContact O-CG2 3.5Å; S590-A594 WeakPolarHBondContact O-CB 3.22Å; S590-A594 PolarHBondContact O-N 3.04Å
591	S	84.4	Confident	86.6	Confident	81 Å²	81	54.9 Å²	54.9	57%	0.566	33%	0.33	S	S	*	.	H	α-helix	trans	-65.9	-49	-168	61.3	0	0	0	0	113	D589 A595	D589-S591 PolarHBondContact OD1-N 3.42Å; D589-S591 PolarHBondContact OD1-OG 2.68Å; D589-S591 VanDerWaalsContact OD1-OG 3.11Å; S591-A595 PolarHBondContact O-N 2.82Å
592	M	83.4	Confident	86.5	Confident	108 Å²	108	54 Å²	54	53%	0.532	34%	0.335	S	S	.	.	H	α-helix	trans	-70.9	-44.9	-180	-73.9	-167.6	-89.7	0	0	112.1	F582 A594 A595 I596	F582-M592 HydrophobicContact CD1-CB 3.95Å; F582-M592 HydrophobicContact CE1-CB 4.06Å; F582-M592 HydrophobicContact CE1-CE 4.47Å; F582-M592 HydrophobicContact CE1-SD 3.93Å; M592-A594 VanDerWaalsContact C-N 3.34Å; M592-A594 PolarHBondContact O-N 3.4Å; M592-A595 WeakPolarHBondContact O-CB 3.47Å; M592-A595 PolarHBondContact O-N 2.79Å; M592-A595 VanDerWaalsContact O-N 3.09Å; M592-I596 WeakPolarHBondContact O-CG1 3.38Å; M592-I596 PolarHBondContact O-N 3.03Å
593	I	87.9	Confident	86.5	Confident	2 Å²	2	55 Å²	55	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-64.3	-36.9	179.2	-172.1	157.6	0	0	0	112.5	I578 F582 V583 L586 S590 A595 I596 I597 W620 L621	I578-I593 HydrophobicContact CD1-CG1 4.5Å; I578-I593 HydrophobicContact CG2-CD1 3.77Å; I578-I593 HydrophobicContact CG2-CG1 4.07Å; F582-I593 HydrophobicContact CB-CB 4.27Å; F582-I593 HydrophobicContact CB-CD1 4.31Å; V583-I593 HydrophobicContact CG2-CD1 3.97Å; L586-I593 HydrophobicContact CD1-CD1 3.93Å; L586-I593 HydrophobicContact CD2-CG2 3.89Å; L586-I593 HydrophobicContact CG-CG2 4.48Å; S590-I593 VanDerWaalsContact O-CG2 3.27Å; S590-I593 WeakPolarHBondContact O-CG2 3.5Å; I593-A595 VanDerWaalsContact C-N 3.3Å; I593-A595 PolarHBondContact O-N 3.09Å; I593-I596 PolarHBondContact O-N 2.87Å; I593-I597 HydrophobicContact CG1-CD1 3.99Å; I593-I597 HydrophobicContact CG1-CG1 4.43Å; I593-I597 VanDerWaalsContact O-CG1 3.26Å; I593-I597 WeakPolarHBondContact O-CG1 3.48Å; I593-I597 PolarHBondContact O-N 2.75Å; I593-W620 HydrophobicContact CD1-CZ3 4.44Å; I593-W620 HydrophobicContact CG1-CZ3 4.29Å; I593-W620 HydrophobicContact CG2-CH2 3.71Å; I593-W620 HydrophobicContact CG2-CZ3 3.89Å; I593-L621 HydrophobicContact CD1-CD2 3.75Å
594	A	88.1	Confident	86.4	Confident	38 Å²	38	62.2 Å²	62.2	31%	0.314	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-38.2	172.7	0	0	0	0	0	112.1	S590 M592 I597 M598	S590-A594 WeakPolarHBondContact O-CB 3.22Å; S590-A594 PolarHBondContact O-N 3.04Å; M592-A594 VanDerWaalsContact C-N 3.34Å; M592-A594 PolarHBondContact O-N 3.4Å; A594-I597 PolarHBondContact O-N 3.32Å; A594-M598 WeakPolarHBondContact O-CB 3.44Å; A594-M598 WeakPolarHBondContact O-CG 3.39Å; A594-M598 PolarHBondContact O-N 2.93Å
595	A	86.9	Confident	86.4	Confident	60 Å²	60	57.9 Å²	57.9	50%	0.496	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-41	176	0	0	0	0	0	112.2	S591 M592 I593 M598 L599	S591-A595 PolarHBondContact O-N 2.82Å; M592-A595 WeakPolarHBondContact O-CB 3.47Å; M592-A595 PolarHBondContact O-N 2.79Å; M592-A595 VanDerWaalsContact O-N 3.09Å; I593-A595 VanDerWaalsContact C-N 3.3Å; I593-A595 PolarHBondContact O-N 3.09Å; A595-M598 PolarHBondContact O-N 3.06Å; A595-L599 WeakPolarHBondContact O-CB 3.35Å; A595-L599 PolarHBondContact O-N 3.14Å
596	I	85.7	Confident	86.7	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.067	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-46.6	175.2	-64.6	169.1	0	0	0	110.4	F555 L576 I578 F582 M592 I593 M598 L599 A600	F555-I596 HydrophobicContact CD1-CB 4.45Å; F555-I596 HydrophobicContact CD1-CD1 4.37Å; F555-I596 HydrophobicContact CD1-CG1 4Å; F555-I596 HydrophobicContact CD1-CG2 3.77Å; F555-I596 HydrophobicContact CE1-CG1 4.03Å; F555-I596 HydrophobicContact CE1-CG2 4.16Å; L576-I596 HydrophobicContact CD2-CG2 3.63Å; I578-I596 HydrophobicContact CG1-CG2 4.07Å; F582-I596 HydrophobicContact CD1-CD1 4.25Å; F582-I596 HydrophobicContact CD2-CD1 3.92Å; F582-I596 HydrophobicContact CE1-CD1 4.34Å; F582-I596 HydrophobicContact CE2-CD1 4.03Å; F582-I596 HydrophobicContact CG-CD1 4.03Å; F582-I596 HydrophobicContact CZ-CD1 4.24Å; M592-I596 WeakPolarHBondContact O-CG1 3.38Å; M592-I596 PolarHBondContact O-N 3.03Å; I593-I596 PolarHBondContact O-N 2.87Å; I596-M598 PolarHBondContact O-N 3.49Å; I596-L599 WeakPolarHBondContact O-CB 3.22Å; I596-L599 PolarHBondContact O-N 3.23Å; I596-A600 PolarHBondContact O-N 3.49Å
597	I	89.9	Confident	87	Confident	7 Å²	7	60 Å²	60	4%	0.036	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-47.2	178.3	-69.4	167.3	0	0	0	111	I578 I593 A594 L599 A600 Q601 M607 W620 A624 V626	I578-I597 HydrophobicContact CD1-CG1 3.98Å; I593-I597 HydrophobicContact CG1-CD1 3.99Å; I593-I597 HydrophobicContact CG1-CG1 4.43Å; I593-I597 VanDerWaalsContact O-CG1 3.26Å; I593-I597 WeakPolarHBondContact O-CG1 3.48Å; I593-I597 PolarHBondContact O-N 2.75Å; A594-I597 PolarHBondContact O-N 3.32Å; I597-L599 VanDerWaalsContact C-N 3.29Å; I597-L599 PolarHBondContact O-N 3Å; I597-A600 PolarHBondContact O-N 3.14Å; I597-Q601 HydrophobicContact CG2-CG 4.43Å; I597-Q601 WeakPolarHBondContact O-CB 3.39Å; I597-Q601 VanDerWaalsContact O-CG 3.31Å; I597-Q601 WeakPolarHBondContact O-CG 3.32Å; I597-Q601 PolarHBondContact O-N 2.97Å; I597-M607 HydrophobicContact CB-SD 4.19Å; I597-M607 HydrophobicContact CG1-SD 4.1Å; I597-M607 HydrophobicContact CG2-CE 4.22Å; I597-M607 HydrophobicContact CG2-SD 4.01Å; I597-W620 HydrophobicContact CD1-CH2 4.35Å; I597-W620 HydrophobicContact CD1-CZ3 4.02Å; I597-A624 HydrophobicContact CD1-CB 3.77Å; I597-V626 HydrophobicContact CD1-CG2 3.61Å; I597-V626 HydrophobicContact CG1-CG2 3.83Å
598	M	88.8	Confident	87.6	Confident	135 Å²	135	56.5 Å²	56.5	67%	0.665	34%	0.338	S	S	*	.	H	α-helix	trans	-59.8	-40.2	177.4	-76.9	-173.1	69.1	0	0	112.2	A594 A595 I596 S602	A594-M598 WeakPolarHBondContact O-CB 3.44Å; A594-M598 WeakPolarHBondContact O-CG 3.39Å; A594-M598 PolarHBondContact O-N 2.93Å; A595-M598 PolarHBondContact O-N 3.06Å; I596-M598 PolarHBondContact O-N 3.49Å; M598-S602 WeakPolarHBondContact O-CB 3.4Å; M598-S602 PolarHBondContact O-N 3.17Å
599	L	85.1	Confident	88	Confident	39 Å²	39	53 Å²	53	20%	0.204	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-49.3	177.3	-179.6	69.5	0	0	0	111.3	F555 L565 M568 A595 I596 I597 Q601 S602 L603	F555-L599 HydrophobicContact CE1-CD2 3.69Å; F555-L599 HydrophobicContact CE2-CD2 4.44Å; F555-L599 HydrophobicContact CZ-CD2 3.36Å; L565-L599 HydrophobicContact CD2-CD1 4.41Å; L565-L599 HydrophobicContact CD2-CD2 3.59Å; M568-L599 HydrophobicContact CE-CD1 4.3Å; M568-L599 HydrophobicContact CE-CD2 3.6Å; M568-L599 HydrophobicContact CE-CG 3.96Å; A595-L599 WeakPolarHBondContact O-CB 3.35Å; A595-L599 PolarHBondContact O-N 3.14Å; I596-L599 WeakPolarHBondContact O-CB 3.22Å; I596-L599 PolarHBondContact O-N 3.23Å; I597-L599 VanDerWaalsContact C-N 3.29Å; I597-L599 PolarHBondContact O-N 3Å; L599-Q601 VanDerWaalsContact C-N 3.33Å; L599-Q601 PolarHBondContact O-N 2.79Å; L599-S602 PolarHBondContact O-N 2.85Å; L599-S602 VanDerWaalsContact O-N 3.14Å; L599-S602 PolarHBondContact O-OG 3.19Å; L599-L603 HydrophobicContact CD1-CD1 4.22Å; L599-L603 HydrophobicContact CG-CD1 4.26Å; L599-L603 WeakPolarHBondContact O-CG 3.31Å; L599-L603 PolarHBondContact O-N 2.94Å; L599-L603 VanDerWaalsContact O-N 3.13Å
600	A	86.9	Confident	88.3	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-43.4	178.5	0	0	0	0	0	111.8	L576 I596 I597 S602 L603 N604 L605 M607	L576-A600 HydrophobicContact CD1-CB 4.28Å; I596-A600 PolarHBondContact O-N 3.49Å; I597-A600 PolarHBondContact O-N 3.14Å; A600-S602 PolarHBondContact O-N 2.82Å; A600-L603 CarbonylContact O-C 3.59Å; A600-L603 PolarHBondContact O-N 3.37Å; A600-N604 PolarHBondContact O-N 3.23Å; A600-L605 HydrophobicContact CB-CB 4.41Å; A600-L605 PolarHBondContact O-N 3.41Å; A600-M607 HydrophobicContact CB-CG 3.51Å; A600-M607 HydrophobicContact CB-SD 3.53Å; A600-M607 VanDerWaalsContact CB-SD 3.53Å
601	Q	89.6	Confident	88.6	Confident	99 Å²	99	48.8 Å²	48.8	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-43.1	173.9	-72.5	174.5	-6.1	0	0	112.1	I597 L599 L603 N604 M607 A624	I597-Q601 HydrophobicContact CG2-CG 4.43Å; I597-Q601 WeakPolarHBondContact O-CB 3.39Å; I597-Q601 VanDerWaalsContact O-CG 3.31Å; I597-Q601 WeakPolarHBondContact O-CG 3.32Å; I597-Q601 PolarHBondContact O-N 2.97Å; L599-Q601 VanDerWaalsContact C-N 3.33Å; L599-Q601 PolarHBondContact O-N 2.79Å; Q601-L603 PolarHBondContact O-N 3.01Å; Q601-N604 PolarHBondContact O-N 2.89Å; Q601-M607 HydrophobicContact CG-CE 3.97Å; Q601-A624 PolarHBondContact NE2-O 2.94Å
602	S	86.6	Confident	89	Confident	86 Å²	86	45 Å²	45	60%	0.601	25%	0.253	S	S	*	.	H	α-helix	trans	-64.1	-23.3	179	78.7	0	0	0	0	113.7	M598 L599 A600	M598-S602 WeakPolarHBondContact O-CB 3.4Å; M598-S602 PolarHBondContact O-N 3.17Å; L599-S602 PolarHBondContact O-N 2.85Å; L599-S602 VanDerWaalsContact O-N 3.14Å; L599-S602 PolarHBondContact O-OG 3.19Å; A600-S602 PolarHBondContact O-N 2.82Å
603	L	85	Confident	89.5	Confident	45 Å²	45	44.8 Å²	44.8	24%	0.236	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	1.2	177.6	-63.1	175.7	0	0	0	112.9	M568 K569 L599 A600 Q601 L605	M568-L603 HydrophobicContact CE-CD1 3.24Å; K569-L603 HydrophobicContact CD-CD2 4.48Å; K569-L603 HydrophobicContact CG-CD2 3.79Å; L599-L603 HydrophobicContact CD1-CD1 4.22Å; L599-L603 HydrophobicContact CG-CD1 4.26Å; L599-L603 WeakPolarHBondContact O-CG 3.31Å; L599-L603 PolarHBondContact O-N 2.94Å; L599-L603 VanDerWaalsContact O-N 3.13Å; A600-L603 CarbonylContact O-C 3.59Å; A600-L603 PolarHBondContact O-N 3.37Å; Q601-L603 PolarHBondContact O-N 3.01Å; L603-L605 VanDerWaalsContact C-N 3.26Å; L603-L605 HydrophobicContact CB-CD1 4.01Å; L603-L605 HydrophobicContact CB-CG 3.81Å; L603-L605 HydrophobicContact CD1-CD1 4.19Å; L603-L605 PolarHBondContact O-N 2.9Å
604	N	87.5	Confident	89.7	Confident	151 Å²	151	47.7 Å²	47.7	81%	0.807	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	39.3	-177.6	-162.1	53.8	0	0	0	113.1	A600 Q601	A600-N604 PolarHBondContact O-N 3.23Å; Q601-N604 PolarHBondContact O-N 2.89Å
605	L	89.3	Confident	89.9	Confident	26 Å²	26	51.7 Å²	51.7	14%	0.136	28%	0.281	C	S	.	.			trans	-88.9	143	177.8	-60.1	176.7	0	0	0	110.9	I573 L576 A600 L603	I573-L605 HydrophobicContact CG2-CD2 4.37Å; I573-L605 VanDerWaalsContact O-CD2 3.23Å; I573-L605 WeakPolarHBondContact O-CD2 3.47Å; L576-L605 HydrophobicContact CB-CB 4.42Å; L576-L605 HydrophobicContact CB-CD1 4.22Å; L576-L605 HydrophobicContact CD1-CD1 4.2Å; A600-L605 HydrophobicContact CB-CB 4.41Å; A600-L605 PolarHBondContact O-N 3.41Å; L603-L605 VanDerWaalsContact C-N 3.26Å; L603-L605 HydrophobicContact CB-CD1 4.01Å; L603-L605 HydrophobicContact CB-CG 3.81Å; L603-L605 HydrophobicContact CD1-CD1 4.19Å; L603-L605 PolarHBondContact O-N 2.9Å
606	Q	91.6	Very high	90.1	Very high	73 Å²	73	51.3 Å²	51.3	34%	0.341	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.9	170.2	-176.2	173.3	4.9	0	0	109.2	D574 V575 L576 I628	D574-Q606 PolarHBondContact O-N 3.11Å; D574-Q606 VanDerWaalsContact O-N 3.16Å; V575-Q606 CarbonylContact C-O 3.57Å; V575-Q606 VanDerWaalsContact CA-O 3.31Å; V575-Q606 WeakPolarHBondContact CA-O 3.33Å; V575-Q606 HydrophobicContact CG2-CB 4.31Å; L576-Q606 PolarHBondContact N-O 3.42Å; Q606-I628 HydrophobicContact CG-CD1 4.15Å
607	M	92.8	Very high	90.5	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.9	-177	-66.8	174.6	-74.1	0	0	111.8	L576 I597 A600 Q601 V626	L576-M607 WeakPolarHBondContact O-CA 3.49Å; I597-M607 HydrophobicContact CB-SD 4.19Å; I597-M607 HydrophobicContact CG1-SD 4.1Å; I597-M607 HydrophobicContact CG2-CE 4.22Å; I597-M607 HydrophobicContact CG2-SD 4.01Å; A600-M607 HydrophobicContact CB-CG 3.51Å; A600-M607 HydrophobicContact CB-SD 3.53Å; A600-M607 VanDerWaalsContact CB-SD 3.53Å; Q601-M607 HydrophobicContact CG-CE 3.97Å; M607-V626 HydrophobicContact CB-CG1 4.24Å; M607-V626 HydrophobicContact SD-CG2 4.4Å
608	I	94	Very high	90.5	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124	171.3	-57.9	-177.9	0	0	0	107.6	V575 L576 K577 I578 I628	V575-I608 HydrophobicContact CG1-CD1 3.65Å; V575-I608 HydrophobicContact CG1-CG1 3.81Å; L576-I608 PolarHBondContact O-N 2.95Å; K577-I608 CarbonylContact C-O 3.51Å; K577-I608 WeakPolarHBondContact CA-O 3.31Å; K577-I608 HydrophobicContact CG-CB 4.34Å; I578-I608 PolarHBondContact N-O 3.44Å; I608-I628 WeakPolarHBondContact CA-O 3.42Å; I608-I628 HydrophobicContact CB-CG2 4.42Å; I608-I628 HydrophobicContact CD1-CG2 4.36Å; I608-I628 HydrophobicContact CG1-CB 4.06Å; I608-I628 HydrophobicContact CG1-CG2 3.9Å; I608-I628 HydrophobicContact CG2-CG2 4.12Å
609	A	93.4	Very high	90.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.1	172.1	0	0	0	0	0	111	M424 V583 V612 L621 V626 I628 A629 Q630	M424-A609 HydrophobicContact CE-CB 4.28Å; V583-A609 HydrophobicContact CG2-CB 4.34Å; A609-V612 HydrophobicContact CB-CG2 4.13Å; A609-L621 HydrophobicContact CB-CD1 3.66Å; A609-L621 HydrophobicContact CB-CD2 4.12Å; A609-L621 HydrophobicContact CB-CG 4.47Å; A609-V626 HydrophobicContact CB-CG1 3.95Å; A609-I628 PolarHBondContact N-O 3.2Å; A609-A629 CarbonylContact O-C 3.55Å; A609-A629 WeakPolarHBondContact O-CA 3.47Å; A609-Q630 PolarHBondContact O-N 3.32Å
610	E	92.3	Very high	91	Very high	26 Å²	26	52 Å²	52	12%	0.121	27%	0.274	C	S	.	.			trans	-95.7	161.9	178.1	-60.9	-176.2	-161.8	0	0	112.5	D553 K577 I578 V583 V612 Q630	D553-E610 VanDerWaalsContact OD1-OE1 3.09Å; K577-E610 VanDerWaalsContact CB-OE1 3.25Å; K577-E610 WeakPolarHBondContact CB-OE1 3.46Å; K577-E610 VanDerWaalsContact CD-OE1 3.25Å; K577-E610 WeakPolarHBondContact CD-OE1 3.44Å; K577-E610 WeakPolarHBondContact CE-OE1 3.29Å; K577-E610 IonicContact NZ-OE1 3.76Å; K577-E610 PolarHBondContact NZ-OE1 2.93Å; I578-E610 WeakPolarHBondContact O-CB 3.26Å; I578-E610 PolarHBondContact O-N 2.97Å; V583-E610 WeakPolarHBondContact CB-O 3.4Å; V583-E610 VanDerWaalsContact CG2-O 3.29Å; V583-E610 WeakPolarHBondContact CG2-O 3.38Å; E610-V612 VanDerWaalsContact C-N 3.25Å; E610-V612 PolarHBondContact O-N 3.47Å; E610-Q630 CarbonylContact C-O 3.49Å; E610-Q630 WeakPolarHBondContact CA-O 3.49Å
611	G	91.2	Very high	91.3	Very high	18 Å²	18	52 Å²	52	19%	0.186	27%	0.274	C	S	.	.			trans	62.7	29.6	175.4	0	0	0	0	0	114.1	E613 Q630	G611-E613 PolarHBondContact O-N 3.27Å; G611-Q630 PolarHBondContact N-O 2.85Å
612	V	92.6	Very high	91.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.			trans	-74.8	110.4	174.3	-175.5	0	0	0	0	109.1	M424 V583 A609 E610 Q617 R618 L621 A629 Q630 G631 F632 L633 F634	M424-V612 HydrophobicContact CE-CG2 4.21Å; V583-V612 HydrophobicContact CG1-CG2 4.15Å; A609-V612 HydrophobicContact CB-CG2 4.13Å; E610-V612 VanDerWaalsContact C-N 3.25Å; E610-V612 PolarHBondContact O-N 3.47Å; V612-Q617 HydrophobicContact CG1-CB 4.27Å; V612-R618 HydrophobicContact CG1-CB 4.08Å; V612-L621 HydrophobicContact CG2-CD1 3.7Å; V612-A629 HydrophobicContact CG2-CB 4.28Å; V612-Q630 PolarHBondContact N-O 3.17Å; V612-G631 CarbonylContact O-C 3.34Å; V612-G631 WeakPolarHBondContact O-CA 3.27Å; V612-F632 PolarHBondContact O-N 3.48Å; V612-L633 HydrophobicContact CG1-CD2 3.97Å; V612-L633 WeakPolarHBondContact O-CB 3.27Å; V612-L633 PolarHBondContact O-N 3.01Å; V612-L633 VanDerWaalsContact O-N 3.09Å; V612-F634 HydrophobicContact CB-CE2 4.09Å; V612-F634 HydrophobicContact CG1-CE2 4.04Å
613	E	93.5	Very high	91.5	Very high	105 Å²	105	53.6 Å²	53.6	49%	0.491	28%	0.276	S	S	.	.			trans	-113.6	-22.2	-174.6	-63.8	-168.6	159.4	0	0	113.3	G611	G611-E613 PolarHBondContact O-N 3.27Å
614	T	93.1	Very high	91.7	Very high	63 Å²	63	53 Å²	53	39%	0.387	28%	0.278	S	S	.	.	S	Bend	trans	-125.6	150.8	-176.6	68.9	0	0	0	0	112.8	A616 Q617 R618	T614-A616 PolarHBondContact O-N 3.4Å; T614-Q617 PolarHBondContact O-N 3.03Å; T614-Q617 VanDerWaalsContact OG1-CD 3.26Å; T614-Q617 VanDerWaalsContact OG1-CG 3.25Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.2Å; T614-Q617 PolarHBondContact OG1-N 3.09Å; T614-Q617 PolarHBondContact OG1-OE1 2.83Å; T614-R618 PolarHBondContact O-N 2.97Å; T614-R618 VanDerWaalsContact O-N 3.17Å
615	E	91.2	Very high	91.8	Very high	122 Å²	122	47.8 Å²	47.8	57%	0.57	26%	0.26	S	S	*	.	H	α-helix	trans	-59.9	-32.2	174.5	-64.8	-168.6	153.2	0	0	112.3	R618 D619 L633	E615-R618 WeakPolarHBondContact O-CB 3.47Å; E615-R618 PolarHBondContact O-N 3.41Å; E615-D619 WeakPolarHBondContact O-CB 3.38Å; E615-D619 VanDerWaalsContact O-CG 3.23Å; E615-D619 PolarHBondContact O-N 3.03Å; E615-L633 HydrophobicContact CG-CD1 4.25Å
616	A	91.9	Very high	91.9	Very high	52 Å²	52	46.7 Å²	46.7	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-41.3	177.6	0	0	0	0	0	112.5	T614 W620	T614-A616 PolarHBondContact O-N 3.4Å; A616-W620 WeakPolarHBondContact O-CB 3.47Å; A616-W620 PolarHBondContact O-N 3.19Å; A616-W620 VanDerWaalsContact O-N 3.14Å
617	Q	93.4	Very high	91.7	Very high	12 Å²	12	45 Å²	45	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-48.5	173.4	-71.9	161.4	-21.1	0	0	110.4	V583 L586 V612 T614 D619 W620 L621	V583-Q617 HydrophobicContact CG1-CB 4.27Å; V583-Q617 HydrophobicContact CG1-CG 4.27Å; V583-Q617 PolarHBondContact O-NE2 3.45Å; L586-Q617 HydrophobicContact CB-CG 4.03Å; V612-Q617 HydrophobicContact CG1-CB 4.27Å; T614-Q617 PolarHBondContact O-N 3.03Å; T614-Q617 VanDerWaalsContact OG1-CD 3.26Å; T614-Q617 VanDerWaalsContact OG1-CG 3.25Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.2Å; T614-Q617 PolarHBondContact OG1-N 3.09Å; T614-Q617 PolarHBondContact OG1-OE1 2.83Å; Q617-D619 PolarHBondContact O-N 3.37Å; Q617-W620 PolarHBondContact O-N 3.03Å; Q617-L621 WeakPolarHBondContact O-CB 3.44Å; Q617-L621 VanDerWaalsContact O-CG 3.27Å; Q617-L621 WeakPolarHBondContact O-CG 3.33Å; Q617-L621 PolarHBondContact O-N 3.02Å
618	R	91	Very high	91.8	Very high	69 Å²	69	44.7 Å²	44.7	26%	0.26	26%	0.255	S	S	.	.	H	α-helix	trans	-54.9	-51	177.7	-174.6	-162	67.1	-166.3	-5.9	111.7	M424 V612 T614 E615 W620 L621 A622 L633 F634	M424-R618 HydrophobicContact SD-CB 4.44Å; M424-R618 HydrophobicContact SD-CG 3.55Å; M424-R618 VanDerWaalsContact SD-CG 3.55Å; V612-R618 HydrophobicContact CG1-CB 4.08Å; T614-R618 PolarHBondContact O-N 2.97Å; T614-R618 VanDerWaalsContact O-N 3.17Å; E615-R618 WeakPolarHBondContact O-CB 3.47Å; E615-R618 PolarHBondContact O-N 3.41Å; R618-W620 VanDerWaalsContact C-N 3.31Å; R618-W620 PolarHBondContact O-N 3.19Å; R618-L621 PolarHBondContact O-N 3.38Å; R618-A622 WeakPolarHBondContact O-CB 3.2Å; R618-A622 PolarHBondContact O-N 3.23Å; R618-L633 HydrophobicContact CB-CD2 3.96Å; R618-L633 HydrophobicContact CG-CD2 4.47Å; R618-F634 HydrophobicContact CG-CZ 4.23Å
619	D	91.1	Very high	91.8	Very high	69 Å²	69	44.6 Å²	44.6	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-66.6	-33.7	-176.2	-71	0.5	0	0	0	112.2	E615 Q617 K623	E615-D619 WeakPolarHBondContact O-CB 3.38Å; E615-D619 VanDerWaalsContact O-CG 3.23Å; E615-D619 PolarHBondContact O-N 3.03Å; Q617-D619 PolarHBondContact O-N 3.37Å; D619-K623 WeakPolarHBondContact O-CD 3.33Å; D619-K623 VanDerWaalsContact O-CG 3.26Å; D619-K623 WeakPolarHBondContact O-CG 3.24Å; D619-K623 PolarHBondContact O-N 3.06Å
620	W	92.9	Very high	91.8	Very high	57 Å²	57	44.9 Å²	44.9	22%	0.216	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-48.1	174.4	-171.7	97.1	0	0	0	111.4	L586 P587 I593 I597 A616 Q617 R618 A622 K623 A624	L586-W620 HydrophobicContact CD1-CD2 4.03Å; L586-W620 HydrophobicContact CD1-CE3 3.34Å; L586-W620 HydrophobicContact CD1-CZ3 3.84Å; L586-W620 HydrophobicContact CD2-CD2 3.5Å; L586-W620 VanDerWaalsContact CD2-CD2 3.5Å; L586-W620 HydrophobicContact CD2-CE3 3.46Å; L586-W620 VanDerWaalsContact CD2-CE3 3.46Å; L586-W620 HydrophobicContact CD2-CG 4.14Å; L586-W620 HydrophobicContact CD2-CH2 3.97Å; L586-W620 HydrophobicContact CD2-CZ2 4.01Å; L586-W620 HydrophobicContact CD2-CZ3 3.69Å; L586-W620 HydrophobicContact CG-CD2 4.33Å; L586-W620 HydrophobicContact CG-CE3 4.02Å; L586-W620 HydrophobicContact CG-CZ3 4.4Å; P587-W620 HydrophobicContact CB-CB 4.42Å; P587-W620 HydrophobicContact CB-CG 4.2Å; I593-W620 HydrophobicContact CD1-CZ3 4.44Å; I593-W620 HydrophobicContact CG1-CZ3 4.29Å; I593-W620 HydrophobicContact CG2-CH2 3.71Å; I593-W620 HydrophobicContact CG2-CZ3 3.89Å; I597-W620 HydrophobicContact CD1-CH2 4.35Å; I597-W620 HydrophobicContact CD1-CZ3 4.02Å; A616-W620 WeakPolarHBondContact O-CB 3.47Å; A616-W620 PolarHBondContact O-N 3.19Å; A616-W620 VanDerWaalsContact O-N 3.14Å; Q617-W620 PolarHBondContact O-N 3.03Å; R618-W620 VanDerWaalsContact C-N 3.31Å; R618-W620 PolarHBondContact O-N 3.19Å; W620-A622 PolarHBondContact O-N 3.26Å; W620-K623 PolarHBondContact O-N 3.2Å; W620-A624 HydrophobicContact CE3-CB 4.27Å; W620-A624 HydrophobicContact CH2-CB 4.17Å; W620-A624 HydrophobicContact CZ3-CB 3.93Å; W620-A624 PolarHBondContact O-N 3.32Å
621	L	92.4	Very high	91.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-43.3	179.5	-72	166.1	0	0	0	111.9	M424 V583 L586 I593 A609 V612 Q617 R618 K623 A624 G625 V626	M424-L621 HydrophobicContact CE-CB 3.78Å; M424-L621 HydrophobicContact CE-CD1 3.77Å; M424-L621 HydrophobicContact CE-CG 4.43Å; V583-L621 HydrophobicContact CG1-CD1 4.16Å; L586-L621 HydrophobicContact CD1-CD1 4.33Å; L586-L621 HydrophobicContact CD1-CD2 3.77Å; L586-L621 HydrophobicContact CD1-CG 3.78Å; I593-L621 HydrophobicContact CD1-CD2 3.75Å; A609-L621 HydrophobicContact CB-CD1 3.66Å; A609-L621 HydrophobicContact CB-CD2 4.12Å; A609-L621 HydrophobicContact CB-CG 4.47Å; V612-L621 HydrophobicContact CG2-CD1 3.7Å; Q617-L621 WeakPolarHBondContact O-CB 3.44Å; Q617-L621 VanDerWaalsContact O-CG 3.27Å; Q617-L621 WeakPolarHBondContact O-CG 3.33Å; Q617-L621 PolarHBondContact O-N 3.02Å; R618-L621 PolarHBondContact O-N 3.38Å; L621-K623 VanDerWaalsContact C-N 3.33Å; L621-K623 PolarHBondContact O-N 3.09Å; L621-A624 PolarHBondContact O-N 3.33Å; L621-A624 VanDerWaalsContact O-N 3.13Å; L621-G625 PolarHBondContact O-N 3.11Å; L621-V626 HydrophobicContact CB-CB 4.19Å; L621-V626 HydrophobicContact CD2-CB 4.48Å; L621-V626 HydrophobicContact CD2-CG2 4.06Å; L621-V626 PolarHBondContact O-N 3.38Å
622	A	90.9	Very high	91.8	Very high	40 Å²	40	47.3 Å²	47.3	33%	0.331	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-41.4	176.3	0	0	0	0	0	111.8	M424 R618 W620 A624 G625	M424-A622 HydrophobicContact CB-CB 4.36Å; R618-A622 WeakPolarHBondContact O-CB 3.2Å; R618-A622 PolarHBondContact O-N 3.23Å; W620-A622 PolarHBondContact O-N 3.26Å; A622-A624 VanDerWaalsContact C-N 3.32Å; A622-A624 PolarHBondContact O-N 2.84Å; A622-G625 PolarHBondContact O-N 3.13Å
623	K	90.3	Very high	91.7	Very high	179 Å²	179	49.9 Å²	49.9	78%	0.778	28%	0.276	S	S	*	.	H	α-helix	trans	-65.9	-33.3	174.3	-74.7	170.3	-173.8	168.2	0	112.8	D619 W620 L621 G625	D619-K623 WeakPolarHBondContact O-CD 3.33Å; D619-K623 VanDerWaalsContact O-CG 3.26Å; D619-K623 WeakPolarHBondContact O-CG 3.24Å; D619-K623 PolarHBondContact O-N 3.06Å; W620-K623 PolarHBondContact O-N 3.2Å; L621-K623 VanDerWaalsContact C-N 3.33Å; L621-K623 PolarHBondContact O-N 3.09Å; K623-G625 PolarHBondContact O-N 2.53Å
624	A	90.5	Very high	91.5	Very high	32 Å²	32	47.7 Å²	47.7	26%	0.264	26%	0.264	S	S	.	.	H	α-helix	trans	-75.3	-7	176.9	0	0	0	0	0	113.3	I597 Q601 W620 L621 A622	I597-A624 HydrophobicContact CD1-CB 3.77Å; Q601-A624 PolarHBondContact NE2-O 2.94Å; W620-A624 HydrophobicContact CE3-CB 4.27Å; W620-A624 HydrophobicContact CH2-CB 4.17Å; W620-A624 HydrophobicContact CZ3-CB 3.93Å; W620-A624 PolarHBondContact O-N 3.32Å; L621-A624 PolarHBondContact O-N 3.33Å; L621-A624 VanDerWaalsContact O-N 3.13Å; A622-A624 VanDerWaalsContact C-N 3.32Å; A622-A624 PolarHBondContact O-N 2.84Å
625	G	89.1	Confident	91.4	Very high	42 Å²	42	45.4 Å²	45.4	43%	0.433	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	17.3	178.7	0	0	0	0	0	114.3	L621 A622 K623	L621-G625 PolarHBondContact O-N 3.11Å; A622-G625 PolarHBondContact O-N 3.13Å; K623-G625 PolarHBondContact O-N 2.53Å
626	V	90.7	Very high	91.4	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	25%	0.252	C	S	.	.			trans	-78.3	119.4	169.1	-178.4	0	0	0	0	108.5	M424 I578 I597 M607 A609 L621 I628	M424-V626 HydrophobicContact CE-CG1 4.5Å; M424-V626 WeakPolarHBondContact CG-O 3.32Å; I578-V626 HydrophobicContact CD1-CG2 4.15Å; I597-V626 HydrophobicContact CD1-CG2 3.61Å; I597-V626 HydrophobicContact CG1-CG2 3.83Å; M607-V626 HydrophobicContact CB-CG1 4.24Å; M607-V626 HydrophobicContact SD-CG2 4.4Å; A609-V626 HydrophobicContact CB-CG1 3.95Å; L621-V626 HydrophobicContact CB-CB 4.19Å; L621-V626 HydrophobicContact CD2-CB 4.48Å; L621-V626 HydrophobicContact CD2-CG2 4.06Å; L621-V626 PolarHBondContact O-N 3.38Å; V626-I628 WeakPolarHBondContact CG1-O 3.46Å
627	G	88.1	Confident	91.5	Very high	37 Å²	37	45.3 Å²	45.3	38%	0.381	24%	0.237	S	C	.	.			trans	-87.1	-26.5	-172.6	0	0	0	0	0	114.7	E423 M424	E423-G627 CarbonylContact C-O 3.56Å; E423-G627 WeakPolarHBondContact CA-O 3.49Å; M424-G627 PolarHBondContact N-O 3.2Å
628	I	94.8	Very high	91.6	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.056	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.8	-170.9	-60.8	169.9	0	0	0	110.6	Q421 V422 V430 Q606 I608 A609 V626	Q421-I628 HydrophobicContact CB-CG2 3.99Å; V422-I628 CarbonylContact O-C 3.59Å; V422-I628 VanDerWaalsContact O-CA 3.31Å; V422-I628 WeakPolarHBondContact O-CA 3.43Å; V430-I628 HydrophobicContact CB-CD1 4.3Å; V430-I628 HydrophobicContact CG1-CD1 3.7Å; V430-I628 HydrophobicContact CG1-CG1 4.48Å; V430-I628 HydrophobicContact CG2-CD1 4.44Å; V430-I628 HydrophobicContact CG2-CG1 4.38Å; Q606-I628 HydrophobicContact CG-CD1 4.15Å; I608-I628 WeakPolarHBondContact CA-O 3.42Å; I608-I628 HydrophobicContact CB-CG2 4.42Å; I608-I628 HydrophobicContact CD1-CG2 4.36Å; I608-I628 HydrophobicContact CG1-CB 4.06Å; I608-I628 HydrophobicContact CG1-CG2 3.9Å; I608-I628 HydrophobicContact CG2-CG2 4.12Å; A609-I628 PolarHBondContact N-O 3.2Å; V626-I628 WeakPolarHBondContact CG1-O 3.46Å
629	A	94	Very high	91.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.3	-175.6	0	0	0	0	0	112.2	Q421 V422 M424 A609 V612 F634	Q421-A629 CarbonylContact C-O 3.36Å; Q421-A629 WeakPolarHBondContact CA-O 3.26Å; V422-A629 HydrophobicContact CG2-CB 4.44Å; V422-A629 PolarHBondContact N-O 2.87Å; V422-A629 PolarHBondContact O-N 3.46Å; M424-A629 HydrophobicContact CE-CB 3.16Å; M424-A629 HydrophobicContact CG-CB 4.05Å; M424-A629 HydrophobicContact SD-CB 3.43Å; M424-A629 WeakPolarHBondContact SD-CB 3.43Å; A609-A629 CarbonylContact O-C 3.55Å; A609-A629 WeakPolarHBondContact O-CA 3.47Å; V612-A629 HydrophobicContact CG2-CB 4.28Å; A629-F634 HydrophobicContact CB-CD2 4.19Å; A629-F634 HydrophobicContact CB-CE2 3.31Å; A629-F634 HydrophobicContact CB-CZ 3.64Å
630	Q	93.4	Very high	91.9	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.023	23%	0.23	C	C	.	.			trans	-139.6	143.6	165.2	-178.8	176.4	-24.5	0	0	109	Q419 Q421 E433 A609 E610 G611 V612	Q419-Q630 HydrophobicContact CB-CG 4.49Å; Q419-Q630 VanDerWaalsContact CD-NE2 3.28Å; Q419-Q630 HydrophobicContact CG-CG 3.81Å; Q421-Q630 HydrophobicContact CG-CB 4.12Å; Q421-Q630 HydrophobicContact CG-CG 4.4Å; E433-Q630 PolarHBondContact OE2-NE2 2.9Å; E433-Q630 PolarHBondContact OE2-OE1 3.3Å; A609-Q630 PolarHBondContact O-N 3.32Å; E610-Q630 CarbonylContact C-O 3.49Å; E610-Q630 WeakPolarHBondContact CA-O 3.49Å; G611-Q630 PolarHBondContact N-O 2.85Å; V612-Q630 PolarHBondContact N-O 3.17Å
631	G	91.8	Very high	91.9	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.031	25%	0.25	C	S	.	.	S	Bend	trans	156.3	174.2	178	0	0	0	0	0	112.8	V612 L633 F634 A635	V612-G631 CarbonylContact O-C 3.34Å; V612-G631 WeakPolarHBondContact O-CA 3.27Å; G631-L633 PolarHBondContact O-N 3.13Å; G631-F634 PolarHBondContact O-N 3.44Å; G631-A635 PolarHBondContact O-N 3.31Å; G631-A635 VanDerWaalsContact O-O 3.12Å
632	F	91	Very high	92	Very high	92 Å²	92	50.3 Å²	50.3	40%	0.404	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12.7	-173.8	-63.8	-12.5	0	0	0	114	V612 F634 R636	V612-F632 PolarHBondContact O-N 3.48Å; F632-F634 PolarHBondContact O-N 3.4Å; F632-R636 HydrophobicContact CD1-CB 4.39Å; F632-R636 HydrophobicContact CD1-CG 3.64Å; F632-R636 HydrophobicContact CE1-CB 4.45Å; F632-R636 HydrophobicContact CE1-CG 3.88Å; F632-R636 VanDerWaalsContact CE2-NH1 3.28Å; F632-R636 HydrophobicContact CG-CG 4.07Å; F632-R636 HydrophobicContact CZ-CG 4.48Å
633	L	90	Very high	92.2	Very high	55 Å²	55	48.4 Å²	48.4	29%	0.288	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.2	167.9	-175.9	65.6	0	0	0	111.8	V612 E615 R618 G631	V612-L633 HydrophobicContact CG1-CD2 3.97Å; V612-L633 WeakPolarHBondContact O-CB 3.27Å; V612-L633 PolarHBondContact O-N 3.01Å; V612-L633 VanDerWaalsContact O-N 3.09Å; E615-L633 HydrophobicContact CG-CD1 4.25Å; R618-L633 HydrophobicContact CB-CD2 3.96Å; R618-L633 HydrophobicContact CG-CD2 4.47Å; G631-L633 PolarHBondContact O-N 3.13Å
634	F	89.5	Confident	92.4	Very high	58 Å²	58	41.4 Å²	41.4	25%	0.254	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-61.4	-176.2	-55.1	-76.8	0	0	0	111.2	V422 M424 V612 R618 A629 G631 F632	V422-F634 HydrophobicContact CG2-CB 4.39Å; V422-F634 HydrophobicContact CG2-CD1 3.39Å; V422-F634 HydrophobicContact CG2-CD2 4.09Å; V422-F634 HydrophobicContact CG2-CE1 3.47Å; V422-F634 VanDerWaalsContact CG2-CE1 3.47Å; V422-F634 HydrophobicContact CG2-CE2 4.19Å; V422-F634 HydrophobicContact CG2-CG 3.69Å; V422-F634 HydrophobicContact CG2-CZ 3.88Å; M424-F634 HydrophobicContact SD-CZ 4.48Å; V612-F634 HydrophobicContact CB-CE2 4.09Å; V612-F634 HydrophobicContact CG1-CE2 4.04Å; R618-F634 HydrophobicContact CG-CZ 4.23Å; A629-F634 HydrophobicContact CB-CD2 4.19Å; A629-F634 HydrophobicContact CB-CE2 3.31Å; A629-F634 HydrophobicContact CB-CZ 3.64Å; G631-F634 PolarHBondContact O-N 3.44Å; F632-F634 PolarHBondContact O-N 3.4Å
635	A	90.7	Very high	92.4	Very high	15 Å²	15	45.8 Å²	45.8	12%	0.124	24%	0.239	C	C	.	.			trans	-161.1	150.1	173.3	0	0	0	0	0	111.3	Q419 P420 G631	Q419-A635 PolarHBondContact NE2-O 3.32Å; P420-A635 HydrophobicContact CG-CB 3.55Å; G631-A635 PolarHBondContact O-N 3.31Å; G631-A635 VanDerWaalsContact O-O 3.12Å
636	R	93.1	Very high	92.5	Very high	154 Å²	154	46.9 Å²	46.9	58%	0.581	24%	0.24	S	C	*	.			trans	-72.3	162.5	161.8	-70.7	179	176.4	-87.8	-6.3	109.4	F632 L638	F632-R636 HydrophobicContact CD1-CB 4.39Å; F632-R636 HydrophobicContact CD1-CG 3.64Å; F632-R636 HydrophobicContact CE1-CB 4.45Å; F632-R636 HydrophobicContact CE1-CG 3.88Å; F632-R636 VanDerWaalsContact CE2-NH1 3.28Å; F632-R636 HydrophobicContact CG-CG 4.07Å; F632-R636 HydrophobicContact CZ-CG 4.48Å; R636-L638 WeakPolarHBondContact O-CG 3.19Å; R636-L638 PolarHBondContact O-N 3.17Å
637	P	93.2	Very high	92.5	Very high	18 Å²	18	50.5 Å²	50.5	12%	0.117	25%	0.254	C	S	.	.			trans	-53.1	135.4	168.7	-27	37.4	0	0	0	110.8	W417 L418 Q419 L435	W417-P637 HydrophobicContact CB-CB 4.43Å; W417-P637 HydrophobicContact CE3-CB 4.35Å; W417-P637 VanDerWaalsContact CE3-O 3.31Å; L418-P637 WeakPolarHBondContact O-CA 3.39Å; Q419-P637 HydrophobicContact CB-CB 4.41Å; Q419-P637 HydrophobicContact CB-CG 4.16Å; Q419-P637 HydrophobicContact CG-CG 4.23Å; L435-P637 HydrophobicContact CD1-CB 3.79Å; L435-P637 HydrophobicContact CD1-CG 3.34Å
638	L	95.1	Very high	92.4	Very high	33 Å²	33	50.3 Å²	50.3	17%	0.173	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	148.8	-175.2	-60.3	172.8	0	0	0	110.5	W417 L418 R636 I642 F643 Y647	W417-L638 CarbonylContact C-O 3.59Å; W417-L638 WeakPolarHBondContact CA-O 3.45Å; W417-L638 WeakPolarHBondContact CB-O 3.26Å; L418-L638 PolarHBondContact N-O 3.32Å; L418-L638 PolarHBondContact O-N 3.45Å; R636-L638 WeakPolarHBondContact O-CG 3.19Å; R636-L638 PolarHBondContact O-N 3.17Å; L638-I642 HydrophobicContact CD1-CG2 4.36Å; L638-I642 HydrophobicContact CD2-CG2 4.18Å; L638-F643 HydrophobicContact CB-CB 4.23Å; L638-F643 HydrophobicContact CD1-CD2 4.46Å; L638-Y647 HydrophobicContact CD1-CE2 3.93Å
639	P	94.9	Very high	91.7	Very high	26 Å²	26	55 Å²	55	17%	0.169	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	151.1	161	-19.9	30.8	0	0	0	110.9	W417 E641 I642 F643	W417-P639 HydrophobicContact CD2-CG 4.27Å; W417-P639 HydrophobicContact CE3-CG 4.38Å; W417-P639 HydrophobicContact CH2-CG 3.82Å; W417-P639 HydrophobicContact CZ2-CG 3.67Å; W417-P639 HydrophobicContact CZ3-CG 4.17Å; P639-E641 VanDerWaalsContact C-N 3.25Å; P639-E641 PolarHBondContact O-N 3.43Å; P639-I642 HydrophobicContact CB-CG1 4.38Å; P639-I642 HydrophobicContact CG-CD1 3.89Å; P639-I642 HydrophobicContact CG-CG1 4.28Å; P639-I642 PolarHBondContact O-N 2.97Å; P639-F643 WeakPolarHBondContact O-CB 3.25Å; P639-F643 PolarHBondContact O-N 3.19Å
640	I	94.4	Very high	90	Very high	38 Å²	38	64.5 Å²	64.5	20%	0.195	31%	0.31	C	S	.	.	H	α-helix	trans	-54.1	-45.2	-178	-65.7	166.1	0	0	0	110.7	I416 L418 L475 I642 F643 E644	I416-I640 HydrophobicContact CD1-CD1 4.26Å; I416-I640 HydrophobicContact CG1-CD1 3.88Å; L418-I640 HydrophobicContact CD1-CG1 4.42Å; L418-I640 HydrophobicContact CG-CG1 4.43Å; L475-I640 HydrophobicContact CD1-CD1 4.49Å; L475-I640 HydrophobicContact CD1-CG2 3.78Å; L475-I640 HydrophobicContact CD2-CD1 4.01Å; L475-I640 HydrophobicContact CD2-CG1 4.08Å; L475-I640 HydrophobicContact CD2-CG2 4.36Å; I640-I642 PolarHBondContact O-N 3.47Å; I640-F643 WeakPolarHBondContact O-CB 3.44Å; I640-F643 PolarHBondContact O-N 3.3Å; I640-E644 HydrophobicContact CG2-CG 4.2Å; I640-E644 WeakPolarHBondContact O-CG 3.26Å; I640-E644 PolarHBondContact O-N 3.21Å
641	E	93.2	Very high	87.5	Confident	136 Å²	136	77 Å²	77	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-62.6	-44.2	-175.4	-56.8	75.7	-164.6	0	0	111.5	P639 F643 E644 E645	P639-E641 VanDerWaalsContact C-N 3.25Å; P639-E641 PolarHBondContact O-N 3.43Å; E641-F643 VanDerWaalsContact C-N 3.34Å; E641-E644 PolarHBondContact O-N 3.27Å; E641-E645 PolarHBondContact O-N 3.28Å; E641-E645 VanDerWaalsContact O-N 3.09Å
642	I	94.2	Very high	87.3	Confident	79 Å²	79	80.7 Å²	80.7	41%	0.405	38%	0.381	S	S	.	.	H	α-helix	trans	-69	-37	178.3	-58.6	-175.8	0	0	0	110.5	L638 P639 I640 S646	L638-I642 HydrophobicContact CD1-CG2 4.36Å; L638-I642 HydrophobicContact CD2-CG2 4.18Å; P639-I642 HydrophobicContact CB-CG1 4.38Å; P639-I642 HydrophobicContact CG-CD1 3.89Å; P639-I642 HydrophobicContact CG-CG1 4.28Å; P639-I642 PolarHBondContact O-N 2.97Å; I640-I642 PolarHBondContact O-N 3.47Å; I642-S646 VanDerWaalsContact O-CB 3.22Å; I642-S646 WeakPolarHBondContact O-CB 3.41Å; I642-S646 PolarHBondContact O-N 3.48Å; I642-S646 PolarHBondContact O-OG 3.23Å
643	F	95.1	Very high	87.1	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62.8	-46.4	175.6	-176.2	-83.4	0	0	0	111.2	L418 P420 L429 A432 W479 L486 L638 P639 I640 E641 S646 Y647 L648	L418-F643 HydrophobicContact CB-CB 4.24Å; L418-F643 HydrophobicContact CB-CD1 4.44Å; L418-F643 HydrophobicContact CB-CD2 3.58Å; L418-F643 HydrophobicContact CB-CE2 4.01Å; L418-F643 HydrophobicContact CB-CG 3.83Å; L418-F643 HydrophobicContact CD1-CB 4.07Å; L418-F643 HydrophobicContact CD1-CD1 3.56Å; L418-F643 HydrophobicContact CD1-CD2 4.2Å; L418-F643 HydrophobicContact CD1-CE1 4.03Å; L418-F643 HydrophobicContact CD1-CG 3.67Å; L418-F643 HydrophobicContact CG-CG 4.42Å; P420-F643 HydrophobicContact CB-CE2 3.85Å; P420-F643 HydrophobicContact CG-CE2 4.4Å; L429-F643 HydrophobicContact CD1-CZ 4.21Å; L429-F643 HydrophobicContact CD2-CE1 4.14Å; L429-F643 HydrophobicContact CD2-CZ 3.7Å; A432-F643 HydrophobicContact CB-CE1 4.4Å; A432-F643 HydrophobicContact CB-CE2 3.81Å; A432-F643 HydrophobicContact CB-CZ 3.56Å; W479-F643 HydrophobicContact CH2-CD1 4.29Å; W479-F643 AromaticContact CH2-CE1 3.95Å; W479-F643 HydrophobicContact CH2-CE1 3.95Å; W479-F643 HydrophobicContact CZ2-CD1 4.18Å; W479-F643 HydrophobicContact CZ2-CE1 4.24Å; L486-F643 HydrophobicContact CD2-CE1 3.8Å; L486-F643 HydrophobicContact CD2-CZ 3.97Å; L638-F643 HydrophobicContact CB-CB 4.23Å; L638-F643 HydrophobicContact CD1-CD2 4.46Å; P639-F643 WeakPolarHBondContact O-CB 3.25Å; P639-F643 PolarHBondContact O-N 3.19Å; I640-F643 WeakPolarHBondContact O-CB 3.44Å; I640-F643 PolarHBondContact O-N 3.3Å; E641-F643 VanDerWaalsContact C-N 3.34Å; F643-S646 PolarHBondContact O-N 2.99Å; F643-Y647 AromaticContact CD2-CD2 3.96Å; F643-Y647 HydrophobicContact CD2-CD2 3.96Å; F643-Y647 HydrophobicContact CD2-CE2 4.32Å; F643-Y647 AromaticContact CE2-CD2 4Å; F643-Y647 HydrophobicContact CE2-CD2 4Å; F643-Y647 HydrophobicContact CE2-CE2 4.39Å; F643-Y647 HydrophobicContact CG-CD2 4.29Å; F643-Y647 HydrophobicContact CZ-CD2 4.34Å; F643-Y647 WeakPolarHBondContact O-CD2 3.36Å; F643-Y647 PolarHBondContact O-N 3.23Å; F643-L648 HydrophobicContact CD1-CD1 4.44Å; F643-L648 HydrophobicContact CE1-CD1 4.26Å; F643-L648 HydrophobicContact CE1-CG 4.41Å
644	E	93.2	Very high	86.9	Confident	32 Å²	32	81.5 Å²	81.5	15%	0.15	39%	0.385	C	S	.	.	H	α-helix	trans	-61.3	-47.5	178.4	-69.8	-168.1	177.1	0	0	111.9	W479 R482 I640 E641 S646 L648 E649	W479-E644 HydrophobicContact CZ2-CG 4.47Å; W479-E644 PolarHBondContact NE1-OE1 2.88Å; R482-E644 IonicContact CZ-OE2 3.51Å; R482-E644 IonicContact NH1-OE1 3.73Å; R482-E644 IonicContact NH1-OE2 2.57Å; R482-E644 PolarHBondContact NH1-OE2 3.46Å; R482-E644 IonicContact NH2-OE2 3.55Å; I640-E644 HydrophobicContact CG2-CG 4.2Å; I640-E644 WeakPolarHBondContact O-CG 3.26Å; I640-E644 PolarHBondContact O-N 3.21Å; E641-E644 PolarHBondContact O-N 3.27Å; E644-S646 VanDerWaalsContact C-N 3.31Å; E644-S646 PolarHBondContact O-N 3.33Å; E644-L648 HydrophobicContact CG-CD1 4.16Å; E644-L648 WeakPolarHBondContact O-CA 3.46Å; E644-L648 WeakPolarHBondContact O-CB 3.46Å; E644-L648 PolarHBondContact O-N 2.88Å; E644-E649 PolarHBondContact O-N 3.14Å; E644-E649 VanDerWaalsContact O-N 3.09Å
645	E	92.1	Very high	86.8	Confident	124 Å²	124	82.9 Å²	82.9	58%	0.579	39%	0.393	S	S	*	.	H	α-helix	trans	-61	-39.2	177	-174.8	-178.5	-174.3	0	0	112	E641	E641-E645 PolarHBondContact O-N 3.28Å; E641-E645 VanDerWaalsContact O-N 3.09Å
646	S	90	Very high	86.5	Confident	66 Å²	66	87.1 Å²	87.1	46%	0.462	41%	0.41	S	S	.	.	H	α-helix	trans	-77.8	-29.9	-174.6	-61	0	0	0	0	113.6	I642 F643 E644	I642-S646 VanDerWaalsContact O-CB 3.22Å; I642-S646 WeakPolarHBondContact O-CB 3.41Å; I642-S646 PolarHBondContact O-N 3.48Å; I642-S646 PolarHBondContact O-OG 3.23Å; F643-S646 PolarHBondContact O-N 2.99Å; E644-S646 VanDerWaalsContact C-N 3.31Å; E644-S646 PolarHBondContact O-N 3.33Å
647	Y	90.1	Very high	86.1	Confident	78 Å²	78	82.7 Å²	82.7	31%	0.306	40%	0.398	S	S	.	.	H	α-helix	trans	-130	-21.2	-167	-66.1	-79.6	0	0	0	116.2	P420 L429 L638 F643	P420-Y647 HydrophobicContact CB-CE1 4.26Å; P420-Y647 HydrophobicContact CB-CE2 4.21Å; P420-Y647 HydrophobicContact CG-CE1 4.47Å; P420-Y647 HydrophobicContact CG-CE2 3.98Å; L429-Y647 HydrophobicContact CB-CD1 4.28Å; L429-Y647 HydrophobicContact CD1-CD1 4.43Å; L429-Y647 HydrophobicContact CD2-CD1 4.12Å; L429-Y647 HydrophobicContact CD2-CG 3.99Å; L638-Y647 HydrophobicContact CD1-CE2 3.93Å; F643-Y647 AromaticContact CD2-CD2 3.96Å; F643-Y647 HydrophobicContact CD2-CD2 3.96Å; F643-Y647 HydrophobicContact CD2-CE2 4.32Å; F643-Y647 AromaticContact CE2-CD2 4Å; F643-Y647 HydrophobicContact CE2-CD2 4Å; F643-Y647 HydrophobicContact CE2-CE2 4.39Å; F643-Y647 HydrophobicContact CG-CD2 4.29Å; F643-Y647 HydrophobicContact CZ-CD2 4.34Å; F643-Y647 WeakPolarHBondContact O-CD2 3.36Å; F643-Y647 PolarHBondContact O-N 3.23Å
648	L	87	Confident	85.6	Confident	33 Å²	33	87.3 Å²	87.3	17%	0.173	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-21.2	-171.7	-64.4	-178	0	0	0	113.7	W479 I484 L486 F643 E644	W479-L648 HydrophobicContact CD2-CD1 4.02Å; W479-L648 HydrophobicContact CG-CD1 4.48Å; W479-L648 HydrophobicContact CH2-CD1 4.25Å; W479-L648 HydrophobicContact CZ2-CD1 3.66Å; I484-L648 HydrophobicContact CD1-CB 4.16Å; I484-L648 HydrophobicContact CD1-CD1 4.29Å; I484-L648 HydrophobicContact CG2-CD1 4.24Å; I484-L648 HydrophobicContact CG2-CD2 3.78Å; L486-L648 HydrophobicContact CD2-CD2 4.18Å; F643-L648 HydrophobicContact CD1-CD1 4.44Å; F643-L648 HydrophobicContact CE1-CD1 4.26Å; F643-L648 HydrophobicContact CE1-CG 4.41Å; E644-L648 HydrophobicContact CG-CD1 4.16Å; E644-L648 WeakPolarHBondContact O-CA 3.46Å; E644-L648 WeakPolarHBondContact O-CB 3.46Å; E644-L648 PolarHBondContact O-N 2.88Å
649	E	79	Confident	84.9	Confident	111 Å²	111	91.5 Å²	91.5	52%	0.519	44%	0.437	S	S	.	.	S	Bend	trans	-78.6	124.3	170.3	-64.5	-172.2	164.4	0	0	110.4	E644 K651	E644-E649 PolarHBondContact O-N 3.14Å; E644-E649 VanDerWaalsContact O-N 3.09Å; E649-K651 PolarHBondContact O-N 2.94Å
650	E	59.1	Low	84	Confident	199 Å²	199	96.9 Å²	96.9	93%	0.93	46%	0.46	S	S	*	.			trans	-61.1	116.7	170.2	-75.8	-176.8	163.8	0	0	108.8
651	K	40.9	Very low	83.1	Confident	267 Å²	267	102.3 Å²	102.3	100%	1.161	48%	0.484	S	S	*	.			trans	-72.4	0	169.7	-84.8	-172.9	177.4	174.3	0	112.9	E649	E649-K651 PolarHBondContact O-N 2.94Å

Retrieved 651 of 651 residues in 478.9 ms (Link to these results)

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