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Protein translocase subunit SecY

The central subunit of the protein translocation channel SecYEG. Consists of two halves formed by TMs 1-5 and 6-10. These two domains form a lateral gate at the front which open onto the bilayer between TMs 2 and 7, and are clamped together by SecE at the back. The channel is closed by both a pore ring composed of hydrophobic SecY resides and a short helix (helix 2A) on the extracellular side of the membrane which forms a plug. The plug probably moves laterally to allow the channel to open. The ring and the pore may move independently.

AlphaFold DB (O08387), UniProt , Accession Q99S39, Species STAAM (Staphylococcus aureus (strain Mu50 / ATCC 700699)), Gene secY, Length 430 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.9	Low	66.9	Low	189 Å²	189	103.3 Å²	103.3	93%	0.931	51%	0.505	S	S	*	.				0	-50.1	0	-64.6	-160.6	-163.3	0	0	113.1	Q3 T4 L5	M1-Q3 VanDerWaalsContact C-N 3.32Å; M1-Q3 PolarHBondContact O-N 3.23Å; M1-T4 WeakPolarHBondContact O-CA 3.48Å; M1-T4 VanDerWaalsContact O-CB 3.28Å; M1-T4 WeakPolarHBondContact O-CB 3.46Å; M1-T4 PolarHBondContact O-N 2.93Å; M1-T4 PolarHBondContact O-OG1 3.5Å; M1-L5 PolarHBondContact O-N 3.21Å
2	I	62.5	Low	68	Low	144 Å²	144	107 Å²	107	74%	0.738	52%	0.516	S	S	*	.	H	α-helix	trans	-59.3	-41.5	179	-62.1	170.1	0	0	0	112	T4 L5 V6	I2-T4 VanDerWaalsContact C-N 3.29Å; I2-T4 PolarHBondContact O-N 3.41Å; I2-L5 WeakPolarHBondContact O-CB 3.47Å; I2-L5 PolarHBondContact O-N 2.95Å; I2-L5 VanDerWaalsContact O-N 3.15Å; I2-V6 WeakPolarHBondContact O-CG2 3.46Å; I2-V6 PolarHBondContact O-N 3Å
3	Q	64.6	Low	69.2	Low	160 Å²	160	105.7 Å²	105.7	75%	0.748	51%	0.509	S	S	*	.	H	α-helix	trans	-61.3	-36.4	174.3	-69.4	176.4	-7.9	0	0	112.6	M1 V6 N7	M1-Q3 VanDerWaalsContact C-N 3.32Å; M1-Q3 PolarHBondContact O-N 3.23Å; Q3-V6 PolarHBondContact O-N 2.97Å; Q3-N7 WeakPolarHBondContact O-CB 3.45Å; Q3-N7 PolarHBondContact O-N 3Å; Q3-N7 PolarHBondContact O-ND2 2.81Å; Q3-N7 PolarHBondContact O-OD1 3.16Å
4	T	65.2	Low	70.1	Confident	58 Å²	58	98.2 Å²	98.2	36%	0.356	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-40.6	174.6	-38.7	0	0	0	0	111.2	M1 I2 N7 F8	M1-T4 WeakPolarHBondContact O-CA 3.48Å; M1-T4 VanDerWaalsContact O-CB 3.28Å; M1-T4 WeakPolarHBondContact O-CB 3.46Å; M1-T4 PolarHBondContact O-N 2.93Å; M1-T4 PolarHBondContact O-OG1 3.5Å; I2-T4 VanDerWaalsContact C-N 3.29Å; I2-T4 PolarHBondContact O-N 3.41Å; T4-N7 PolarHBondContact O-N 3.01Å; T4-F8 HydrophobicContact CG2-CE1 4.44Å; T4-F8 HydrophobicContact CG2-CE2 3.94Å; T4-F8 HydrophobicContact CG2-CZ 3.79Å; T4-F8 VanDerWaalsContact O-CD2 3.29Å; T4-F8 WeakPolarHBondContact O-CD2 3.34Å; T4-F8 WeakPolarHBondContact O-CG 3.45Å; T4-F8 PolarHBondContact O-N 3.27Å
5	L	67	Low	71.1	Confident	106 Å²	106	97.7 Å²	97.7	56%	0.555	46%	0.464	S	S	*	.	H	α-helix	trans	-60.5	-47	173.7	-128	97.6	0	0	0	111.3	M1 I2 N7 F8 F9	M1-L5 PolarHBondContact O-N 3.21Å; I2-L5 WeakPolarHBondContact O-CB 3.47Å; I2-L5 PolarHBondContact O-N 2.95Å; I2-L5 VanDerWaalsContact O-N 3.15Å; L5-N7 VanDerWaalsContact C-N 3.28Å; L5-N7 PolarHBondContact O-N 3.3Å; L5-F8 WeakPolarHBondContact O-CB 3.32Å; L5-F8 PolarHBondContact O-N 3.47Å; L5-F9 WeakPolarHBondContact O-CD2 3.28Å; L5-F9 PolarHBondContact O-N 3.45Å
6	V	69.4	Low	72.1	Confident	67 Å²	67	96.5 Å²	96.5	41%	0.406	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-38	175.9	175.1	0	0	0	0	111	I2 Q3 F9 R10	I2-V6 WeakPolarHBondContact O-CG2 3.46Å; I2-V6 PolarHBondContact O-N 3Å; Q3-V6 PolarHBondContact O-N 2.97Å; V6-F9 PolarHBondContact O-N 3.27Å; V6-R10 WeakPolarHBondContact O-CG 3.42Å; V6-R10 PolarHBondContact O-N 3.5Å
7	N	68.9	Low	73	Confident	63 Å²	63	93.4 Å²	93.4	34%	0.337	45%	0.445	S	S	.	.	H	α-helix	trans	-67.1	-34.1	177.2	-69.2	-13.1	0	0	0	112.8	Q3 T4 L5 F9 R10 T11	Q3-N7 WeakPolarHBondContact O-CB 3.45Å; Q3-N7 PolarHBondContact O-N 3Å; Q3-N7 PolarHBondContact O-ND2 2.81Å; Q3-N7 PolarHBondContact O-OD1 3.16Å; T4-N7 PolarHBondContact O-N 3.01Å; L5-N7 VanDerWaalsContact C-N 3.28Å; L5-N7 PolarHBondContact O-N 3.3Å; N7-F9 VanDerWaalsContact C-N 3.33Å; N7-F9 PolarHBondContact O-N 3Å; N7-R10 PolarHBondContact O-N 2.94Å; N7-T11 PolarHBondContact O-N 3.47Å; N7-T11 PolarHBondContact O-OG1 3.48Å
8	F	67.8	Low	73.9	Confident	18 Å²	18	89.8 Å²	89.8	8%	0.079	43%	0.429	C	S	.	.	H	α-helix	trans	-61.6	-41.6	171.9	-65.1	-45.2	0	0	0	111.8	T4 L5 V14 L415 E416 V419	T4-F8 HydrophobicContact CG2-CE1 4.44Å; T4-F8 HydrophobicContact CG2-CE2 3.94Å; T4-F8 HydrophobicContact CG2-CZ 3.79Å; T4-F8 VanDerWaalsContact O-CD2 3.29Å; T4-F8 WeakPolarHBondContact O-CD2 3.34Å; T4-F8 WeakPolarHBondContact O-CG 3.45Å; T4-F8 PolarHBondContact O-N 3.27Å; L5-F8 WeakPolarHBondContact O-CB 3.32Å; L5-F8 PolarHBondContact O-N 3.47Å; F8-V14 HydrophobicContact CB-CG1 4.28Å; F8-V14 HydrophobicContact CD1-CG1 4.4Å; F8-L415 HydrophobicContact CE1-CB 4.11Å; F8-L415 HydrophobicContact CZ-CB 4.21Å; F8-E416 HydrophobicContact CZ-CG 4.15Å; F8-V419 HydrophobicContact CD1-CG2 3.54Å; F8-V419 HydrophobicContact CE1-CB 4.21Å; F8-V419 HydrophobicContact CE1-CG2 3.49Å; F8-V419 VanDerWaalsContact CE1-CG2 3.49Å
9	F	71.7	Confident	74.8	Confident	103 Å²	103	91.1 Å²	91.1	45%	0.452	43%	0.433	S	S	.	.	H	α-helix	trans	-73.1	-24.8	177.1	-81.7	-83.9	0	0	0	113.8	L5 V6 N7 R15	L5-F9 WeakPolarHBondContact O-CD2 3.28Å; L5-F9 PolarHBondContact O-N 3.45Å; V6-F9 PolarHBondContact O-N 3.27Å; N7-F9 VanDerWaalsContact C-N 3.33Å; N7-F9 PolarHBondContact O-N 3Å; F9-R15 WeakPolarHBondContact O-CD 3.47Å
10	R	68.6	Low	75.6	Confident	190 Å²	190	89.4 Å²	89.4	72%	0.717	42%	0.424	S	S	*	.	H	α-helix	trans	-73.7	-32.1	176.3	-76.6	176.8	175.4	-170.2	-2.3	113.2	V6 N7 K12	V6-R10 WeakPolarHBondContact O-CG 3.42Å; V6-R10 PolarHBondContact O-N 3.5Å; N7-R10 PolarHBondContact O-N 2.94Å; R10-K12 PolarHBondContact O-N 2.72Å
11	T	74.8	Confident	76.4	Confident	38 Å²	38	85.7 Å²	85.7	23%	0.233	41%	0.407	C	S	.	.	S	Bend	trans	-78	107.9	-176.8	-53.3	0	0	0	0	110.4	N7 E13 V14 R15 K422	N7-T11 PolarHBondContact O-N 3.47Å; N7-T11 PolarHBondContact O-OG1 3.48Å; T11-E13 PolarHBondContact O-N 3.43Å; T11-E13 VanDerWaalsContact O-N 3.08Å; T11-V14 HydrophobicContact CG2-CB 4.42Å; T11-V14 HydrophobicContact CG2-CG2 3.96Å; T11-V14 PolarHBondContact O-N 2.86Å; T11-V14 VanDerWaalsContact O-N 3.09Å; T11-R15 WeakPolarHBondContact O-CB 3.23Å; T11-R15 PolarHBondContact O-N 3.28Å; T11-K422 HydrophobicContact CG2-CD 4.08Å
12	K	80.2	Confident	78.1	Confident	148 Å²	148	81 Å²	81	64%	0.643	39%	0.385	S	S	*	.	H	α-helix	trans	-47.2	-43.4	-174.5	-175.6	177.7	179.3	-178.7	0	113.7	R10 N16	R10-K12 PolarHBondContact O-N 2.72Å; K12-N16 WeakPolarHBondContact O-CB 3.38Å; K12-N16 PolarHBondContact O-N 3.41Å; K12-N16 PolarHBondContact O-OD1 2.89Å
13	E	82.7	Confident	79.5	Confident	90 Å²	90	76.3 Å²	76.3	42%	0.421	37%	0.368	S	S	.	.	H	α-helix	trans	-68	-49.6	-179.4	-167.3	-166.8	153.6	0	0	112.6	T11 R15 N16 K17 K422	T11-E13 PolarHBondContact O-N 3.43Å; T11-E13 VanDerWaalsContact O-N 3.08Å; E13-R15 VanDerWaalsContact C-N 3.32Å; E13-R15 PolarHBondContact O-N 2.92Å; E13-N16 PolarHBondContact O-N 2.73Å; E13-K17 WeakPolarHBondContact O-CG 3.17Å; E13-K17 PolarHBondContact O-N 3.01Å; E13-K17 WeakPolarHBondContact OE1-CE 3.27Å; E13-K17 IonicContact OE1-NZ 2.71Å; E13-K17 PolarHBondContact OE1-NZ 2.87Å; E13-K422 WeakPolarHBondContact OE2-CE 3.31Å; E13-K422 IonicContact OE2-NZ 3.02Å; E13-K422 PolarHBondContact OE2-NZ 3.19Å
14	V	82.1	Confident	80.8	Confident	1 Å²	1	70 Å²	70	1%	0.006	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-43.9	179.7	177.6	0	0	0	0	110	F8 T11 N16 K17 I18 L415 V419	F8-V14 HydrophobicContact CB-CG1 4.28Å; F8-V14 HydrophobicContact CD1-CG1 4.4Å; T11-V14 HydrophobicContact CG2-CB 4.42Å; T11-V14 HydrophobicContact CG2-CG2 3.96Å; T11-V14 PolarHBondContact O-N 2.86Å; T11-V14 VanDerWaalsContact O-N 3.09Å; V14-N16 PolarHBondContact O-N 3.49Å; V14-K17 PolarHBondContact O-N 3.17Å; V14-I18 HydrophobicContact CG1-CD1 3.88Å; V14-I18 HydrophobicContact CG1-CG1 4.42Å; V14-I18 WeakPolarHBondContact O-CG1 3.32Å; V14-I18 PolarHBondContact O-N 3.44Å; V14-L415 HydrophobicContact CG1-CD2 3.72Å; V14-V419 HydrophobicContact CG2-CG2 4.24Å
15	R	84.7	Confident	82	Confident	90 Å²	90	68.8 Å²	68.8	34%	0.34	33%	0.33	S	S	.	.	H	α-helix	trans	-56.5	-46.3	175	-174.4	-167.3	69.9	-173.9	3.1	112.2	F9 T11 E13 K17 I18 F19	F9-R15 WeakPolarHBondContact O-CD 3.47Å; T11-R15 WeakPolarHBondContact O-CB 3.23Å; T11-R15 PolarHBondContact O-N 3.28Å; E13-R15 VanDerWaalsContact C-N 3.32Å; E13-R15 PolarHBondContact O-N 2.92Å; R15-K17 VanDerWaalsContact C-N 3.35Å; R15-K17 PolarHBondContact O-N 3.32Å; R15-I18 PolarHBondContact O-N 3.49Å; R15-F19 HydrophobicContact CG-CD2 3.7Å; R15-F19 HydrophobicContact CG-CE2 3.42Å; R15-F19 VanDerWaalsContact CG-CE2 3.42Å; R15-F19 HydrophobicContact CG-CZ 4.49Å; R15-F19 VanDerWaalsContact O-CD2 3.25Å; R15-F19 WeakPolarHBondContact O-CD2 3.41Å; R15-F19 PolarHBondContact O-N 3.35Å
16	N	87.7	Confident	83.1	Confident	79 Å²	79	67.8 Å²	67.8	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-64.2	-39.8	178.6	-72.8	1.3	0	0	0	111.7	K12 E13 V14 F19 F20	K12-N16 WeakPolarHBondContact O-CB 3.38Å; K12-N16 PolarHBondContact O-N 3.41Å; K12-N16 PolarHBondContact O-OD1 2.89Å; E13-N16 PolarHBondContact O-N 2.73Å; V14-N16 PolarHBondContact O-N 3.49Å; N16-F19 PolarHBondContact O-N 3.24Å; N16-F20 WeakPolarHBondContact O-CB 3.36Å; N16-F20 PolarHBondContact O-N 2.87Å
17	K	88.2	Confident	84.1	Confident	43 Å²	43	67.9 Å²	67.9	19%	0.187	33%	0.326	C	S	.	.	H	α-helix	trans	-63.5	-40.6	174.3	-66.1	-177.5	-177.3	167.2	0	112.1	E13 V14 R15 F20 T21 F174 V176	E13-K17 WeakPolarHBondContact O-CG 3.17Å; E13-K17 PolarHBondContact O-N 3.01Å; E13-K17 WeakPolarHBondContact OE1-CE 3.27Å; E13-K17 IonicContact OE1-NZ 2.71Å; E13-K17 PolarHBondContact OE1-NZ 2.87Å; V14-K17 PolarHBondContact O-N 3.17Å; R15-K17 VanDerWaalsContact C-N 3.35Å; R15-K17 PolarHBondContact O-N 3.32Å; K17-F20 PolarHBondContact O-N 2.86Å; K17-T21 WeakPolarHBondContact O-CB 3.25Å; K17-T21 PolarHBondContact O-N 3.26Å; K17-T21 PolarHBondContact O-OG1 3.15Å; K17-F174 WeakPolarHBondContact CG-O 3.45Å; K17-V176 HydrophobicContact CB-CG2 3.75Å
18	I	87.8	Confident	85	Confident	30 Å²	30	65.1 Å²	65.1	15%	0.154	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-49.2	175.8	-67.8	167.6	0	0	0	110.3	V14 R15 F20 T21 L22 V176	V14-I18 HydrophobicContact CG1-CD1 3.88Å; V14-I18 HydrophobicContact CG1-CG1 4.42Å; V14-I18 WeakPolarHBondContact O-CG1 3.32Å; V14-I18 PolarHBondContact O-N 3.44Å; R15-I18 PolarHBondContact O-N 3.49Å; I18-F20 VanDerWaalsContact C-N 3.33Å; I18-F20 PolarHBondContact O-N 2.9Å; I18-T21 WeakPolarHBondContact O-CB 3.38Å; I18-T21 PolarHBondContact O-N 3.42Å; I18-L22 HydrophobicContact CG2-CD1 4.04Å; I18-L22 HydrophobicContact CG2-CG 4.43Å; I18-L22 WeakPolarHBondContact O-CG 3.3Å; I18-L22 PolarHBondContact O-N 3.37Å; I18-V176 HydrophobicContact CG1-CG2 3.86Å
19	F	90.7	Very high	85.8	Confident	114 Å²	114	66.9 Å²	66.9	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-39.4	178	-78.4	-55.3	0	0	0	112.6	R15 N16 L22 A23	R15-F19 HydrophobicContact CG-CD2 3.7Å; R15-F19 HydrophobicContact CG-CE2 3.42Å; R15-F19 VanDerWaalsContact CG-CE2 3.42Å; R15-F19 HydrophobicContact CG-CZ 4.49Å; R15-F19 VanDerWaalsContact O-CD2 3.25Å; R15-F19 WeakPolarHBondContact O-CD2 3.41Å; R15-F19 PolarHBondContact O-N 3.35Å; N16-F19 PolarHBondContact O-N 3.24Å; F19-L22 PolarHBondContact O-N 3.01Å; F19-A23 WeakPolarHBondContact O-CB 3.06Å; F19-A23 PolarHBondContact O-N 2.96Å
20	F	92.5	Very high	86.6	Confident	57 Å²	57	66.7 Å²	66.7	25%	0.25	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-45.8	173.6	-175.7	-89.6	0	0	0	111.3	N16 K17 I18 L22 A23 M24 Q170 F174	N16-F20 WeakPolarHBondContact O-CB 3.36Å; N16-F20 PolarHBondContact O-N 2.87Å; K17-F20 PolarHBondContact O-N 2.86Å; I18-F20 VanDerWaalsContact C-N 3.33Å; I18-F20 PolarHBondContact O-N 2.9Å; F20-L22 PolarHBondContact O-N 3.24Å; F20-A23 PolarHBondContact O-N 3.44Å; F20-M24 HydrophobicContact CD1-CG 4.02Å; F20-M24 HydrophobicContact CD2-CE 4.36Å; F20-M24 HydrophobicContact CE1-CE 4.11Å; F20-M24 HydrophobicContact CE1-CG 3.68Å; F20-M24 HydrophobicContact CE1-SD 4.39Å; F20-M24 HydrophobicContact CE2-CE 3.67Å; F20-M24 HydrophobicContact CZ-CE 3.53Å; F20-M24 HydrophobicContact CZ-CG 4.1Å; F20-M24 HydrophobicContact CZ-SD 4.27Å; F20-M24 VanDerWaalsContact O-CG 3.26Å; F20-M24 WeakPolarHBondContact O-CG 3.36Å; F20-M24 PolarHBondContact O-N 2.98Å; F20-Q170 HydrophobicContact CE1-CB 4.29Å; F20-Q170 WeakPolarHBondContact CE1-O 3.17Å; F20-Q170 HydrophobicContact CZ-CB 4.22Å; F20-F174 HydrophobicContact CD1-CB 3.78Å; F20-F174 HydrophobicContact CD2-CB 4.35Å; F20-F174 HydrophobicContact CE1-CB 3.57Å; F20-F174 HydrophobicContact CE1-CD2 4.48Å; F20-F174 HydrophobicContact CE1-CG 4.49Å; F20-F174 HydrophobicContact CE2-CB 4.14Å; F20-F174 HydrophobicContact CG-CB 4.17Å; F20-F174 HydrophobicContact CZ-CB 3.74Å; F20-F174 HydrophobicContact CZ-CD2 4.07Å; F20-F174 HydrophobicContact CZ-CG 4.26Å
21	T	91.4	Very high	87.3	Confident	12 Å²	12	57.9 Å²	57.9	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-45.8	177.3	-54	0	0	0	0	111.2	K17 I18 M24 L25 I171 G175 V176 I182	K17-T21 WeakPolarHBondContact O-CB 3.25Å; K17-T21 PolarHBondContact O-N 3.26Å; K17-T21 PolarHBondContact O-OG1 3.15Å; I18-T21 WeakPolarHBondContact O-CB 3.38Å; I18-T21 PolarHBondContact O-N 3.42Å; T21-M24 PolarHBondContact O-N 3.06Å; T21-L25 WeakPolarHBondContact O-CG 3.44Å; T21-L25 PolarHBondContact O-N 2.94Å; T21-I171 HydrophobicContact CG2-CG2 3.9Å; T21-G175 WeakPolarHBondContact OG1-CA 3.34Å; T21-V176 PolarHBondContact OG1-N 3.1Å; T21-I182 HydrophobicContact CG2-CD1 4.14Å; T21-I182 HydrophobicContact CG2-CG2 3.95Å
22	L	91.4	Very high	87.5	Confident	89 Å²	89	56.2 Å²	56.2	47%	0.466	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-42.6	176.4	-71.1	173.5	0	0	0	112.1	I18 F19 F20 M24 L25 V26	I18-L22 HydrophobicContact CG2-CD1 4.04Å; I18-L22 HydrophobicContact CG2-CG 4.43Å; I18-L22 WeakPolarHBondContact O-CG 3.3Å; I18-L22 PolarHBondContact O-N 3.37Å; F19-L22 PolarHBondContact O-N 3.01Å; F20-L22 PolarHBondContact O-N 3.24Å; L22-M24 VanDerWaalsContact C-N 3.33Å; L22-M24 PolarHBondContact O-N 3.47Å; L22-L25 PolarHBondContact O-N 2.89Å; L22-V26 WeakPolarHBondContact O-CG2 2.98Å; L22-V26 PolarHBondContact O-N 3.36Å
23	A	92.6	Very high	87.5	Confident	47 Å²	47	55 Å²	55	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-42.9	176.2	0	0	0	0	0	111.7	F19 F20 L25 V26 I27	F19-A23 WeakPolarHBondContact O-CB 3.06Å; F19-A23 PolarHBondContact O-N 2.96Å; F20-A23 PolarHBondContact O-N 3.44Å; A23-L25 PolarHBondContact O-N 3.21Å; A23-V26 WeakPolarHBondContact O-CB 3.34Å; A23-V26 PolarHBondContact O-N 2.94Å; A23-I27 WeakPolarHBondContact O-CG1 3.21Å; A23-I27 PolarHBondContact O-N 3.25Å
24	M	92.1	Very high	87.6	Confident	26 Å²	26	54.8 Å²	54.8	13%	0.128	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-36.8	175.9	-66.8	-67.4	143.3	0	0	112.3	F20 T21 L22 I27 F28 L167 I171	F20-M24 HydrophobicContact CD1-CG 4.02Å; F20-M24 HydrophobicContact CD2-CE 4.36Å; F20-M24 HydrophobicContact CE1-CE 4.11Å; F20-M24 HydrophobicContact CE1-CG 3.68Å; F20-M24 HydrophobicContact CE1-SD 4.39Å; F20-M24 HydrophobicContact CE2-CE 3.67Å; F20-M24 HydrophobicContact CZ-CE 3.53Å; F20-M24 HydrophobicContact CZ-CG 4.1Å; F20-M24 HydrophobicContact CZ-SD 4.27Å; F20-M24 VanDerWaalsContact O-CG 3.26Å; F20-M24 WeakPolarHBondContact O-CG 3.36Å; F20-M24 PolarHBondContact O-N 2.98Å; T21-M24 PolarHBondContact O-N 3.06Å; L22-M24 VanDerWaalsContact C-N 3.33Å; L22-M24 PolarHBondContact O-N 3.47Å; M24-I27 HydrophobicContact CE-CD1 4.14Å; M24-I27 PolarHBondContact O-N 2.81Å; M24-I27 HydrophobicContact SD-CD1 4.12Å; M24-F28 PolarHBondContact O-N 3.32Å; M24-L167 HydrophobicContact CB-CD2 4.03Å; M24-L167 HydrophobicContact CB-CG 4.3Å; M24-L167 HydrophobicContact SD-CG 4.16Å; M24-I171 HydrophobicContact CB-CD1 3.7Å; M24-I171 HydrophobicContact CB-CG1 3.55Å; M24-I171 HydrophobicContact CG-CG1 3.88Å
25	L	90	Very high	87.4	Confident	33 Å²	33	57.8 Å²	57.8	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-34.4	173.5	-72.5	-178.3	0	0	0	112.8	T21 L22 A23 F28 K29 I182 A186	T21-L25 WeakPolarHBondContact O-CG 3.44Å; T21-L25 PolarHBondContact O-N 2.94Å; L22-L25 PolarHBondContact O-N 2.89Å; A23-L25 PolarHBondContact O-N 3.21Å; L25-F28 WeakPolarHBondContact O-CB 3.31Å; L25-F28 PolarHBondContact O-N 2.94Å; L25-K29 WeakPolarHBondContact O-CB 3.47Å; L25-K29 PolarHBondContact O-N 3.5Å; L25-I182 HydrophobicContact CD1-CG2 4.01Å; L25-I182 HydrophobicContact CD2-CG2 3.92Å; L25-I182 HydrophobicContact CG-CG2 4.23Å; L25-A186 HydrophobicContact CD1-CB 4.16Å; L25-A186 HydrophobicContact CD2-CB 3.39Å; L25-A186 HydrophobicContact CG-CB 4.33Å
26	V	90.3	Very high	87.1	Confident	85 Å²	85	53.7 Å²	53.7	52%	0.515	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-45.3	172	171.1	0	0	0	0	110.3	L22 A23 F28 K29 I30	L22-V26 WeakPolarHBondContact O-CG2 2.98Å; L22-V26 PolarHBondContact O-N 3.36Å; A23-V26 WeakPolarHBondContact O-CB 3.34Å; A23-V26 PolarHBondContact O-N 2.94Å; V26-F28 VanDerWaalsContact C-N 3.34Å; V26-F28 PolarHBondContact O-N 3.37Å; V26-K29 PolarHBondContact O-N 3.19Å; V26-K29 VanDerWaalsContact O-N 3.14Å; V26-I30 HydrophobicContact CG1-CD1 3.75Å; V26-I30 HydrophobicContact CG1-CG1 4.34Å; V26-I30 VanDerWaalsContact O-CG1 3.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.28Å; V26-I30 PolarHBondContact O-N 3.45Å
27	I	90.9	Very high	86.4	Confident	69 Å²	69	53.3 Å²	53.3	35%	0.354	28%	0.279	S	S	.	.	H	α-helix	trans	-58.9	-45.8	174.9	-66.7	165.8	0	0	0	110.9	A23 M24 K29 I30 G31 F163 L167	A23-I27 WeakPolarHBondContact O-CG1 3.21Å; A23-I27 PolarHBondContact O-N 3.25Å; M24-I27 HydrophobicContact CE-CD1 4.14Å; M24-I27 PolarHBondContact O-N 2.81Å; M24-I27 HydrophobicContact SD-CD1 4.12Å; I27-K29 VanDerWaalsContact C-N 3.32Å; I27-K29 PolarHBondContact O-N 2.97Å; I27-I30 PolarHBondContact O-N 3.26Å; I27-G31 PolarHBondContact O-N 3.46Å; I27-F163 HydrophobicContact CG2-CE1 4.07Å; I27-F163 HydrophobicContact CG2-CZ 4.1Å; I27-L167 HydrophobicContact CB-CD1 4.29Å; I27-L167 HydrophobicContact CG2-CD1 3.9Å
28	F	87.7	Confident	85.3	Confident	5 Å²	5	52.9 Å²	52.9	2%	0.022	29%	0.287	C	S	.	.	H	α-helix	trans	-54.2	-49.7	173.6	166.9	-112.9	0	0	0	111.1	M24 L25 V26 G31 T32 F71 L164 I183	M24-F28 PolarHBondContact O-N 3.32Å; L25-F28 WeakPolarHBondContact O-CB 3.31Å; L25-F28 PolarHBondContact O-N 2.94Å; V26-F28 VanDerWaalsContact C-N 3.34Å; V26-F28 PolarHBondContact O-N 3.37Å; F28-G31 PolarHBondContact O-N 2.82Å; F28-T32 HydrophobicContact CE2-CG2 4.22Å; F28-T32 HydrophobicContact CZ-CG2 4.17Å; F28-T32 WeakPolarHBondContact O-CG2 3.2Å; F28-T32 PolarHBondContact O-N 2.66Å; F28-F71 HydrophobicContact CD2-CD2 4.19Å; F28-F71 HydrophobicContact CD2-CE2 4.38Å; F28-F71 HydrophobicContact CE2-CD2 4.4Å; F28-F71 WeakPolarHBondContact O-CE2 3.21Å; F28-L164 HydrophobicContact CD2-CD2 3.45Å; F28-L164 VanDerWaalsContact CD2-CD2 3.45Å; F28-L164 HydrophobicContact CE2-CD2 3.85Å; F28-I183 HydrophobicContact CD1-CG2 4.23Å; F28-I183 HydrophobicContact CD2-CG2 3.75Å; F28-I183 HydrophobicContact CE1-CG2 4.09Å; F28-I183 HydrophobicContact CE2-CG2 3.6Å; F28-I183 HydrophobicContact CG-CG2 4.06Å; F28-I183 HydrophobicContact CZ-CG2 3.78Å
29	K	84.7	Confident	84.3	Confident	56 Å²	56	52 Å²	52	24%	0.243	28%	0.283	C	S	.	.	H	α-helix	trans	-66.8	-40.7	-177.8	-166.7	64.6	-177.5	171.4	0	112.2	L25 V26 I27 G31 T32 Y33 G62 S190	L25-K29 WeakPolarHBondContact O-CB 3.47Å; L25-K29 PolarHBondContact O-N 3.5Å; V26-K29 PolarHBondContact O-N 3.19Å; V26-K29 VanDerWaalsContact O-N 3.14Å; I27-K29 VanDerWaalsContact C-N 3.32Å; I27-K29 PolarHBondContact O-N 2.97Å; K29-G31 VanDerWaalsContact C-N 3.3Å; K29-G31 PolarHBondContact O-N 2.81Å; K29-T32 WeakPolarHBondContact O-CB 3.36Å; K29-T32 PolarHBondContact O-N 3.16Å; K29-T32 PolarHBondContact O-OG1 2.85Å; K29-Y33 HydrophobicContact CD-CE2 4.39Å; K29-Y33 HydrophobicContact CG-CE2 3.97Å; K29-Y33 WeakPolarHBondContact O-CD2 3.39Å; K29-G62 PolarHBondContact NZ-O 2.94Å; K29-G62 VanDerWaalsContact NZ-O 3.13Å; K29-S190 PolarHBondContact NZ-OG 2.76Å
30	I	87.5	Confident	83.1	Confident	99 Å²	99	50.1 Å²	50.1	51%	0.508	28%	0.278	S	S	.	.	H	α-helix	trans	-57	-45.5	174.3	-69.1	166	0	0	0	110.3	V26 I27 T32 Y33	V26-I30 HydrophobicContact CG1-CD1 3.75Å; V26-I30 HydrophobicContact CG1-CG1 4.34Å; V26-I30 VanDerWaalsContact O-CG1 3.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.28Å; V26-I30 PolarHBondContact O-N 3.45Å; I27-I30 PolarHBondContact O-N 3.26Å; I30-T32 VanDerWaalsContact C-N 3.25Å; I30-T32 PolarHBondContact O-N 3.32Å; I30-Y33 WeakPolarHBondContact O-CB 3.44Å; I30-Y33 PolarHBondContact O-N 2.87Å
31	G	84.5	Confident	81.6	Confident	4 Å²	4	50 Å²	50	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-23.7	178.1	0	0	0	0	0	114.1	I27 F28 K29 Y33 I34 I70 F71	I27-G31 PolarHBondContact O-N 3.46Å; F28-G31 PolarHBondContact O-N 2.82Å; K29-G31 VanDerWaalsContact C-N 3.3Å; K29-G31 PolarHBondContact O-N 2.81Å; G31-Y33 PolarHBondContact O-N 2.63Å; G31-I34 PolarHBondContact O-N 2.58Å; G31-I70 WeakPolarHBondContact O-CG1 3.2Å; G31-F71 VanDerWaalsContact C-CD2 3.49Å; G31-F71 VanDerWaalsContact CA-CE2 3.41Å
32	T	79	Confident	80.2	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-17	170.8	69.5	0	0	0	0	113.7	F28 K29 I30 A64 S69 F71	F28-T32 HydrophobicContact CE2-CG2 4.22Å; F28-T32 HydrophobicContact CZ-CG2 4.17Å; F28-T32 WeakPolarHBondContact O-CG2 3.2Å; F28-T32 PolarHBondContact O-N 2.66Å; K29-T32 WeakPolarHBondContact O-CB 3.36Å; K29-T32 PolarHBondContact O-N 3.16Å; K29-T32 PolarHBondContact O-OG1 2.85Å; I30-T32 VanDerWaalsContact C-N 3.25Å; I30-T32 PolarHBondContact O-N 3.32Å; T32-A64 HydrophobicContact CG2-CB 4.39Å; T32-S69 WeakPolarHBondContact O-CB 3.2Å; T32-S69 PolarHBondContact O-OG 2.95Å; T32-F71 HydrophobicContact CG2-CD2 4.28Å
33	Y	80.3	Confident	78.5	Confident	123 Å²	123	48 Å²	48	48%	0.482	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-11.3	176.7	-70.3	-75.3	0	0	0	113.8	K29 I30 G31 P35 R67	K29-Y33 HydrophobicContact CD-CE2 4.39Å; K29-Y33 HydrophobicContact CG-CE2 3.97Å; K29-Y33 WeakPolarHBondContact O-CD2 3.39Å; I30-Y33 WeakPolarHBondContact O-CB 3.44Å; I30-Y33 PolarHBondContact O-N 2.87Å; G31-Y33 PolarHBondContact O-N 2.63Å; Y33-P35 VanDerWaalsContact O-CD 3.24Å; Y33-P35 WeakPolarHBondContact O-CD 3.17Å; Y33-R67 VanDerWaalsContact CE1-NH1 3.32Å
34	I	83.2	Confident	76.7	Confident	84 Å²	84	47.6 Å²	47.6	43%	0.431	27%	0.27	S	S	.	.	S	Bend	trans	-88.2	106.2	-179.7	-57	174.8	0	0	0	108.7	G31 S69 I70	G31-I34 PolarHBondContact O-N 2.58Å; I34-S69 CarbonylContact O-C 3.46Å; I34-S69 WeakPolarHBondContact O-CA 3.39Å; I34-S69 WeakPolarHBondContact O-CB 3.41Å; I34-I70 HydrophobicContact CB-CD1 4.26Å; I34-I70 HydrophobicContact CB-CG1 4.36Å; I34-I70 HydrophobicContact CD1-CD1 4.35Å; I34-I70 HydrophobicContact CG2-CD1 4.49Å; I34-I70 HydrophobicContact CG2-CG2 4.17Å; I34-I70 PolarHBondContact O-N 3.4Å
35	P	79.3	Confident	75	Confident	64 Å²	64	51.9 Å²	51.9	42%	0.416	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-65.6	148.4	177.6	29.1	-34.2	0	0	0	110.6	Y33	Y33-P35 VanDerWaalsContact O-CD 3.24Å; Y33-P35 WeakPolarHBondContact O-CD 3.17Å
36	A	76.6	Confident	73.2	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.033	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-63.6	145	171.3	0	0	0	0	0	110.2	G38 V39 F68 V156	A36-G38 PolarHBondContact O-N 3.16Å; A36-V39 HydrophobicContact CB-CG2 3.82Å; A36-V39 WeakPolarHBondContact O-CG2 3.46Å; A36-F68 HydrophobicContact CB-CD1 4.43Å; A36-F68 PolarHBondContact N-O 3.16Å; A36-V156 HydrophobicContact CB-CG1 4.19Å
37	P	73.4	Confident	71.4	Confident	71 Å²	71	57.2 Å²	57.2	46%	0.461	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	136.9	173.4	-23.6	34.4	0	0	0	111.3
38	G	65.3	Low	69.3	Low	35 Å²	35	61.6 Å²	61.6	36%	0.361	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	3.5	175.3	0	0	0	0	0	115.6	A36 I142 I143	A36-G38 PolarHBondContact O-N 3.16Å; G38-I142 WeakPolarHBondContact O-CA 3.42Å; G38-I143 PolarHBondContact O-N 2.97Å
39	V	67.1	Low	67.5	Low	11 Å²	11	63.2 Å²	63.2	7%	0.067	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-107.5	138.5	171.4	-75.3	0	0	0	0	112.9	A36 P41 F68 L141 I142 I153	A36-V39 HydrophobicContact CB-CG2 3.82Å; A36-V39 WeakPolarHBondContact O-CG2 3.46Å; V39-P41 VanDerWaalsContact O-CD 3.3Å; V39-P41 WeakPolarHBondContact O-CD 3.29Å; V39-F68 HydrophobicContact CB-CD1 4.29Å; V39-F68 HydrophobicContact CG1-CD1 3.75Å; V39-F68 HydrophobicContact CG1-CE1 4.11Å; V39-F68 HydrophobicContact CG1-CG 4.38Å; V39-F68 HydrophobicContact CG2-CB 4.16Å; V39-F68 HydrophobicContact CG2-CD1 3.94Å; V39-F68 HydrophobicContact CG2-CG 4.45Å; V39-L141 CarbonylContact C-O 3.51Å; V39-L141 WeakPolarHBondContact CA-O 3.31Å; V39-L141 HydrophobicContact CB-CG 4.24Å; V39-L141 HydrophobicContact CG1-CD2 3.83Å; V39-L141 HydrophobicContact CG1-CG 3.8Å; V39-I142 HydrophobicContact CG1-CG1 4.36Å; V39-I153 HydrophobicContact CG1-CD1 3.94Å
40	N	66.3	Low	65.9	Low	74 Å²	74	63.2 Å²	63.2	40%	0.396	37%	0.37	S	S	.	.			trans	-91.8	104.8	171	-174	-3.7	0	0	0	109.7	A42 A43 L141	N40-A42 PolarHBondContact O-N 2.98Å; N40-A42 VanDerWaalsContact OD1-CB 3.31Å; N40-A42 WeakPolarHBondContact OD1-CB 3.35Å; N40-A42 PolarHBondContact OD1-N 3.26Å; N40-A42 VanDerWaalsContact OD1-N 3.13Å; N40-A43 WeakPolarHBondContact O-CB 3.46Å; N40-A43 PolarHBondContact O-N 3Å; N40-L141 PolarHBondContact N-O 3.42Å
41	P	60.9	Low	64.1	Low	55 Å²	55	64.7 Å²	64.7	36%	0.357	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-64.9	-20	-178.3	26.8	-34.3	0	0	0	113	V39 A43 F44	V39-P41 VanDerWaalsContact O-CD 3.3Å; V39-P41 WeakPolarHBondContact O-CD 3.29Å; P41-A43 PolarHBondContact O-N 3.15Å; P41-F44 PolarHBondContact O-N 3.04Å
42	A	61.8	Low	62.5	Low	52 Å²	52	65.4 Å²	65.4	43%	0.43	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-69.2	-15.7	178	0	0	0	0	0	113.2	N40 F44 D45	N40-A42 PolarHBondContact O-N 2.98Å; N40-A42 VanDerWaalsContact OD1-CB 3.31Å; N40-A42 WeakPolarHBondContact OD1-CB 3.35Å; N40-A42 PolarHBondContact OD1-N 3.26Å; N40-A42 VanDerWaalsContact OD1-N 3.13Å; A42-F44 PolarHBondContact O-N 3.31Å; A42-D45 PolarHBondContact O-N 3.37Å
43	A	55.2	Low	61.1	Low	7 Å²	7	65.7 Å²	65.7	6%	0.058	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-63.6	-21.5	177.4	0	0	0	0	0	113	N40 P41 L137 A140 L141	N40-A43 WeakPolarHBondContact O-CB 3.46Å; N40-A43 PolarHBondContact O-N 3Å; P41-A43 PolarHBondContact O-N 3.15Å; A43-L137 HydrophobicContact CB-CD1 4.16Å; A43-A140 HydrophobicContact CB-CB 4.12Å; A43-L141 HydrophobicContact CB-CD1 4.21Å
44	F	55.6	Low	59.9	Low	38 Å²	38	61.7 Å²	61.7	17%	0.167	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-85.1	-7	178.2	-74.8	-73.4	0	0	0	114.9	P41 A42 N46 K66 F68 F133 L137 L141	P41-F44 PolarHBondContact O-N 3.04Å; A42-F44 PolarHBondContact O-N 3.31Å; F44-N46 PolarHBondContact O-N 3.49Å; F44-K66 WeakPolarHBondContact CD2-O 3.28Å; F44-F68 HydrophobicContact CE2-CB 4.05Å; F44-F68 AromaticContact CE2-CD2 3.96Å; F44-F68 HydrophobicContact CE2-CD2 3.96Å; F44-F68 HydrophobicContact CE2-CG 4.44Å; F44-F68 AromaticContact CZ-CD2 3.98Å; F44-F68 HydrophobicContact CZ-CD2 3.98Å; F44-F133 AromaticContact CE1-CD1 3.55Å; F44-F133 HydrophobicContact CE1-CD1 3.55Å; F44-F133 AromaticContact CE1-CE1 3.66Å; F44-F133 HydrophobicContact CE1-CE1 3.66Å; F44-F133 AromaticContact CZ-CD1 3.52Å; F44-F133 HydrophobicContact CZ-CD1 3.52Å; F44-F133 AromaticContact CZ-CE1 3.94Å; F44-F133 HydrophobicContact CZ-CE1 3.94Å; F44-F133 HydrophobicContact CZ-CG 4.32Å; F44-L137 HydrophobicContact CD1-CD1 4.22Å; F44-L137 HydrophobicContact CE1-CD1 3.82Å; F44-L137 HydrophobicContact CE2-CD1 4.18Å; F44-L137 HydrophobicContact CZ-CD1 3.8Å; F44-L141 HydrophobicContact CD2-CD1 3.96Å; F44-L141 HydrophobicContact CE2-CD1 3.3Å; F44-L141 HydrophobicContact CZ-CD1 3.91Å
45	D	55.8	Low	58.6	Low	117 Å²	117	60.4 Å²	60.4	63%	0.626	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-78.4	-8	177.3	-70.2	-32.3	0	0	0	112.5	A42	A42-D45 PolarHBondContact O-N 3.37Å
46	N	53	Low	57.3	Low	111 Å²	111	57.5 Å²	57.5	59%	0.594	35%	0.346	S	S	*	.	S	Bend	trans	-78.9	125.5	172.7	-73.2	-39.9	0	0	0	111.1	F44 Q48	F44-N46 PolarHBondContact O-N 3.49Å; N46-Q48 PolarHBondContact O-N 2.93Å
47	P	51.5	Low	56.4	Low	118 Å²	118	60.2 Å²	60.2	77%	0.766	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	0.9	-174.3	-22.4	30.8	0	0	0	117	G49	P47-G49 PolarHBondContact O-N 3.42Å
48	Q	46.9	Very low	56	Low	162 Å²	162	58.2 Å²	58.2	76%	0.757	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	6.9	-170.5	-77	-178.1	0	0	0	114.4	N46 S50 Y136	N46-Q48 PolarHBondContact O-N 2.93Å; Q48-S50 PolarHBondContact O-N 2.82Å; Q48-Y136 PolarHBondContact O-OH 2.96Å
49	G	50.2	Low	55.7	Low	39 Å²	39	57.1 Å²	57.1	40%	0.402	33%	0.332	S	S	.	.	S	Bend	trans	-84.8	103.6	-178.1	0	0	0	0	0	116.2	P47 Q51 Y136	P47-G49 PolarHBondContact O-N 3.42Å; G49-Q51 PolarHBondContact O-N 2.98Å; G49-Y136 WeakPolarHBondContact CA-OH 3.5Å
50	S	49.8	Very low	55.2	Low	55 Å²	55	58 Å²	58	39%	0.385	34%	0.335	S	S	.	.			trans	-21.3	107.3	169.7	176.4	0	0	0	0	114.7	Q48 G52 Y136 R284	Q48-S50 PolarHBondContact O-N 2.82Å; S50-G52 PolarHBondContact O-N 3.21Å; S50-G52 VanDerWaalsContact O-N 3.12Å; S50-Y136 WeakPolarHBondContact CB-OH 3.37Å; S50-Y136 PolarHBondContact N-OH 3.21Å; S50-R284 PolarHBondContact OG-NH2 3.04Å
51	Q	51.7	Low	54.8	Low	130 Å²	130	54.6 Å²	54.6	61%	0.607	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	76.2	-167	-62.2	170.9	-0.4	0	0	112.8	G49 Q392	G49-Q51 PolarHBondContact O-N 2.98Å; Q51-Q392 PolarHBondContact O-OE1 3.26Å
52	G	50.5	Low	54.6	Low	20 Å²	20	52 Å²	52	21%	0.206	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-174.1	-75.7	171.8	0	0	0	0	0	116	S50 E55 L56	S50-G52 PolarHBondContact O-N 3.21Å; S50-G52 VanDerWaalsContact O-N 3.12Å; G52-E55 PolarHBondContact O-N 2.79Å; G52-L56 PolarHBondContact O-N 3.39Å
53	A	49	Very low	54.5	Low	10 Å²	10	50.4 Å²	50.4	8%	0.083	29%	0.289	C	S	.	.	H	α-helix	trans	-76.4	-31.6	-178.5	0	0	0	0	0	112.7	E55 L56 L57 L281 R284	A53-E55 PolarHBondContact O-N 2.87Å; A53-L56 PolarHBondContact O-N 3.37Å; A53-L57 WeakPolarHBondContact O-CB 3.37Å; A53-L57 WeakPolarHBondContact O-CG 3.27Å; A53-L57 PolarHBondContact O-N 3.38Å; A53-L281 HydrophobicContact CB-CD2 3.68Å; A53-R284 VanDerWaalsContact CB-CD 3.42Å
54	T	55.4	Low	54.5	Low	39 Å²	39	50.1 Å²	50.1	24%	0.239	29%	0.286	C	S	.	.	H	α-helix	trans	-58.9	-38.8	171.1	-51.1	0	0	0	0	110.2	N58 L65 F133	T54-N58 WeakPolarHBondContact O-CB 3.41Å; T54-N58 PolarHBondContact O-N 2.93Å; T54-L65 HydrophobicContact CG2-CD2 3.9Å; T54-L65 HydrophobicContact CG2-CG 4.34Å; T54-F133 HydrophobicContact CG2-CE1 3.95Å; T54-F133 HydrophobicContact CG2-CZ 3.93Å
55	E	55.3	Low	54.6	Low	56 Å²	56	48.3 Å²	48.3	26%	0.262	28%	0.278	S	S	.	.	H	α-helix	trans	-69.8	-40.6	179.4	-167.2	167.6	-166.1	0	0	111.8	G52 A53 N58 T59 S393 I396	G52-E55 PolarHBondContact O-N 2.79Å; A53-E55 PolarHBondContact O-N 2.87Å; E55-N58 CarbonylContact O-C 3.54Å; E55-N58 WeakPolarHBondContact O-CA 3.43Å; E55-N58 WeakPolarHBondContact O-CB 3.32Å; E55-N58 PolarHBondContact O-N 3.43Å; E55-T59 PolarHBondContact O-N 3.31Å; E55-T59 PolarHBondContact O-OG1 3.21Å; E55-S393 VanDerWaalsContact OE1-CA 3.22Å; E55-S393 WeakPolarHBondContact OE1-CA 3.23Å; E55-S393 WeakPolarHBondContact OE1-CB 3.17Å; E55-I396 HydrophobicContact CB-CD1 3.61Å; E55-I396 HydrophobicContact CG-CD1 3.6Å
56	L	52.4	Low	54.8	Low	3 Å²	3	48.6 Å²	48.6	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-44.8	174.5	-178.1	81.3	0	0	0	113.2	G52 A53 N58 T59 F60 M277 L281 I396	G52-L56 PolarHBondContact O-N 3.39Å; A53-L56 PolarHBondContact O-N 3.37Å; L56-N58 PolarHBondContact O-N 2.92Å; L56-T59 WeakPolarHBondContact O-CB 3.29Å; L56-T59 PolarHBondContact O-N 3.13Å; L56-T59 VanDerWaalsContact O-N 3.1Å; L56-F60 HydrophobicContact CD1-CD2 4.35Å; L56-F60 HydrophobicContact CD1-CE2 3.65Å; L56-F60 HydrophobicContact CD1-CZ 3.81Å; L56-F60 HydrophobicContact CD2-CD2 4.49Å; L56-F60 HydrophobicContact CD2-CE2 3.86Å; L56-F60 HydrophobicContact CG-CD2 3.98Å; L56-F60 HydrophobicContact CG-CE2 3.57Å; L56-F60 HydrophobicContact CG-CZ 4.26Å; L56-F60 PolarHBondContact O-N 3.23Å; L56-M277 HydrophobicContact CD1-CE 4.27Å; L56-M277 HydrophobicContact CD2-CE 3.26Å; L56-M277 HydrophobicContact CD2-CG 3.83Å; L56-M277 HydrophobicContact CD2-SD 4.38Å; L56-M277 HydrophobicContact CG-CE 4.29Å; L56-L281 HydrophobicContact CD2-CD1 3.39Å; L56-L281 HydrophobicContact CD2-CD2 4.28Å; L56-L281 HydrophobicContact CD2-CG 4.34Å; L56-I396 HydrophobicContact CB-CD1 4.29Å; L56-I396 HydrophobicContact CB-CG2 4.47Å; L56-I396 HydrophobicContact CD1-CG2 3.45Å; L56-I396 VanDerWaalsContact CD1-CG2 3.45Å
57	L	57.9	Low	55.1	Low	62 Å²	62	49.3 Å²	49.3	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-38.3	174.1	-71	172.6	0	0	0	110.1	A53 G61 L65	A53-L57 WeakPolarHBondContact O-CB 3.37Å; A53-L57 WeakPolarHBondContact O-CG 3.27Å; A53-L57 PolarHBondContact O-N 3.38Å; L57-G61 PolarHBondContact O-N 2.95Å; L57-L65 HydrophobicContact CB-CD2 3.71Å
58	N	64	Low	55.8	Low	28 Å²	28	43.7 Å²	43.7	15%	0.15	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-37.2	174.3	-165.8	44.8	0	0	0	112.8	T54 E55 L56 G61 G62 G63 L65 K66	T54-N58 WeakPolarHBondContact O-CB 3.41Å; T54-N58 PolarHBondContact O-N 2.93Å; E55-N58 CarbonylContact O-C 3.54Å; E55-N58 WeakPolarHBondContact O-CA 3.43Å; E55-N58 WeakPolarHBondContact O-CB 3.32Å; E55-N58 PolarHBondContact O-N 3.43Å; L56-N58 PolarHBondContact O-N 2.92Å; N58-G61 CarbonylContact O-C 3.58Å; N58-G61 PolarHBondContact O-N 2.98Å; N58-G62 PolarHBondContact O-N 3.06Å; N58-G63 PolarHBondContact O-N 3.14Å; N58-G63 WeakPolarHBondContact OD1-CA 3.43Å; N58-G63 PolarHBondContact OD1-O 3.39Å; N58-L65 HydrophobicContact CB-CB 3.93Å; N58-L65 HydrophobicContact CB-CD2 4.49Å; N58-L65 WeakPolarHBondContact OD1-CB 3.33Å; N58-L65 PolarHBondContact OD1-N 3.06Å; N58-L65 VanDerWaalsContact OD1-N 3.11Å; N58-K66 PolarHBondContact OD1-N 3.12Å
59	T	59.1	Low	56.9	Low	13 Å²	13	36 Å²	36	8%	0.08	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-45.8	175.2	-54	0	0	0	0	111.5	E55 L56 G61 G62 G187 I188 I396	E55-T59 PolarHBondContact O-N 3.31Å; E55-T59 PolarHBondContact O-OG1 3.21Å; L56-T59 WeakPolarHBondContact O-CB 3.29Å; L56-T59 PolarHBondContact O-N 3.13Å; L56-T59 VanDerWaalsContact O-N 3.1Å; T59-G61 VanDerWaalsContact C-N 3.33Å; T59-G61 PolarHBondContact O-N 3.3Å; T59-G62 PolarHBondContact O-N 2.94Å; T59-G187 CarbonylContact O-C 3.58Å; T59-I188 HydrophobicContact CG2-CB 4.46Å; T59-I188 HydrophobicContact CG2-CG1 4.14Å; T59-I188 HydrophobicContact CG2-CG2 4.4Å; T59-I396 HydrophobicContact CG2-CG2 4.38Å
60	F	58	Low	58.2	Low	30 Å²	30	35.9 Å²	35.9	13%	0.132	19%	0.186	C	C	.	.	H	α-helix	trans	-69.8	-30.3	176.8	-66.2	-42.1	0	0	0	113	L56 G62 V76 I184 I188 I403	L56-F60 HydrophobicContact CD1-CD2 4.35Å; L56-F60 HydrophobicContact CD1-CE2 3.65Å; L56-F60 HydrophobicContact CD1-CZ 3.81Å; L56-F60 HydrophobicContact CD2-CD2 4.49Å; L56-F60 HydrophobicContact CD2-CE2 3.86Å; L56-F60 HydrophobicContact CG-CD2 3.98Å; L56-F60 HydrophobicContact CG-CE2 3.57Å; L56-F60 HydrophobicContact CG-CZ 4.26Å; L56-F60 PolarHBondContact O-N 3.23Å; F60-G62 VanDerWaalsContact C-N 3.31Å; F60-V76 HydrophobicContact CB-CG2 4.24Å; F60-I184 HydrophobicContact CD1-CG2 4.41Å; F60-I188 HydrophobicContact CD1-CD1 4.29Å; F60-I188 HydrophobicContact CD1-CG1 4.25Å; F60-I188 HydrophobicContact CE1-CD1 4.21Å; F60-I403 HydrophobicContact CE1-CD1 3.6Å; F60-I403 HydrophobicContact CZ-CD1 4.01Å
61	G	56.9	Low	59.6	Low	1 Å²	1	33.4 Å²	33.4	1%	0.01	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	0.5	172.2	0	0	0	0	0	114.9	L57 N58 T59 G63 A64	L57-G61 PolarHBondContact O-N 2.95Å; N58-G61 CarbonylContact O-C 3.58Å; N58-G61 PolarHBondContact O-N 2.98Å; T59-G61 VanDerWaalsContact C-N 3.33Å; T59-G61 PolarHBondContact O-N 3.3Å; G61-G63 PolarHBondContact O-N 3.36Å; G61-A64 WeakPolarHBondContact O-CB 3.47Å; G61-A64 PolarHBondContact O-N 3.41Å
62	G	56.6	Low	60.6	Low	1 Å²	1	27.4 Å²	27.4	1%	0.01	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	30.7	179.6	0	0	0	0	0	115.5	K29 N58 T59 F60 G187 S190	K29-G62 PolarHBondContact NZ-O 2.94Å; K29-G62 VanDerWaalsContact NZ-O 3.13Å; N58-G62 PolarHBondContact O-N 3.06Å; T59-G62 PolarHBondContact O-N 2.94Å; F60-G62 VanDerWaalsContact C-N 3.31Å; G62-G187 WeakPolarHBondContact CA-O 3.29Å; G62-S190 WeakPolarHBondContact CA-OG 3.14Å; G62-S190 PolarHBondContact O-OG 3.11Å
63	G	59.6	Low	61.6	Low	19 Å²	19	27.2 Å²	27.2	20%	0.196	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	-0.2	-175.4	0	0	0	0	0	114.3	N58 G61 L65 K66	N58-G63 PolarHBondContact O-N 3.14Å; N58-G63 WeakPolarHBondContact OD1-CA 3.43Å; N58-G63 PolarHBondContact OD1-O 3.39Å; G61-G63 PolarHBondContact O-N 3.36Å; G63-L65 PolarHBondContact O-N 3.26Å; G63-K66 PolarHBondContact O-N 3.4Å
64	A	55	Low	62.9	Low	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.2	-176.8	0	0	0	0	0	113.7	T32 G61 R67 F68 S69 F71	T32-A64 HydrophobicContact CG2-CB 4.39Å; G61-A64 WeakPolarHBondContact O-CB 3.47Å; G61-A64 PolarHBondContact O-N 3.41Å; A64-R67 PolarHBondContact O-N 2.92Å; A64-F68 WeakPolarHBondContact O-CA 3.45Å; A64-F68 PolarHBondContact O-N 3.38Å; A64-S69 WeakPolarHBondContact CA-OG 3.47Å; A64-S69 WeakPolarHBondContact CB-OG 3.48Å; A64-S69 PolarHBondContact O-N 3.04Å; A64-S69 PolarHBondContact O-OG 2.93Å; A64-F71 HydrophobicContact CB-CB 4.29Å; A64-F71 WeakPolarHBondContact CB-O 3.29Å
65	L	58.3	Low	64	Low	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-40.6	-178.5	-179.4	47.2	0	0	0	112	T54 L57 N58 G63 R67 F68 M129 F133	T54-L65 HydrophobicContact CG2-CD2 3.9Å; T54-L65 HydrophobicContact CG2-CG 4.34Å; L57-L65 HydrophobicContact CB-CD2 3.71Å; N58-L65 HydrophobicContact CB-CB 3.93Å; N58-L65 HydrophobicContact CB-CD2 4.49Å; N58-L65 WeakPolarHBondContact OD1-CB 3.33Å; N58-L65 PolarHBondContact OD1-N 3.06Å; N58-L65 VanDerWaalsContact OD1-N 3.11Å; G63-L65 PolarHBondContact O-N 3.26Å; L65-R67 PolarHBondContact O-N 3.15Å; L65-R67 VanDerWaalsContact O-N 3.12Å; L65-F68 HydrophobicContact CD1-CD2 4.05Å; L65-F68 HydrophobicContact CD1-CE2 4.22Å; L65-F68 PolarHBondContact O-N 3.44Å; L65-M129 HydrophobicContact CD1-CE 3.03Å; L65-M129 HydrophobicContact CD2-CE 3.86Å; L65-M129 HydrophobicContact CG-CE 4.01Å; L65-F133 HydrophobicContact CD1-CE1 4.14Å; L65-F133 HydrophobicContact CD1-CE2 3.97Å; L65-F133 HydrophobicContact CD1-CZ 3.74Å; L65-F133 HydrophobicContact CD2-CE2 4.46Å; L65-F133 HydrophobicContact CD2-CZ 3.9Å; L65-F133 HydrophobicContact CG-CZ 4.16Å
66	K	59.3	Low	65	Low	123 Å²	123	24.3 Å²	24.3	54%	0.535	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.9	176.6	-170.8	176.3	-179.5	-179.4	0	112.6	F44 N58 G63	F44-K66 WeakPolarHBondContact CD2-O 3.28Å; N58-K66 PolarHBondContact OD1-N 3.12Å; G63-K66 PolarHBondContact O-N 3.4Å
67	R	60.2	Low	66.4	Low	126 Å²	126	24.1 Å²	24.1	48%	0.475	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	0	178.3	-61.2	-176.9	-178.5	-134.4	0.9	113.5	Y33 A64 L65 S69	Y33-R67 VanDerWaalsContact CE1-NH1 3.32Å; A64-R67 PolarHBondContact O-N 2.92Å; L65-R67 PolarHBondContact O-N 3.15Å; L65-R67 VanDerWaalsContact O-N 3.12Å; R67-S69 PolarHBondContact O-N 2.88Å
68	F	65.8	Low	67.6	Low	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	40.7	51.5	-170	-142	-91.9	0	0	0	112.9	A36 V39 F44 A64 L65 M129 F133 L141 I153 L157	A36-F68 HydrophobicContact CB-CD1 4.43Å; A36-F68 PolarHBondContact N-O 3.16Å; V39-F68 HydrophobicContact CB-CD1 4.29Å; V39-F68 HydrophobicContact CG1-CD1 3.75Å; V39-F68 HydrophobicContact CG1-CE1 4.11Å; V39-F68 HydrophobicContact CG1-CG 4.38Å; V39-F68 HydrophobicContact CG2-CB 4.16Å; V39-F68 HydrophobicContact CG2-CD1 3.94Å; V39-F68 HydrophobicContact CG2-CG 4.45Å; F44-F68 HydrophobicContact CE2-CB 4.05Å; F44-F68 AromaticContact CE2-CD2 3.96Å; F44-F68 HydrophobicContact CE2-CD2 3.96Å; F44-F68 HydrophobicContact CE2-CG 4.44Å; F44-F68 AromaticContact CZ-CD2 3.98Å; F44-F68 HydrophobicContact CZ-CD2 3.98Å; A64-F68 WeakPolarHBondContact O-CA 3.45Å; A64-F68 PolarHBondContact O-N 3.38Å; L65-F68 HydrophobicContact CD1-CD2 4.05Å; L65-F68 HydrophobicContact CD1-CE2 4.22Å; L65-F68 PolarHBondContact O-N 3.44Å; F68-M129 HydrophobicContact CE2-CE 4.32Å; F68-F133 HydrophobicContact CE2-CB 4.16Å; F68-F133 HydrophobicContact CE2-CD2 4.14Å; F68-F133 HydrophobicContact CE2-CG 4.13Å; F68-L141 HydrophobicContact CD2-CD2 4.11Å; F68-L141 HydrophobicContact CE2-CD2 4.04Å; F68-L141 HydrophobicContact CG-CD2 4.38Å; F68-L141 HydrophobicContact CZ-CD2 4.24Å; F68-I153 HydrophobicContact CE1-CG2 3.81Å; F68-L157 HydrophobicContact CE1-CD1 3.92Å; F68-L157 HydrophobicContact CZ-CD1 4.15Å
69	S	69.4	Low	68.3	Low	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-71.9	169.5	-178.4	68.6	0	0	0	0	112.1	T32 I34 A64 R67 F71 A72 L157	T32-S69 WeakPolarHBondContact O-CB 3.2Å; T32-S69 PolarHBondContact O-OG 2.95Å; I34-S69 CarbonylContact O-C 3.46Å; I34-S69 WeakPolarHBondContact O-CA 3.39Å; I34-S69 WeakPolarHBondContact O-CB 3.41Å; A64-S69 WeakPolarHBondContact CA-OG 3.47Å; A64-S69 WeakPolarHBondContact CB-OG 3.48Å; A64-S69 PolarHBondContact O-N 3.04Å; A64-S69 PolarHBondContact O-OG 2.93Å; R67-S69 PolarHBondContact O-N 2.88Å; S69-F71 PolarHBondContact O-N 3.29Å; S69-F71 PolarHBondContact OG-N 2.9Å; S69-A72 VanDerWaalsContact O-CB 3.24Å; S69-A72 WeakPolarHBondContact O-CB 3.34Å; S69-A72 PolarHBondContact O-N 3.17Å; S69-L157 WeakPolarHBondContact O-CD2 3.22Å
70	I	78.1	Confident	69.3	Low	37 Å²	37	23.8 Å²	23.8	19%	0.19	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-22	172.7	59	172.5	0	0	0	112.6	G31 I34 V156 G160	G31-I70 WeakPolarHBondContact O-CG1 3.2Å; I34-I70 HydrophobicContact CB-CD1 4.26Å; I34-I70 HydrophobicContact CB-CG1 4.36Å; I34-I70 HydrophobicContact CD1-CD1 4.35Å; I34-I70 HydrophobicContact CG2-CD1 4.49Å; I34-I70 HydrophobicContact CG2-CG2 4.17Å; I34-I70 PolarHBondContact O-N 3.4Å; I70-V156 HydrophobicContact CB-CG1 4.41Å; I70-V156 HydrophobicContact CG2-CG1 3.77Å; I70-G160 WeakPolarHBondContact O-CA 3.3Å
71	F	79.8	Confident	70.6	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.018	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	18.9	177.6	-61.4	-27.2	0	0	0	113.7	F28 G31 T32 A64 S69 M73 G74 G160 F163 L164	F28-F71 HydrophobicContact CD2-CD2 4.19Å; F28-F71 HydrophobicContact CD2-CE2 4.38Å; F28-F71 HydrophobicContact CE2-CD2 4.4Å; F28-F71 WeakPolarHBondContact O-CE2 3.21Å; G31-F71 VanDerWaalsContact C-CD2 3.49Å; G31-F71 VanDerWaalsContact CA-CE2 3.41Å; T32-F71 HydrophobicContact CG2-CD2 4.28Å; A64-F71 HydrophobicContact CB-CB 4.29Å; A64-F71 WeakPolarHBondContact CB-O 3.29Å; S69-F71 PolarHBondContact O-N 3.29Å; S69-F71 PolarHBondContact OG-N 2.9Å; F71-M73 PolarHBondContact O-N 2.87Å; F71-G74 WeakPolarHBondContact O-CA 3.36Å; F71-G74 PolarHBondContact O-N 2.85Å; F71-G160 WeakPolarHBondContact CE1-O 3.04Å; F71-F163 AromaticContact CE1-CD1 3.87Å; F71-F163 HydrophobicContact CE1-CD1 3.87Å; F71-F163 AromaticContact CZ-CD1 3.61Å; F71-F163 HydrophobicContact CZ-CD1 3.61Å; F71-F163 HydrophobicContact CZ-CE1 4.01Å; F71-L164 HydrophobicContact CB-CD1 3.96Å; F71-L164 HydrophobicContact CD1-CD1 3.74Å; F71-L164 HydrophobicContact CD1-CD2 3.84Å; F71-L164 HydrophobicContact CD1-CG 3.57Å; F71-L164 HydrophobicContact CD2-CD2 3.89Å; F71-L164 HydrophobicContact CD2-CG 4.48Å; F71-L164 HydrophobicContact CE1-CD1 4.43Å; F71-L164 HydrophobicContact CE1-CD2 3.8Å; F71-L164 HydrophobicContact CE1-CG 3.75Å; F71-L164 HydrophobicContact CE2-CD2 3.81Å; F71-L164 HydrophobicContact CG-CD1 3.85Å; F71-L164 HydrophobicContact CG-CD2 3.91Å; F71-L164 HydrophobicContact CG-CG 4Å; F71-L164 HydrophobicContact CZ-CD2 3.81Å; F71-L164 HydrophobicContact CZ-CG 4.29Å
72	A	71.6	Confident	71.7	Confident	3 Å²	3	23.7 Å²	23.7	3%	0.025	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.4	-176.7	0	0	0	0	0	113.5	S69 G74 L157	S69-A72 VanDerWaalsContact O-CB 3.24Å; S69-A72 WeakPolarHBondContact O-CB 3.34Å; S69-A72 PolarHBondContact O-N 3.17Å; A72-G74 VanDerWaalsContact C-N 3.3Å; A72-L157 HydrophobicContact CB-CD2 3.83Å
73	M	71.8	Confident	72.5	Confident	16 Å²	16	25 Å²	25	8%	0.079	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-21.2	173.3	-73	-60.5	-53.8	0	0	113.4	F71 V76 P77 Q125 M129 L157 T161	F71-M73 PolarHBondContact O-N 2.87Å; M73-V76 PolarHBondContact O-N 3.46Å; M73-P77 HydrophobicContact CB-CG 4.38Å; M73-P77 HydrophobicContact CE-CG 3.56Å; M73-Q125 HydrophobicContact CE-CB 3.46Å; M73-Q125 VanDerWaalsContact CE-CB 3.46Å; M73-Q125 HydrophobicContact CE-CG 4.41Å; M73-Q125 VanDerWaalsContact CE-OE1 3.23Å; M73-Q125 HydrophobicContact SD-CB 4.42Å; M73-M129 HydrophobicContact CG-SD 4.36Å; M73-M129 HydrophobicContact SD-CB 4.32Å; M73-M129 HydrophobicContact SD-CG 4.49Å; M73-M129 HydrophobicContact SD-SD 3.24Å; M73-L157 HydrophobicContact CG-CB 4.18Å; M73-L157 HydrophobicContact CG-CD1 4.38Å; M73-T161 WeakPolarHBondContact CB-OG1 3.27Å
74	G	77.3	Confident	73.6	Confident	2 Å²	2	26.5 Å²	26.5	2%	0.021	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	-140.8	-174.8	0	0	0	0	0	112.6	F71 A72 T161	F71-G74 WeakPolarHBondContact O-CA 3.36Å; F71-G74 PolarHBondContact O-N 2.85Å; A72-G74 VanDerWaalsContact C-N 3.3Å; G74-T161 PolarHBondContact O-OG1 3.01Å; G74-T161 VanDerWaalsContact O-OG1 3.12Å
75	I	77.8	Confident	75	Confident	9 Å²	9	26.6 Å²	26.6	5%	0.046	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	3.1	178.1	-54.9	165.4	0	0	0	111.3	P77 Y78 I79 L164 I180 I183 I184	I75-P77 VanDerWaalsContact C-CD 3.49Å; I75-Y78 HydrophobicContact CG2-CD1 4.1Å; I75-Y78 HydrophobicContact CG2-CG 4.26Å; I75-Y78 WeakPolarHBondContact O-CB 3.19Å; I75-Y78 PolarHBondContact O-N 3.12Å; I75-I79 HydrophobicContact CG2-CG1 4.47Å; I75-I79 PolarHBondContact O-N 3.36Å; I75-L164 HydrophobicContact CG1-CB 4.22Å; I75-L164 HydrophobicContact CG1-CD1 4.26Å; I75-I180 HydrophobicContact CG2-CG2 3.87Å; I75-I183 HydrophobicContact CD1-CB 3.36Å; I75-I183 HydrophobicContact CD1-CD1 3.85Å; I75-I183 HydrophobicContact CD1-CG1 4.23Å; I75-I183 HydrophobicContact CD1-CG2 3.25Å; I75-I183 HydrophobicContact CG1-CG2 4.32Å; I75-I184 HydrophobicContact CD1-CG1 4.43Å
76	V	75.3	Confident	75.8	Confident	33 Å²	33	29.2 Å²	29.2	20%	0.2	14%	0.143	C	C	.	.	H	α-helix	trans	-53.4	-45.2	-177.2	179.7	0	0	0	0	112.5	F60 M73 Y78 I79 T80	F60-V76 HydrophobicContact CB-CG2 4.24Å; M73-V76 PolarHBondContact O-N 3.46Å; V76-Y78 PolarHBondContact O-N 2.87Å; V76-I79 PolarHBondContact O-N 2.95Å; V76-I79 VanDerWaalsContact O-N 3.1Å; V76-T80 PolarHBondContact O-N 3.43Å; V76-T80 PolarHBondContact O-OG1 3.36Å
77	P	82	Confident	76.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.1	-34.8	177.8	-24.8	34.6	0	0	0	113.6	M73 I75 A81 L121 A122 T161	M73-P77 HydrophobicContact CB-CG 4.38Å; M73-P77 HydrophobicContact CE-CG 3.56Å; I75-P77 VanDerWaalsContact C-CD 3.49Å; P77-A81 WeakPolarHBondContact O-CB 3.35Å; P77-A81 PolarHBondContact O-N 2.86Å; P77-L121 HydrophobicContact CB-CB 4.48Å; P77-A122 HydrophobicContact CB-CB 3.78Å; P77-A122 HydrophobicContact CG-CB 3.82Å; P77-T161 HydrophobicContact CB-CG2 4.37Å; P77-T161 HydrophobicContact CG-CG2 4.17Å
78	Y	84.1	Confident	77.7	Confident	27 Å²	27	22.5 Å²	22.5	11%	0.106	12%	0.122	C	C	.	.	H	α-helix	trans	-72.7	-38.7	177.1	179.9	-88.2	0	0	0	112.1	I75 V76 T80 A81 S82 T114 R115 A118 I165 I180	I75-Y78 HydrophobicContact CG2-CD1 4.1Å; I75-Y78 HydrophobicContact CG2-CG 4.26Å; I75-Y78 WeakPolarHBondContact O-CB 3.19Å; I75-Y78 PolarHBondContact O-N 3.12Å; V76-Y78 PolarHBondContact O-N 2.87Å; Y78-T80 VanDerWaalsContact C-N 3.32Å; Y78-A81 PolarHBondContact O-N 2.72Å; Y78-S82 VanDerWaalsContact O-CB 3.32Å; Y78-S82 WeakPolarHBondContact O-CB 3.36Å; Y78-S82 PolarHBondContact O-N 2.95Å; Y78-T114 HydrophobicContact CE2-CG2 4.01Å; Y78-R115 HydrophobicContact CE2-CG 4.27Å; Y78-A118 HydrophobicContact CD2-CB 3.93Å; Y78-A118 HydrophobicContact CG-CB 4.45Å; Y78-I165 HydrophobicContact CD2-CD1 3.94Å; Y78-I165 HydrophobicContact CD2-CG1 3.94Å; Y78-I165 HydrophobicContact CD2-CG2 4.18Å; Y78-I165 HydrophobicContact CE2-CG2 4.3Å; Y78-I165 HydrophobicContact CG-CD1 4.42Å; Y78-I165 HydrophobicContact CG-CG1 4.22Å; Y78-I180 HydrophobicContact CD1-CD1 4.02Å; Y78-I180 HydrophobicContact CD1-CG1 4.43Å; Y78-I180 HydrophobicContact CD1-CG2 4.19Å; Y78-I180 HydrophobicContact CE1-CD1 3.29Å; Y78-I180 HydrophobicContact CE1-CG1 4.15Å; Y78-I180 HydrophobicContact CE1-CG2 4.25Å; Y78-I180 HydrophobicContact CE2-CD1 4.38Å; Y78-I180 VanDerWaalsContact CZ-CD1 3.49Å
79	I	78.1	Confident	78.5	Confident	31 Å²	31	25 Å²	25	16%	0.159	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-48.4	174	-61	171.2	0	0	0	109.1	I75 V76 A81 S82 I83 I184 I274	I75-I79 HydrophobicContact CG2-CG1 4.47Å; I75-I79 PolarHBondContact O-N 3.36Å; V76-I79 PolarHBondContact O-N 2.95Å; V76-I79 VanDerWaalsContact O-N 3.1Å; I79-A81 VanDerWaalsContact C-N 3.33Å; I79-A81 PolarHBondContact O-N 3.23Å; I79-S82 PolarHBondContact O-N 3.44Å; I79-I83 HydrophobicContact CG2-CD1 3.99Å; I79-I83 WeakPolarHBondContact O-CD1 3.39Å; I79-I83 VanDerWaalsContact O-CG1 3.25Å; I79-I83 WeakPolarHBondContact O-CG1 3.15Å; I79-I83 PolarHBondContact O-N 3.5Å; I79-I184 HydrophobicContact CD1-CD1 3.69Å; I79-I184 HydrophobicContact CD1-CG1 4.39Å; I79-I184 HydrophobicContact CG1-CD1 4.26Å; I79-I274 HydrophobicContact CG2-CG2 3.84Å
80	T	80.3	Confident	78.4	Confident	38 Å²	38	28.5 Å²	28.5	23%	0.233	15%	0.151	C	C	.	.	H	α-helix	trans	-57.8	-45	175.3	-53.4	0	0	0	0	111.6	V76 Y78 S82 I83 V84 L121	V76-T80 PolarHBondContact O-N 3.43Å; V76-T80 PolarHBondContact O-OG1 3.36Å; Y78-T80 VanDerWaalsContact C-N 3.32Å; T80-S82 PolarHBondContact O-N 3.48Å; T80-I83 WeakPolarHBondContact O-CB 3.17Å; T80-I83 PolarHBondContact O-N 2.8Å; T80-V84 WeakPolarHBondContact O-CG2 3.22Å; T80-V84 PolarHBondContact O-N 3.09Å; T80-L121 HydrophobicContact CG2-CD1 3.83Å
81	A	85.3	Confident	78	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-40.9	179	0	0	0	0	0	113.2	P77 Y78 I79 I83 V84 M85 T114 L117 A118 L121	P77-A81 WeakPolarHBondContact O-CB 3.35Å; P77-A81 PolarHBondContact O-N 2.86Å; Y78-A81 PolarHBondContact O-N 2.72Å; I79-A81 VanDerWaalsContact C-N 3.33Å; I79-A81 PolarHBondContact O-N 3.23Å; A81-I83 VanDerWaalsContact C-N 3.32Å; A81-I83 PolarHBondContact O-N 3.02Å; A81-V84 PolarHBondContact O-N 2.73Å; A81-M85 WeakPolarHBondContact O-CB 3.46Å; A81-M85 WeakPolarHBondContact O-CG 3.45Å; A81-M85 PolarHBondContact O-N 3.22Å; A81-T114 HydrophobicContact CB-CG2 4.11Å; A81-T114 WeakPolarHBondContact CB-O 3.34Å; A81-L117 HydrophobicContact CB-CB 4.25Å; A81-L117 HydrophobicContact CB-CD2 3.4Å; A81-L117 VanDerWaalsContact CB-CD2 3.4Å; A81-L117 HydrophobicContact CB-CG 4.43Å; A81-A118 HydrophobicContact CB-CB 3.69Å; A81-L121 HydrophobicContact CB-CD1 4.32Å
82	S	79.6	Confident	77.9	Confident	29 Å²	29	37.2 Å²	37.2	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-41	176.7	-174.8	0	0	0	0	111.2	Y78 I79 T80 M85 Q86	Y78-S82 VanDerWaalsContact O-CB 3.32Å; Y78-S82 WeakPolarHBondContact O-CB 3.36Å; Y78-S82 PolarHBondContact O-N 2.95Å; I79-S82 PolarHBondContact O-N 3.44Å; T80-S82 PolarHBondContact O-N 3.48Å; S82-M85 PolarHBondContact O-N 3.46Å; S82-Q86 WeakPolarHBondContact O-CB 3.42Å; S82-Q86 VanDerWaalsContact O-CG 3.23Å; S82-Q86 WeakPolarHBondContact O-CG 3.31Å; S82-Q86 PolarHBondContact O-N 3.05Å; S82-Q86 PolarHBondContact OG-NE2 3.48Å
83	I	74.4	Confident	78.4	Confident	27 Å²	27	39.1 Å²	39.1	14%	0.138	21%	0.208	C	C	.	.	H	α-helix	trans	-57.1	-54.4	172.9	-69.4	159.5	0	0	0	110.5	I79 T80 A81 M85 Q86 L87 F275 A278	I79-I83 HydrophobicContact CG2-CD1 3.99Å; I79-I83 WeakPolarHBondContact O-CD1 3.39Å; I79-I83 VanDerWaalsContact O-CG1 3.25Å; I79-I83 WeakPolarHBondContact O-CG1 3.15Å; I79-I83 PolarHBondContact O-N 3.5Å; T80-I83 WeakPolarHBondContact O-CB 3.17Å; T80-I83 PolarHBondContact O-N 2.8Å; A81-I83 VanDerWaalsContact C-N 3.32Å; A81-I83 PolarHBondContact O-N 3.02Å; I83-M85 VanDerWaalsContact C-N 3.27Å; I83-M85 PolarHBondContact O-N 3.31Å; I83-Q86 PolarHBondContact O-N 3.43Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.45Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 3.39Å; I83-F275 HydrophobicContact CB-CE1 4.3Å; I83-F275 HydrophobicContact CB-CZ 4.36Å; I83-F275 HydrophobicContact CD1-CD1 3.38Å; I83-F275 HydrophobicContact CD1-CE1 3.51Å; I83-F275 HydrophobicContact CD1-CG 4.25Å; I83-F275 HydrophobicContact CD1-CZ 4.38Å; I83-F275 HydrophobicContact CG1-CD1 3.38Å; I83-F275 HydrophobicContact CG1-CE1 3.01Å; I83-F275 HydrophobicContact CG1-CE2 4.21Å; I83-F275 HydrophobicContact CG1-CG 4.17Å; I83-F275 HydrophobicContact CG1-CZ 3.44Å; I83-F275 VanDerWaalsContact CG1-CZ 3.44Å; I83-A278 HydrophobicContact CD1-CB 4.47Å
84	V	81.7	Confident	78.8	Confident	51 Å²	51	42.3 Å²	42.3	31%	0.309	23%	0.23	S	C	.	.	H	α-helix	trans	-56.7	-46	-179	172	0	0	0	0	109.9	T80 A81 Q86 L87 L88 L117	T80-V84 WeakPolarHBondContact O-CG2 3.22Å; T80-V84 PolarHBondContact O-N 3.09Å; A81-V84 PolarHBondContact O-N 2.73Å; V84-Q86 PolarHBondContact O-N 3.23Å; V84-L87 PolarHBondContact O-N 3.02Å; V84-L88 HydrophobicContact CG1-CD1 3.77Å; V84-L88 HydrophobicContact CG1-CG 4.28Å; V84-L88 VanDerWaalsContact O-CG 3.24Å; V84-L88 WeakPolarHBondContact O-CG 3.49Å; V84-L88 PolarHBondContact O-N 3.44Å; V84-L117 HydrophobicContact CG1-CD1 4.03Å
85	M	84.3	Confident	79.2	Confident	2 Å²	2	48 Å²	48	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-35.5	179.2	-73	-57.1	-57	0	0	113.6	A81 S82 I83 L88 Q89 F96 L110 V113 T114 L117	A81-M85 WeakPolarHBondContact O-CB 3.46Å; A81-M85 WeakPolarHBondContact O-CG 3.45Å; A81-M85 PolarHBondContact O-N 3.22Å; S82-M85 PolarHBondContact O-N 3.46Å; I83-M85 VanDerWaalsContact C-N 3.27Å; I83-M85 PolarHBondContact O-N 3.31Å; M85-L88 HydrophobicContact SD-CD1 4.22Å; M85-Q89 WeakPolarHBondContact O-CG 3.41Å; M85-Q89 PolarHBondContact O-N 2.9Å; M85-Q89 VanDerWaalsContact O-N 3.15Å; M85-Q89 PolarHBondContact O-NE2 3.32Å; M85-F96 HydrophobicContact CE-CD1 4.28Å; M85-F96 HydrophobicContact CE-CD2 3.85Å; M85-F96 HydrophobicContact CE-CE1 4.22Å; M85-F96 HydrophobicContact CE-CE2 3.79Å; M85-F96 HydrophobicContact CE-CG 4.11Å; M85-F96 HydrophobicContact CE-CZ 3.99Å; M85-F96 HydrophobicContact SD-CE2 4.1Å; M85-F96 HydrophobicContact SD-CZ 4.45Å; M85-L110 HydrophobicContact CE-CD2 3.74Å; M85-V113 HydrophobicContact CE-CB 4.04Å; M85-V113 HydrophobicContact CE-CG1 3.72Å; M85-V113 HydrophobicContact SD-CB 4.46Å; M85-V113 HydrophobicContact SD-CG1 3.66Å; M85-T114 HydrophobicContact CG-CG2 4.3Å; M85-T114 WeakPolarHBondContact CG-OG1 3.39Å; M85-L117 HydrophobicContact SD-CD1 4.3Å
86	Q	74.9	Confident	79.7	Confident	55 Å²	55	49.1 Å²	49.1	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-67.3	-39.6	175	-74.1	172.4	13.1	0	0	111.7	S82 I83 V84 Q89	S82-Q86 WeakPolarHBondContact O-CB 3.42Å; S82-Q86 VanDerWaalsContact O-CG 3.23Å; S82-Q86 WeakPolarHBondContact O-CG 3.31Å; S82-Q86 PolarHBondContact O-N 3.05Å; S82-Q86 PolarHBondContact OG-NE2 3.48Å; I83-Q86 PolarHBondContact O-N 3.43Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; V84-Q86 PolarHBondContact O-N 3.23Å; Q86-Q89 PolarHBondContact O-N 3.36Å
87	L	78.4	Confident	79.9	Confident	63 Å²	63	47.8 Å²	47.8	33%	0.33	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-45.5	174.5	-65.9	175.9	0	0	0	111.3	I83 V84 Q89 M90 I92 F324	I83-L87 HydrophobicContact CG2-CD1 4.05Å; I83-L87 HydrophobicContact CG2-CG 4.45Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 3.39Å; V84-L87 PolarHBondContact O-N 3.02Å; L87-Q89 PolarHBondContact O-N 3.34Å; L87-M90 WeakPolarHBondContact O-CB 3.48Å; L87-M90 PolarHBondContact O-N 3.17Å; L87-I92 WeakPolarHBondContact O-CD1 3.47Å; L87-F324 HydrophobicContact CD2-CE1 3.37Å; L87-F324 HydrophobicContact CD2-CZ 3.35Å
88	L	82.8	Confident	80.1	Confident	46 Å²	46	52.7 Å²	52.7	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-24.3	-179.2	-64.3	171.5	0	0	0	113.2	V84 M85 M90 I92 V93 F96	V84-L88 HydrophobicContact CG1-CD1 3.77Å; V84-L88 HydrophobicContact CG1-CG 4.28Å; V84-L88 VanDerWaalsContact O-CG 3.24Å; V84-L88 WeakPolarHBondContact O-CG 3.49Å; V84-L88 PolarHBondContact O-N 3.44Å; M85-L88 HydrophobicContact SD-CD1 4.22Å; L88-M90 PolarHBondContact O-N 2.94Å; L88-I92 HydrophobicContact CD2-CG2 4.23Å; L88-V93 HydrophobicContact CB-CG2 4.2Å; L88-V93 HydrophobicContact CD2-CG2 3.88Å; L88-V93 PolarHBondContact O-N 2.93Å; L88-V93 VanDerWaalsContact O-N 3.13Å; L88-F96 HydrophobicContact CB-CD2 3.7Å; L88-F96 HydrophobicContact CB-CE2 4.16Å; L88-F96 HydrophobicContact CD1-CD2 4.35Å; L88-F96 HydrophobicContact CD1-CE2 3.94Å
89	Q	81.4	Confident	80.2	Confident	53 Å²	53	53.5 Å²	53.5	25%	0.248	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.9	173.8	-76.7	166	59.2	0	0	113.6	M85 Q86 L87 D91 F96 S97 L110	M85-Q89 WeakPolarHBondContact O-CG 3.41Å; M85-Q89 PolarHBondContact O-N 2.9Å; M85-Q89 VanDerWaalsContact O-N 3.15Å; M85-Q89 PolarHBondContact O-NE2 3.32Å; Q86-Q89 PolarHBondContact O-N 3.36Å; L87-Q89 PolarHBondContact O-N 3.34Å; Q89-D91 PolarHBondContact O-N 3.27Å; Q89-F96 HydrophobicContact CG-CB 4.05Å; Q89-S97 WeakPolarHBondContact O-CB 3.29Å; Q89-L110 HydrophobicContact CG-CD1 4.19Å; Q89-L110 HydrophobicContact CG-CD2 4.05Å
90	M	68.2	Low	80.3	Confident	73 Å²	73	53.4 Å²	53.4	36%	0.36	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	54.7	-179.5	-65.2	-175.2	65.3	0	0	112.3	L87 L88 I92 F324 V328	L87-M90 WeakPolarHBondContact O-CB 3.48Å; L87-M90 PolarHBondContact O-N 3.17Å; L88-M90 PolarHBondContact O-N 2.94Å; M90-I92 PolarHBondContact O-N 3.43Å; M90-F324 HydrophobicContact CE-CE2 3.78Å; M90-F324 HydrophobicContact CE-CZ 3.85Å; M90-F324 HydrophobicContact SD-CE1 3.89Å; M90-F324 HydrophobicContact SD-CE2 3.8Å; M90-F324 HydrophobicContact SD-CZ 3.2Å; M90-F324 WeakPolarHBondContact SD-CZ 3.47Å; M90-V328 HydrophobicContact CE-CG2 3.49Å; M90-V328 VanDerWaalsContact CE-CG2 3.49Å; M90-V328 HydrophobicContact CG-CG1 4.22Å; M90-V328 HydrophobicContact CG-CG2 4.5Å; M90-V328 HydrophobicContact SD-CB 4.28Å; M90-V328 HydrophobicContact SD-CG1 3.99Å; M90-V328 HydrophobicContact SD-CG2 3.29Å; M90-V328 WeakPolarHBondContact SD-CG2 3.24Å
91	D	68.6	Low	80.3	Confident	109 Å²	109	57.5 Å²	57.5	58%	0.583	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	8.1	176.8	-57.5	-40.5	0	0	0	115.3	Q89 S97 K101	Q89-D91 PolarHBondContact O-N 3.27Å; D91-S97 WeakPolarHBondContact OD1-CB 3.36Å; D91-S97 PolarHBondContact OD1-OG 3.46Å; D91-K101 IonicContact OD1-NZ 2.88Å
92	I	78	Confident	80.2	Confident	115 Å²	115	62.7 Å²	62.7	59%	0.59	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-44.2	166.6	-55.6	178.8	0	0	0	109	L87 L88 M90	L87-I92 WeakPolarHBondContact O-CD1 3.47Å; L88-I92 HydrophobicContact CD2-CG2 4.23Å; M90-I92 PolarHBondContact O-N 3.43Å
93	V	82.3	Confident	80.4	Confident	43 Å²	43	63 Å²	63	26%	0.261	33%	0.328	S	S	.	.	S	Bend	trans	-117.4	101.8	173.9	-176.9	0	0	0	0	108.4	L88 K95 F96 S97	L88-V93 HydrophobicContact CB-CG2 4.2Å; L88-V93 HydrophobicContact CD2-CG2 3.88Å; L88-V93 PolarHBondContact O-N 2.93Å; L88-V93 VanDerWaalsContact O-N 3.13Å; V93-K95 HydrophobicContact CG1-CB 4.27Å; V93-K95 PolarHBondContact O-N 3.43Å; V93-K95 VanDerWaalsContact O-N 3.14Å; V93-F96 HydrophobicContact CB-CB 4.34Å; V93-F96 HydrophobicContact CB-CD2 3.7Å; V93-F96 HydrophobicContact CB-CE2 4.28Å; V93-F96 HydrophobicContact CB-CG 4.18Å; V93-F96 HydrophobicContact CG1-CB 4.4Å; V93-F96 HydrophobicContact CG1-CD1 4.47Å; V93-F96 HydrophobicContact CG1-CD2 3.73Å; V93-F96 HydrophobicContact CG1-CE2 4.06Å; V93-F96 HydrophobicContact CG1-CG 3.95Å; V93-F96 HydrophobicContact CG2-CD2 4.17Å; V93-F96 HydrophobicContact CG2-CE2 4.38Å; V93-F96 PolarHBondContact O-N 3.35Å; V93-S97 PolarHBondContact O-N 2.81Å
94	P	80.5	Confident	80.8	Confident	83 Å²	83	69 Å²	69	54%	0.539	36%	0.355	S	S	.	.	H	α-helix	trans	-57.7	-35.9	-173.3	19.2	-30.6	0	0	0	112.1	F96 S97 E98	P94-F96 VanDerWaalsContact C-N 3.31Å; P94-F96 PolarHBondContact O-N 2.97Å; P94-S97 WeakPolarHBondContact O-CB 3.38Å; P94-S97 PolarHBondContact O-N 3.06Å; P94-S97 VanDerWaalsContact O-N 3.16Å; P94-E98 WeakPolarHBondContact O-CG 3.23Å; P94-E98 PolarHBondContact O-N 3.13Å
95	K	86.2	Confident	81	Confident	120 Å²	120	71.2 Å²	71.2	52%	0.522	37%	0.369	S	S	.	.	H	α-helix	trans	-58.6	-38.3	176.4	-162.9	177.4	-169.5	179.8	0	113.4	V93 W99	V93-K95 HydrophobicContact CG1-CB 4.27Å; V93-K95 PolarHBondContact O-N 3.43Å; V93-K95 VanDerWaalsContact O-N 3.14Å; K95-W99 HydrophobicContact CD-CH2 4.34Å; K95-W99 HydrophobicContact CD-CZ2 4.03Å; K95-W99 VanDerWaalsContact CE-CZ2 3.46Å; K95-W99 HydrophobicContact CG-CH2 4.5Å; K95-W99 HydrophobicContact CG-CZ2 3.98Å; K95-W99 VanDerWaalsContact O-CG 3.25Å; K95-W99 PolarHBondContact O-N 2.89Å
96	F	86.3	Confident	81.1	Confident	33 Å²	33	71.1 Å²	71.1	15%	0.145	37%	0.368	C	S	.	.	H	α-helix	trans	-76	-35.8	177.6	-66.1	-22.5	0	0	0	111.8	M85 L88 Q89 V93 P94 W99 A100 L110 V113	M85-F96 HydrophobicContact CE-CD1 4.28Å; M85-F96 HydrophobicContact CE-CD2 3.85Å; M85-F96 HydrophobicContact CE-CE1 4.22Å; M85-F96 HydrophobicContact CE-CE2 3.79Å; M85-F96 HydrophobicContact CE-CG 4.11Å; M85-F96 HydrophobicContact CE-CZ 3.99Å; M85-F96 HydrophobicContact SD-CE2 4.1Å; M85-F96 HydrophobicContact SD-CZ 4.45Å; L88-F96 HydrophobicContact CB-CD2 3.7Å; L88-F96 HydrophobicContact CB-CE2 4.16Å; L88-F96 HydrophobicContact CD1-CD2 4.35Å; L88-F96 HydrophobicContact CD1-CE2 3.94Å; Q89-F96 HydrophobicContact CG-CB 4.05Å; V93-F96 HydrophobicContact CB-CB 4.34Å; V93-F96 HydrophobicContact CB-CD2 3.7Å; V93-F96 HydrophobicContact CB-CE2 4.28Å; V93-F96 HydrophobicContact CB-CG 4.18Å; V93-F96 HydrophobicContact CG1-CB 4.4Å; V93-F96 HydrophobicContact CG1-CD1 4.47Å; V93-F96 HydrophobicContact CG1-CD2 3.73Å; V93-F96 HydrophobicContact CG1-CE2 4.06Å; V93-F96 HydrophobicContact CG1-CG 3.95Å; V93-F96 HydrophobicContact CG2-CD2 4.17Å; V93-F96 HydrophobicContact CG2-CE2 4.38Å; V93-F96 PolarHBondContact O-N 3.35Å; P94-F96 VanDerWaalsContact C-N 3.31Å; P94-F96 PolarHBondContact O-N 2.97Å; F96-W99 AromaticContact CD1-CE3 3.61Å; F96-W99 HydrophobicContact CD1-CE3 3.61Å; F96-W99 AromaticContact CD1-CZ3 3.65Å; F96-W99 HydrophobicContact CD1-CZ3 3.65Å; F96-W99 HydrophobicContact CE1-CE3 4.02Å; F96-W99 HydrophobicContact CE1-CH2 4.36Å; F96-W99 AromaticContact CE1-CZ3 3.55Å; F96-W99 HydrophobicContact CE1-CZ3 3.55Å; F96-W99 PolarHBondContact O-N 3.42Å; F96-A100 WeakPolarHBondContact O-CB 3.45Å; F96-A100 PolarHBondContact O-N 3.31Å; F96-L110 HydrophobicContact CB-CD2 3.79Å; F96-L110 HydrophobicContact CD1-CD2 3.88Å; F96-L110 HydrophobicContact CG-CD2 3.96Å; F96-V113 HydrophobicContact CE1-CG1 4.47Å; F96-V113 HydrophobicContact CZ-CG1 4.15Å
97	S	80.4	Confident	81.5	Confident	5 Å²	5	76.4 Å²	76.4	4%	0.035	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-41.6	171.4	-178.3	0	0	0	0	111.8	Q89 D91 V93 P94 A100 K101	Q89-S97 WeakPolarHBondContact O-CB 3.29Å; D91-S97 WeakPolarHBondContact OD1-CB 3.36Å; D91-S97 PolarHBondContact OD1-OG 3.46Å; V93-S97 PolarHBondContact O-N 2.81Å; P94-S97 WeakPolarHBondContact O-CB 3.38Å; P94-S97 PolarHBondContact O-N 3.06Å; P94-S97 VanDerWaalsContact O-N 3.16Å; S97-A100 WeakPolarHBondContact O-CB 3.4Å; S97-A100 PolarHBondContact O-N 3.31Å; S97-K101 VanDerWaalsContact O-CG 3.29Å; S97-K101 WeakPolarHBondContact O-CG 3.35Å; S97-K101 PolarHBondContact O-N 2.86Å; S97-K101 VanDerWaalsContact O-N 3.12Å; S97-K101 WeakPolarHBondContact OG-CE 3.12Å; S97-K101 PolarHBondContact OG-NZ 2.65Å; S97-K101 VanDerWaalsContact OG-NZ 3.16Å
98	E	85.9	Confident	81.8	Confident	103 Å²	103	81.6 Å²	81.6	48%	0.481	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-48.4	174.4	-74.9	173.4	-167.1	0	0	111.9	P94 A100 K101 Q102	P94-E98 WeakPolarHBondContact O-CG 3.23Å; P94-E98 PolarHBondContact O-N 3.13Å; E98-A100 PolarHBondContact O-N 3.2Å; E98-K101 CarbonylContact O-C 3.23Å; E98-K101 WeakPolarHBondContact O-CA 3.33Å; E98-K101 WeakPolarHBondContact O-CB 3.18Å; E98-K101 PolarHBondContact O-N 3.23Å; E98-Q102 WeakPolarHBondContact O-CG 3.42Å; E98-Q102 PolarHBondContact O-N 3.26Å
99	W	87.4	Confident	82.1	Confident	44 Å²	44	83.9 Å²	83.9	17%	0.167	41%	0.409	C	S	.	.	H	α-helix	trans	-60.6	-35	175.6	-67.9	-11.2	0	0	0	112.2	K95 F96 K101 Q102 G106 K109 L110 V113	K95-W99 HydrophobicContact CD-CH2 4.34Å; K95-W99 HydrophobicContact CD-CZ2 4.03Å; K95-W99 VanDerWaalsContact CE-CZ2 3.46Å; K95-W99 HydrophobicContact CG-CH2 4.5Å; K95-W99 HydrophobicContact CG-CZ2 3.98Å; K95-W99 VanDerWaalsContact O-CG 3.25Å; K95-W99 PolarHBondContact O-N 2.89Å; F96-W99 AromaticContact CD1-CE3 3.61Å; F96-W99 HydrophobicContact CD1-CE3 3.61Å; F96-W99 AromaticContact CD1-CZ3 3.65Å; F96-W99 HydrophobicContact CD1-CZ3 3.65Å; F96-W99 HydrophobicContact CE1-CE3 4.02Å; F96-W99 HydrophobicContact CE1-CH2 4.36Å; F96-W99 AromaticContact CE1-CZ3 3.55Å; F96-W99 HydrophobicContact CE1-CZ3 3.55Å; F96-W99 PolarHBondContact O-N 3.42Å; W99-K101 PolarHBondContact O-N 3.46Å; W99-Q102 PolarHBondContact O-N 3.27Å; W99-G106 CarbonylContact O-C 3.47Å; W99-G106 VanDerWaalsContact O-C 3.23Å; W99-G106 WeakPolarHBondContact O-CA 3.32Å; W99-K109 HydrophobicContact CD2-CB 4.34Å; W99-K109 HydrophobicContact CD2-CD 4.47Å; W99-K109 HydrophobicContact CE3-CB 4.18Å; W99-L110 HydrophobicContact CB-CD1 4.1Å; W99-L110 HydrophobicContact CB-CD2 4.36Å; W99-L110 HydrophobicContact CB-CG 3.93Å; W99-L110 HydrophobicContact CE3-CD2 4.09Å; W99-L110 HydrophobicContact CE3-CG 4.35Å; W99-V113 HydrophobicContact CZ3-CG2 4.13Å
100	A	79.2	Confident	82.4	Confident	30 Å²	30	81.6 Å²	81.6	25%	0.248	40%	0.398	C	S	.	.	H	α-helix	trans	-65.5	-28.9	173.7	0	0	0	0	0	112.5	F96 S97 E98 L110	F96-A100 WeakPolarHBondContact O-CB 3.45Å; F96-A100 PolarHBondContact O-N 3.31Å; S97-A100 WeakPolarHBondContact O-CB 3.4Å; S97-A100 PolarHBondContact O-N 3.31Å; E98-A100 PolarHBondContact O-N 3.2Å; A100-L110 HydrophobicContact CB-CD1 3.8Å
101	K	80.4	Confident	83.3	Confident	124 Å²	124	81.7 Å²	81.7	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-86.7	-21.9	179.1	-67.5	165.8	-172.8	166.6	0	113.5	D91 S97 E98 W99 G103	D91-K101 IonicContact OD1-NZ 2.88Å; S97-K101 VanDerWaalsContact O-CG 3.29Å; S97-K101 WeakPolarHBondContact O-CG 3.35Å; S97-K101 PolarHBondContact O-N 2.86Å; S97-K101 VanDerWaalsContact O-N 3.12Å; S97-K101 WeakPolarHBondContact OG-CE 3.12Å; S97-K101 PolarHBondContact OG-NZ 2.65Å; S97-K101 VanDerWaalsContact OG-NZ 3.16Å; E98-K101 CarbonylContact O-C 3.23Å; E98-K101 WeakPolarHBondContact O-CA 3.33Å; E98-K101 WeakPolarHBondContact O-CB 3.18Å; E98-K101 PolarHBondContact O-N 3.23Å; W99-K101 PolarHBondContact O-N 3.46Å; K101-G103 PolarHBondContact O-N 3.43Å; K101-G103 VanDerWaalsContact O-N 3.11Å
102	Q	83	Confident	84.3	Confident	108 Å²	108	79.9 Å²	79.9	51%	0.505	39%	0.391	S	S	.	.	S	Bend	trans	-73.4	8.6	-178.7	-76.9	174.5	5.3	0	0	115.1	E98 W99	E98-Q102 WeakPolarHBondContact O-CG 3.42Å; E98-Q102 PolarHBondContact O-N 3.26Å; W99-Q102 PolarHBondContact O-N 3.27Å
103	G	84.2	Confident	85	Confident	37 Å²	37	76.3 Å²	76.3	38%	0.381	37%	0.374	S	S	.	.			trans	78.6	-148.5	179.5	0	0	0	0	0	113.5	K101 V105 G106 R107	K101-G103 PolarHBondContact O-N 3.43Å; K101-G103 VanDerWaalsContact O-N 3.11Å; G103-V105 PolarHBondContact O-N 3.45Å; G103-G106 PolarHBondContact O-N 3.42Å; G103-R107 WeakPolarHBondContact O-CG 3.42Å; G103-R107 PolarHBondContact O-N 3.43Å
104	E	82.8	Confident	85.4	Confident	153 Å²	153	74.6 Å²	74.6	72%	0.715	36%	0.364	S	S	*	.	H	α-helix	trans	-63.7	-40.2	-170.8	-67	-173.6	171.7	0	0	113.6	G106 R107 R108	E104-G106 PolarHBondContact O-N 3.48Å; E104-R107 PolarHBondContact O-N 3.34Å; E104-R108 WeakPolarHBondContact O-CG 3.42Å; E104-R108 PolarHBondContact O-N 3.23Å
105	V	85.9	Confident	85.8	Confident	97 Å²	97	74 Å²	74	59%	0.588	35%	0.351	S	S	*	.	H	α-helix	trans	-63.6	-43.7	-179.4	179	0	0	0	0	110.7	G103 R108 K109	G103-V105 PolarHBondContact O-N 3.45Å; V105-R108 PolarHBondContact O-N 2.92Å; V105-K109 PolarHBondContact O-N 3.27Å; V105-K109 VanDerWaalsContact O-N 3.17Å
106	G	86.5	Confident	86.1	Confident	0 Å²	0	76 Å²	76	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.9	-37.8	177.5	0	0	0	0	0	112.6	W99 G103 E104 R108 K109 L110	W99-G106 CarbonylContact O-C 3.47Å; W99-G106 VanDerWaalsContact O-C 3.23Å; W99-G106 WeakPolarHBondContact O-CA 3.32Å; G103-G106 PolarHBondContact O-N 3.42Å; E104-G106 PolarHBondContact O-N 3.48Å; G106-R108 PolarHBondContact O-N 3.02Å; G106-K109 WeakPolarHBondContact O-CB 3.35Å; G106-K109 PolarHBondContact O-N 3.24Å; G106-L110 PolarHBondContact O-N 2.91Å
107	R	82.5	Confident	86.3	Confident	166 Å²	166	76.6 Å²	76.6	63%	0.626	36%	0.361	S	S	*	.	H	α-helix	trans	-61.7	-39.5	171.9	-75.6	-176.1	169.8	-165.9	-4.3	112.9	G103 E104 K109 L110 N111	G103-R107 WeakPolarHBondContact O-CG 3.42Å; G103-R107 PolarHBondContact O-N 3.43Å; E104-R107 PolarHBondContact O-N 3.34Å; R107-K109 VanDerWaalsContact C-N 3.35Å; R107-K109 PolarHBondContact O-N 2.63Å; R107-L110 PolarHBondContact O-N 3.39Å; R107-N111 VanDerWaalsContact O-CG 3.27Å; R107-N111 PolarHBondContact O-N 3.26Å; R107-N111 PolarHBondContact O-OD1 3.28Å
108	R	86.1	Confident	86.8	Confident	172 Å²	172	76.4 Å²	76.4	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-62	-41.2	174.3	-72.5	179.6	-176.1	-173.8	3.1	111.9	E104 V105 G106 N111 N112	E104-R108 WeakPolarHBondContact O-CG 3.42Å; E104-R108 PolarHBondContact O-N 3.23Å; V105-R108 PolarHBondContact O-N 2.92Å; G106-R108 PolarHBondContact O-N 3.02Å; R108-N111 PolarHBondContact O-N 3.04Å; R108-N112 PolarHBondContact O-N 2.95Å
109	K	87.8	Confident	87.1	Confident	94 Å²	94	74.5 Å²	74.5	41%	0.409	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-46.7	175.3	-70.8	-179.1	-179.4	177.7	0	111.8	W99 V105 G106 R107 N111 N112 V113	W99-K109 HydrophobicContact CD2-CB 4.34Å; W99-K109 HydrophobicContact CD2-CD 4.47Å; W99-K109 HydrophobicContact CE3-CB 4.18Å; V105-K109 PolarHBondContact O-N 3.27Å; V105-K109 VanDerWaalsContact O-N 3.17Å; G106-K109 WeakPolarHBondContact O-CB 3.35Å; G106-K109 PolarHBondContact O-N 3.24Å; R107-K109 VanDerWaalsContact C-N 3.35Å; R107-K109 PolarHBondContact O-N 2.63Å; K109-N111 VanDerWaalsContact C-N 3.33Å; K109-N111 PolarHBondContact O-N 2.78Å; K109-N112 PolarHBondContact O-N 3.08Å; K109-V113 WeakPolarHBondContact O-CG2 3.35Å; K109-V113 PolarHBondContact O-N 3Å; K109-V113 VanDerWaalsContact O-N 3.1Å
110	L	88.9	Confident	87.2	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-58.6	-45.5	176.3	-75.4	167.7	0	0	0	111.7	M85 Q89 F96 W99 A100 G106 R107 N112 V113 T114	M85-L110 HydrophobicContact CE-CD2 3.74Å; Q89-L110 HydrophobicContact CG-CD1 4.19Å; Q89-L110 HydrophobicContact CG-CD2 4.05Å; F96-L110 HydrophobicContact CB-CD2 3.79Å; F96-L110 HydrophobicContact CD1-CD2 3.88Å; F96-L110 HydrophobicContact CG-CD2 3.96Å; W99-L110 HydrophobicContact CB-CD1 4.1Å; W99-L110 HydrophobicContact CB-CD2 4.36Å; W99-L110 HydrophobicContact CB-CG 3.93Å; W99-L110 HydrophobicContact CE3-CD2 4.09Å; W99-L110 HydrophobicContact CE3-CG 4.35Å; A100-L110 HydrophobicContact CB-CD1 3.8Å; G106-L110 PolarHBondContact O-N 2.91Å; R107-L110 PolarHBondContact O-N 3.39Å; L110-N112 VanDerWaalsContact C-N 3.32Å; L110-N112 PolarHBondContact O-N 3.21Å; L110-V113 PolarHBondContact O-N 3.45Å; L110-V113 VanDerWaalsContact O-N 3.16Å; L110-T114 PolarHBondContact O-N 2.93Å; L110-T114 PolarHBondContact O-OG1 3.24Å
111	N	87.2	Confident	87.6	Confident	76 Å²	76	76.5 Å²	76.5	41%	0.406	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-40	178.1	-71	-7.7	0	0	0	112.2	R107 R108 K109 T114 R115	R107-N111 VanDerWaalsContact O-CG 3.27Å; R107-N111 PolarHBondContact O-N 3.26Å; R107-N111 PolarHBondContact O-OD1 3.28Å; R108-N111 PolarHBondContact O-N 3.04Å; K109-N111 VanDerWaalsContact C-N 3.33Å; K109-N111 PolarHBondContact O-N 2.78Å; N111-T114 WeakPolarHBondContact O-CB 3.45Å; N111-T114 PolarHBondContact O-N 2.98Å; N111-R115 WeakPolarHBondContact O-CG 3.08Å; N111-R115 PolarHBondContact O-N 3.3Å
112	N	89.7	Confident	87.9	Confident	70 Å²	70	70.6 Å²	70.6	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175.7	-71.3	-14.7	0	0	0	112	R108 K109 L110 R115 Y116	R108-N112 PolarHBondContact O-N 2.95Å; K109-N112 PolarHBondContact O-N 3.08Å; L110-N112 VanDerWaalsContact C-N 3.32Å; L110-N112 PolarHBondContact O-N 3.21Å; N112-R115 WeakPolarHBondContact O-CB 3.43Å; N112-R115 PolarHBondContact O-N 3.38Å; N112-R115 PolarHBondContact OD1-NH1 3.34Å; N112-Y116 HydrophobicContact CB-CE2 4.42Å; N112-Y116 WeakPolarHBondContact O-CD2 3.04Å; N112-Y116 PolarHBondContact O-N 3.14Å
113	V	92.4	Very high	88.2	Confident	41 Å²	41	69.4 Å²	69.4	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-43.9	174.6	177.6	0	0	0	0	110.9	M85 F96 W99 K109 L110 R115 Y116 L117	M85-V113 HydrophobicContact CE-CB 4.04Å; M85-V113 HydrophobicContact CE-CG1 3.72Å; M85-V113 HydrophobicContact SD-CB 4.46Å; M85-V113 HydrophobicContact SD-CG1 3.66Å; F96-V113 HydrophobicContact CE1-CG1 4.47Å; F96-V113 HydrophobicContact CZ-CG1 4.15Å; W99-V113 HydrophobicContact CZ3-CG2 4.13Å; K109-V113 WeakPolarHBondContact O-CG2 3.35Å; K109-V113 PolarHBondContact O-N 3Å; K109-V113 VanDerWaalsContact O-N 3.1Å; L110-V113 PolarHBondContact O-N 3.45Å; L110-V113 VanDerWaalsContact O-N 3.16Å; V113-R115 PolarHBondContact O-N 3.26Å; V113-Y116 PolarHBondContact O-N 2.71Å; V113-L117 WeakPolarHBondContact O-CB 3.5Å; V113-L117 PolarHBondContact O-N 3.06Å
114	T	89.7	Confident	88.2	Confident	6 Å²	6	72.8 Å²	72.8	4%	0.037	34%	0.342	C	S	.	.	H	α-helix	trans	-55.1	-42	173.9	-52.2	0	0	0	0	111.5	Y78 A81 M85 L110 N111 L117 A118	Y78-T114 HydrophobicContact CE2-CG2 4.01Å; A81-T114 HydrophobicContact CB-CG2 4.11Å; A81-T114 WeakPolarHBondContact CB-O 3.34Å; M85-T114 HydrophobicContact CG-CG2 4.3Å; M85-T114 WeakPolarHBondContact CG-OG1 3.39Å; L110-T114 PolarHBondContact O-N 2.93Å; L110-T114 PolarHBondContact O-OG1 3.24Å; N111-T114 WeakPolarHBondContact O-CB 3.45Å; N111-T114 PolarHBondContact O-N 2.98Å; T114-L117 PolarHBondContact O-N 2.93Å; T114-A118 VanDerWaalsContact O-CB 3.29Å; T114-A118 WeakPolarHBondContact O-CB 3.36Å; T114-A118 PolarHBondContact O-N 2.91Å
115	R	89.7	Confident	88.2	Confident	71 Å²	71	68.4 Å²	68.4	27%	0.268	32%	0.322	S	S	.	.	H	α-helix	trans	-66.1	-45.1	178.5	-70.1	175.2	-174.6	161.2	3.9	112.4	Y78 N111 N112 V113 L117 A118 I119 I165 D169	Y78-R115 HydrophobicContact CE2-CG 4.27Å; N111-R115 WeakPolarHBondContact O-CG 3.08Å; N111-R115 PolarHBondContact O-N 3.3Å; N112-R115 WeakPolarHBondContact O-CB 3.43Å; N112-R115 PolarHBondContact O-N 3.38Å; N112-R115 PolarHBondContact OD1-NH1 3.34Å; V113-R115 PolarHBondContact O-N 3.26Å; R115-L117 VanDerWaalsContact C-N 3.33Å; R115-L117 PolarHBondContact O-N 3.24Å; R115-A118 WeakPolarHBondContact O-CB 3.47Å; R115-A118 PolarHBondContact O-N 3.44Å; R115-I119 WeakPolarHBondContact O-CG1 3.2Å; R115-I119 PolarHBondContact O-N 2.88Å; R115-I165 HydrophobicContact CG-CG2 4.06Å; R115-D169 IonicContact CZ-OD1 3.78Å; R115-D169 IonicContact CZ-OD2 2.67Å; R115-D169 IonicContact NE-OD1 2.77Å; R115-D169 IonicContact NE-OD2 2.79Å; R115-D169 PolarHBondContact NE-OD2 2.91Å; R115-D169 IonicContact NH1-OD2 2.59Å; R115-D169 IonicContact NH2-OD1 3.64Å; R115-D169 PolarHBondContact NH2-OD1 3.3Å; R115-D169 IonicContact NH2-OD2 2.94Å; R115-D169 PolarHBondContact NH2-OD2 3.44Å
116	Y	92.2	Very high	87.9	Confident	161 Å²	161	63.8 Å²	63.8	63%	0.631	29%	0.294	S	S	*	.	H	α-helix	trans	-62.6	-43.9	176.9	-65.5	-48	0	0	0	111.5	N112 V113 A118 I119 S120	N112-Y116 HydrophobicContact CB-CE2 4.42Å; N112-Y116 WeakPolarHBondContact O-CD2 3.04Å; N112-Y116 PolarHBondContact O-N 3.14Å; V113-Y116 PolarHBondContact O-N 2.71Å; Y116-A118 VanDerWaalsContact C-N 3.31Å; Y116-A118 PolarHBondContact O-N 2.94Å; Y116-I119 PolarHBondContact O-N 3.19Å; Y116-S120 PolarHBondContact O-N 3.38Å; Y116-S120 PolarHBondContact O-OG 3.45Å; Y116-S120 VanDerWaalsContact O-OG 3.13Å
117	L	91.3	Very high	87.7	Confident	47 Å²	47	66.8 Å²	66.8	25%	0.246	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-40.5	176.2	-164	155.2	0	0	0	111.2	A81 V84 M85 V113 T114 R115 I119 S120 L121	A81-L117 HydrophobicContact CB-CB 4.25Å; A81-L117 HydrophobicContact CB-CD2 3.4Å; A81-L117 VanDerWaalsContact CB-CD2 3.4Å; A81-L117 HydrophobicContact CB-CG 4.43Å; V84-L117 HydrophobicContact CG1-CD1 4.03Å; M85-L117 HydrophobicContact SD-CD1 4.3Å; V113-L117 WeakPolarHBondContact O-CB 3.5Å; V113-L117 PolarHBondContact O-N 3.06Å; T114-L117 PolarHBondContact O-N 2.93Å; R115-L117 VanDerWaalsContact C-N 3.33Å; R115-L117 PolarHBondContact O-N 3.24Å; L117-I119 PolarHBondContact O-N 3.31Å; L117-S120 PolarHBondContact O-N 3.24Å; L117-L121 HydrophobicContact CD2-CD1 3.4Å; L117-L121 VanDerWaalsContact CD2-CD1 3.4Å; L117-L121 HydrophobicContact CD2-CG 3.82Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.49Å
118	A	89.7	Confident	87.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-43	175.9	0	0	0	0	0	112.7	Y78 A81 T114 R115 Y116 L121 A122 I165	Y78-A118 HydrophobicContact CD2-CB 3.93Å; Y78-A118 HydrophobicContact CG-CB 4.45Å; A81-A118 HydrophobicContact CB-CB 3.69Å; T114-A118 VanDerWaalsContact O-CB 3.29Å; T114-A118 WeakPolarHBondContact O-CB 3.36Å; T114-A118 PolarHBondContact O-N 2.91Å; R115-A118 WeakPolarHBondContact O-CB 3.47Å; R115-A118 PolarHBondContact O-N 3.44Å; Y116-A118 VanDerWaalsContact C-N 3.31Å; Y116-A118 PolarHBondContact O-N 2.94Å; A118-L121 PolarHBondContact O-N 3.37Å; A118-A122 VanDerWaalsContact O-CB 3.26Å; A118-A122 WeakPolarHBondContact O-CB 3.45Å; A118-A122 PolarHBondContact O-N 3.3Å; A118-I165 HydrophobicContact CB-CD1 3.92Å
119	I	92.1	Very high	86.7	Confident	64 Å²	64	52.7 Å²	52.7	33%	0.328	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-43.7	178.2	-67.2	168	0	0	0	110.4	R115 Y116 L117 L121 A122 F123 T158 A162	R115-I119 WeakPolarHBondContact O-CG1 3.2Å; R115-I119 PolarHBondContact O-N 2.88Å; Y116-I119 PolarHBondContact O-N 3.19Å; L117-I119 PolarHBondContact O-N 3.31Å; I119-L121 PolarHBondContact O-N 3.16Å; I119-A122 PolarHBondContact O-N 3.1Å; I119-F123 PolarHBondContact O-N 3Å; I119-T158 HydrophobicContact CG2-CG2 3.87Å; I119-A162 HydrophobicContact CD1-CB 4.42Å; I119-A162 HydrophobicContact CG1-CB 4.4Å
120	S	90.4	Very high	86	Confident	71 Å²	71	48.2 Å²	48.2	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	-61.7	-43.8	175.5	-59.5	0	0	0	0	112	Y116 L117 F123 I124	Y116-S120 PolarHBondContact O-N 3.38Å; Y116-S120 PolarHBondContact O-OG 3.45Å; Y116-S120 VanDerWaalsContact O-OG 3.13Å; L117-S120 PolarHBondContact O-N 3.24Å; S120-F123 PolarHBondContact O-N 3.06Å; S120-I124 WeakPolarHBondContact O-CG1 3.5Å; S120-I124 PolarHBondContact O-N 3.36Å; S120-I124 VanDerWaalsContact O-N 3.11Å
121	L	87.6	Confident	85.1	Confident	44 Å²	44	53.1 Å²	53.1	23%	0.23	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-40.1	174.6	-74.7	-176.7	0	0	0	111.9	P77 T80 A81 L117 A118 I119 F123 I124 Q125	P77-L121 HydrophobicContact CB-CB 4.48Å; T80-L121 HydrophobicContact CG2-CD1 3.83Å; A81-L121 HydrophobicContact CB-CD1 4.32Å; L117-L121 HydrophobicContact CD2-CD1 3.4Å; L117-L121 VanDerWaalsContact CD2-CD1 3.4Å; L117-L121 HydrophobicContact CD2-CG 3.82Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.49Å; A118-L121 PolarHBondContact O-N 3.37Å; I119-L121 PolarHBondContact O-N 3.16Å; L121-F123 VanDerWaalsContact C-N 3.3Å; L121-F123 PolarHBondContact O-N 3.3Å; L121-I124 PolarHBondContact O-N 2.98Å; L121-Q125 VanDerWaalsContact O-CB 3.22Å; L121-Q125 WeakPolarHBondContact O-CB 3.35Å; L121-Q125 VanDerWaalsContact O-CG 3.23Å; L121-Q125 WeakPolarHBondContact O-CG 3.16Å; L121-Q125 PolarHBondContact O-N 3.28Å
122	A	87.2	Confident	84	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-39.8	176.8	0	0	0	0	0	111.3	P77 A118 I119 S126 T158 T161	P77-A122 HydrophobicContact CB-CB 3.78Å; P77-A122 HydrophobicContact CG-CB 3.82Å; A118-A122 VanDerWaalsContact O-CB 3.26Å; A118-A122 WeakPolarHBondContact O-CB 3.45Å; A118-A122 PolarHBondContact O-N 3.3Å; I119-A122 PolarHBondContact O-N 3.1Å; A122-S126 WeakPolarHBondContact O-CB 3.41Å; A122-S126 PolarHBondContact O-N 2.83Å; A122-S126 PolarHBondContact O-OG 3.49Å; A122-T158 HydrophobicContact CB-CG2 4.3Å; A122-T161 HydrophobicContact CB-CG2 4.08Å
123	F	87.9	Confident	82.8	Confident	84 Å²	84	48.9 Å²	48.9	37%	0.368	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-48.4	175.7	-169.8	-103.6	0	0	0	112	I119 S120 L121 S126 I127 L151 A154 T158	I119-F123 PolarHBondContact O-N 3Å; S120-F123 PolarHBondContact O-N 3.06Å; L121-F123 VanDerWaalsContact C-N 3.3Å; L121-F123 PolarHBondContact O-N 3.3Å; F123-S126 PolarHBondContact O-N 3.42Å; F123-S126 PolarHBondContact O-OG 2.97Å; F123-I127 HydrophobicContact CD1-CD1 4.01Å; F123-I127 HydrophobicContact CE1-CD1 3.63Å; F123-I127 HydrophobicContact CZ-CD1 4.01Å; F123-I127 WeakPolarHBondContact O-CG1 3.35Å; F123-I127 PolarHBondContact O-N 3.33Å; F123-L151 HydrophobicContact CZ-CD2 4.43Å; F123-A154 HydrophobicContact CE2-CB 4.37Å; F123-T158 VanDerWaalsContact CA-OG1 3.23Å; F123-T158 WeakPolarHBondContact CA-OG1 3.39Å; F123-T158 HydrophobicContact CB-CG2 4.25Å; F123-T158 PolarHBondContact N-OG1 3.48Å
124	I	85.5	Confident	81.6	Confident	107 Å²	107	47 Å²	47	55%	0.549	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-45.5	179.3	-64.2	166.3	0	0	0	111.1	S120 L121 I127 G128	S120-I124 WeakPolarHBondContact O-CG1 3.5Å; S120-I124 PolarHBondContact O-N 3.36Å; S120-I124 VanDerWaalsContact O-N 3.11Å; L121-I124 PolarHBondContact O-N 2.98Å; I124-I127 PolarHBondContact O-N 3.49Å; I124-G128 PolarHBondContact O-N 2.57Å
125	Q	81	Confident	80.5	Confident	62 Å²	62	50.3 Å²	50.3	29%	0.29	25%	0.247	S	C	.	.	H	α-helix	trans	-68.1	-35.6	-179.8	-71.2	179.8	-3.1	0	0	112	M73 L121 G128 M129	M73-Q125 HydrophobicContact CE-CB 3.46Å; M73-Q125 VanDerWaalsContact CE-CB 3.46Å; M73-Q125 HydrophobicContact CE-CG 4.41Å; M73-Q125 VanDerWaalsContact CE-OE1 3.23Å; M73-Q125 HydrophobicContact SD-CB 4.42Å; L121-Q125 VanDerWaalsContact O-CB 3.22Å; L121-Q125 WeakPolarHBondContact O-CB 3.35Å; L121-Q125 VanDerWaalsContact O-CG 3.23Å; L121-Q125 WeakPolarHBondContact O-CG 3.16Å; L121-Q125 PolarHBondContact O-N 3.28Å; Q125-G128 PolarHBondContact O-N 2.89Å; Q125-M129 WeakPolarHBondContact O-CB 3.37Å; Q125-M129 PolarHBondContact O-N 3.26Å
126	S	81.4	Confident	79	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.8	-36.6	178.5	61.2	0	0	0	0	112.4	A122 F123 M129 A130 A154 T158	A122-S126 WeakPolarHBondContact O-CB 3.41Å; A122-S126 PolarHBondContact O-N 2.83Å; A122-S126 PolarHBondContact O-OG 3.49Å; F123-S126 PolarHBondContact O-N 3.42Å; F123-S126 PolarHBondContact O-OG 2.97Å; S126-M129 PolarHBondContact O-N 3.25Å; S126-A130 VanDerWaalsContact O-CB 3.29Å; S126-A130 WeakPolarHBondContact O-CB 3.4Å; S126-A130 PolarHBondContact O-N 2.92Å; S126-A154 WeakPolarHBondContact OG-CA 3.49Å; S126-A154 WeakPolarHBondContact OG-CB 3.35Å; S126-A154 PolarHBondContact OG-O 2.97Å; S126-T158 PolarHBondContact OG-OG1 3.35Å
127	I	80.6	Confident	77.4	Confident	63 Å²	63	45.3 Å²	45.3	32%	0.323	23%	0.229	S	C	.	.	H	α-helix	trans	-61.1	-51.4	170.9	-65.5	168.5	0	0	0	110.2	F123 I124 M129 A130 F131 A154	F123-I127 HydrophobicContact CD1-CD1 4.01Å; F123-I127 HydrophobicContact CE1-CD1 3.63Å; F123-I127 HydrophobicContact CZ-CD1 4.01Å; F123-I127 WeakPolarHBondContact O-CG1 3.35Å; F123-I127 PolarHBondContact O-N 3.33Å; I124-I127 PolarHBondContact O-N 3.49Å; I127-M129 VanDerWaalsContact C-N 3.28Å; I127-M129 PolarHBondContact O-N 3.02Å; I127-A130 PolarHBondContact O-N 3.39Å; I127-F131 WeakPolarHBondContact O-CB 3.25Å; I127-F131 PolarHBondContact O-N 3.34Å; I127-A154 HydrophobicContact CG1-CB 3.55Å
128	G	76	Confident	75.8	Confident	20 Å²	20	51.9 Å²	51.9	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-39.1	179.3	0	0	0	0	0	112.5	I124 Q125 Q132	I124-G128 PolarHBondContact O-N 2.57Å; Q125-G128 PolarHBondContact O-N 2.89Å; G128-Q132 VanDerWaalsContact O-CB 3.29Å; G128-Q132 WeakPolarHBondContact O-CB 3.41Å; G128-Q132 PolarHBondContact O-N 3.3Å
129	M	72.3	Confident	74.3	Confident	21 Å²	21	52.7 Å²	52.7	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-69.1	-45.3	177.8	-169.9	171.2	-178.7	0	0	112.1	L65 F68 M73 Q125 S126 I127 F131 Q132 F133	L65-M129 HydrophobicContact CD1-CE 3.03Å; L65-M129 HydrophobicContact CD2-CE 3.86Å; L65-M129 HydrophobicContact CG-CE 4.01Å; F68-M129 HydrophobicContact CE2-CE 4.32Å; M73-M129 HydrophobicContact CG-SD 4.36Å; M73-M129 HydrophobicContact SD-CB 4.32Å; M73-M129 HydrophobicContact SD-CG 4.49Å; M73-M129 HydrophobicContact SD-SD 3.24Å; Q125-M129 WeakPolarHBondContact O-CB 3.37Å; Q125-M129 PolarHBondContact O-N 3.26Å; S126-M129 PolarHBondContact O-N 3.25Å; I127-M129 VanDerWaalsContact C-N 3.28Å; I127-M129 PolarHBondContact O-N 3.02Å; M129-F131 VanDerWaalsContact C-N 3.34Å; M129-F131 PolarHBondContact O-N 3.31Å; M129-Q132 PolarHBondContact O-N 3.32Å; M129-F133 HydrophobicContact CE-CD2 4.16Å; M129-F133 HydrophobicContact CE-CE2 3.63Å; M129-F133 HydrophobicContact CE-CZ 4.36Å; M129-F133 HydrophobicContact CG-CD2 3.55Å; M129-F133 HydrophobicContact CG-CE2 3.69Å; M129-F133 WeakPolarHBondContact O-CD2 3.36Å; M129-F133 PolarHBondContact O-N 2.82Å; M129-F133 HydrophobicContact SD-CE2 4.49Å
130	A	73.1	Confident	72.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-43.4	177.4	0	0	0	0	0	111.4	S126 I127 N134 Y150 I153	S126-A130 VanDerWaalsContact O-CB 3.29Å; S126-A130 WeakPolarHBondContact O-CB 3.4Å; S126-A130 PolarHBondContact O-N 2.92Å; I127-A130 PolarHBondContact O-N 3.39Å; A130-N134 VanDerWaalsContact O-CB 3.3Å; A130-N134 WeakPolarHBondContact O-CB 3.42Å; A130-N134 PolarHBondContact O-N 3.13Å; A130-N134 VanDerWaalsContact O-N 3.16Å; A130-Y150 HydrophobicContact CB-CD1 3.89Å; A130-I153 HydrophobicContact CB-CG2 3.97Å
131	F	70.4	Confident	71.2	Confident	108 Å²	108	48.8 Å²	48.8	47%	0.474	25%	0.246	S	C	.	.	H	α-helix	trans	-63.4	-48	175.3	-170.6	-105	0	0	0	112	I127 M129 N134 N135 Y150	I127-F131 WeakPolarHBondContact O-CB 3.25Å; I127-F131 PolarHBondContact O-N 3.34Å; M129-F131 VanDerWaalsContact C-N 3.34Å; M129-F131 PolarHBondContact O-N 3.31Å; F131-N134 PolarHBondContact O-N 3.41Å; F131-N135 VanDerWaalsContact CD1-ND2 3.32Å; F131-N135 WeakPolarHBondContact CD1-ND2 3.32Å; F131-N135 WeakPolarHBondContact CE1-ND2 3.29Å; F131-N135 WeakPolarHBondContact CZ-ND2 3.36Å; F131-N135 WeakPolarHBondContact O-CB 3.36Å; F131-N135 VanDerWaalsContact O-CG 3.29Å; F131-N135 PolarHBondContact O-N 2.86Å; F131-N135 PolarHBondContact O-ND2 3.36Å; F131-Y150 HydrophobicContact CD2-CE1 4.47Å
132	Q	64.8	Low	69.9	Low	37 Å²	37	46.9 Å²	46.9	17%	0.173	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-52.3	-179.1	-174.7	74.6	5.2	0	0	112.1	G128 M129 N134 N135 Y136 L288	G128-Q132 VanDerWaalsContact O-CB 3.29Å; G128-Q132 WeakPolarHBondContact O-CB 3.41Å; G128-Q132 PolarHBondContact O-N 3.3Å; M129-Q132 PolarHBondContact O-N 3.32Å; Q132-N134 VanDerWaalsContact C-N 3.27Å; Q132-N134 PolarHBondContact O-N 3.04Å; Q132-N135 PolarHBondContact O-N 2.85Å; Q132-Y136 WeakPolarHBondContact O-CB 3.39Å; Q132-Y136 PolarHBondContact O-N 3.29Å; Q132-L288 HydrophobicContact CB-CD2 3.89Å; Q132-L288 VanDerWaalsContact CD-CD2 3.45Å; Q132-L288 HydrophobicContact CG-CD2 3.37Å; Q132-L288 PolarHBondContact OE1-O 3.38Å
133	F	64.3	Low	68.6	Low	19 Å²	19	52.8 Å²	52.8	8%	0.083	27%	0.266	C	S	.	.	H	α-helix	trans	-67.2	-32.9	-175.4	-84.3	-84.1	0	0	0	111.3	F44 T54 L65 F68 M129 L137 L141	F44-F133 AromaticContact CE1-CD1 3.55Å; F44-F133 HydrophobicContact CE1-CD1 3.55Å; F44-F133 AromaticContact CE1-CE1 3.66Å; F44-F133 HydrophobicContact CE1-CE1 3.66Å; F44-F133 AromaticContact CZ-CD1 3.52Å; F44-F133 HydrophobicContact CZ-CD1 3.52Å; F44-F133 AromaticContact CZ-CE1 3.94Å; F44-F133 HydrophobicContact CZ-CE1 3.94Å; F44-F133 HydrophobicContact CZ-CG 4.32Å; T54-F133 HydrophobicContact CG2-CE1 3.95Å; T54-F133 HydrophobicContact CG2-CZ 3.93Å; L65-F133 HydrophobicContact CD1-CE1 4.14Å; L65-F133 HydrophobicContact CD1-CE2 3.97Å; L65-F133 HydrophobicContact CD1-CZ 3.74Å; L65-F133 HydrophobicContact CD2-CE2 4.46Å; L65-F133 HydrophobicContact CD2-CZ 3.9Å; L65-F133 HydrophobicContact CG-CZ 4.16Å; F68-F133 HydrophobicContact CE2-CB 4.16Å; F68-F133 HydrophobicContact CE2-CD2 4.14Å; F68-F133 HydrophobicContact CE2-CG 4.13Å; M129-F133 HydrophobicContact CE-CD2 4.16Å; M129-F133 HydrophobicContact CE-CE2 3.63Å; M129-F133 HydrophobicContact CE-CZ 4.36Å; M129-F133 HydrophobicContact CG-CD2 3.55Å; M129-F133 HydrophobicContact CG-CE2 3.69Å; M129-F133 WeakPolarHBondContact O-CD2 3.36Å; M129-F133 PolarHBondContact O-N 2.82Å; M129-F133 HydrophobicContact SD-CE2 4.49Å; F133-L137 VanDerWaalsContact O-CB 3.23Å; F133-L137 WeakPolarHBondContact O-CB 3.35Å; F133-L137 VanDerWaalsContact O-CG 3.3Å; F133-L137 WeakPolarHBondContact O-CG 3.35Å; F133-L137 PolarHBondContact O-N 2.84Å; F133-L141 HydrophobicContact CB-CD2 3.88Å
134	N	67.2	Low	67.4	Low	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-68.7	-44.5	174.1	-164.6	55.1	0	0	0	112.3	A130 F131 Q132 Y136 L137 K138 G139 I142 Y150	A130-N134 VanDerWaalsContact O-CB 3.3Å; A130-N134 WeakPolarHBondContact O-CB 3.42Å; A130-N134 PolarHBondContact O-N 3.13Å; A130-N134 VanDerWaalsContact O-N 3.16Å; F131-N134 PolarHBondContact O-N 3.41Å; Q132-N134 VanDerWaalsContact C-N 3.27Å; Q132-N134 PolarHBondContact O-N 3.04Å; N134-Y136 VanDerWaalsContact C-N 3.34Å; N134-Y136 PolarHBondContact O-N 3.28Å; N134-L137 CarbonylContact O-C 3.32Å; N134-L137 PolarHBondContact O-N 3.22Å; N134-K138 PolarHBondContact O-N 2.93Å; N134-G139 PolarHBondContact O-N 2.87Å; N134-G139 WeakPolarHBondContact OD1-CA 3.34Å; N134-I142 HydrophobicContact CB-CD1 3.67Å; N134-I142 HydrophobicContact CB-CG1 4.02Å; N134-I142 PolarHBondContact OD1-N 3.38Å; N134-I142 VanDerWaalsContact OD1-N 3.1Å; N134-Y150 HydrophobicContact CB-CE1 4.07Å; N134-Y150 PolarHBondContact ND2-OH 3.41Å
135	N	64.9	Low	66.5	Low	77 Å²	77	55 Å²	55	41%	0.412	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-41.7	175.9	-72.1	-14	0	0	0	112	F131 Q132 K138	F131-N135 VanDerWaalsContact CD1-ND2 3.32Å; F131-N135 WeakPolarHBondContact CD1-ND2 3.32Å; F131-N135 WeakPolarHBondContact CE1-ND2 3.29Å; F131-N135 WeakPolarHBondContact CZ-ND2 3.36Å; F131-N135 WeakPolarHBondContact O-CB 3.36Å; F131-N135 VanDerWaalsContact O-CG 3.29Å; F131-N135 PolarHBondContact O-N 2.86Å; F131-N135 PolarHBondContact O-ND2 3.36Å; Q132-N135 PolarHBondContact O-N 2.85Å; N135-K138 PolarHBondContact O-N 3.47Å
136	Y	59.7	Low	65.9	Low	98 Å²	98	55 Å²	55	38%	0.384	29%	0.286	S	S	.	.	H	α-helix	trans	-68.5	-36.9	-178.6	-173.9	-100.9	0	0	0	112.5	Q48 G49 S50 Q132 N134 K138	Q48-Y136 PolarHBondContact O-OH 2.96Å; G49-Y136 WeakPolarHBondContact CA-OH 3.5Å; S50-Y136 WeakPolarHBondContact CB-OH 3.37Å; S50-Y136 PolarHBondContact N-OH 3.21Å; Q132-Y136 WeakPolarHBondContact O-CB 3.39Å; Q132-Y136 PolarHBondContact O-N 3.29Å; N134-Y136 VanDerWaalsContact C-N 3.34Å; N134-Y136 PolarHBondContact O-N 3.28Å; Y136-K138 PolarHBondContact O-N 3.33Å
137	L	58.2	Low	65.7	Low	28 Å²	28	61.5 Å²	61.5	15%	0.147	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	20.3	174.4	-63.4	168.6	0	0	0	112.6	A43 F44 F133 N134 G139 A140 L141	A43-L137 HydrophobicContact CB-CD1 4.16Å; F44-L137 HydrophobicContact CD1-CD1 4.22Å; F44-L137 HydrophobicContact CE1-CD1 3.82Å; F44-L137 HydrophobicContact CE2-CD1 4.18Å; F44-L137 HydrophobicContact CZ-CD1 3.8Å; F133-L137 VanDerWaalsContact O-CB 3.23Å; F133-L137 WeakPolarHBondContact O-CB 3.35Å; F133-L137 VanDerWaalsContact O-CG 3.3Å; F133-L137 WeakPolarHBondContact O-CG 3.35Å; F133-L137 PolarHBondContact O-N 2.84Å; N134-L137 CarbonylContact O-C 3.32Å; N134-L137 PolarHBondContact O-N 3.22Å; L137-G139 PolarHBondContact O-N 3.37Å; L137-G139 VanDerWaalsContact O-N 3.11Å; L137-A140 VanDerWaalsContact O-CB 3.27Å; L137-A140 WeakPolarHBondContact O-CB 3.33Å; L137-A140 PolarHBondContact O-N 2.94Å; L137-L141 HydrophobicContact CB-CB 4.43Å; L137-L141 HydrophobicContact CD1-CB 3.94Å; L137-L141 HydrophobicContact CD1-CD1 3.6Å; L137-L141 HydrophobicContact CD1-CG 4.22Å
138	K	57.1	Low	65.7	Low	185 Å²	185	65.1 Å²	65.1	80%	0.804	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	36.9	177.5	-63	-176.3	177.4	178.9	0	114	N134 N135 Y136 A140	N134-K138 PolarHBondContact O-N 2.93Å; N135-K138 PolarHBondContact O-N 3.47Å; Y136-K138 PolarHBondContact O-N 3.33Å; K138-A140 VanDerWaalsContact C-N 3.32Å; K138-A140 PolarHBondContact O-N 3.43Å
139	G	59	Low	65.7	Low	17 Å²	17	65.4 Å²	65.4	18%	0.175	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	2.6	178.7	0	0	0	0	0	115.6	N134 L137 L141	N134-G139 PolarHBondContact O-N 2.87Å; N134-G139 WeakPolarHBondContact OD1-CA 3.34Å; L137-G139 PolarHBondContact O-N 3.37Å; L137-G139 VanDerWaalsContact O-N 3.11Å; G139-L141 VanDerWaalsContact C-N 3.28Å; G139-L141 PolarHBondContact O-N 3.41Å
140	A	58.9	Low	65.9	Low	54 Å²	54	66 Å²	66	45%	0.446	34%	0.337	S	S	.	.			trans	-77.5	-13.8	-179.4	0	0	0	0	0	113.5	A43 L137 K138	A43-A140 HydrophobicContact CB-CB 4.12Å; L137-A140 VanDerWaalsContact O-CB 3.27Å; L137-A140 WeakPolarHBondContact O-CB 3.33Å; L137-A140 PolarHBondContact O-N 2.94Å; K138-A140 VanDerWaalsContact C-N 3.32Å; K138-A140 PolarHBondContact O-N 3.43Å
141	L	58.7	Low	66.4	Low	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	-79.2	-47.5	-178.5	-166.1	82.1	0	0	0	111.3	V39 N40 A43 F44 F68 F133 L137 G139	V39-L141 CarbonylContact C-O 3.51Å; V39-L141 WeakPolarHBondContact CA-O 3.31Å; V39-L141 HydrophobicContact CB-CG 4.24Å; V39-L141 HydrophobicContact CG1-CD2 3.83Å; V39-L141 HydrophobicContact CG1-CG 3.8Å; N40-L141 PolarHBondContact N-O 3.42Å; A43-L141 HydrophobicContact CB-CD1 4.21Å; F44-L141 HydrophobicContact CD2-CD1 3.96Å; F44-L141 HydrophobicContact CE2-CD1 3.3Å; F44-L141 HydrophobicContact CZ-CD1 3.91Å; F68-L141 HydrophobicContact CD2-CD2 4.11Å; F68-L141 HydrophobicContact CE2-CD2 4.04Å; F68-L141 HydrophobicContact CG-CD2 4.38Å; F68-L141 HydrophobicContact CZ-CD2 4.24Å; F133-L141 HydrophobicContact CB-CD2 3.88Å; L137-L141 HydrophobicContact CB-CB 4.43Å; L137-L141 HydrophobicContact CD1-CB 3.94Å; L137-L141 HydrophobicContact CD1-CD1 3.6Å; L137-L141 HydrophobicContact CD1-CG 4.22Å; G139-L141 VanDerWaalsContact C-N 3.28Å; G139-L141 PolarHBondContact O-N 3.41Å
142	I	60.1	Low	67.2	Low	3 Å²	3	68.8 Å²	68.8	2%	0.015	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-103.3	116.6	-173.2	-55	175.3	0	0	0	109.7	G38 V39 N134 N144 Y150 I153	G38-I142 WeakPolarHBondContact O-CA 3.42Å; V39-I142 HydrophobicContact CG1-CG1 4.36Å; N134-I142 HydrophobicContact CB-CD1 3.67Å; N134-I142 HydrophobicContact CB-CG1 4.02Å; N134-I142 PolarHBondContact OD1-N 3.38Å; N134-I142 VanDerWaalsContact OD1-N 3.1Å; I142-N144 VanDerWaalsContact CG2-O 3.28Å; I142-N144 WeakPolarHBondContact CG2-O 3.22Å; I142-N144 PolarHBondContact O-N 3.18Å; I142-N144 VanDerWaalsContact O-N 3.16Å; I142-Y150 HydrophobicContact CD1-CD1 3.59Å; I142-Y150 HydrophobicContact CD1-CE1 3.21Å; I142-Y150 HydrophobicContact CD1-CG 4.39Å; I142-I153 HydrophobicContact CD1-CD1 3.77Å; I142-I153 HydrophobicContact CG1-CD1 3.83Å; I142-I153 HydrophobicContact CG2-CD1 4.16Å
143	I	60.3	Low	68	Low	124 Å²	124	67.1 Å²	67.1	64%	0.636	35%	0.348	S	S	*	.	S	Bend	trans	-56.9	-36.5	-175	-58.1	170.8	0	0	0	111.5	G38	G38-I143 PolarHBondContact O-N 2.97Å
144	N	61.3	Low	69	Low	112 Å²	112	66.2 Å²	66.2	60%	0.599	34%	0.344	S	S	*	.	S	Bend	trans	-129.7	110.2	177.5	-75.6	-36.9	0	0	0	110.4	I142 S146 S149	I142-N144 VanDerWaalsContact CG2-O 3.28Å; I142-N144 WeakPolarHBondContact CG2-O 3.22Å; I142-N144 PolarHBondContact O-N 3.18Å; I142-N144 VanDerWaalsContact O-N 3.16Å; N144-S146 PolarHBondContact O-N 3.33Å; N144-S149 WeakPolarHBondContact O-CB 3.43Å; N144-S149 PolarHBondContact O-OG 3.4Å
145	Q	66.7	Low	70.1	Confident	127 Å²	127	71.3 Å²	71.3	59%	0.593	37%	0.371	S	S	*	.			trans	-74.4	39.1	-177.6	-57.9	-176.9	9.1	0	0	113.9
146	S	69.4	Low	71.2	Confident	60 Å²	60	69.1 Å²	69.1	42%	0.42	36%	0.36	S	S	.	.			trans	-81.4	144.8	174.4	176.1	0	0	0	0	110.8	N144 M148 S149 Y150	N144-S146 PolarHBondContact O-N 3.33Å; S146-M148 PolarHBondContact O-N 3.26Å; S146-M148 VanDerWaalsContact O-N 3.13Å; S146-M148 PolarHBondContact OG-N 3.27Å; S146-S149 WeakPolarHBondContact O-CB 3.44Å; S146-S149 PolarHBondContact O-N 3.03Å; S146-Y150 VanDerWaalsContact O-CD2 3.26Å; S146-Y150 WeakPolarHBondContact O-CD2 3.26Å; S146-Y150 PolarHBondContact O-N 3.18Å
147	I	77.2	Confident	72.5	Confident	137 Å²	137	64.4 Å²	64.4	70%	0.703	34%	0.342	S	S	*	.	H	α-helix	trans	-50.5	-36.4	169.6	-62.6	168.7	0	0	0	110.4	S149 Y150 L151	I147-S149 VanDerWaalsContact C-N 3.35Å; I147-S149 PolarHBondContact O-N 3.43Å; I147-Y150 PolarHBondContact O-N 2.81Å; I147-L151 HydrophobicContact CG2-CD1 4.32Å; I147-L151 WeakPolarHBondContact O-CG 3.44Å; I147-L151 PolarHBondContact O-N 3.27Å
148	M	79	Confident	74	Confident	139 Å²	139	63.7 Å²	63.7	69%	0.685	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-37.2	177.2	-166.2	64.8	176.9	0	0	112.7	S146 L151 L152	S146-M148 PolarHBondContact O-N 3.26Å; S146-M148 VanDerWaalsContact O-N 3.13Å; S146-M148 PolarHBondContact OG-N 3.27Å; M148-L151 PolarHBondContact O-N 3.14Å; M148-L152 WeakPolarHBondContact O-CB 3.11Å; M148-L152 PolarHBondContact O-N 3.36Å
149	S	76.8	Confident	75.6	Confident	27 Å²	27	57.4 Å²	57.4	19%	0.189	32%	0.321	C	S	.	.	H	α-helix	trans	-68.8	-39	177.1	-59.9	0	0	0	0	111.4	N144 S146 I147 L152 I153	N144-S149 WeakPolarHBondContact O-CB 3.43Å; N144-S149 PolarHBondContact O-OG 3.4Å; S146-S149 WeakPolarHBondContact O-CB 3.44Å; S146-S149 PolarHBondContact O-N 3.03Å; I147-S149 VanDerWaalsContact C-N 3.35Å; I147-S149 PolarHBondContact O-N 3.43Å; S149-L152 PolarHBondContact O-N 2.69Å; S149-I153 VanDerWaalsContact O-CG1 3.29Å; S149-I153 WeakPolarHBondContact O-CG1 3.24Å; S149-I153 PolarHBondContact O-N 3.07Å
150	Y	77.3	Confident	77.1	Confident	32 Å²	32	56.9 Å²	56.9	13%	0.125	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-42.8	174.1	-71.2	-79	0	0	0	111.9	A130 F131 N134 I142 S146 I147 I153 A154	A130-Y150 HydrophobicContact CB-CD1 3.89Å; F131-Y150 HydrophobicContact CD2-CE1 4.47Å; N134-Y150 HydrophobicContact CB-CE1 4.07Å; N134-Y150 PolarHBondContact ND2-OH 3.41Å; I142-Y150 HydrophobicContact CD1-CD1 3.59Å; I142-Y150 HydrophobicContact CD1-CE1 3.21Å; I142-Y150 HydrophobicContact CD1-CG 4.39Å; S146-Y150 VanDerWaalsContact O-CD2 3.26Å; S146-Y150 WeakPolarHBondContact O-CD2 3.26Å; S146-Y150 PolarHBondContact O-N 3.18Å; I147-Y150 PolarHBondContact O-N 2.81Å; Y150-I153 PolarHBondContact O-N 3.13Å; Y150-A154 VanDerWaalsContact O-CB 3.31Å; Y150-A154 WeakPolarHBondContact O-CB 3.22Å; Y150-A154 PolarHBondContact O-N 2.89Å
151	L	83.8	Confident	78.4	Confident	79 Å²	79	54.3 Å²	54.3	41%	0.414	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-39.9	175.6	-73.6	175.4	0	0	0	112	F123 I147 M148 A154 L155	F123-L151 HydrophobicContact CZ-CD2 4.43Å; I147-L151 HydrophobicContact CG2-CD1 4.32Å; I147-L151 WeakPolarHBondContact O-CG 3.44Å; I147-L151 PolarHBondContact O-N 3.27Å; M148-L151 PolarHBondContact O-N 3.14Å; L151-A154 PolarHBondContact O-N 2.88Å; L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 PolarHBondContact O-N 3Å
152	L	85.6	Confident	80	Confident	89 Å²	89	55.9 Å²	55.9	47%	0.466	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-48.4	175.2	-176.9	69.1	0	0	0	111.1	M148 S149 A154 L155 V156	M148-L152 WeakPolarHBondContact O-CB 3.11Å; M148-L152 PolarHBondContact O-N 3.36Å; S149-L152 PolarHBondContact O-N 2.69Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 2.59Å; L152-L155 PolarHBondContact O-N 3.04Å; L152-V156 VanDerWaalsContact O-CG2 3.27Å; L152-V156 WeakPolarHBondContact O-CG2 3.42Å; L152-V156 PolarHBondContact O-N 2.67Å
153	I	82.7	Confident	81.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-45.5	177.1	-69	164.1	0	0	0	110.3	V39 F68 A130 I142 S149 Y150 L155 V156 L157	V39-I153 HydrophobicContact CG1-CD1 3.94Å; F68-I153 HydrophobicContact CE1-CG2 3.81Å; A130-I153 HydrophobicContact CB-CG2 3.97Å; I142-I153 HydrophobicContact CD1-CD1 3.77Å; I142-I153 HydrophobicContact CG1-CD1 3.83Å; I142-I153 HydrophobicContact CG2-CD1 4.16Å; S149-I153 VanDerWaalsContact O-CG1 3.29Å; S149-I153 WeakPolarHBondContact O-CG1 3.24Å; S149-I153 PolarHBondContact O-N 3.07Å; Y150-I153 PolarHBondContact O-N 3.13Å; I153-L155 VanDerWaalsContact C-N 3.34Å; I153-L155 PolarHBondContact O-N 3.31Å; I153-V156 PolarHBondContact O-N 2.92Å; I153-L157 HydrophobicContact CG2-CD1 3.87Å; I153-L157 HydrophobicContact CG2-CG 4.18Å; I153-L157 WeakPolarHBondContact O-CB 3.49Å; I153-L157 VanDerWaalsContact O-CG 3.29Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 2.87Å
154	A	85.6	Confident	82.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-43	178.2	0	0	0	0	0	112.1	F123 S126 I127 Y150 L151 L152 T158	F123-A154 HydrophobicContact CE2-CB 4.37Å; S126-A154 WeakPolarHBondContact OG-CA 3.49Å; S126-A154 WeakPolarHBondContact OG-CB 3.35Å; S126-A154 PolarHBondContact OG-O 2.97Å; I127-A154 HydrophobicContact CG1-CB 3.55Å; Y150-A154 VanDerWaalsContact O-CB 3.31Å; Y150-A154 WeakPolarHBondContact O-CB 3.22Å; Y150-A154 PolarHBondContact O-N 2.89Å; L151-A154 PolarHBondContact O-N 2.88Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 2.59Å; A154-T158 VanDerWaalsContact O-CB 3.24Å; A154-T158 WeakPolarHBondContact O-CB 3.05Å; A154-T158 PolarHBondContact O-N 3.41Å; A154-T158 PolarHBondContact O-OG1 2.74Å
155	L	88.9	Confident	84.3	Confident	109 Å²	109	48.8 Å²	48.8	57%	0.571	27%	0.266	S	S	*	.	H	α-helix	trans	-64.3	-45	176.7	-162.4	164.3	0	0	0	110.9	L151 L152 I153 T158 A159	L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 PolarHBondContact O-N 3Å; L152-L155 PolarHBondContact O-N 3.04Å; I153-L155 VanDerWaalsContact C-N 3.34Å; I153-L155 PolarHBondContact O-N 3.31Å; L155-T158 PolarHBondContact O-N 3.46Å; L155-A159 VanDerWaalsContact O-CB 3.31Å; L155-A159 WeakPolarHBondContact O-CB 3.29Å; L155-A159 PolarHBondContact O-N 3.37Å
156	V	89.5	Confident	85.5	Confident	30 Å²	30	48.8 Å²	48.8	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-46.2	177.9	170.7	0	0	0	0	111.7	A36 I70 L152 I153 T158 A159 G160	A36-V156 HydrophobicContact CB-CG1 4.19Å; I70-V156 HydrophobicContact CB-CG1 4.41Å; I70-V156 HydrophobicContact CG2-CG1 3.77Å; L152-V156 VanDerWaalsContact O-CG2 3.27Å; L152-V156 WeakPolarHBondContact O-CG2 3.42Å; L152-V156 PolarHBondContact O-N 2.67Å; I153-V156 PolarHBondContact O-N 2.92Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.3Å; V156-A159 PolarHBondContact O-N 2.93Å; V156-G160 PolarHBondContact O-N 2.88Å
157	L	86.4	Confident	86.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-39.6	177.1	-70.6	-179.5	0	0	0	111.6	F68 S69 A72 M73 I153 G160 T161	F68-L157 HydrophobicContact CE1-CD1 3.92Å; F68-L157 HydrophobicContact CZ-CD1 4.15Å; S69-L157 WeakPolarHBondContact O-CD2 3.22Å; A72-L157 HydrophobicContact CB-CD2 3.83Å; M73-L157 HydrophobicContact CG-CB 4.18Å; M73-L157 HydrophobicContact CG-CD1 4.38Å; I153-L157 HydrophobicContact CG2-CD1 3.87Å; I153-L157 HydrophobicContact CG2-CG 4.18Å; I153-L157 WeakPolarHBondContact O-CB 3.49Å; I153-L157 VanDerWaalsContact O-CG 3.29Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 2.87Å; L157-G160 PolarHBondContact O-N 3.46Å; L157-T161 PolarHBondContact O-N 3.38Å; L157-T161 PolarHBondContact O-OG1 3.48Å
158	T	89.9	Confident	87.2	Confident	13 Å²	13	39.4 Å²	39.4	8%	0.08	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-42.9	176.5	-58.3	0	0	0	0	111.4	I119 A122 F123 S126 A154 L155 V156 G160 T161 A162	I119-T158 HydrophobicContact CG2-CG2 3.87Å; A122-T158 HydrophobicContact CB-CG2 4.3Å; F123-T158 VanDerWaalsContact CA-OG1 3.23Å; F123-T158 WeakPolarHBondContact CA-OG1 3.39Å; F123-T158 HydrophobicContact CB-CG2 4.25Å; F123-T158 PolarHBondContact N-OG1 3.48Å; S126-T158 PolarHBondContact OG-OG1 3.35Å; A154-T158 VanDerWaalsContact O-CB 3.24Å; A154-T158 WeakPolarHBondContact O-CB 3.05Å; A154-T158 PolarHBondContact O-N 3.41Å; A154-T158 PolarHBondContact O-OG1 2.74Å; L155-T158 PolarHBondContact O-N 3.46Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.3Å; T158-G160 VanDerWaalsContact C-N 3.3Å; T158-G160 PolarHBondContact O-N 3.28Å; T158-T161 PolarHBondContact O-N 2.84Å; T158-A162 WeakPolarHBondContact O-CB 3.35Å; T158-A162 PolarHBondContact O-N 3.49Å
159	A	91.3	Very high	87.7	Confident	53 Å²	53	34 Å²	34	44%	0.438	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-39.9	174	0	0	0	0	0	111.2	L155 V156 A162 F163	L155-A159 VanDerWaalsContact O-CB 3.31Å; L155-A159 WeakPolarHBondContact O-CB 3.29Å; L155-A159 PolarHBondContact O-N 3.37Å; V156-A159 PolarHBondContact O-N 2.93Å; A159-A162 PolarHBondContact O-N 2.88Å; A159-F163 WeakPolarHBondContact O-CB 3.43Å; A159-F163 PolarHBondContact O-N 2.9Å
160	G	89.3	Confident	88.5	Confident	5 Å²	5	34.4 Å²	34.4	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-49.5	173.4	0	0	0	0	0	112.5	I70 F71 V156 L157 T158 A162 F163 L164	I70-G160 WeakPolarHBondContact O-CA 3.3Å; F71-G160 WeakPolarHBondContact CE1-O 3.04Å; V156-G160 PolarHBondContact O-N 2.88Å; L157-G160 PolarHBondContact O-N 3.46Å; T158-G160 VanDerWaalsContact C-N 3.3Å; T158-G160 PolarHBondContact O-N 3.28Å; G160-A162 PolarHBondContact O-N 3.13Å; G160-F163 PolarHBondContact O-N 2.92Å; G160-L164 WeakPolarHBondContact O-CG 3.04Å; G160-L164 PolarHBondContact O-N 3.29Å
161	T	87.2	Confident	89.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-39.8	174.8	-65.5	0	0	0	0	112.2	M73 G74 P77 A122 L157 T158 F163 L164 I165	M73-T161 WeakPolarHBondContact CB-OG1 3.27Å; G74-T161 PolarHBondContact O-OG1 3.01Å; G74-T161 VanDerWaalsContact O-OG1 3.12Å; P77-T161 HydrophobicContact CB-CG2 4.37Å; P77-T161 HydrophobicContact CG-CG2 4.17Å; A122-T161 HydrophobicContact CB-CG2 4.08Å; L157-T161 PolarHBondContact O-N 3.38Å; L157-T161 PolarHBondContact O-OG1 3.48Å; T158-T161 PolarHBondContact O-N 2.84Å; T161-F163 VanDerWaalsContact C-N 3.32Å; T161-F163 PolarHBondContact O-N 3.37Å; T161-L164 PolarHBondContact O-N 3.4Å; T161-I165 HydrophobicContact CG2-CD1 4.04Å; T161-I165 HydrophobicContact CG2-CG1 4.46Å; T161-I165 VanDerWaalsContact O-CG1 3.31Å; T161-I165 WeakPolarHBondContact O-CG1 3.5Å; T161-I165 PolarHBondContact O-N 3.49Å
162	A	91.4	Very high	89.5	Confident	33 Å²	33	32.2 Å²	32.2	27%	0.273	17%	0.174	S	C	.	.	H	α-helix	trans	-61.5	-41.4	175.5	0	0	0	0	0	111.8	I119 T158 A159 G160 I165 W166	I119-A162 HydrophobicContact CD1-CB 4.42Å; I119-A162 HydrophobicContact CG1-CB 4.4Å; T158-A162 WeakPolarHBondContact O-CB 3.35Å; T158-A162 PolarHBondContact O-N 3.49Å; A159-A162 PolarHBondContact O-N 2.88Å; G160-A162 PolarHBondContact O-N 3.13Å; A162-I165 PolarHBondContact O-N 3.49Å; A162-W166 PolarHBondContact O-N 2.99Å
163	F	92.1	Very high	89.6	Confident	82 Å²	82	34 Å²	34	36%	0.36	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-40.2	173.7	-178.2	-97.1	0	0	0	112.1	I27 F71 A159 G160 T161 W166 L167	I27-F163 HydrophobicContact CG2-CE1 4.07Å; I27-F163 HydrophobicContact CG2-CZ 4.1Å; F71-F163 AromaticContact CE1-CD1 3.87Å; F71-F163 HydrophobicContact CE1-CD1 3.87Å; F71-F163 AromaticContact CZ-CD1 3.61Å; F71-F163 HydrophobicContact CZ-CD1 3.61Å; F71-F163 HydrophobicContact CZ-CE1 4.01Å; A159-F163 WeakPolarHBondContact O-CB 3.43Å; A159-F163 PolarHBondContact O-N 2.9Å; G160-F163 PolarHBondContact O-N 2.92Å; T161-F163 VanDerWaalsContact C-N 3.32Å; T161-F163 PolarHBondContact O-N 3.37Å; F163-W166 HydrophobicContact CD2-CE3 4.19Å; F163-W166 AromaticContact CE2-CE3 3.93Å; F163-W166 HydrophobicContact CE2-CE3 3.93Å; F163-W166 AromaticContact CE2-CZ3 3.91Å; F163-W166 HydrophobicContact CE2-CZ3 3.91Å; F163-W166 HydrophobicContact CZ-CE3 4.49Å; F163-W166 HydrophobicContact CZ-CZ3 4.31Å; F163-W166 PolarHBondContact O-N 3.25Å; F163-L167 HydrophobicContact CE1-CD1 3.88Å; F163-L167 HydrophobicContact CZ-CD1 4.39Å; F163-L167 WeakPolarHBondContact O-CB 3.34Å; F163-L167 PolarHBondContact O-N 3.11Å
164	L	89.9	Confident	90	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-40.9	175	-70.3	179.1	0	0	0	112.9	F28 F71 I75 G160 T161 W166 L167 G168	F28-L164 HydrophobicContact CD2-CD2 3.45Å; F28-L164 VanDerWaalsContact CD2-CD2 3.45Å; F28-L164 HydrophobicContact CE2-CD2 3.85Å; F71-L164 HydrophobicContact CB-CD1 3.96Å; F71-L164 HydrophobicContact CD1-CD1 3.74Å; F71-L164 HydrophobicContact CD1-CD2 3.84Å; F71-L164 HydrophobicContact CD1-CG 3.57Å; F71-L164 HydrophobicContact CD2-CD2 3.89Å; F71-L164 HydrophobicContact CD2-CG 4.48Å; F71-L164 HydrophobicContact CE1-CD1 4.43Å; F71-L164 HydrophobicContact CE1-CD2 3.8Å; F71-L164 HydrophobicContact CE1-CG 3.75Å; F71-L164 HydrophobicContact CE2-CD2 3.81Å; F71-L164 HydrophobicContact CG-CD1 3.85Å; F71-L164 HydrophobicContact CG-CD2 3.91Å; F71-L164 HydrophobicContact CG-CG 4Å; F71-L164 HydrophobicContact CZ-CD2 3.81Å; F71-L164 HydrophobicContact CZ-CG 4.29Å; I75-L164 HydrophobicContact CG1-CB 4.22Å; I75-L164 HydrophobicContact CG1-CD1 4.26Å; G160-L164 WeakPolarHBondContact O-CG 3.04Å; G160-L164 PolarHBondContact O-N 3.29Å; T161-L164 PolarHBondContact O-N 3.4Å; L164-W166 VanDerWaalsContact C-N 3.33Å; L164-L167 PolarHBondContact O-N 2.87Å; L164-G168 PolarHBondContact O-N 2.98Å
165	I	90.3	Very high	90.1	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-47.1	175.3	-67.5	165.4	0	0	0	109.3	Y78 R115 A118 T161 A162 L167 G168 D169	Y78-I165 HydrophobicContact CD2-CD1 3.94Å; Y78-I165 HydrophobicContact CD2-CG1 3.94Å; Y78-I165 HydrophobicContact CD2-CG2 4.18Å; Y78-I165 HydrophobicContact CE2-CG2 4.3Å; Y78-I165 HydrophobicContact CG-CD1 4.42Å; Y78-I165 HydrophobicContact CG-CG1 4.22Å; R115-I165 HydrophobicContact CG-CG2 4.06Å; A118-I165 HydrophobicContact CB-CD1 3.92Å; T161-I165 HydrophobicContact CG2-CD1 4.04Å; T161-I165 HydrophobicContact CG2-CG1 4.46Å; T161-I165 VanDerWaalsContact O-CG1 3.31Å; T161-I165 WeakPolarHBondContact O-CG1 3.5Å; T161-I165 PolarHBondContact O-N 3.49Å; A162-I165 PolarHBondContact O-N 3.49Å; I165-L167 PolarHBondContact O-N 3.26Å; I165-G168 PolarHBondContact O-N 3.43Å; I165-D169 PolarHBondContact O-N 3.02Å
166	W	92.3	Very high	89.9	Confident	128 Å²	128	34.5 Å²	34.5	49%	0.485	18%	0.18	S	C	.	.	H	α-helix	trans	-59.6	-45	176	176.7	85.7	0	0	0	112.1	A162 F163 L164 G168 D169 Q170	A162-W166 PolarHBondContact O-N 2.99Å; F163-W166 HydrophobicContact CD2-CE3 4.19Å; F163-W166 AromaticContact CE2-CE3 3.93Å; F163-W166 HydrophobicContact CE2-CE3 3.93Å; F163-W166 AromaticContact CE2-CZ3 3.91Å; F163-W166 HydrophobicContact CE2-CZ3 3.91Å; F163-W166 HydrophobicContact CZ-CE3 4.49Å; F163-W166 HydrophobicContact CZ-CZ3 4.31Å; F163-W166 PolarHBondContact O-N 3.25Å; L164-W166 VanDerWaalsContact C-N 3.33Å; W166-G168 VanDerWaalsContact C-N 3.31Å; W166-G168 PolarHBondContact O-N 3.2Å; W166-D169 WeakPolarHBondContact O-CB 3.49Å; W166-D169 PolarHBondContact O-N 3.45Å; W166-D169 VanDerWaalsContact O-N 3.13Å; W166-Q170 HydrophobicContact CD2-CG 3.97Å; W166-Q170 HydrophobicContact CE3-CG 4.17Å; W166-Q170 HydrophobicContact CH2-CG 3.87Å; W166-Q170 HydrophobicContact CZ2-CG 3.64Å; W166-Q170 HydrophobicContact CZ3-CG 4.12Å; W166-Q170 WeakPolarHBondContact O-CG 3.39Å; W166-Q170 PolarHBondContact O-N 3.02Å
167	L	91.9	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-40.5	177.2	-171.4	153.4	0	0	0	111.2	M24 I27 F163 L164 I165 D169 Q170 I171 I183	M24-L167 HydrophobicContact CB-CD2 4.03Å; M24-L167 HydrophobicContact CB-CG 4.3Å; M24-L167 HydrophobicContact SD-CG 4.16Å; I27-L167 HydrophobicContact CB-CD1 4.29Å; I27-L167 HydrophobicContact CG2-CD1 3.9Å; F163-L167 HydrophobicContact CE1-CD1 3.88Å; F163-L167 HydrophobicContact CZ-CD1 4.39Å; F163-L167 WeakPolarHBondContact O-CB 3.34Å; F163-L167 PolarHBondContact O-N 3.11Å; L164-L167 PolarHBondContact O-N 2.87Å; I165-L167 PolarHBondContact O-N 3.26Å; L167-D169 VanDerWaalsContact C-N 3.35Å; L167-D169 PolarHBondContact O-N 2.98Å; L167-Q170 PolarHBondContact O-N 3.06Å; L167-I171 HydrophobicContact CD2-CD1 3.53Å; L167-I171 HydrophobicContact CD2-CG1 4.21Å; L167-I171 WeakPolarHBondContact O-CG1 3.41Å; L167-I171 PolarHBondContact O-N 3.47Å; L167-I183 HydrophobicContact CD2-CD1 3.61Å; L167-I183 HydrophobicContact CD2-CG1 3.97Å
168	G	90.7	Very high	89.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-39.7	173.3	0	0	0	0	0	112.9	L164 I165 W166 I171 T172 G179	L164-G168 PolarHBondContact O-N 2.98Å; I165-G168 PolarHBondContact O-N 3.43Å; W166-G168 VanDerWaalsContact C-N 3.31Å; W166-G168 PolarHBondContact O-N 3.2Å; G168-I171 PolarHBondContact O-N 3.5Å; G168-T172 PolarHBondContact O-N 2.81Å; G168-T172 PolarHBondContact O-OG1 2.86Å; G168-G179 WeakPolarHBondContact O-CA 3.04Å
169	D	89.8	Confident	89.5	Confident	24 Å²	24	36.2 Å²	36.2	13%	0.128	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-38.6	174.4	-70.9	-45.9	0	0	0	112.2	R115 I165 W166 L167 T172 Q173	R115-D169 IonicContact CZ-OD1 3.78Å; R115-D169 IonicContact CZ-OD2 2.67Å; R115-D169 IonicContact NE-OD1 2.77Å; R115-D169 IonicContact NE-OD2 2.79Å; R115-D169 PolarHBondContact NE-OD2 2.91Å; R115-D169 IonicContact NH1-OD2 2.59Å; R115-D169 IonicContact NH2-OD1 3.64Å; R115-D169 PolarHBondContact NH2-OD1 3.3Å; R115-D169 IonicContact NH2-OD2 2.94Å; R115-D169 PolarHBondContact NH2-OD2 3.44Å; I165-D169 PolarHBondContact O-N 3.02Å; W166-D169 WeakPolarHBondContact O-CB 3.49Å; W166-D169 PolarHBondContact O-N 3.45Å; W166-D169 VanDerWaalsContact O-N 3.13Å; L167-D169 VanDerWaalsContact C-N 3.35Å; L167-D169 PolarHBondContact O-N 2.98Å; D169-T172 PolarHBondContact O-N 2.79Å; D169-Q173 WeakPolarHBondContact O-CG 3.22Å; D169-Q173 PolarHBondContact O-N 2.77Å
170	Q	92.5	Very high	89.1	Confident	36 Å²	36	34.5 Å²	34.5	17%	0.168	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-45.3	175.6	-67.9	-54.6	-50.4	0	0	111.6	F20 W166 L167 T172 Q173 F174	F20-Q170 HydrophobicContact CE1-CB 4.29Å; F20-Q170 WeakPolarHBondContact CE1-O 3.17Å; F20-Q170 HydrophobicContact CZ-CB 4.22Å; W166-Q170 HydrophobicContact CD2-CG 3.97Å; W166-Q170 HydrophobicContact CE3-CG 4.17Å; W166-Q170 HydrophobicContact CH2-CG 3.87Å; W166-Q170 HydrophobicContact CZ2-CG 3.64Å; W166-Q170 HydrophobicContact CZ3-CG 4.12Å; W166-Q170 WeakPolarHBondContact O-CG 3.39Å; W166-Q170 PolarHBondContact O-N 3.02Å; L167-Q170 PolarHBondContact O-N 3.06Å; Q170-T172 VanDerWaalsContact C-N 3.26Å; Q170-T172 PolarHBondContact O-N 3.2Å; Q170-Q173 PolarHBondContact O-N 3.47Å; Q170-F174 PolarHBondContact O-N 2.98Å
171	I	91.9	Very high	88.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-38.3	174.6	-65.2	171.6	0	0	0	110.4	T21 M24 L167 G168 Q173 G175 G179 I182 I183	T21-I171 HydrophobicContact CG2-CG2 3.9Å; M24-I171 HydrophobicContact CB-CD1 3.7Å; M24-I171 HydrophobicContact CB-CG1 3.55Å; M24-I171 HydrophobicContact CG-CG1 3.88Å; L167-I171 HydrophobicContact CD2-CD1 3.53Å; L167-I171 HydrophobicContact CD2-CG1 4.21Å; L167-I171 WeakPolarHBondContact O-CG1 3.41Å; L167-I171 PolarHBondContact O-N 3.47Å; G168-I171 PolarHBondContact O-N 3.5Å; I171-Q173 VanDerWaalsContact C-N 3.34Å; I171-Q173 PolarHBondContact O-N 3.17Å; I171-G175 CarbonylContact O-C 3.27Å; I171-G175 VanDerWaalsContact O-C 3.32Å; I171-G175 WeakPolarHBondContact O-CA 3.24Å; I171-G175 PolarHBondContact O-N 3.06Å; I171-G179 VanDerWaalsContact CG2-CA 3.46Å; I171-I182 HydrophobicContact CG2-CD1 4.26Å; I171-I183 HydrophobicContact CD1-CD1 4.43Å; I171-I183 HydrophobicContact CD1-CG1 4.08Å
172	T	90.3	Very high	88.9	Confident	66 Å²	66	35.8 Å²	35.8	41%	0.405	18%	0.182	S	C	.	.	H	α-helix	trans	-66.9	-35.3	179.1	-53.8	0	0	0	0	112.3	G168 D169 Q170 G179	G168-T172 PolarHBondContact O-N 2.81Å; G168-T172 PolarHBondContact O-OG1 2.86Å; D169-T172 PolarHBondContact O-N 2.79Å; Q170-T172 VanDerWaalsContact C-N 3.26Å; Q170-T172 PolarHBondContact O-N 3.2Å; T172-G179 PolarHBondContact OG1-N 3.04Å
173	Q	88.8	Confident	88.7	Confident	126 Å²	126	34.3 Å²	34.3	59%	0.589	17%	0.17	S	C	*	.	H	α-helix	trans	-82.2	-45.4	-178.8	-72.2	178	55	0	0	113.3	D169 Q170 I171	D169-Q173 WeakPolarHBondContact O-CG 3.22Å; D169-Q173 PolarHBondContact O-N 2.77Å; Q170-Q173 PolarHBondContact O-N 3.47Å; I171-Q173 VanDerWaalsContact C-N 3.34Å; I171-Q173 PolarHBondContact O-N 3.17Å
174	F	89.2	Confident	88.2	Confident	110 Å²	110	31.1 Å²	31.1	48%	0.482	16%	0.156	S	C	.	.	H	α-helix	trans	-111.9	-12.5	-171.5	-60.6	-70	0	0	0	113.8	K17 F20 Q170	K17-F174 WeakPolarHBondContact CG-O 3.45Å; F20-F174 HydrophobicContact CD1-CB 3.78Å; F20-F174 HydrophobicContact CD2-CB 4.35Å; F20-F174 HydrophobicContact CE1-CB 3.57Å; F20-F174 HydrophobicContact CE1-CD2 4.48Å; F20-F174 HydrophobicContact CE1-CG 4.49Å; F20-F174 HydrophobicContact CE2-CB 4.14Å; F20-F174 HydrophobicContact CG-CB 4.17Å; F20-F174 HydrophobicContact CZ-CB 3.74Å; F20-F174 HydrophobicContact CZ-CD2 4.07Å; F20-F174 HydrophobicContact CZ-CG 4.26Å; Q170-F174 PolarHBondContact O-N 2.98Å
175	G	88.5	Confident	88	Confident	6 Å²	6	33.6 Å²	33.6	6%	0.062	17%	0.167	C	C	.	.	S	Bend	trans	-99.4	-154.4	179.4	0	0	0	0	0	112.8	T21 I171	T21-G175 WeakPolarHBondContact OG1-CA 3.34Å; I171-G175 CarbonylContact O-C 3.27Å; I171-G175 VanDerWaalsContact O-C 3.32Å; I171-G175 WeakPolarHBondContact O-CA 3.24Å; I171-G175 PolarHBondContact O-N 3.06Å
176	V	85.6	Confident	87.8	Confident	5 Å²	5	34 Å²	34	3%	0.03	17%	0.172	C	C	.	.	S	Bend	trans	-109.2	138.4	-179.1	-179.1	0	0	0	0	108.9	K17 I18 T21 I182 T411 L415	K17-V176 HydrophobicContact CB-CG2 3.75Å; I18-V176 HydrophobicContact CG1-CG2 3.86Å; T21-V176 PolarHBondContact OG1-N 3.1Å; V176-I182 WeakPolarHBondContact O-CD1 3.39Å; V176-T411 HydrophobicContact CG1-CG2 3.74Å; V176-L415 HydrophobicContact CB-CD2 4.25Å; V176-L415 HydrophobicContact CG1-CD1 3.9Å; V176-L415 HydrophobicContact CG1-CD2 3.33Å; V176-L415 HydrophobicContact CG1-CG 3.36Å; V176-L415 HydrophobicContact CG2-CD2 3.84Å
177	G	84.7	Confident	87.3	Confident	19 Å²	19	28 Å²	28	20%	0.196	15%	0.149	C	C	.	.	S	Bend	trans	67.9	-155.7	172	0	0	0	0	0	114.5
178	N	86.3	Confident	86.7	Confident	59 Å²	59	28 Å²	28	32%	0.316	15%	0.15	S	C	.	.			trans	-91.9	116.1	176.9	-177.7	-28.3	0	0	0	109.7	I180 S181 I182	N178-I180 PolarHBondContact O-N 3.22Å; N178-I180 PolarHBondContact OD1-N 3.06Å; N178-I180 VanDerWaalsContact OD1-N 3.16Å; N178-S181 WeakPolarHBondContact O-CB 3.27Å; N178-S181 PolarHBondContact O-N 3.21Å; N178-I182 WeakPolarHBondContact O-CG1 3.38Å; N178-I182 PolarHBondContact O-N 3.41Å
179	G	86.1	Confident	86.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.5	-35.4	-172.8	0	0	0	0	0	114.5	G168 I171 T172 I182 I183	G168-G179 WeakPolarHBondContact O-CA 3.04Å; I171-G179 VanDerWaalsContact CG2-CA 3.46Å; T172-G179 PolarHBondContact OG1-N 3.04Å; G179-I182 PolarHBondContact O-N 3.39Å; G179-I183 VanDerWaalsContact O-CG1 3.28Å; G179-I183 WeakPolarHBondContact O-CG1 3.33Å; G179-I183 PolarHBondContact O-N 2.69Å
180	I	83.5	Confident	85.7	Confident	17 Å²	17	31.4 Å²	31.4	9%	0.087	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-46.2	175.3	-71.8	146.8	0	0	0	110.4	I75 Y78 N178 I182 I183 I184	I75-I180 HydrophobicContact CG2-CG2 3.87Å; Y78-I180 HydrophobicContact CD1-CD1 4.02Å; Y78-I180 HydrophobicContact CD1-CG1 4.43Å; Y78-I180 HydrophobicContact CD1-CG2 4.19Å; Y78-I180 HydrophobicContact CE1-CD1 3.29Å; Y78-I180 HydrophobicContact CE1-CG1 4.15Å; Y78-I180 HydrophobicContact CE1-CG2 4.25Å; Y78-I180 HydrophobicContact CE2-CD1 4.38Å; Y78-I180 VanDerWaalsContact CZ-CD1 3.49Å; N178-I180 PolarHBondContact O-N 3.22Å; N178-I180 PolarHBondContact OD1-N 3.06Å; N178-I180 VanDerWaalsContact OD1-N 3.16Å; I180-I182 VanDerWaalsContact C-N 3.28Å; I180-I182 PolarHBondContact O-N 2.99Å; I180-I183 PolarHBondContact O-N 3.15Å; I180-I184 HydrophobicContact CG2-CD1 4.13Å; I180-I184 WeakPolarHBondContact O-CG1 3.39Å; I180-I184 PolarHBondContact O-N 3.08Å; I180-I184 VanDerWaalsContact O-N 3.09Å
181	S	83.8	Confident	84.8	Confident	23 Å²	23	30.7 Å²	30.7	16%	0.161	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-41	175.9	-62	0	0	0	0	111.7	N178 I184 F185	N178-S181 WeakPolarHBondContact O-CB 3.27Å; N178-S181 PolarHBondContact O-N 3.21Å; S181-I184 PolarHBondContact O-N 3.02Å; S181-F185 WeakPolarHBondContact O-CB 3.38Å; S181-F185 PolarHBondContact O-N 2.88Å
182	I	88	Confident	84.1	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.046	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-37.3	178.9	-74.4	175.5	0	0	0	112.5	T21 L25 I171 V176 N178 G179 I180 F185 A186 V407 T411	T21-I182 HydrophobicContact CG2-CD1 4.14Å; T21-I182 HydrophobicContact CG2-CG2 3.95Å; L25-I182 HydrophobicContact CD1-CG2 4.01Å; L25-I182 HydrophobicContact CD2-CG2 3.92Å; L25-I182 HydrophobicContact CG-CG2 4.23Å; I171-I182 HydrophobicContact CG2-CD1 4.26Å; V176-I182 WeakPolarHBondContact O-CD1 3.39Å; N178-I182 WeakPolarHBondContact O-CG1 3.38Å; N178-I182 PolarHBondContact O-N 3.41Å; G179-I182 PolarHBondContact O-N 3.39Å; I180-I182 VanDerWaalsContact C-N 3.28Å; I180-I182 PolarHBondContact O-N 2.99Å; I182-F185 WeakPolarHBondContact O-CB 3.45Å; I182-F185 PolarHBondContact O-N 3.46Å; I182-A186 WeakPolarHBondContact O-CB 3.38Å; I182-A186 PolarHBondContact O-N 3.45Å; I182-V407 HydrophobicContact CG1-CG1 4.36Å; I182-T411 HydrophobicContact CD1-CG2 4.34Å
183	I	86.9	Confident	83.4	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-67.6	-40.2	175.3	-60.9	159.3	0	0	0	110.5	F28 I75 L167 I171 G179 I180 F185 A186 G187	F28-I183 HydrophobicContact CD1-CG2 4.23Å; F28-I183 HydrophobicContact CD2-CG2 3.75Å; F28-I183 HydrophobicContact CE1-CG2 4.09Å; F28-I183 HydrophobicContact CE2-CG2 3.6Å; F28-I183 HydrophobicContact CG-CG2 4.06Å; F28-I183 HydrophobicContact CZ-CG2 3.78Å; I75-I183 HydrophobicContact CD1-CB 3.36Å; I75-I183 HydrophobicContact CD1-CD1 3.85Å; I75-I183 HydrophobicContact CD1-CG1 4.23Å; I75-I183 HydrophobicContact CD1-CG2 3.25Å; I75-I183 HydrophobicContact CG1-CG2 4.32Å; L167-I183 HydrophobicContact CD2-CD1 3.61Å; L167-I183 HydrophobicContact CD2-CG1 3.97Å; I171-I183 HydrophobicContact CD1-CD1 4.43Å; I171-I183 HydrophobicContact CD1-CG1 4.08Å; G179-I183 VanDerWaalsContact O-CG1 3.28Å; G179-I183 WeakPolarHBondContact O-CG1 3.33Å; G179-I183 PolarHBondContact O-N 2.69Å; I180-I183 PolarHBondContact O-N 3.15Å; I183-F185 VanDerWaalsContact C-N 3.34Å; I183-A186 PolarHBondContact O-N 2.93Å; I183-G187 PolarHBondContact O-N 3.48Å
184	I	81.8	Confident	82.6	Confident	15 Å²	15	31.9 Å²	31.9	8%	0.077	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-46.8	174.1	-63.6	164.5	0	0	0	110.2	F60 I75 I79 I180 S181 A186 G187 I188 I403	F60-I184 HydrophobicContact CD1-CG2 4.41Å; I75-I184 HydrophobicContact CD1-CG1 4.43Å; I79-I184 HydrophobicContact CD1-CD1 3.69Å; I79-I184 HydrophobicContact CD1-CG1 4.39Å; I79-I184 HydrophobicContact CG1-CD1 4.26Å; I180-I184 HydrophobicContact CG2-CD1 4.13Å; I180-I184 WeakPolarHBondContact O-CG1 3.39Å; I180-I184 PolarHBondContact O-N 3.08Å; I180-I184 VanDerWaalsContact O-N 3.09Å; S181-I184 PolarHBondContact O-N 3.02Å; I184-A186 VanDerWaalsContact C-N 3.35Å; I184-A186 PolarHBondContact O-N 3.16Å; I184-G187 PolarHBondContact O-N 2.81Å; I184-I188 HydrophobicContact CG2-CD1 3.85Å; I184-I188 WeakPolarHBondContact O-CG1 3.17Å; I184-I188 PolarHBondContact O-N 3.23Å; I184-I403 HydrophobicContact CG2-CG2 3.76Å
185	F	85.1	Confident	81.6	Confident	52 Å²	52	28 Å²	28	23%	0.228	18%	0.175	C	C	.	.	H	α-helix	trans	-56.2	-48.2	175.7	171.7	-89.9	0	0	0	111.6	S181 I182 I183 G187 I188 L189 V404 V407 A408	S181-F185 WeakPolarHBondContact O-CB 3.38Å; S181-F185 PolarHBondContact O-N 2.88Å; I182-F185 WeakPolarHBondContact O-CB 3.45Å; I182-F185 PolarHBondContact O-N 3.46Å; I183-F185 VanDerWaalsContact C-N 3.34Å; F185-G187 PolarHBondContact O-N 2.96Å; F185-I188 PolarHBondContact O-N 3.41Å; F185-L189 HydrophobicContact CD1-CD1 3.92Å; F185-L189 HydrophobicContact CD1-CG 4.47Å; F185-L189 HydrophobicContact CD2-CD1 4.49Å; F185-L189 HydrophobicContact CE1-CD1 3.27Å; F185-L189 HydrophobicContact CE1-CG 4.23Å; F185-L189 HydrophobicContact CE2-CD1 3.92Å; F185-L189 HydrophobicContact CE2-CG 4.43Å; F185-L189 HydrophobicContact CG-CD1 4.49Å; F185-L189 HydrophobicContact CZ-CD1 3.27Å; F185-L189 HydrophobicContact CZ-CG 4.21Å; F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 WeakPolarHBondContact O-CG 3.34Å; F185-L189 PolarHBondContact O-N 3.46Å; F185-V404 HydrophobicContact CD2-CB 4.27Å; F185-V404 HydrophobicContact CD2-CG1 4.06Å; F185-V404 HydrophobicContact CD2-CG2 4.29Å; F185-V404 HydrophobicContact CE2-CB 4.37Å; F185-V404 HydrophobicContact CE2-CG1 3.67Å; F185-V407 HydrophobicContact CB-CB 4.2Å; F185-V407 HydrophobicContact CB-CG1 3.82Å; F185-V407 HydrophobicContact CD2-CB 4.15Å; F185-V407 HydrophobicContact CD2-CG1 4.23Å; F185-V407 HydrophobicContact CG-CG1 4.21Å; F185-A408 HydrophobicContact CE2-CB 4.14Å
186	A	86.3	Confident	80.8	Confident	18 Å²	18	32.9 Å²	32.9	15%	0.149	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-37.4	177.6	0	0	0	0	0	112.4	L25 I182 I183 I184 S190	L25-A186 HydrophobicContact CD1-CB 4.16Å; L25-A186 HydrophobicContact CD2-CB 3.39Å; L25-A186 HydrophobicContact CG-CB 4.33Å; I182-A186 WeakPolarHBondContact O-CB 3.38Å; I182-A186 PolarHBondContact O-N 3.45Å; I183-A186 PolarHBondContact O-N 2.93Å; I184-A186 VanDerWaalsContact C-N 3.35Å; I184-A186 PolarHBondContact O-N 3.16Å; A186-S190 WeakPolarHBondContact O-CB 3.26Å; A186-S190 PolarHBondContact O-N 2.71Å; A186-S190 PolarHBondContact O-OG 3.39Å
187	G	81.2	Confident	80.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56.9	-55.5	173.8	0	0	0	0	0	111.2	T59 G62 I183 I184 F185 S190	T59-G187 CarbonylContact O-C 3.58Å; G62-G187 WeakPolarHBondContact CA-O 3.29Å; I183-G187 PolarHBondContact O-N 3.48Å; I184-G187 PolarHBondContact O-N 2.81Å; F185-G187 PolarHBondContact O-N 2.96Å; G187-S190 PolarHBondContact O-N 3.14Å; G187-S190 PolarHBondContact O-OG 3.28Å
188	I	79.5	Confident	79.5	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-48.8	178.8	-64.8	165.3	0	0	0	111.4	T59 F60 I184 F185 S190 T191 I403 V404	T59-I188 HydrophobicContact CG2-CB 4.46Å; T59-I188 HydrophobicContact CG2-CG1 4.14Å; T59-I188 HydrophobicContact CG2-CG2 4.4Å; F60-I188 HydrophobicContact CD1-CD1 4.29Å; F60-I188 HydrophobicContact CD1-CG1 4.25Å; F60-I188 HydrophobicContact CE1-CD1 4.21Å; I184-I188 HydrophobicContact CG2-CD1 3.85Å; I184-I188 WeakPolarHBondContact O-CG1 3.17Å; I184-I188 PolarHBondContact O-N 3.23Å; F185-I188 PolarHBondContact O-N 3.41Å; I188-S190 PolarHBondContact O-N 3.26Å; I188-T191 PolarHBondContact O-N 2.94Å; I188-T191 PolarHBondContact O-OG1 3.47Å; I188-I403 HydrophobicContact CD1-CB 3.88Å; I188-I403 HydrophobicContact CD1-CD1 4.25Å; I188-I403 HydrophobicContact CD1-CG2 3.69Å; I188-V404 HydrophobicContact CB-CG2 4.01Å; I188-V404 HydrophobicContact CD1-CG2 4.34Å; I188-V404 HydrophobicContact CG2-CG2 3.51Å
189	L	83.1	Confident	78.6	Confident	60 Å²	60	39.2 Å²	39.2	31%	0.314	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-29.3	-179.6	-72.7	-169.6	0	0	0	112.4	F185 T191 L192 P193 V404	F185-L189 HydrophobicContact CD1-CD1 3.92Å; F185-L189 HydrophobicContact CD1-CG 4.47Å; F185-L189 HydrophobicContact CD2-CD1 4.49Å; F185-L189 HydrophobicContact CE1-CD1 3.27Å; F185-L189 HydrophobicContact CE1-CG 4.23Å; F185-L189 HydrophobicContact CE2-CD1 3.92Å; F185-L189 HydrophobicContact CE2-CG 4.43Å; F185-L189 HydrophobicContact CG-CD1 4.49Å; F185-L189 HydrophobicContact CZ-CD1 3.27Å; F185-L189 HydrophobicContact CZ-CG 4.21Å; F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 WeakPolarHBondContact O-CG 3.34Å; F185-L189 PolarHBondContact O-N 3.46Å; L189-T191 PolarHBondContact O-N 3.47Å; L189-L192 HydrophobicContact CD2-CD1 3.4Å; L189-L192 VanDerWaalsContact CD2-CD1 3.4Å; L189-L192 HydrophobicContact CD2-CG 4.43Å; L189-L192 WeakPolarHBondContact O-CB 3.48Å; L189-L192 PolarHBondContact O-N 3.09Å; L189-P193 WeakPolarHBondContact O-CD 3.36Å; L189-V404 HydrophobicContact CD2-CG1 3.93Å; L189-V404 HydrophobicContact CD2-CG2 4.07Å; L189-V404 HydrophobicContact CG-CG2 4.38Å
190	S	77.9	Confident	77.9	Confident	34 Å²	34	40.1 Å²	40.1	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-70.7	-18.7	180	79.6	0	0	0	0	113.8	K29 G62 A186 G187 I188	K29-S190 PolarHBondContact NZ-OG 2.76Å; G62-S190 WeakPolarHBondContact CA-OG 3.14Å; G62-S190 PolarHBondContact O-OG 3.11Å; A186-S190 WeakPolarHBondContact O-CB 3.26Å; A186-S190 PolarHBondContact O-N 2.71Å; A186-S190 PolarHBondContact O-OG 3.39Å; G187-S190 PolarHBondContact O-N 3.14Å; G187-S190 PolarHBondContact O-OG 3.28Å; I188-S190 PolarHBondContact O-N 3.26Å
191	T	73.1	Confident	77.2	Confident	22 Å²	22	45 Å²	45	14%	0.135	26%	0.255	C	S	.	.	H	α-helix	trans	-86.6	-22.6	173.4	59.2	0	0	0	0	112.5	I188 L189 A194 S195	I188-T191 PolarHBondContact O-N 2.94Å; I188-T191 PolarHBondContact O-OG1 3.47Å; L189-T191 PolarHBondContact O-N 3.47Å; T191-A194 PolarHBondContact O-N 3.24Å; T191-S195 PolarHBondContact O-N 3.38Å; T191-S195 PolarHBondContact O-OG 3.22Å; T191-S195 VanDerWaalsContact O-OG 3.11Å
192	L	76.4	Confident	76.4	Confident	78 Å²	78	47.2 Å²	47.2	41%	0.408	27%	0.268	S	S	.	.	H	α-helix	trans	-56.5	-45.8	-178.5	-69.9	-178.4	0	0	0	113.9	L189 A194 S195 L196	L189-L192 HydrophobicContact CD2-CD1 3.4Å; L189-L192 VanDerWaalsContact CD2-CD1 3.4Å; L189-L192 HydrophobicContact CD2-CG 4.43Å; L189-L192 WeakPolarHBondContact O-CB 3.48Å; L189-L192 PolarHBondContact O-N 3.09Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.07Å; L192-S195 PolarHBondContact O-N 3.26Å; L192-L196 WeakPolarHBondContact O-CB 3.34Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.14Å
193	P	75.9	Confident	75.3	Confident	74 Å²	74	47.2 Å²	47.2	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-58.6	-43.8	179	-25.9	34	0	0	0	112.8	L189 L196 I197	L189-P193 WeakPolarHBondContact O-CD 3.36Å; P193-L196 PolarHBondContact O-N 2.89Å; P193-I197 VanDerWaalsContact O-CG1 3.26Å; P193-I197 WeakPolarHBondContact O-CG1 3.5Å; P193-I197 PolarHBondContact O-N 2.83Å
194	A	71.1	Confident	74.2	Confident	64 Å²	64	51.1 Å²	51.1	53%	0.529	29%	0.287	S	S	.	.	H	α-helix	trans	-65.5	-41.6	178.2	0	0	0	0	0	111.4	T191 L192 I197 Q198	T191-A194 PolarHBondContact O-N 3.24Å; L192-A194 VanDerWaalsContact C-N 3.33Å; L192-A194 PolarHBondContact O-N 3.07Å; A194-I197 PolarHBondContact O-N 2.89Å; A194-Q198 WeakPolarHBondContact O-CB 3.08Å; A194-Q198 PolarHBondContact O-N 3.1Å
195	S	68.9	Low	73.1	Confident	29 Å²	29	55.8 Å²	55.8	20%	0.203	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-38.2	175.7	-57.8	0	0	0	0	112.5	T191 L192 F199	T191-S195 PolarHBondContact O-N 3.38Å; T191-S195 PolarHBondContact O-OG 3.22Å; T191-S195 VanDerWaalsContact O-OG 3.11Å; L192-S195 PolarHBondContact O-N 3.26Å; S195-F199 VanDerWaalsContact O-CB 3.22Å; S195-F199 WeakPolarHBondContact O-CB 3.22Å; S195-F199 PolarHBondContact O-N 3.45Å
196	L	72.4	Confident	71.8	Confident	108 Å²	108	57.2 Å²	57.2	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-69.2	-41.2	176.6	-71.6	173.4	0	0	0	112.1	L192 P193 F199 G200	L192-L196 WeakPolarHBondContact O-CB 3.34Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.14Å; P193-L196 PolarHBondContact O-N 2.89Å; L196-F199 PolarHBondContact O-N 3.29Å; L196-G200 PolarHBondContact O-N 2.9Å
197	I	74	Confident	70.3	Confident	106 Å²	106	60.5 Å²	60.5	54%	0.544	36%	0.357	S	S	.	.	H	α-helix	trans	-64.3	-46.4	175.4	-67.6	164.3	0	0	0	110.2	P193 A194 F199 G200 Q201	P193-I197 VanDerWaalsContact O-CG1 3.26Å; P193-I197 WeakPolarHBondContact O-CG1 3.5Å; P193-I197 PolarHBondContact O-N 2.83Å; A194-I197 PolarHBondContact O-N 2.89Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 3.37Å; I197-G200 PolarHBondContact O-N 3.17Å; I197-Q201 WeakPolarHBondContact O-CG 3.04Å; I197-Q201 PolarHBondContact O-N 3.33Å
198	Q	68	Low	69.1	Low	96 Å²	96	70.1 Å²	70.1	45%	0.449	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-44.2	177	-174.8	-179	11.5	0	0	111.2	A194 G200 Q201 T202	A194-Q198 WeakPolarHBondContact O-CB 3.08Å; A194-Q198 PolarHBondContact O-N 3.1Å; Q198-G200 VanDerWaalsContact C-N 3.34Å; Q198-G200 PolarHBondContact O-N 2.96Å; Q198-Q201 PolarHBondContact O-N 3Å; Q198-T202 WeakPolarHBondContact O-CG2 3.46Å; Q198-T202 PolarHBondContact O-N 3.39Å; Q198-T202 PolarHBondContact O-OG1 3.36Å; Q198-T202 VanDerWaalsContact O-OG1 3.11Å
199	F	68.7	Low	68.1	Low	15 Å²	15	74.9 Å²	74.9	7%	0.066	43%	0.428	C	S	.	.	H	α-helix	trans	-59	-46.5	175	178.1	-112.2	0	0	0	111.2	S195 L196 I197 Q201 T202 A203 V217 L220 L390 P391 I394	S195-F199 VanDerWaalsContact O-CB 3.22Å; S195-F199 WeakPolarHBondContact O-CB 3.22Å; S195-F199 PolarHBondContact O-N 3.45Å; L196-F199 PolarHBondContact O-N 3.29Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 3.37Å; F199-Q201 PolarHBondContact O-N 3.43Å; F199-T202 WeakPolarHBondContact CA-OG1 3.41Å; F199-T202 PolarHBondContact O-N 3.11Å; F199-T202 PolarHBondContact O-OG1 2.91Å; F199-A203 WeakPolarHBondContact O-CB 3.43Å; F199-A203 PolarHBondContact O-N 3.47Å; F199-V217 HydrophobicContact CE1-CB 4.28Å; F199-V217 HydrophobicContact CE1-CG2 3.54Å; F199-V217 HydrophobicContact CZ-CG2 4.08Å; F199-L220 HydrophobicContact CD1-CD2 4.31Å; F199-L220 HydrophobicContact CE1-CD2 3.94Å; F199-L220 HydrophobicContact CZ-CD2 4.14Å; F199-L390 HydrophobicContact CD2-CD2 4.45Å; F199-L390 HydrophobicContact CE2-CD2 3.5Å; F199-L390 VanDerWaalsContact CE2-CD2 3.5Å; F199-L390 HydrophobicContact CZ-CD2 4.08Å; F199-P391 HydrophobicContact CD2-CG 4.26Å; F199-I394 HydrophobicContact CD2-CD1 3.96Å; F199-I394 HydrophobicContact CE2-CD1 4.32Å; F199-I394 HydrophobicContact CG-CD1 4.46Å
200	G	69.7	Low	67.1	Low	19 Å²	19	76.3 Å²	76.3	20%	0.196	44%	0.439	C	S	.	.	H	α-helix	trans	-58.1	-44.8	174.9	0	0	0	0	0	112.6	L196 I197 Q198 A203 F204	L196-G200 PolarHBondContact O-N 2.9Å; I197-G200 PolarHBondContact O-N 3.17Å; Q198-G200 VanDerWaalsContact C-N 3.34Å; Q198-G200 PolarHBondContact O-N 2.96Å; G200-A203 PolarHBondContact O-N 3.3Å; G200-F204 VanDerWaalsContact O-CB 3.31Å; G200-F204 WeakPolarHBondContact O-CB 3.42Å; G200-F204 WeakPolarHBondContact O-CD2 3.43Å; G200-F204 PolarHBondContact O-N 3.46Å
201	Q	69.7	Low	66.4	Low	118 Å²	118	78.5 Å²	78.5	55%	0.551	45%	0.454	S	S	*	.	H	α-helix	trans	-62	-47.1	175.9	-72	175.2	-14.8	0	0	111.6	I197 Q198 F199 A203 V205	I197-Q201 WeakPolarHBondContact O-CG 3.04Å; I197-Q201 PolarHBondContact O-N 3.33Å; Q198-Q201 PolarHBondContact O-N 3Å; F199-Q201 PolarHBondContact O-N 3.43Å; Q201-A203 VanDerWaalsContact C-N 3.3Å; Q201-A203 PolarHBondContact O-N 2.95Å; Q201-V205 WeakPolarHBondContact O-CA 3.4Å; Q201-V205 WeakPolarHBondContact O-CB 3.45Å; Q201-V205 PolarHBondContact O-N 2.98Å
202	T	67.1	Low	66.1	Low	70 Å²	70	81.7 Å²	81.7	43%	0.429	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-25.9	179.5	56.6	0	0	0	0	114.2	Q198 F199 Q207	Q198-T202 WeakPolarHBondContact O-CG2 3.46Å; Q198-T202 PolarHBondContact O-N 3.39Å; Q198-T202 PolarHBondContact O-OG1 3.36Å; Q198-T202 VanDerWaalsContact O-OG1 3.11Å; F199-T202 WeakPolarHBondContact CA-OG1 3.41Å; F199-T202 PolarHBondContact O-N 3.11Å; F199-T202 PolarHBondContact O-OG1 2.91Å; T202-Q207 PolarHBondContact O-NE2 3.31Å
203	A	64.2	Low	65.7	Low	9 Å²	9	78 Å²	78	7%	0.074	45%	0.451	C	S	.	.	H	α-helix	trans	-89.5	-34.1	-178.2	0	0	0	0	0	112.5	F199 G200 Q201 A213	F199-A203 WeakPolarHBondContact O-CB 3.43Å; F199-A203 PolarHBondContact O-N 3.47Å; G200-A203 PolarHBondContact O-N 3.3Å; Q201-A203 VanDerWaalsContact C-N 3.3Å; Q201-A203 PolarHBondContact O-N 2.95Å; A203-A213 HydrophobicContact CB-CB 4.32Å; A203-A213 WeakPolarHBondContact O-CB 3.5Å
204	F	65.2	Low	65.5	Low	85 Å²	85	82.4 Å²	82.4	37%	0.373	46%	0.458	S	S	.	.	H	α-helix	trans	-109.1	-24.1	-173.1	-63.1	-71.1	0	0	0	114.3	G200 T210 A213 W214 V217	G200-F204 VanDerWaalsContact O-CB 3.31Å; G200-F204 WeakPolarHBondContact O-CB 3.42Å; G200-F204 WeakPolarHBondContact O-CD2 3.43Å; G200-F204 PolarHBondContact O-N 3.46Å; F204-T210 HydrophobicContact CD1-CG2 4.33Å; F204-A213 HydrophobicContact CD1-CB 4.28Å; F204-A213 HydrophobicContact CE1-CB 4.17Å; F204-W214 HydrophobicContact CE1-CE3 4.03Å; F204-W214 HydrophobicContact CE1-CZ3 4.49Å; F204-W214 AromaticContact CZ-CE3 3.9Å; F204-W214 HydrophobicContact CZ-CE3 3.9Å; F204-W214 HydrophobicContact CZ-CZ3 4.14Å; F204-V217 HydrophobicContact CE2-CG2 4.14Å; F204-V217 HydrophobicContact CZ-CG2 3.9Å
205	V	57.2	Low	65.6	Low	113 Å²	113	85 Å²	85	69%	0.685	46%	0.463	S	S	*	.	S	Bend	trans	-97.5	109.2	-177.9	-173.8	0	0	0	0	109.3	Q201	Q201-V205 WeakPolarHBondContact O-CA 3.4Å; Q201-V205 WeakPolarHBondContact O-CB 3.45Å; Q201-V205 PolarHBondContact O-N 2.98Å
206	G	57.8	Low	65.7	Low	82 Å²	82	87.7 Å²	87.7	85%	0.845	47%	0.47	S	S	*	.	S	Bend	trans	98.1	10.2	172.2	0	0	0	0	0	116.9
207	Q	55	Low	65.8	Low	87 Å²	87	83.8 Å²	83.8	41%	0.407	45%	0.451	S	S	.	.			trans	-107.8	128	168.9	-73.1	-172.6	54.4	0	0	110.6	T202 D209	T202-Q207 PolarHBondContact O-NE2 3.31Å; Q207-D209 VanDerWaalsContact C-N 3.27Å; Q207-D209 PolarHBondContact O-N 3.45Å
208	E	55.4	Low	66	Low	201 Å²	201	83 Å²	83	94%	0.939	45%	0.448	S	S	*	.	S	Bend	trans	-67.5	-27	178.9	-63.7	-175.9	160.4	0	0	112.2
209	D	59.1	Low	66.5	Low	103 Å²	103	79.9 Å²	79.9	55%	0.551	44%	0.441	S	S	*	.			trans	-102.5	94.6	177.4	-88.9	-37.4	0	0	0	112.8	Q207 S211 L212	Q207-D209 VanDerWaalsContact C-N 3.27Å; Q207-D209 PolarHBondContact O-N 3.45Å; D209-S211 PolarHBondContact O-N 2.95Å; D209-L212 HydrophobicContact CB-CD1 4.27Å
210	T	63	Low	66.8	Low	90 Å²	90	81 Å²	81	55%	0.552	45%	0.447	S	S	*	.	H	α-helix	trans	-71.1	-17	177.2	7.8	0	0	0	0	113.6	F204 A213 W214	F204-T210 HydrophobicContact CD1-CG2 4.33Å; T210-A213 PolarHBondContact O-N 3.36Å; T210-W214 PolarHBondContact O-N 3.47Å
211	S	63.5	Low	67.2	Low	80 Å²	80	84.6 Å²	84.6	56%	0.559	46%	0.461	S	S	*	.	H	α-helix	trans	-67.7	-43.1	-178.4	57.7	0	0	0	0	112.6	D209 A213 W214 L215	D209-S211 PolarHBondContact O-N 2.95Å; S211-A213 VanDerWaalsContact C-N 3.33Å; S211-A213 PolarHBondContact O-N 2.9Å; S211-W214 PolarHBondContact O-N 2.84Å; S211-L215 PolarHBondContact O-N 3.24Å
212	L	66.4	Low	67.9	Low	89 Å²	89	82.7 Å²	82.7	47%	0.466	46%	0.458	S	S	.	.	H	α-helix	trans	-67.5	-33.9	176.4	-74.3	161.5	0	0	0	111.9	D209 L215 K216	D209-L212 HydrophobicContact CB-CD1 4.27Å; L212-L215 PolarHBondContact O-N 2.89Å; L212-K216 WeakPolarHBondContact O-CG 3.46Å; L212-K216 PolarHBondContact O-N 2.9Å
213	A	67.5	Low	68.4	Low	1 Å²	1	81.6 Å²	81.6	1%	0.008	45%	0.453	C	S	.	.	H	α-helix	trans	-65.1	-46.1	176.8	0	0	0	0	0	111.7	A203 F204 T210 S211 L215 K216 V217	A203-A213 HydrophobicContact CB-CB 4.32Å; A203-A213 WeakPolarHBondContact O-CB 3.5Å; F204-A213 HydrophobicContact CD1-CB 4.28Å; F204-A213 HydrophobicContact CE1-CB 4.17Å; T210-A213 PolarHBondContact O-N 3.36Å; S211-A213 VanDerWaalsContact C-N 3.33Å; S211-A213 PolarHBondContact O-N 2.9Å; A213-L215 VanDerWaalsContact C-N 3.34Å; A213-L215 PolarHBondContact O-N 3.1Å; A213-K216 PolarHBondContact O-N 3.16Å; A213-V217 WeakPolarHBondContact O-CG2 3.43Å; A213-V217 PolarHBondContact O-N 3.21Å
214	W	71.1	Confident	69.2	Low	165 Å²	165	85.1 Å²	85.1	63%	0.625	47%	0.47	S	S	*	.	H	α-helix	trans	-64.6	-39.1	177.6	-160.4	-102.3	0	0	0	112.2	F204 T210 S211 K216 V217 L218	F204-W214 HydrophobicContact CE1-CE3 4.03Å; F204-W214 HydrophobicContact CE1-CZ3 4.49Å; F204-W214 AromaticContact CZ-CE3 3.9Å; F204-W214 HydrophobicContact CZ-CE3 3.9Å; F204-W214 HydrophobicContact CZ-CZ3 4.14Å; T210-W214 PolarHBondContact O-N 3.47Å; S211-W214 PolarHBondContact O-N 2.84Å; W214-K216 PolarHBondContact O-N 2.77Å; W214-V217 PolarHBondContact O-N 3.13Å; W214-L218 WeakPolarHBondContact O-CB 3.33Å; W214-L218 PolarHBondContact O-N 2.84Å
215	L	73.5	Confident	70.1	Confident	120 Å²	120	86.1 Å²	86.1	63%	0.628	48%	0.478	S	S	*	.	H	α-helix	trans	-63.3	-39.8	175.1	-173.5	62.7	0	0	0	112	S211 L212 A213 G219	S211-L215 PolarHBondContact O-N 3.24Å; L212-L215 PolarHBondContact O-N 2.89Å; A213-L215 VanDerWaalsContact C-N 3.34Å; A213-L215 PolarHBondContact O-N 3.1Å; L215-G219 PolarHBondContact O-N 3.03Å
216	K	71	Confident	71.5	Confident	84 Å²	84	86.3 Å²	86.3	37%	0.365	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-42.1	174.4	-75	176.1	-178.6	-178.6	0	112.3	L212 A213 W214 L220	L212-K216 WeakPolarHBondContact O-CG 3.46Å; L212-K216 PolarHBondContact O-N 2.9Å; A213-K216 PolarHBondContact O-N 3.16Å; W214-K216 PolarHBondContact O-N 2.77Å; K216-L220 WeakPolarHBondContact O-CB 3.44Å; K216-L220 PolarHBondContact O-N 3.32Å
217	V	73.9	Confident	72.8	Confident	27 Å²	27	83 Å²	83	16%	0.164	44%	0.437	C	S	.	.	H	α-helix	trans	-63.2	-47.8	176.8	174.9	0	0	0	0	110.6	F199 F204 A213 W214 L220 L221	F199-V217 HydrophobicContact CE1-CB 4.28Å; F199-V217 HydrophobicContact CE1-CG2 3.54Å; F199-V217 HydrophobicContact CZ-CG2 4.08Å; F204-V217 HydrophobicContact CE2-CG2 4.14Å; F204-V217 HydrophobicContact CZ-CG2 3.9Å; A213-V217 WeakPolarHBondContact O-CG2 3.43Å; A213-V217 PolarHBondContact O-N 3.21Å; W214-V217 PolarHBondContact O-N 3.13Å; V217-L220 PolarHBondContact O-N 3.47Å; V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 3Å
218	L	78.2	Confident	74.2	Confident	90 Å²	90	80.6 Å²	80.6	47%	0.471	43%	0.429	S	S	.	.	H	α-helix	trans	-65.7	-42.2	179.8	-161	152.1	0	0	0	110.9	W214 L220 L221 V222	W214-L218 WeakPolarHBondContact O-CB 3.33Å; W214-L218 PolarHBondContact O-N 2.84Å; L218-L220 PolarHBondContact O-N 3.5Å; L218-L221 PolarHBondContact O-N 2.82Å; L218-V222 HydrophobicContact CD2-CG2 3.87Å; L218-V222 WeakPolarHBondContact O-CB 3.44Å; L218-V222 VanDerWaalsContact O-CG2 3.3Å; L218-V222 WeakPolarHBondContact O-CG2 3.41Å; L218-V222 PolarHBondContact O-N 2.92Å
219	G	78.4	Confident	75.7	Confident	29 Å²	29	75.3 Å²	75.3	30%	0.299	41%	0.41	S	S	.	.	H	α-helix	trans	-60.1	-41.3	173.4	0	0	0	0	0	113.1	L215 S223	L215-G219 PolarHBondContact O-N 3.03Å; G219-S223 WeakPolarHBondContact O-CB 3.46Å; G219-S223 PolarHBondContact O-N 3.36Å
220	L	75.6	Confident	77	Confident	38 Å²	38	71.5 Å²	71.5	20%	0.199	40%	0.395	C	S	.	.	H	α-helix	trans	-64.1	-46	175	-178.7	68.4	0	0	0	111.7	F199 K216 V217 L218 S223 L224 L390 I394	F199-L220 HydrophobicContact CD1-CD2 4.31Å; F199-L220 HydrophobicContact CE1-CD2 3.94Å; F199-L220 HydrophobicContact CZ-CD2 4.14Å; K216-L220 WeakPolarHBondContact O-CB 3.44Å; K216-L220 PolarHBondContact O-N 3.32Å; V217-L220 PolarHBondContact O-N 3.47Å; L218-L220 PolarHBondContact O-N 3.5Å; L220-S223 PolarHBondContact O-N 3.17Å; L220-L224 WeakPolarHBondContact O-CB 3.39Å; L220-L224 PolarHBondContact O-N 2.69Å; L220-L390 HydrophobicContact CD1-CD1 4.43Å; L220-I394 HydrophobicContact CD1-CD1 4.4Å; L220-I394 HydrophobicContact CD1-CG2 4.04Å; L220-I394 HydrophobicContact CD2-CD1 4.01Å
221	L	79.4	Confident	78	Confident	95 Å²	95	67.2 Å²	67.2	50%	0.497	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-45.9	178	-75.9	173.8	0	0	0	111.9	V217 L218 S223 L224 I225	V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 3Å; L218-L221 PolarHBondContact O-N 2.82Å; L221-S223 VanDerWaalsContact C-N 3.35Å; L221-L224 PolarHBondContact O-N 2.84Å; L221-I225 VanDerWaalsContact O-CG1 3.3Å; L221-I225 WeakPolarHBondContact O-CG1 3.27Å; L221-I225 PolarHBondContact O-N 2.92Å
222	V	82.4	Confident	79.1	Confident	78 Å²	78	66.9 Å²	66.9	47%	0.473	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-43.6	176.4	171.5	0	0	0	0	110.6	L218 I225 L226	L218-V222 HydrophobicContact CD2-CG2 3.87Å; L218-V222 WeakPolarHBondContact O-CB 3.44Å; L218-V222 VanDerWaalsContact O-CG2 3.3Å; L218-V222 WeakPolarHBondContact O-CG2 3.41Å; L218-V222 PolarHBondContact O-N 2.92Å; V222-I225 PolarHBondContact O-N 3.46Å; V222-L226 VanDerWaalsContact O-CB 3.26Å; V222-L226 WeakPolarHBondContact O-CB 3.29Å; V222-L226 PolarHBondContact O-N 3.47Å
223	S	79.4	Confident	80	Confident	47 Å²	47	71.5 Å²	71.5	33%	0.329	37%	0.373	S	S	.	.	H	α-helix	trans	-60.6	-45.4	175.8	-176.4	0	0	0	0	111.7	G219 L220 L221 I225 L226 L227	G219-S223 WeakPolarHBondContact O-CB 3.46Å; G219-S223 PolarHBondContact O-N 3.36Å; L220-S223 PolarHBondContact O-N 3.17Å; L221-S223 VanDerWaalsContact C-N 3.35Å; S223-I225 PolarHBondContact O-N 2.84Å; S223-L226 PolarHBondContact O-N 3.31Å; S223-L227 WeakPolarHBondContact O-CB 3.29Å; S223-L227 VanDerWaalsContact O-CG 3.22Å; S223-L227 WeakPolarHBondContact O-CG 3.43Å; S223-L227 PolarHBondContact O-N 2.87Å
224	L	80.4	Confident	80.8	Confident	83 Å²	83	72.3 Å²	72.3	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-59.8	-46.2	177.4	-170.4	86.9	0	0	0	111.5	L220 L221 T228 L401	L220-L224 WeakPolarHBondContact O-CB 3.39Å; L220-L224 PolarHBondContact O-N 2.69Å; L221-L224 PolarHBondContact O-N 2.84Å; L224-T228 VanDerWaalsContact O-CB 3.28Å; L224-T228 WeakPolarHBondContact O-CB 3.27Å; L224-T228 PolarHBondContact O-N 3.46Å; L224-T228 PolarHBondContact O-OG1 3.5Å; L224-L401 HydrophobicContact CD1-CD1 3.95Å; L224-L401 HydrophobicContact CD1-CD2 4.05Å
225	I	84.9	Confident	81.2	Confident	106 Å²	106	65.2 Å²	65.2	54%	0.544	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-46.8	177.8	-67.9	166.1	0	0	0	110.1	L221 V222 S223 T228 V229	L221-I225 VanDerWaalsContact O-CG1 3.3Å; L221-I225 WeakPolarHBondContact O-CG1 3.27Å; L221-I225 PolarHBondContact O-N 2.92Å; V222-I225 PolarHBondContact O-N 3.46Å; S223-I225 PolarHBondContact O-N 2.84Å; I225-T228 PolarHBondContact O-N 3.36Å; I225-T228 VanDerWaalsContact O-N 3.17Å; I225-V229 HydrophobicContact CG2-CG2 4.27Å; I225-V229 WeakPolarHBondContact O-CG2 3.48Å; I225-V229 PolarHBondContact O-N 3.26Å
226	L	86.2	Confident	81.6	Confident	117 Å²	117	62.9 Å²	62.9	61%	0.613	34%	0.338	S	S	*	.	H	α-helix	trans	-64	-44.1	-178.6	-170.3	148	0	0	0	111.7	V222 S223 T228 V229 G230	V222-L226 VanDerWaalsContact O-CB 3.26Å; V222-L226 WeakPolarHBondContact O-CB 3.29Å; V222-L226 PolarHBondContact O-N 3.47Å; S223-L226 PolarHBondContact O-N 3.31Å; L226-T228 VanDerWaalsContact C-N 3.3Å; L226-T228 PolarHBondContact O-N 2.94Å; L226-V229 PolarHBondContact O-N 3.5Å; L226-G230 PolarHBondContact O-N 3.34Å
227	L	84.3	Confident	82.4	Confident	12 Å²	12	60.2 Å²	60.2	6%	0.063	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-40.4	173.2	-72.4	174.7	0	0	0	111.4	S223 A231 I377 L380 P381 L401	S223-L227 WeakPolarHBondContact O-CB 3.29Å; S223-L227 VanDerWaalsContact O-CG 3.22Å; S223-L227 WeakPolarHBondContact O-CG 3.43Å; S223-L227 PolarHBondContact O-N 2.87Å; L227-A231 WeakPolarHBondContact O-CB 3.26Å; L227-A231 PolarHBondContact O-N 3.47Å; L227-I377 HydrophobicContact CD2-CG1 4.5Å; L227-I377 HydrophobicContact CD2-CG2 4.4Å; L227-L380 HydrophobicContact CD2-CB 4.03Å; L227-L380 HydrophobicContact CD2-CD1 3.58Å; L227-L380 HydrophobicContact CD2-CG 4.46Å; L227-P381 HydrophobicContact CD1-CG 3.83Å; L227-L401 HydrophobicContact CB-CD2 3.99Å; L227-L401 HydrophobicContact CD1-CD2 4.31Å
228	T	84.9	Confident	83.1	Confident	37 Å²	37	62 Å²	62	23%	0.227	34%	0.342	C	S	.	.	H	α-helix	trans	-66.5	-48.9	179.2	-59.3	0	0	0	0	111.8	L224 I225 L226 G230 A231 I232 I405	L224-T228 VanDerWaalsContact O-CB 3.28Å; L224-T228 WeakPolarHBondContact O-CB 3.27Å; L224-T228 PolarHBondContact O-N 3.46Å; L224-T228 PolarHBondContact O-OG1 3.5Å; I225-T228 PolarHBondContact O-N 3.36Å; I225-T228 VanDerWaalsContact O-N 3.17Å; L226-T228 VanDerWaalsContact C-N 3.3Å; L226-T228 PolarHBondContact O-N 2.94Å; T228-G230 VanDerWaalsContact C-N 3.35Å; T228-G230 PolarHBondContact O-N 3.21Å; T228-A231 PolarHBondContact O-N 2.82Å; T228-I232 HydrophobicContact CG2-CD1 3.81Å; T228-I232 HydrophobicContact CG2-CG1 4.49Å; T228-I232 WeakPolarHBondContact O-CD1 3.09Å; T228-I232 VanDerWaalsContact O-CG1 3.23Å; T228-I232 WeakPolarHBondContact O-CG1 2.93Å; T228-I232 PolarHBondContact O-N 3.34Å; T228-I405 HydrophobicContact CG2-CD1 3.87Å; T228-I405 HydrophobicContact CG2-CG1 4.08Å
229	V	87.5	Confident	83.7	Confident	91 Å²	91	64.5 Å²	64.5	55%	0.552	35%	0.345	S	S	*	.	H	α-helix	trans	-62.4	-44	177.4	173	0	0	0	0	110.5	I225 L226 I232 Y233	I225-V229 HydrophobicContact CG2-CG2 4.27Å; I225-V229 WeakPolarHBondContact O-CG2 3.48Å; I225-V229 PolarHBondContact O-N 3.26Å; L226-V229 PolarHBondContact O-N 3.5Å; V229-I232 PolarHBondContact O-N 3.22Å; V229-Y233 WeakPolarHBondContact O-CB 3.43Å; V229-Y233 PolarHBondContact O-N 3.4Å
230	G	85.9	Confident	84.2	Confident	22 Å²	22	68.5 Å²	68.5	23%	0.227	35%	0.354	C	S	.	.	H	α-helix	trans	-58.5	-49.4	174.5	0	0	0	0	0	111.9	L226 T228 I232 Y233 V234 F373	L226-G230 PolarHBondContact O-N 3.34Å; T228-G230 VanDerWaalsContact C-N 3.35Å; T228-G230 PolarHBondContact O-N 3.21Å; G230-I232 PolarHBondContact O-N 2.9Å; G230-Y233 PolarHBondContact O-N 2.8Å; G230-V234 PolarHBondContact O-N 3.31Å; G230-F373 VanDerWaalsContact C-CZ 3.46Å; G230-F373 WeakPolarHBondContact O-CE1 3.27Å; G230-F373 WeakPolarHBondContact O-CZ 3.33Å
231	A	84.1	Confident	84.8	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.008	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-48.1	177.9	0	0	0	0	0	111.6	L227 T228 Y233 V234 L235 I377 L402 I405	L227-A231 WeakPolarHBondContact O-CB 3.26Å; L227-A231 PolarHBondContact O-N 3.47Å; T228-A231 PolarHBondContact O-N 2.82Å; A231-Y233 PolarHBondContact O-N 2.81Å; A231-V234 PolarHBondContact O-N 3.48Å; A231-L235 HydrophobicContact CB-CD1 4.49Å; A231-L235 VanDerWaalsContact O-CB 3.24Å; A231-L235 WeakPolarHBondContact O-CB 3.23Å; A231-L235 WeakPolarHBondContact O-CD1 3.2Å; A231-L235 WeakPolarHBondContact O-CG 3.44Å; A231-L235 PolarHBondContact O-N 2.93Å; A231-I377 HydrophobicContact CB-CD1 3.9Å; A231-L402 HydrophobicContact CB-CD2 4.11Å; A231-I405 HydrophobicContact CB-CD1 3.8Å; A231-I405 HydrophobicContact CB-CG2 4.26Å
232	I	85.3	Confident	85.2	Confident	72 Å²	72	65.2 Å²	65.2	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-47.2	178.1	-66.6	163.4	0	0	0	110.4	T228 V229 G230 V234 L235 E236 I405 I409	T228-I232 HydrophobicContact CG2-CD1 3.81Å; T228-I232 HydrophobicContact CG2-CG1 4.49Å; T228-I232 WeakPolarHBondContact O-CD1 3.09Å; T228-I232 VanDerWaalsContact O-CG1 3.23Å; T228-I232 WeakPolarHBondContact O-CG1 2.93Å; T228-I232 PolarHBondContact O-N 3.34Å; V229-I232 PolarHBondContact O-N 3.22Å; G230-I232 PolarHBondContact O-N 2.9Å; I232-V234 VanDerWaalsContact C-N 3.3Å; I232-V234 PolarHBondContact O-N 3.44Å; I232-L235 PolarHBondContact O-N 3.46Å; I232-E236 HydrophobicContact CG2-CG 4.25Å; I232-E236 WeakPolarHBondContact O-CB 3.3Å; I232-E236 WeakPolarHBondContact O-CG 3.22Å; I232-E236 PolarHBondContact O-N 3.23Å; I232-I405 HydrophobicContact CG1-CG2 3.92Å; I232-I409 HydrophobicContact CG1-CD1 4.1Å
233	Y	86.8	Confident	85.4	Confident	186 Å²	186	62 Å²	62	73%	0.729	32%	0.321	S	S	*	.	H	α-helix	trans	-56.6	-43.8	-177.7	-174.1	-96.2	0	0	0	112.1	V229 G230 A231 A237	V229-Y233 WeakPolarHBondContact O-CB 3.43Å; V229-Y233 PolarHBondContact O-N 3.4Å; G230-Y233 PolarHBondContact O-N 2.8Å; A231-Y233 PolarHBondContact O-N 2.81Å; Y233-A237 WeakPolarHBondContact O-CB 3.28Å; Y233-A237 PolarHBondContact O-N 2.97Å; Y233-A237 VanDerWaalsContact O-N 3.14Å
234	V	83.7	Confident	85.5	Confident	18 Å²	18	63.5 Å²	63.5	11%	0.109	32%	0.323	C	S	.	.	H	α-helix	trans	-81.9	-35.3	-178.8	177.6	0	0	0	0	112.8	G230 A231 I232 E236 A237 V265 F373	G230-V234 PolarHBondContact O-N 3.31Å; A231-V234 PolarHBondContact O-N 3.48Å; I232-V234 VanDerWaalsContact C-N 3.3Å; I232-V234 PolarHBondContact O-N 3.44Å; V234-E236 VanDerWaalsContact C-N 3.28Å; V234-E236 PolarHBondContact O-N 3.01Å; V234-A237 PolarHBondContact O-N 3.39Å; V234-V265 HydrophobicContact CG1-CG1 4.14Å; V234-F373 HydrophobicContact CB-CD1 3.47Å; V234-F373 VanDerWaalsContact CB-CD1 3.47Å; V234-F373 HydrophobicContact CB-CE1 3.3Å; V234-F373 HydrophobicContact CB-CG 4.17Å; V234-F373 HydrophobicContact CB-CZ 3.94Å; V234-F373 HydrophobicContact CG1-CB 4.36Å; V234-F373 HydrophobicContact CG1-CD1 3.47Å; V234-F373 VanDerWaalsContact CG1-CD1 3.47Å; V234-F373 HydrophobicContact CG1-CE1 3.89Å; V234-F373 HydrophobicContact CG1-CG 3.99Å; V234-F373 HydrophobicContact CG2-CD1 3.51Å; V234-F373 HydrophobicContact CG2-CD2 3.85Å; V234-F373 HydrophobicContact CG2-CE1 3.25Å; V234-F373 HydrophobicContact CG2-CE2 3.66Å; V234-F373 HydrophobicContact CG2-CG 3.77Å; V234-F373 HydrophobicContact CG2-CZ 3.34Å
235	L	79.2	Confident	85.4	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-32.5	176.2	-73.1	171	0	0	0	112.1	A231 I232 I405 I409	A231-L235 HydrophobicContact CB-CD1 4.49Å; A231-L235 VanDerWaalsContact O-CB 3.24Å; A231-L235 WeakPolarHBondContact O-CB 3.23Å; A231-L235 WeakPolarHBondContact O-CD1 3.2Å; A231-L235 WeakPolarHBondContact O-CG 3.44Å; A231-L235 PolarHBondContact O-N 2.93Å; I232-L235 PolarHBondContact O-N 3.46Å; L235-I405 HydrophobicContact CD1-CG2 4.12Å; L235-I409 HydrophobicContact CB-CD1 4.28Å; L235-I409 HydrophobicContact CD1-CD1 4.06Å
236	E	82.9	Confident	84.7	Confident	71 Å²	71	63.7 Å²	63.7	33%	0.332	33%	0.327	S	S	.	.	H	α-helix	trans	-88.3	-13.4	176	-69.1	-58	141.1	0	0	114.1	I232 V234 V238 I409 K413	I232-E236 HydrophobicContact CG2-CG 4.25Å; I232-E236 WeakPolarHBondContact O-CB 3.3Å; I232-E236 WeakPolarHBondContact O-CG 3.22Å; I232-E236 PolarHBondContact O-N 3.23Å; V234-E236 VanDerWaalsContact C-N 3.28Å; V234-E236 PolarHBondContact O-N 3.01Å; E236-V238 PolarHBondContact O-N 2.93Å; E236-I409 WeakPolarHBondContact OE1-CG2 3.41Å; E236-K413 WeakPolarHBondContact OE1-CE 3.33Å; E236-K413 IonicContact OE1-NZ 2.73Å; E236-K413 PolarHBondContact OE1-NZ 3.46Å; E236-K413 WeakPolarHBondContact OE2-CE 3.4Å; E236-K413 IonicContact OE2-NZ 3.99Å; E236-K413 PolarHBondContact OE2-NZ 3.35Å
237	A	87.4	Confident	83.3	Confident	28 Å²	28	67.3 Å²	67.3	23%	0.231	34%	0.337	C	S	.	.			trans	-64.6	123.8	-178.5	0	0	0	0	0	111.2	Y233 V234 K264 V265	Y233-A237 WeakPolarHBondContact O-CB 3.28Å; Y233-A237 PolarHBondContact O-N 2.97Å; Y233-A237 VanDerWaalsContact O-N 3.14Å; V234-A237 PolarHBondContact O-N 3.39Å; A237-K264 WeakPolarHBondContact O-CA 3.33Å; A237-V265 HydrophobicContact CB-CB 4.06Å; A237-V265 HydrophobicContact CB-CG2 3.5Å; A237-V265 VanDerWaalsContact CB-CG2 3.5Å; A237-V265 WeakPolarHBondContact O-CG2 3.23Å; A237-V265 PolarHBondContact O-N 3.39Å
238	V	88.4	Confident	81.9	Confident	64 Å²	64	76.4 Å²	76.4	39%	0.388	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.8	179.1	-69.6	0	0	0	0	111.6	E236 K240 P262 L263 K264	E236-V238 PolarHBondContact O-N 2.93Å; V238-K240 HydrophobicContact CG2-CG 4.45Å; V238-P262 HydrophobicContact CB-CB 4.48Å; V238-P262 HydrophobicContact CG1-CB 4.47Å; V238-L263 CarbonylContact C-O 3.53Å; V238-L263 WeakPolarHBondContact CA-O 3.26Å; V238-K264 HydrophobicContact CG1-CG 3.83Å
239	R	91.2	Very high	80.4	Confident	142 Å²	142	84.4 Å²	84.4	54%	0.536	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.2	164.1	-176.7	66.8	-178.9	-164	2.6	108.9	I241 L263 V362 L366	R239-I241 PolarHBondContact O-N 3.25Å; R239-L263 PolarHBondContact N-O 2.89Å; R239-L263 PolarHBondContact O-N 3.45Å; R239-V362 HydrophobicContact CG-CG1 4.31Å; R239-L366 HydrophobicContact CB-CD1 3.65Å; R239-L366 HydrophobicContact CB-CD2 3.87Å; R239-L366 HydrophobicContact CB-CG 4.4Å; R239-L366 HydrophobicContact CG-CD1 4.17Å; R239-L366 HydrophobicContact CG-CD2 4.36Å
240	K	89.3	Confident	78.7	Confident	113 Å²	113	86.3 Å²	86.3	49%	0.491	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	106.1	175.8	-60.3	-175.7	-179.8	178.3	0	109.2	V238 Y260	V238-K240 HydrophobicContact CG2-CG 4.45Å; K240-Y260 HydrophobicContact CB-CD2 3.72Å; K240-Y260 HydrophobicContact CB-CE2 4.48Å; K240-Y260 HydrophobicContact CB-CG 3.81Å; K240-Y260 HydrophobicContact CD-CD1 4.1Å; K240-Y260 HydrophobicContact CD-CD2 3.79Å; K240-Y260 HydrophobicContact CD-CE1 4.09Å; K240-Y260 HydrophobicContact CD-CE2 3.75Å; K240-Y260 HydrophobicContact CD-CG 3.96Å; K240-Y260 HydrophobicContact CG-CD2 3.49Å; K240-Y260 VanDerWaalsContact CG-CD2 3.49Å; K240-Y260 HydrophobicContact CG-CE2 3.75Å; K240-Y260 HydrophobicContact CG-CG 3.95Å
241	I	88.2	Confident	76.8	Confident	1 Å²	1	89.4 Å²	89.4	1%	0.005	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	118.7	171.6	-63.3	178.6	0	0	0	107.9	R239 I243 Y260 L261 L263 V346 Y358 V362	R239-I241 PolarHBondContact O-N 3.25Å; I241-I243 PolarHBondContact O-N 3.02Å; I241-Y260 CarbonylContact O-C 3.56Å; I241-Y260 WeakPolarHBondContact O-CA 3.5Å; I241-L261 HydrophobicContact CB-CB 4.31Å; I241-L261 PolarHBondContact N-O 3Å; I241-L261 PolarHBondContact O-N 3.26Å; I241-L263 HydrophobicContact CD1-CD1 3.34Å; I241-L263 HydrophobicContact CD1-CG 3.95Å; I241-L263 HydrophobicContact CG1-CD1 4.31Å; I241-V346 HydrophobicContact CG2-CG1 4.05Å; I241-V346 HydrophobicContact CG2-CG2 3.93Å; I241-Y358 HydrophobicContact CD1-CE1 4.14Å; I241-Y358 HydrophobicContact CG2-CE1 3.93Å; I241-V362 HydrophobicContact CD1-CG1 4.16Å
242	P	87.4	Confident	75.3	Confident	63 Å²	63	97.5 Å²	97.5	41%	0.409	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	135.2	178.5	27.9	-33.9	0	0	0	110.5	P347	P242-P347 WeakPolarHBondContact O-CD 3.36Å
243	I	86.1	Confident	73.4	Confident	10 Å²	10	106.2 Å²	106.2	5%	0.051	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.2	173	59.7	170.3	0	0	0	109.5	I241 T259 L261 L339 Y345 V346	I241-I243 PolarHBondContact O-N 3.02Å; I243-T259 HydrophobicContact CD1-CG2 3.93Å; I243-T259 HydrophobicContact CG1-CG2 3.94Å; I243-T259 WeakPolarHBondContact CG1-O 3.1Å; I243-T259 PolarHBondContact N-O 3.49Å; I243-T259 VanDerWaalsContact O-O 3.04Å; I243-L261 HydrophobicContact CG2-CB 4.03Å; I243-L339 HydrophobicContact CD1-CD2 4.46Å; I243-L339 HydrophobicContact CG2-CD2 4.31Å; I243-Y345 WeakPolarHBondContact CA-O 3.49Å; I243-V346 HydrophobicContact CG2-CG2 4.28Å
244	Q	81.8	Confident	71.5	Confident	80 Å²	80	105.1 Å²	105.1	37%	0.374	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.7	173.4	-72.5	177.8	-5.4	0	0	109	S344 Y345 P347	Q244-S344 CarbonylContact O-C 3.51Å; Q244-S344 WeakPolarHBondContact O-CA 3.38Å; Q244-Y345 HydrophobicContact CB-CE1 4.39Å; Q244-Y345 HydrophobicContact CB-CE2 3.97Å; Q244-Y345 PolarHBondContact N-O 2.88Å; Q244-Y345 PolarHBondContact O-N 3.23Å; Q244-Y345 PolarHBondContact OE1-OH 3.3Å; Q244-P347 HydrophobicContact CB-CG 4.46Å; Q244-P347 HydrophobicContact CG-CG 3.8Å
245	Y	78.8	Confident	69.8	Low	124 Å²	124	107.4 Å²	107.4	49%	0.486	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.1	171.4	-67.3	-87.6	0	0	0	108.7	K247 T259 S344	Y245-K247 PolarHBondContact O-N 3.38Å; Y245-K247 VanDerWaalsContact O-N 3.16Å; Y245-T259 HydrophobicContact CE2-CG2 4.22Å; Y245-S344 WeakPolarHBondContact CD1-OG 3.17Å; Y245-S344 WeakPolarHBondContact CE1-OG 3.33Å
246	A	68.5	Low	68.4	Low	69 Å²	69	111.8 Å²	111.8	57%	0.57	58%	0.577	S	S	*	*	S	Bend	trans	-67.3	-11.1	179.2	0	0	0	0	0	113.9	G343 Y345	A246-G343 VanDerWaalsContact CB-O 3.28Å; A246-G343 WeakPolarHBondContact CB-O 3.5Å; A246-G343 PolarHBondContact N-O 3.28Å; A246-Y345 HydrophobicContact CB-CD1 4.08Å; A246-Y345 HydrophobicContact CB-CE1 3.79Å
247	K	58.8	Low	67.1	Low	192 Å²	192	116.9 Å²	116.9	84%	0.835	60%	0.601	S	S	*	*			trans	-122	90.4	-175.2	-102.3	-178.1	172	-179.5	0	111.6	Y245	Y245-K247 PolarHBondContact O-N 3.38Å; Y245-K247 VanDerWaalsContact O-N 3.16Å
248	K	55	Low	65.8	Low	204 Å²	204	118.5 Å²	118.5	89%	0.887	62%	0.615	S	S	*	*			trans	178.5	80.5	142.4	-100.2	178.8	-176.8	-171.1	0	109.4
249	Q	52.4	Low	65.3	Low	204 Å²	204	118.1 Å²	118.1	95%	0.953	61%	0.613	S	S	*	*			trans	-99.3	9.7	166.4	-107.6	-178.5	-21.4	0	0	112.5	A251	Q249-A251 PolarHBondContact O-N 2.82Å
250	T	51.2	Low	65.1	Low	131 Å²	131	116.6 Å²	116.6	80%	0.804	61%	0.608	S	S	*	*	S	Bend	trans	-92.5	104.5	178.2	-45	0	0	0	0	110.1
251	A	45.9	Very low	64.9	Low	87 Å²	87	112.8 Å²	112.8	72%	0.719	59%	0.592	S	S	*	*	S	Bend	trans	55.5	121.5	152.1	0	0	0	0	0	118.4	Q249	Q249-A251 PolarHBondContact O-N 2.82Å
252	Q	52.7	Low	64.8	Low	172 Å²	172	116.1 Å²	116.1	80%	0.804	61%	0.614	S	S	*	*	S	Bend	trans	90.6	91.8	157.9	-150.6	158.6	-10.6	0	0	116	L254	Q252-L254 PolarHBondContact O-N 2.93Å
253	R	45.8	Very low	64.8	Low	255 Å²	255	113.4 Å²	113.4	96%	0.962	60%	0.596	S	S	*	*			trans	17.5	44.6	142.4	-61.9	-174.1	174.7	-179.8	-1.1	119
254	L	46.4	Very low	64.7	Low	163 Å²	163	117.2 Å²	117.2	85%	0.853	61%	0.613	S	S	*	*			trans	-94.6	107.8	160.2	-81.2	134.7	0	0	0	105	Q252	Q252-L254 PolarHBondContact O-N 2.93Å
255	G	48.7	Very low	64.8	Low	66 Å²	66	114.4 Å²	114.4	68%	0.68	60%	0.601	S	S	*	*			trans	-44.2	145.6	-169	0	0	0	0	0	112.7	Q257	G255-Q257 PolarHBondContact O-N 3.48Å
256	S	50.7	Low	64.8	Low	108 Å²	108	108.7 Å²	108.7	76%	0.755	58%	0.579	S	S	*	*			trans	-56.5	75	163.5	171.1	0	0	0	0	109.1	A258	S256-A258 PolarHBondContact O-N 3.12Å
257	Q	54.7	Low	64.7	Low	178 Å²	178	106 Å²	106	83%	0.832	56%	0.556	S	S	*	*			trans	-66.9	90.2	157.2	-78.3	-165.9	-1.9	0	0	104	G255 T259	G255-Q257 PolarHBondContact O-N 3.48Å; Q257-T259 VanDerWaalsContact C-N 3.3Å; Q257-T259 PolarHBondContact O-N 3.48Å; Q257-T259 PolarHBondContact O-OG1 2.75Å
258	A	60.2	Low	65	Low	62 Å²	62	97 Å²	97	51%	0.512	52%	0.517	S	S	.	.			trans	-48.3	104.1	169.4	0	0	0	0	0	106.1	S256	S256-A258 PolarHBondContact O-N 3.12Å
259	T	78.1	Confident	66	Low	57 Å²	57	88.3 Å²	88.3	35%	0.35	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	147.5	174.7	-57.8	0	0	0	0	106	I243 Y245 Q257	I243-T259 HydrophobicContact CD1-CG2 3.93Å; I243-T259 HydrophobicContact CG1-CG2 3.94Å; I243-T259 WeakPolarHBondContact CG1-O 3.1Å; I243-T259 PolarHBondContact N-O 3.49Å; I243-T259 VanDerWaalsContact O-O 3.04Å; Y245-T259 HydrophobicContact CE2-CG2 4.22Å; Q257-T259 VanDerWaalsContact C-N 3.3Å; Q257-T259 PolarHBondContact O-N 3.48Å; Q257-T259 PolarHBondContact O-OG1 2.75Å
260	Y	86.1	Confident	66.9	Low	110 Å²	110	79.3 Å²	79.3	43%	0.431	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145.9	177.6	60.4	-89.9	0	0	0	110.1	K240 I241 P262	K240-Y260 HydrophobicContact CB-CD2 3.72Å; K240-Y260 HydrophobicContact CB-CE2 4.48Å; K240-Y260 HydrophobicContact CB-CG 3.81Å; K240-Y260 HydrophobicContact CD-CD1 4.1Å; K240-Y260 HydrophobicContact CD-CD2 3.79Å; K240-Y260 HydrophobicContact CD-CE1 4.09Å; K240-Y260 HydrophobicContact CD-CE2 3.75Å; K240-Y260 HydrophobicContact CD-CG 3.96Å; K240-Y260 HydrophobicContact CG-CD2 3.49Å; K240-Y260 VanDerWaalsContact CG-CD2 3.49Å; K240-Y260 HydrophobicContact CG-CE2 3.75Å; K240-Y260 HydrophobicContact CG-CG 3.95Å; I241-Y260 CarbonylContact O-C 3.56Å; I241-Y260 WeakPolarHBondContact O-CA 3.5Å; Y260-P262 HydrophobicContact CD2-CB 4.21Å; Y260-P262 HydrophobicContact CE2-CB 4.1Å; Y260-P262 HydrophobicContact CE2-CG 4.44Å; Y260-P262 VanDerWaalsContact O-CD 3.32Å; Y260-P262 WeakPolarHBondContact O-CD 3.19Å
261	L	85.1	Confident	68	Low	32 Å²	32	75.7 Å²	75.7	17%	0.168	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.5	166.2	179.6	65.8	0	0	0	107.8	I241 I243 L263 M335 L339	I241-L261 HydrophobicContact CB-CB 4.31Å; I241-L261 PolarHBondContact N-O 3Å; I241-L261 PolarHBondContact O-N 3.26Å; I243-L261 HydrophobicContact CG2-CB 4.03Å; L261-L263 PolarHBondContact O-N 3.25Å; L261-M335 HydrophobicContact CD2-CG 4.15Å; L261-M335 HydrophobicContact CD2-SD 3.66Å; L261-M335 HydrophobicContact CG-SD 4.46Å; L261-L339 HydrophobicContact CD2-CD1 4.2Å
262	P	87.4	Confident	69.6	Low	72 Å²	72	71.6 Å²	71.6	47%	0.468	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.8	178	29.3	-32	0	0	0	110.2	V238 Y260	V238-P262 HydrophobicContact CB-CB 4.48Å; V238-P262 HydrophobicContact CG1-CB 4.47Å; Y260-P262 HydrophobicContact CD2-CB 4.21Å; Y260-P262 HydrophobicContact CE2-CB 4.1Å; Y260-P262 HydrophobicContact CE2-CG 4.44Å; Y260-P262 VanDerWaalsContact O-CD 3.32Å; Y260-P262 WeakPolarHBondContact O-CD 3.19Å
263	L	87.1	Confident	70.9	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.026	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.5	165.9	-66.3	-173	0	0	0	109.2	V238 R239 I241 L261 V330 M335 I359 V362 L366	V238-L263 CarbonylContact C-O 3.53Å; V238-L263 WeakPolarHBondContact CA-O 3.26Å; R239-L263 PolarHBondContact N-O 2.89Å; R239-L263 PolarHBondContact O-N 3.45Å; I241-L263 HydrophobicContact CD1-CD1 3.34Å; I241-L263 HydrophobicContact CD1-CG 3.95Å; I241-L263 HydrophobicContact CG1-CD1 4.31Å; L261-L263 PolarHBondContact O-N 3.25Å; L263-V330 HydrophobicContact CD2-CG1 4.12Å; L263-M335 HydrophobicContact CD2-CE 4.01Å; L263-M335 HydrophobicContact CD2-SD 3.97Å; L263-I359 HydrophobicContact CD1-CG2 4.41Å; L263-V362 HydrophobicContact CD1-CG1 4.09Å; L263-L366 HydrophobicContact CB-CD1 3.98Å; L263-L366 HydrophobicContact CD1-CD1 4.48Å
264	K	83.3	Confident	72.2	Confident	91 Å²	91	52.7 Å²	52.7	40%	0.396	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.9	175.4	-68	179.9	179.4	-177.1	0	110.3	A237 V238 N266 S267	A237-K264 WeakPolarHBondContact O-CA 3.33Å; V238-K264 HydrophobicContact CG1-CG 3.83Å; K264-N266 PolarHBondContact O-N 2.79Å; K264-S267 PolarHBondContact O-N 2.9Å; K264-S267 PolarHBondContact O-OG 2.88Å; K264-S267 VanDerWaalsContact O-OG 3.12Å
265	V	83.3	Confident	73.6	Confident	20 Å²	20	45.7 Å²	45.7	12%	0.121	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-44.8	173.1	172.6	0	0	0	0	109.7	V234 A237 L366 V369	V234-V265 HydrophobicContact CG1-CG1 4.14Å; A237-V265 HydrophobicContact CB-CB 4.06Å; A237-V265 HydrophobicContact CB-CG2 3.5Å; A237-V265 VanDerWaalsContact CB-CG2 3.5Å; A237-V265 WeakPolarHBondContact O-CG2 3.23Å; A237-V265 PolarHBondContact O-N 3.39Å; V265-L366 HydrophobicContact CG2-CD2 4.22Å; V265-V369 HydrophobicContact CG1-CG1 4.46Å
266	N	79.7	Confident	75.1	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.027	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	86	168.5	-178.9	16.7	0	0	0	109.8	K264 A268 G269 L374	K264-N266 PolarHBondContact O-N 2.79Å; N266-A268 PolarHBondContact O-N 2.85Å; N266-A268 WeakPolarHBondContact OD1-CB 3.08Å; N266-A268 PolarHBondContact OD1-N 3.09Å; N266-G269 PolarHBondContact ND2-O 3.33Å; N266-G269 PolarHBondContact O-N 3.27Å; N266-G269 PolarHBondContact OD1-N 3.38Å; N266-L374 WeakPolarHBondContact ND2-CD1 3.24Å
267	S	67.1	Low	76.3	Confident	13 Å²	13	38.3 Å²	38.3	9%	0.091	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-35.4	174.7	-63.9	0	0	0	0	111.2	K264 G269 Q329 V330	K264-S267 PolarHBondContact O-N 2.9Å; K264-S267 PolarHBondContact O-OG 2.88Å; K264-S267 VanDerWaalsContact O-OG 3.12Å; S267-G269 VanDerWaalsContact C-N 3.28Å; S267-G269 PolarHBondContact O-N 2.99Å; S267-Q329 VanDerWaalsContact O-CD 3.25Å; S267-Q329 PolarHBondContact O-NE2 3.03Å; S267-Q329 PolarHBondContact O-OE1 3.09Å; S267-V330 WeakPolarHBondContact OG-CG2 3.09Å
268	A	64.8	Low	77.1	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.017	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-14	-172.9	0	0	0	0	0	115.7	N266 V270 P272 Y325 Q329	N266-A268 PolarHBondContact O-N 2.85Å; N266-A268 WeakPolarHBondContact OD1-CB 3.08Å; N266-A268 PolarHBondContact OD1-N 3.09Å; A268-V270 PolarHBondContact O-N 3.36Å; A268-P272 HydrophobicContact CB-CG 3.31Å; A268-P272 WeakPolarHBondContact O-CD 3.31Å; A268-Y325 VanDerWaalsContact CA-CD1 3.48Å; A268-Y325 HydrophobicContact CB-CD1 3.39Å; A268-Y325 HydrophobicContact CB-CE1 4.23Å; A268-Y325 HydrophobicContact CB-CG 4.14Å; A268-Q329 VanDerWaalsContact CA-OE1 3.3Å
269	G	74.6	Confident	77.9	Confident	22 Å²	22	33.5 Å²	33.5	23%	0.227	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-135.2	-176.2	0	0	0	0	0	111.4	N266 S267	N266-G269 PolarHBondContact ND2-O 3.33Å; N266-G269 PolarHBondContact O-N 3.27Å; N266-G269 PolarHBondContact OD1-N 3.38Å; S267-G269 VanDerWaalsContact C-N 3.28Å; S267-G269 PolarHBondContact O-N 2.99Å
270	V	73.1	Confident	77.8	Confident	15 Å²	15	31.1 Å²	31.1	9%	0.091	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-12.8	-176	-170.6	0	0	0	0	112.8	A268 P272 V273 I274 L402 I403	A268-V270 PolarHBondContact O-N 3.36Å; V270-P272 VanDerWaalsContact C-CD 3.48Å; V270-V273 PolarHBondContact O-N 3.37Å; V270-I274 HydrophobicContact CG1-CG1 4.46Å; V270-I274 PolarHBondContact O-N 2.71Å; V270-L402 HydrophobicContact CG1-CB 4.02Å; V270-L402 VanDerWaalsContact CG2-O 3.3Å; V270-L402 WeakPolarHBondContact CG2-O 3.22Å; V270-I403 HydrophobicContact CG1-CB 4.34Å; V270-I403 HydrophobicContact CG1-CG1 3.63Å
271	I	74.2	Confident	76.9	Confident	55 Å²	55	27.4 Å²	27.4	28%	0.282	15%	0.151	S	C	.	.	H	α-helix	trans	-55.9	-41.8	-172.7	-64	173	0	0	0	112.8	V273 I274 F275 Y325	I271-V273 VanDerWaalsContact C-N 3.28Å; I271-V273 PolarHBondContact O-N 3.06Å; I271-I274 WeakPolarHBondContact O-CB 3.44Å; I271-I274 PolarHBondContact O-N 2.98Å; I271-F275 HydrophobicContact CG2-CD1 3.97Å; I271-F275 HydrophobicContact CG2-CD2 4.04Å; I271-F275 HydrophobicContact CG2-CE1 3.32Å; I271-F275 HydrophobicContact CG2-CE2 3.48Å; I271-F275 VanDerWaalsContact CG2-CE2 3.48Å; I271-F275 HydrophobicContact CG2-CG 4.29Å; I271-F275 HydrophobicContact CG2-CZ 3.09Å; I271-F275 WeakPolarHBondContact O-CD1 3.29Å; I271-F275 WeakPolarHBondContact O-CG 3.43Å; I271-F275 PolarHBondContact O-N 3.38Å; I271-Y325 HydrophobicContact CB-CE1 4.3Å; I271-Y325 HydrophobicContact CB-CE2 4.29Å; I271-Y325 HydrophobicContact CD1-CE1 4.16Å; I271-Y325 HydrophobicContact CD1-CE2 4.4Å; I271-Y325 WeakPolarHBondContact CD1-OH 3.34Å; I271-Y325 HydrophobicContact CG2-CD2 3.98Å; I271-Y325 HydrophobicContact CG2-CE1 4.45Å; I271-Y325 HydrophobicContact CG2-CE2 3.58Å
272	P	79.1	Confident	76.3	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.2	-36.5	175.7	-28.8	36.1	0	0	0	115	A268 V270 F275 A276 F321 T322 Y325	A268-P272 HydrophobicContact CB-CG 3.31Å; A268-P272 WeakPolarHBondContact O-CD 3.31Å; V270-P272 VanDerWaalsContact C-CD 3.48Å; P272-F275 PolarHBondContact O-N 2.98Å; P272-A276 WeakPolarHBondContact O-CB 3.22Å; P272-A276 PolarHBondContact O-N 3.21Å; P272-F321 HydrophobicContact CB-CB 4.08Å; P272-T322 WeakPolarHBondContact CB-OG1 3.23Å; P272-Y325 HydrophobicContact CG-CG 4.45Å
273	V	78.6	Confident	75.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-71.3	-39.7	-179	-172.9	0	0	0	0	109.7	V270 I271 F275 A276 M277 Y314 I318 L374 T399 L402	V270-V273 PolarHBondContact O-N 3.37Å; I271-V273 VanDerWaalsContact C-N 3.28Å; I271-V273 PolarHBondContact O-N 3.06Å; V273-F275 VanDerWaalsContact C-N 3.28Å; V273-F275 PolarHBondContact O-N 2.94Å; V273-A276 PolarHBondContact O-N 3.31Å; V273-M277 WeakPolarHBondContact O-CB 3.36Å; V273-M277 PolarHBondContact O-N 3.1Å; V273-Y314 WeakPolarHBondContact CG1-OH 3.38Å; V273-I318 HydrophobicContact CG2-CG2 4.45Å; V273-L374 HydrophobicContact CG2-CB 4.44Å; V273-L374 HydrophobicContact CG2-CD1 4.36Å; V273-L374 HydrophobicContact CG2-CD2 4.27Å; V273-T399 HydrophobicContact CG1-CG2 3.7Å; V273-L402 HydrophobicContact CG1-CD1 4.4Å; V273-L402 HydrophobicContact CG2-CD1 4.19Å
274	I	73.7	Confident	74.4	Confident	31 Å²	31	30.5 Å²	30.5	16%	0.159	16%	0.161	C	C	.	.	H	α-helix	trans	-59.6	-43	172.5	-58.1	173.2	0	0	0	110	I79 V270 I271 M277 A278 I403	I79-I274 HydrophobicContact CG2-CG2 3.84Å; V270-I274 HydrophobicContact CG1-CG1 4.46Å; V270-I274 PolarHBondContact O-N 2.71Å; I271-I274 WeakPolarHBondContact O-CB 3.44Å; I271-I274 PolarHBondContact O-N 2.98Å; I274-M277 PolarHBondContact O-N 3.35Å; I274-A278 WeakPolarHBondContact O-CB 3.33Å; I274-A278 PolarHBondContact O-N 3.17Å; I274-I403 HydrophobicContact CD1-CD1 4.29Å; I274-I403 HydrophobicContact CD1-CG1 4.11Å; I274-I403 HydrophobicContact CG1-CD1 3.88Å; I274-I403 HydrophobicContact CG1-CG1 3.96Å
275	F	75.6	Confident	73.6	Confident	16 Å²	16	28.7 Å²	28.7	7%	0.07	16%	0.158	C	C	.	.	H	α-helix	trans	-69.3	-44.2	-179.5	-67.2	0.8	0	0	0	112	I83 I271 P272 V273 M277 A278 F279 F321 Y325	I83-F275 HydrophobicContact CB-CE1 4.3Å; I83-F275 HydrophobicContact CB-CZ 4.36Å; I83-F275 HydrophobicContact CD1-CD1 3.38Å; I83-F275 HydrophobicContact CD1-CE1 3.51Å; I83-F275 HydrophobicContact CD1-CG 4.25Å; I83-F275 HydrophobicContact CD1-CZ 4.38Å; I83-F275 HydrophobicContact CG1-CD1 3.38Å; I83-F275 HydrophobicContact CG1-CE1 3.01Å; I83-F275 HydrophobicContact CG1-CE2 4.21Å; I83-F275 HydrophobicContact CG1-CG 4.17Å; I83-F275 HydrophobicContact CG1-CZ 3.44Å; I83-F275 VanDerWaalsContact CG1-CZ 3.44Å; I271-F275 HydrophobicContact CG2-CD1 3.97Å; I271-F275 HydrophobicContact CG2-CD2 4.04Å; I271-F275 HydrophobicContact CG2-CE1 3.32Å; I271-F275 HydrophobicContact CG2-CE2 3.48Å; I271-F275 VanDerWaalsContact CG2-CE2 3.48Å; I271-F275 HydrophobicContact CG2-CG 4.29Å; I271-F275 HydrophobicContact CG2-CZ 3.09Å; I271-F275 WeakPolarHBondContact O-CD1 3.29Å; I271-F275 WeakPolarHBondContact O-CG 3.43Å; I271-F275 PolarHBondContact O-N 3.38Å; P272-F275 PolarHBondContact O-N 2.98Å; V273-F275 VanDerWaalsContact C-N 3.28Å; V273-F275 PolarHBondContact O-N 2.94Å; F275-M277 VanDerWaalsContact C-N 3.26Å; F275-M277 PolarHBondContact O-N 2.98Å; F275-A278 PolarHBondContact O-N 3.39Å; F275-F279 VanDerWaalsContact O-CB 3.29Å; F275-F279 WeakPolarHBondContact O-CB 3.38Å; F275-F279 PolarHBondContact O-N 2.97Å; F275-F321 HydrophobicContact CB-CB 4.44Å; F275-F321 HydrophobicContact CB-CD1 4.08Å; F275-F321 HydrophobicContact CB-CD2 4.28Å; F275-F321 HydrophobicContact CB-CE1 4.41Å; F275-F321 HydrophobicContact CB-CG 4.02Å; F275-F321 HydrophobicContact CD2-CD1 4.48Å; F275-Y325 HydrophobicContact CD2-CD2 4.43Å; F275-Y325 AromaticContact CE2-CD2 3.75Å; F275-Y325 HydrophobicContact CE2-CD2 3.75Å; F275-Y325 HydrophobicContact CE2-CE2 4Å; F275-Y325 HydrophobicContact CZ-CE2 4.33Å
276	A	80.9	Confident	72.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.5	-44.5	174.3	0	0	0	0	0	110.6	P272 V273 F280 Y314 L317 I318 F321	P272-A276 WeakPolarHBondContact O-CB 3.22Å; P272-A276 PolarHBondContact O-N 3.21Å; V273-A276 PolarHBondContact O-N 3.31Å; A276-F280 WeakPolarHBondContact O-CB 3.28Å; A276-F280 PolarHBondContact O-N 3.46Å; A276-Y314 HydrophobicContact CB-CD2 4.41Å; A276-Y314 HydrophobicContact CB-CE2 4.01Å; A276-L317 HydrophobicContact CB-CB 3.93Å; A276-I318 HydrophobicContact CB-CB 4.38Å; A276-I318 HydrophobicContact CB-CG1 3.63Å; A276-F321 HydrophobicContact CB-CD2 3.94Å
277	M	75.5	Confident	71.9	Confident	18 Å²	18	31.9 Å²	31.9	9%	0.089	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-45.8	179	-167.2	63.6	-176.5	0	0	112.4	L56 V273 I274 F275 F279 F280 L281 P305 Y314	L56-M277 HydrophobicContact CD1-CE 4.27Å; L56-M277 HydrophobicContact CD2-CE 3.26Å; L56-M277 HydrophobicContact CD2-CG 3.83Å; L56-M277 HydrophobicContact CD2-SD 4.38Å; L56-M277 HydrophobicContact CG-CE 4.29Å; V273-M277 WeakPolarHBondContact O-CB 3.36Å; V273-M277 PolarHBondContact O-N 3.1Å; I274-M277 PolarHBondContact O-N 3.35Å; F275-M277 VanDerWaalsContact C-N 3.26Å; F275-M277 PolarHBondContact O-N 2.98Å; M277-F279 VanDerWaalsContact C-N 3.3Å; M277-F279 PolarHBondContact O-N 3.22Å; M277-F280 PolarHBondContact O-N 3.17Å; M277-L281 HydrophobicContact CE-CD1 4.37Å; M277-L281 HydrophobicContact CE-CD2 4.33Å; M277-L281 HydrophobicContact CE-CG 4.37Å; M277-L281 HydrophobicContact CG-CD1 4.13Å; M277-L281 WeakPolarHBondContact O-CD1 3.43Å; M277-L281 VanDerWaalsContact O-CG 3.24Å; M277-L281 WeakPolarHBondContact O-CG 2.99Å; M277-L281 PolarHBondContact O-N 3.12Å; M277-P305 HydrophobicContact CE-CG 4.23Å; M277-Y314 HydrophobicContact CB-CE2 4.19Å; M277-Y314 HydrophobicContact SD-CE2 3.89Å
278	A	72.1	Confident	71.4	Confident	34 Å²	34	34 Å²	34	28%	0.281	19%	0.185	S	C	.	.	H	α-helix	trans	-59.2	-44.2	177.3	0	0	0	0	0	111.1	I83 I274 F275 L281 L282	I83-A278 HydrophobicContact CD1-CB 4.47Å; I274-A278 WeakPolarHBondContact O-CB 3.33Å; I274-A278 PolarHBondContact O-N 3.17Å; F275-A278 PolarHBondContact O-N 3.39Å; A278-L281 PolarHBondContact O-N 2.9Å; A278-L282 WeakPolarHBondContact O-CG 3.37Å; A278-L282 PolarHBondContact O-N 3Å
279	F	76.2	Confident	71.3	Confident	106 Å²	106	40.2 Å²	40.2	47%	0.465	21%	0.212	S	C	.	.	H	α-helix	trans	-66	-41.2	176.1	-163.9	-89.6	0	0	0	111.9	F275 M277 L281 L282 P283 L317 F321	F275-F279 VanDerWaalsContact O-CB 3.29Å; F275-F279 WeakPolarHBondContact O-CB 3.38Å; F275-F279 PolarHBondContact O-N 2.97Å; M277-F279 VanDerWaalsContact C-N 3.3Å; M277-F279 PolarHBondContact O-N 3.22Å; F279-L281 PolarHBondContact O-N 2.96Å; F279-L282 HydrophobicContact CD2-CD1 3.71Å; F279-L282 HydrophobicContact CE2-CD1 4.07Å; F279-L282 HydrophobicContact CG-CD1 4.24Å; F279-L282 WeakPolarHBondContact O-CB 3.39Å; F279-L282 PolarHBondContact O-N 3.13Å; F279-L282 VanDerWaalsContact O-N 3.13Å; F279-P283 WeakPolarHBondContact O-CD 3.34Å; F279-L317 HydrophobicContact CD1-CD1 4.01Å; F279-L317 HydrophobicContact CD1-CD2 3.7Å; F279-L317 HydrophobicContact CE1-CD2 4.1Å; F279-F321 HydrophobicContact CB-CE2 3.78Å; F279-F321 HydrophobicContact CB-CZ 3.95Å; F279-F321 HydrophobicContact CD2-CZ 4.05Å; F279-F321 HydrophobicContact CG-CE2 4.09Å; F279-F321 AromaticContact CG-CZ 4Å; F279-F321 HydrophobicContact CG-CZ 4Å
280	F	76.6	Confident	71.1	Confident	7 Å²	7	45 Å²	45	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-27.1	176.9	-171.3	-96.5	0	0	0	112.8	A276 M277 P283 A303 P305 G310 V313 Y314 L317	A276-F280 WeakPolarHBondContact O-CB 3.28Å; A276-F280 PolarHBondContact O-N 3.46Å; M277-F280 PolarHBondContact O-N 3.17Å; F280-P283 WeakPolarHBondContact O-CD 3.45Å; F280-A303 HydrophobicContact CE1-CB 4.45Å; F280-A303 WeakPolarHBondContact CE1-O 3.47Å; F280-A303 VanDerWaalsContact CZ-C 3.43Å; F280-A303 HydrophobicContact CZ-CB 4.41Å; F280-P305 HydrophobicContact CD1-CG 4.17Å; F280-P305 HydrophobicContact CE1-CB 4.26Å; F280-P305 HydrophobicContact CE1-CG 3.56Å; F280-P305 HydrophobicContact CZ-CG 4.37Å; F280-G310 WeakPolarHBondContact CE2-O 3.46Å; F280-V313 HydrophobicContact CD2-CG1 4.25Å; F280-V313 HydrophobicContact CE2-CB 4.28Å; F280-V313 HydrophobicContact CE2-CG1 4.22Å; F280-Y314 HydrophobicContact CB-CD2 4.32Å; F280-Y314 HydrophobicContact CD2-CD2 4.45Å; F280-Y314 HydrophobicContact CG-CD2 4.28Å; F280-L317 HydrophobicContact CB-CD1 4.12Å; F280-L317 HydrophobicContact CD2-CD1 4.07Å
281	L	67.3	Low	70.7	Confident	32 Å²	32	46.9 Å²	46.9	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-83.9	-19.5	175.4	-68.3	162.2	0	0	0	113.8	A53 L56 M277 A278 F279 P283 R284 T285	A53-L281 HydrophobicContact CB-CD2 3.68Å; L56-L281 HydrophobicContact CD2-CD1 3.39Å; L56-L281 HydrophobicContact CD2-CD2 4.28Å; L56-L281 HydrophobicContact CD2-CG 4.34Å; M277-L281 HydrophobicContact CE-CD1 4.37Å; M277-L281 HydrophobicContact CE-CD2 4.33Å; M277-L281 HydrophobicContact CE-CG 4.37Å; M277-L281 HydrophobicContact CG-CD1 4.13Å; M277-L281 WeakPolarHBondContact O-CD1 3.43Å; M277-L281 VanDerWaalsContact O-CG 3.24Å; M277-L281 WeakPolarHBondContact O-CG 2.99Å; M277-L281 PolarHBondContact O-N 3.12Å; A278-L281 PolarHBondContact O-N 2.9Å; F279-L281 PolarHBondContact O-N 2.96Å; L281-P283 VanDerWaalsContact C-CD 3.48Å; L281-R284 WeakPolarHBondContact O-CA 3.43Å; L281-R284 WeakPolarHBondContact O-CB 2.83Å; L281-R284 PolarHBondContact O-N 3.37Å; L281-T285 PolarHBondContact O-N 3.15Å; L281-T285 VanDerWaalsContact O-N 3.08Å
282	L	72.2	Confident	70.3	Confident	85 Å²	85	51.4 Å²	51.4	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-54.1	-44.2	-179.5	-69.6	176.1	0	0	0	113	A278 F279 R284 T285 L286	A278-L282 WeakPolarHBondContact O-CG 3.37Å; A278-L282 PolarHBondContact O-N 3Å; F279-L282 HydrophobicContact CD2-CD1 3.71Å; F279-L282 HydrophobicContact CE2-CD1 4.07Å; F279-L282 HydrophobicContact CG-CD1 4.24Å; F279-L282 WeakPolarHBondContact O-CB 3.39Å; F279-L282 PolarHBondContact O-N 3.13Å; F279-L282 VanDerWaalsContact O-N 3.13Å; L282-R284 VanDerWaalsContact C-N 3.25Å; L282-R284 PolarHBondContact O-N 3.24Å; L282-T285 WeakPolarHBondContact O-CA 3.48Å; L282-T285 WeakPolarHBondContact O-CB 3.47Å; L282-T285 PolarHBondContact O-N 2.97Å; L282-T285 PolarHBondContact O-OG1 3.21Å; L282-L286 PolarHBondContact O-N 3.12Å
283	P	69.6	Low	70	Confident	36 Å²	36	56.9 Å²	56.9	23%	0.234	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-32.9	177.9	-19	31.2	0	0	0	112.7	F279 F280 L281 T285 L286 I299 A303	F279-P283 WeakPolarHBondContact O-CD 3.34Å; F280-P283 WeakPolarHBondContact O-CD 3.45Å; L281-P283 VanDerWaalsContact C-CD 3.48Å; P283-T285 PolarHBondContact O-N 2.89Å; P283-L286 VanDerWaalsContact O-CB 3.29Å; P283-L286 WeakPolarHBondContact O-CB 3.24Å; P283-L286 PolarHBondContact O-N 2.92Å; P283-I299 HydrophobicContact CB-CG2 3.31Å; P283-I299 HydrophobicContact CG-CG2 4.45Å; P283-A303 HydrophobicContact CB-CB 4.28Å; P283-A303 HydrophobicContact CG-CB 4.48Å
284	R	65.3	Low	69.9	Low	52 Å²	52	64.2 Å²	64.2	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-69.8	-21.7	171.9	-172.6	171.4	173.1	161.6	-1	112.4	S50 A53 L281 L282 L286 T287 A300	S50-R284 PolarHBondContact OG-NH2 3.04Å; A53-R284 VanDerWaalsContact CB-CD 3.42Å; L281-R284 WeakPolarHBondContact O-CA 3.43Å; L281-R284 WeakPolarHBondContact O-CB 2.83Å; L281-R284 PolarHBondContact O-N 3.37Å; L282-R284 VanDerWaalsContact C-N 3.25Å; L282-R284 PolarHBondContact O-N 3.24Å; R284-L286 VanDerWaalsContact C-N 3.27Å; R284-T287 PolarHBondContact O-OG1 3.39Å; R284-A300 HydrophobicContact CB-CB 4.45Å; R284-A300 HydrophobicContact CG-CB 4.37Å
285	T	65.1	Low	70.1	Confident	54 Å²	54	68.8 Å²	68.8	33%	0.331	34%	0.335	S	S	.	.	H	α-helix	trans	-71.1	-23.7	168.3	72.3	0	0	0	0	112.5	L281 L282 P283 T287 L288 F289	L281-T285 PolarHBondContact O-N 3.15Å; L281-T285 VanDerWaalsContact O-N 3.08Å; L282-T285 WeakPolarHBondContact O-CA 3.48Å; L282-T285 WeakPolarHBondContact O-CB 3.47Å; L282-T285 PolarHBondContact O-N 2.97Å; L282-T285 PolarHBondContact O-OG1 3.21Å; P283-T285 PolarHBondContact O-N 2.89Å; T285-T287 VanDerWaalsContact C-N 3.32Å; T285-T287 PolarHBondContact O-N 3.48Å; T285-L288 HydrophobicContact CG2-CD1 4.11Å; T285-L288 WeakPolarHBondContact O-CB 3.27Å; T285-L288 WeakPolarHBondContact O-CD1 3.27Å; T285-L288 WeakPolarHBondContact O-CG 3.44Å; T285-L288 PolarHBondContact O-N 3.36Å; T285-F289 WeakPolarHBondContact O-CD2 3.41Å
286	L	63.8	Low	69.8	Low	70 Å²	70	68.1 Å²	68.1	37%	0.366	33%	0.332	S	S	.	.	H	α-helix	trans	-70.2	-30.3	176	-61.5	173.8	0	0	0	112.2	L282 P283 R284 L288 F289 Y290	L282-L286 PolarHBondContact O-N 3.12Å; P283-L286 VanDerWaalsContact O-CB 3.29Å; P283-L286 WeakPolarHBondContact O-CB 3.24Å; P283-L286 PolarHBondContact O-N 2.92Å; R284-L286 VanDerWaalsContact C-N 3.27Å; L286-L288 PolarHBondContact O-N 3.04Å; L286-F289 PolarHBondContact O-N 3.19Å; L286-Y290 PolarHBondContact O-N 3.34Å
287	T	63.6	Low	69.2	Low	21 Å²	21	72.8 Å²	72.8	13%	0.129	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-14.6	170.7	55.2	0	0	0	0	113.1	R284 T285 F289 A296 A300	R284-T287 PolarHBondContact O-OG1 3.39Å; T285-T287 VanDerWaalsContact C-N 3.32Å; T285-T287 PolarHBondContact O-N 3.48Å; T287-F289 VanDerWaalsContact C-N 3.34Å; T287-A296 HydrophobicContact CG2-CB 3.9Å; T287-A296 WeakPolarHBondContact CG2-O 3.29Å; T287-A300 HydrophobicContact CG2-CB 3.44Å; T287-A300 VanDerWaalsContact CG2-CB 3.44Å
288	L	57.1	Low	69	Low	57 Å²	57	76.7 Å²	76.7	30%	0.298	38%	0.375	S	S	.	.	H	α-helix	trans	-72	-31.3	172.1	-51.1	168.5	0	0	0	111.6	Q132 T285 L286	Q132-L288 HydrophobicContact CB-CD2 3.89Å; Q132-L288 VanDerWaalsContact CD-CD2 3.45Å; Q132-L288 HydrophobicContact CG-CD2 3.37Å; Q132-L288 PolarHBondContact OE1-O 3.38Å; T285-L288 HydrophobicContact CG2-CD1 4.11Å; T285-L288 WeakPolarHBondContact O-CB 3.27Å; T285-L288 WeakPolarHBondContact O-CD1 3.27Å; T285-L288 WeakPolarHBondContact O-CG 3.44Å; T285-L288 PolarHBondContact O-N 3.36Å; L286-L288 PolarHBondContact O-N 3.04Å
289	F	64.1	Low	69	Low	133 Å²	133	78.4 Å²	78.4	58%	0.583	38%	0.379	S	S	*	.	H	α-helix	trans	-93.2	-28.6	-179	-63	-75.3	0	0	0	112.6	T285 L286 T287	T285-F289 WeakPolarHBondContact O-CD2 3.41Å; L286-F289 PolarHBondContact O-N 3.19Å; T287-F289 VanDerWaalsContact C-N 3.34Å
290	Y	70.2	Confident	68.6	Low	123 Å²	123	74 Å²	74	48%	0.482	36%	0.362	S	S	.	.			trans	-130.7	68.2	-177.2	-57.6	-77	0	0	0	111.8	L286 D292 W295 A296	L286-Y290 PolarHBondContact O-N 3.34Å; Y290-D292 VanDerWaalsContact C-N 3.32Å; Y290-D292 PolarHBondContact O-N 3.29Å; Y290-W295 HydrophobicContact CD2-CH2 4.18Å; Y290-W295 HydrophobicContact CD2-CZ2 4.09Å; Y290-W295 HydrophobicContact CG-CZ2 4.18Å; Y290-A296 WeakPolarHBondContact O-CB 3.21Å
291	P	63.7	Low	68.2	Low	54 Å²	54	78.6 Å²	78.6	35%	0.351	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-34.8	-176.5	24.7	-33.6	0	0	0	113.2	K293 Q297	P291-K293 VanDerWaalsContact C-N 3.32Å; P291-K293 PolarHBondContact O-N 2.84Å; P291-Q297 PolarHBondContact O-NE2 3.07Å
292	D	66.4	Low	68.2	Low	150 Å²	150	79.3 Å²	79.3	80%	0.802	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.9	-172.4	-53.9	-40.2	0	0	0	114.1	Y290	Y290-D292 VanDerWaalsContact C-N 3.32Å; Y290-D292 PolarHBondContact O-N 3.29Å
293	K	73.4	Confident	67.9	Low	115 Å²	115	75.8 Å²	75.8	50%	0.5	38%	0.38	S	S	.	.			trans	-96.4	119.2	-175.7	-65.2	-60.7	-176	-172.8	0	111	P291 W295 A296 Q297	P291-K293 VanDerWaalsContact C-N 3.32Å; P291-K293 PolarHBondContact O-N 2.84Å; K293-W295 HydrophobicContact CB-CG 4.3Å; K293-W295 VanDerWaalsContact CB-NE1 3.34Å; K293-W295 PolarHBondContact O-N 3.3Å; K293-A296 HydrophobicContact CB-CB 4.24Å; K293-A296 WeakPolarHBondContact O-CB 3.3Å; K293-A296 PolarHBondContact O-N 2.97Å; K293-Q297 PolarHBondContact O-N 2.91Å; K293-Q297 VanDerWaalsContact O-N 3.15Å
294	E	75.9	Confident	67.7	Low	155 Å²	155	76.8 Å²	76.8	72%	0.724	38%	0.383	S	S	*	.	H	α-helix	trans	-53.5	-39.2	176.7	-67.4	-176	172	0	0	112.6	A296 Q297 N298	E294-A296 VanDerWaalsContact C-N 3.28Å; E294-A296 PolarHBondContact O-N 3.32Å; E294-Q297 PolarHBondContact O-N 3.46Å; E294-N298 VanDerWaalsContact O-CB 3.31Å; E294-N298 WeakPolarHBondContact O-CB 3.48Å; E294-N298 PolarHBondContact O-N 2.9Å; E294-N298 PolarHBondContact O-ND2 2.96Å
295	W	78.2	Confident	67.6	Low	127 Å²	127	75.6 Å²	75.6	48%	0.481	38%	0.382	S	S	.	.	H	α-helix	trans	-61.2	-37.9	177.7	70.3	-99.1	0	0	0	112.1	Y290 K293 I299	Y290-W295 HydrophobicContact CD2-CH2 4.18Å; Y290-W295 HydrophobicContact CD2-CZ2 4.09Å; Y290-W295 HydrophobicContact CG-CZ2 4.18Å; K293-W295 HydrophobicContact CB-CG 4.3Å; K293-W295 VanDerWaalsContact CB-NE1 3.34Å; K293-W295 PolarHBondContact O-N 3.3Å; W295-I299 HydrophobicContact CE3-CD1 3.71Å; W295-I299 HydrophobicContact CZ3-CD1 4.04Å; W295-I299 WeakPolarHBondContact O-CB 3.41Å; W295-I299 VanDerWaalsContact O-CG1 3.22Å; W295-I299 WeakPolarHBondContact O-CG1 2.88Å; W295-I299 PolarHBondContact O-N 2.88Å
296	A	68.7	Low	67.5	Low	1 Å²	1	74.8 Å²	74.8	1%	0.008	38%	0.379	C	S	.	.	H	α-helix	trans	-70.9	-43	179.3	0	0	0	0	0	110.3	T287 Y290 K293 E294 I299 A300	T287-A296 HydrophobicContact CG2-CB 3.9Å; T287-A296 WeakPolarHBondContact CG2-O 3.29Å; Y290-A296 WeakPolarHBondContact O-CB 3.21Å; K293-A296 HydrophobicContact CB-CB 4.24Å; K293-A296 WeakPolarHBondContact O-CB 3.3Å; K293-A296 PolarHBondContact O-N 2.97Å; E294-A296 VanDerWaalsContact C-N 3.28Å; E294-A296 PolarHBondContact O-N 3.32Å; A296-I299 PolarHBondContact O-N 2.85Å; A296-A300 PolarHBondContact O-N 2.89Å
297	Q	67.6	Low	67.9	Low	98 Å²	98	73.5 Å²	73.5	46%	0.458	38%	0.376	S	S	.	.	H	α-helix	trans	-64.8	-40.9	176.2	-63.7	-171.4	17.4	0	0	112	P291 K293 E294 I299 A300 N301	P291-Q297 PolarHBondContact O-NE2 3.07Å; K293-Q297 PolarHBondContact O-N 2.91Å; K293-Q297 VanDerWaalsContact O-N 3.15Å; E294-Q297 PolarHBondContact O-N 3.46Å; Q297-I299 VanDerWaalsContact C-N 3.34Å; Q297-I299 PolarHBondContact O-N 3.32Å; Q297-A300 PolarHBondContact O-N 3.43Å; Q297-N301 WeakPolarHBondContact O-CB 3.28Å; Q297-N301 PolarHBondContact O-N 2.85Å; Q297-N301 PolarHBondContact O-ND2 3.37Å
298	N	71.2	Confident	68.6	Low	101 Å²	101	77.4 Å²	77.4	54%	0.54	40%	0.396	S	S	.	.	H	α-helix	trans	-62.1	-42.5	176	-72.7	-18.7	0	0	0	111.6	E294 N301 A302	E294-N298 VanDerWaalsContact O-CB 3.31Å; E294-N298 WeakPolarHBondContact O-CB 3.48Å; E294-N298 PolarHBondContact O-N 2.9Å; E294-N298 PolarHBondContact O-ND2 2.96Å; N298-N301 PolarHBondContact O-N 3.31Å; N298-A302 WeakPolarHBondContact O-CB 3.49Å; N298-A302 PolarHBondContact O-N 3.32Å
299	I	72	Confident	69.7	Low	70 Å²	70	79.1 Å²	79.1	36%	0.359	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-42.4	174.4	-72.6	175.6	0	0	0	111.2	P283 W295 A296 Q297 A302 A303	P283-I299 HydrophobicContact CB-CG2 3.31Å; P283-I299 HydrophobicContact CG-CG2 4.45Å; W295-I299 HydrophobicContact CE3-CD1 3.71Å; W295-I299 HydrophobicContact CZ3-CD1 4.04Å; W295-I299 WeakPolarHBondContact O-CB 3.41Å; W295-I299 VanDerWaalsContact O-CG1 3.22Å; W295-I299 WeakPolarHBondContact O-CG1 2.88Å; W295-I299 PolarHBondContact O-N 2.88Å; A296-I299 PolarHBondContact O-N 2.85Å; Q297-I299 VanDerWaalsContact C-N 3.34Å; Q297-I299 PolarHBondContact O-N 3.32Å; I299-A302 PolarHBondContact O-N 2.81Å; I299-A303 VanDerWaalsContact O-CB 3.26Å; I299-A303 WeakPolarHBondContact O-CB 3.45Å; I299-A303 PolarHBondContact O-N 3.31Å
300	A	67.8	Low	70.4	Confident	14 Å²	14	72.8 Å²	72.8	12%	0.116	38%	0.381	C	S	.	.	H	α-helix	trans	-67.8	-35.7	177.1	0	0	0	0	0	113.1	R284 T287 A296 Q297 A303 N304	R284-A300 HydrophobicContact CB-CB 4.45Å; R284-A300 HydrophobicContact CG-CB 4.37Å; T287-A300 HydrophobicContact CG2-CB 3.44Å; T287-A300 VanDerWaalsContact CG2-CB 3.44Å; A296-A300 PolarHBondContact O-N 2.89Å; Q297-A300 PolarHBondContact O-N 3.43Å; A300-A303 CarbonylContact O-C 3.42Å; A300-A303 VanDerWaalsContact O-C 3.27Å; A300-A303 PolarHBondContact O-N 3.4Å; A300-N304 PolarHBondContact O-N 3.22Å
301	N	68.3	Low	70.9	Confident	103 Å²	103	67.8 Å²	67.8	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-69	-37.6	175.2	-71.2	-24.1	0	0	0	111.3	Q297 N298 A303 N304	Q297-N301 WeakPolarHBondContact O-CB 3.28Å; Q297-N301 PolarHBondContact O-N 2.85Å; Q297-N301 PolarHBondContact O-ND2 3.37Å; N298-N301 PolarHBondContact O-N 3.31Å; N301-A303 VanDerWaalsContact C-N 3.33Å; N301-N304 WeakPolarHBondContact O-CB 3.36Å; N301-N304 PolarHBondContact O-N 3Å
302	A	68	Low	72	Confident	47 Å²	47	69.5 Å²	69.5	39%	0.388	37%	0.372	S	S	.	.	H	α-helix	trans	-66.7	-35.4	170.5	0	0	0	0	0	111.8	N298 I299 N304 G310	N298-A302 WeakPolarHBondContact O-CB 3.49Å; N298-A302 PolarHBondContact O-N 3.32Å; I299-A302 PolarHBondContact O-N 2.81Å; A302-N304 PolarHBondContact O-N 3.36Å; A302-N304 VanDerWaalsContact O-N 3.14Å; A302-G310 VanDerWaalsContact O-CA 3.22Å; A302-G310 WeakPolarHBondContact O-CA 3.3Å
303	A	66.1	Low	73	Confident	10 Å²	10	65.7 Å²	65.7	8%	0.083	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	31.9	173.7	0	0	0	0	0	113.3	F280 P283 I299 A300 N301	F280-A303 HydrophobicContact CE1-CB 4.45Å; F280-A303 WeakPolarHBondContact CE1-O 3.47Å; F280-A303 VanDerWaalsContact CZ-C 3.43Å; F280-A303 HydrophobicContact CZ-CB 4.41Å; P283-A303 HydrophobicContact CB-CB 4.28Å; P283-A303 HydrophobicContact CG-CB 4.48Å; I299-A303 VanDerWaalsContact O-CB 3.26Å; I299-A303 WeakPolarHBondContact O-CB 3.45Å; I299-A303 PolarHBondContact O-N 3.31Å; A300-A303 CarbonylContact O-C 3.42Å; A300-A303 VanDerWaalsContact O-C 3.27Å; A300-A303 PolarHBondContact O-N 3.4Å; N301-A303 VanDerWaalsContact C-N 3.33Å
304	N	66.2	Low	73.4	Confident	57 Å²	57	60.3 Å²	60.3	31%	0.305	33%	0.33	S	S	.	.			trans	-99	122	167.1	-170.6	-22.9	0	0	0	108.9	A300 N301 A302 S306 S307	A300-N304 PolarHBondContact O-N 3.22Å; N301-N304 WeakPolarHBondContact O-CB 3.36Å; N301-N304 PolarHBondContact O-N 3Å; A302-N304 PolarHBondContact O-N 3.36Å; A302-N304 VanDerWaalsContact O-N 3.14Å; N304-S306 PolarHBondContact O-N 2.87Å; N304-S306 WeakPolarHBondContact OD1-CB 3.15Å; N304-S306 PolarHBondContact OD1-N 2.9Å; N304-S306 VanDerWaalsContact OD1-N 3.1Å; N304-S306 PolarHBondContact OD1-OG 2.69Å; N304-S307 WeakPolarHBondContact O-CB 3.3Å; N304-S307 PolarHBondContact O-N 3.45Å
305	P	61.8	Low	74	Confident	27 Å²	27	55 Å²	55	18%	0.175	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22	-179	-18.6	30.9	0	0	0	113.1	M277 F280 I382	M277-P305 HydrophobicContact CE-CG 4.23Å; F280-P305 HydrophobicContact CD1-CG 4.17Å; F280-P305 HydrophobicContact CE1-CB 4.26Å; F280-P305 HydrophobicContact CE1-CG 3.56Å; F280-P305 HydrophobicContact CZ-CG 4.37Å; P305-I382 HydrophobicContact CB-CD1 4.04Å
306	S	63.5	Low	74.7	Confident	37 Å²	37	53 Å²	53	26%	0.259	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-14.7	-179.3	-50.8	0	0	0	0	113	N304 Q395	N304-S306 PolarHBondContact O-N 2.87Å; N304-S306 WeakPolarHBondContact OD1-CB 3.15Å; N304-S306 PolarHBondContact OD1-N 2.9Å; N304-S306 VanDerWaalsContact OD1-N 3.1Å; N304-S306 PolarHBondContact OD1-OG 2.69Å; S306-Q395 PolarHBondContact OG-OE1 3.48Å
307	S	72.9	Confident	75.6	Confident	43 Å²	43	53.9 Å²	53.9	30%	0.301	31%	0.312	S	S	.	.	S	Bend	trans	-74.6	141.4	169.2	176.3	0	0	0	0	110.1	N304 V309 G310 M311	N304-S307 WeakPolarHBondContact O-CB 3.3Å; N304-S307 PolarHBondContact O-N 3.45Å; S307-V309 PolarHBondContact O-N 3.32Å; S307-G310 PolarHBondContact O-N 2.85Å; S307-G310 VanDerWaalsContact O-N 3.13Å; S307-M311 WeakPolarHBondContact O-CB 3.3Å; S307-M311 PolarHBondContact O-N 3.41Å
308	N	77.8	Confident	76.6	Confident	104 Å²	104	49.2 Å²	49.2	56%	0.556	29%	0.29	S	S	*	.	H	α-helix	trans	-57	-38.1	177.7	-68.9	-1	0	0	0	111.7	V312 K386	N308-V312 WeakPolarHBondContact O-CG2 3.42Å; N308-V312 PolarHBondContact O-N 2.91Å; N308-K386 PolarHBondContact OD1-NZ 2.89Å
309	V	80.5	Confident	77.6	Confident	93 Å²	93	46.8 Å²	46.8	56%	0.564	28%	0.277	S	S	*	.	H	α-helix	trans	-70	-45.4	177.7	-179.4	0	0	0	0	110.5	S307 M311 V312 V313	S307-V309 PolarHBondContact O-N 3.32Å; V309-M311 VanDerWaalsContact C-N 3.3Å; V309-M311 PolarHBondContact O-N 3.47Å; V309-V312 PolarHBondContact O-N 3.36Å; V309-V313 WeakPolarHBondContact O-CG2 3.37Å; V309-V313 PolarHBondContact O-N 3.34Å
310	G	77.8	Confident	78.5	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-39.5	177.9	0	0	0	0	0	112.4	F280 A302 S307 V313 Y314	F280-G310 WeakPolarHBondContact CE2-O 3.46Å; A302-G310 VanDerWaalsContact O-CA 3.22Å; A302-G310 WeakPolarHBondContact O-CA 3.3Å; S307-G310 PolarHBondContact O-N 2.85Å; S307-G310 VanDerWaalsContact O-N 3.13Å; G310-V313 PolarHBondContact O-N 2.94Å; G310-Y314 VanDerWaalsContact O-CB 3.29Å; G310-Y314 WeakPolarHBondContact O-CB 3.24Å; G310-Y314 PolarHBondContact O-N 3.34Å
311	M	81.6	Confident	79.4	Confident	18 Å²	18	48.8 Å²	48.8	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-47.3	174.6	-172.9	-179.9	-67	0	0	111.9	S307 V309 V313 Y314 I315 I379 I382 L383	S307-M311 WeakPolarHBondContact O-CB 3.3Å; S307-M311 PolarHBondContact O-N 3.41Å; V309-M311 VanDerWaalsContact C-N 3.3Å; V309-M311 PolarHBondContact O-N 3.47Å; M311-V313 PolarHBondContact O-N 3.27Å; M311-Y314 WeakPolarHBondContact O-CB 3.31Å; M311-Y314 PolarHBondContact O-N 3.2Å; M311-I315 HydrophobicContact CG-CD1 4.25Å; M311-I315 WeakPolarHBondContact O-CG1 3.49Å; M311-I315 PolarHBondContact O-N 3.33Å; M311-I379 HydrophobicContact CE-CG2 4.19Å; M311-I379 HydrophobicContact CG-CG2 4Å; M311-I379 HydrophobicContact SD-CG2 3.53Å; M311-I379 VanDerWaalsContact SD-CG2 3.53Å; M311-I382 HydrophobicContact CE-CB 4.16Å; M311-I382 HydrophobicContact CE-CG2 3.57Å; M311-L383 HydrophobicContact CE-CD2 3.79Å; M311-L383 HydrophobicContact CE-CG 4.27Å; M311-L383 HydrophobicContact SD-CD2 3.87Å; M311-L383 HydrophobicContact SD-CG 4.34Å
312	V	86.3	Confident	80.5	Confident	90 Å²	90	43.9 Å²	43.9	55%	0.545	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-44.7	178.4	173.6	0	0	0	0	111.1	N308 V309 Y314 I315 V316	N308-V312 WeakPolarHBondContact O-CG2 3.42Å; N308-V312 PolarHBondContact O-N 2.91Å; V309-V312 PolarHBondContact O-N 3.36Å; V312-Y314 VanDerWaalsContact C-N 3.3Å; V312-Y314 PolarHBondContact O-N 2.82Å; V312-I315 WeakPolarHBondContact O-CB 3.31Å; V312-I315 PolarHBondContact O-N 3.42Å; V312-V316 WeakPolarHBondContact O-CG2 2.96Å; V312-V316 PolarHBondContact O-N 3.13Å
313	V	86.6	Confident	81.5	Confident	70 Å²	70	44.1 Å²	44.1	42%	0.424	25%	0.25	S	C	.	.	H	α-helix	trans	-61.3	-42.5	176.3	174.2	0	0	0	0	110.7	F280 V309 G310 M311 I315 V316 L317	F280-V313 HydrophobicContact CD2-CG1 4.25Å; F280-V313 HydrophobicContact CE2-CB 4.28Å; F280-V313 HydrophobicContact CE2-CG1 4.22Å; V309-V313 WeakPolarHBondContact O-CG2 3.37Å; V309-V313 PolarHBondContact O-N 3.34Å; G310-V313 PolarHBondContact O-N 2.94Å; M311-V313 PolarHBondContact O-N 3.27Å; V313-I315 PolarHBondContact O-N 3.48Å; V313-V316 PolarHBondContact O-N 2.84Å; V313-L317 HydrophobicContact CG1-CD1 4Å; V313-L317 HydrophobicContact CG1-CG 4.37Å; V313-L317 WeakPolarHBondContact O-CG 3.48Å; V313-L317 PolarHBondContact O-N 2.89Å
314	Y	83.3	Confident	82.5	Confident	1 Å²	1	47 Å²	47	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-42	177.9	-174.4	-128.6	0	0	0	112.2	V273 A276 M277 F280 G310 M311 V312 L317 I318 I382 T399	V273-Y314 WeakPolarHBondContact CG1-OH 3.38Å; A276-Y314 HydrophobicContact CB-CD2 4.41Å; A276-Y314 HydrophobicContact CB-CE2 4.01Å; M277-Y314 HydrophobicContact CB-CE2 4.19Å; M277-Y314 HydrophobicContact SD-CE2 3.89Å; F280-Y314 HydrophobicContact CB-CD2 4.32Å; F280-Y314 HydrophobicContact CD2-CD2 4.45Å; F280-Y314 HydrophobicContact CG-CD2 4.28Å; G310-Y314 VanDerWaalsContact O-CB 3.29Å; G310-Y314 WeakPolarHBondContact O-CB 3.24Å; G310-Y314 PolarHBondContact O-N 3.34Å; M311-Y314 WeakPolarHBondContact O-CB 3.31Å; M311-Y314 PolarHBondContact O-N 3.2Å; V312-Y314 VanDerWaalsContact C-N 3.3Å; V312-Y314 PolarHBondContact O-N 2.82Å; Y314-L317 PolarHBondContact O-N 3.46Å; Y314-I318 HydrophobicContact CD1-CD1 3.9Å; Y314-I318 HydrophobicContact CD2-CD1 4.38Å; Y314-I318 HydrophobicContact CD2-CG1 4.45Å; Y314-I318 HydrophobicContact CE1-CD1 3.58Å; Y314-I318 HydrophobicContact CE2-CD1 4.06Å; Y314-I318 HydrophobicContact CE2-CG1 4.14Å; Y314-I318 HydrophobicContact CG-CD1 4.3Å; Y314-I318 WeakPolarHBondContact O-CG1 3.29Å; Y314-I318 PolarHBondContact O-N 3.34Å; Y314-I382 HydrophobicContact CD1-CD1 4.47Å; Y314-I382 HydrophobicContact CE1-CD1 4.48Å; Y314-T399 PolarHBondContact OH-OG1 3.45Å
315	I	88.6	Confident	83.3	Confident	45 Å²	45	45.5 Å²	45.5	23%	0.231	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-49.4	174.4	-66.8	169.2	0	0	0	111.2	M311 V312 V313 L317 I318 I319 A375 I379	M311-I315 HydrophobicContact CG-CD1 4.25Å; M311-I315 WeakPolarHBondContact O-CG1 3.49Å; M311-I315 PolarHBondContact O-N 3.33Å; V312-I315 WeakPolarHBondContact O-CB 3.31Å; V312-I315 PolarHBondContact O-N 3.42Å; V313-I315 PolarHBondContact O-N 3.48Å; I315-L317 VanDerWaalsContact C-N 3.3Å; I315-L317 PolarHBondContact O-N 2.97Å; I315-I318 PolarHBondContact O-N 3.46Å; I315-I319 HydrophobicContact CG2-CD1 3.85Å; I315-I319 WeakPolarHBondContact O-CG1 3.2Å; I315-I319 PolarHBondContact O-N 3.16Å; I315-A375 HydrophobicContact CG2-CB 4.09Å; I315-I379 HydrophobicContact CD1-CD1 3.31Å; I315-I379 HydrophobicContact CD1-CG1 3.9Å; I315-I379 HydrophobicContact CG1-CD1 3.32Å; I315-I379 HydrophobicContact CG1-CG1 3.64Å
316	V	91.5	Very high	84.5	Confident	83 Å²	83	44.3 Å²	44.3	50%	0.503	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-42.3	-179.5	172.8	0	0	0	0	110.4	V312 V313 I319 L320	V312-V316 WeakPolarHBondContact O-CG2 2.96Å; V312-V316 PolarHBondContact O-N 3.13Å; V313-V316 PolarHBondContact O-N 2.84Å; V316-I319 PolarHBondContact O-N 3.18Å; V316-L320 VanDerWaalsContact O-CB 3.27Å; V316-L320 WeakPolarHBondContact O-CB 3.35Å; V316-L320 PolarHBondContact O-N 2.8Å
317	L	88.8	Confident	85.6	Confident	20 Å²	20	44.6 Å²	44.6	11%	0.105	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-45.2	175.5	-71.7	171.8	0	0	0	112	A276 F279 F280 V313 Y314 I315 I319 L320 F321	A276-L317 HydrophobicContact CB-CB 3.93Å; F279-L317 HydrophobicContact CD1-CD1 4.01Å; F279-L317 HydrophobicContact CD1-CD2 3.7Å; F279-L317 HydrophobicContact CE1-CD2 4.1Å; F280-L317 HydrophobicContact CB-CD1 4.12Å; F280-L317 HydrophobicContact CD2-CD1 4.07Å; V313-L317 HydrophobicContact CG1-CD1 4Å; V313-L317 HydrophobicContact CG1-CG 4.37Å; V313-L317 WeakPolarHBondContact O-CG 3.48Å; V313-L317 PolarHBondContact O-N 2.89Å; Y314-L317 PolarHBondContact O-N 3.46Å; I315-L317 VanDerWaalsContact C-N 3.3Å; I315-L317 PolarHBondContact O-N 2.97Å; L317-I319 VanDerWaalsContact C-N 3.32Å; L317-I319 PolarHBondContact O-N 3.46Å; L317-L320 PolarHBondContact O-N 2.92Å; L317-F321 HydrophobicContact CB-CD2 4.28Å; L317-F321 HydrophobicContact CB-CE2 4.38Å; L317-F321 HydrophobicContact CD2-CE2 3.97Å; L317-F321 WeakPolarHBondContact O-CB 3.32Å; L317-F321 WeakPolarHBondContact O-CD2 3.42Å; L317-F321 PolarHBondContact O-N 2.87Å
318	I	88.1	Confident	86.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-47.6	175.9	-70.3	166.5	0	0	0	110.2	V273 A276 Y314 I315 T322 L374 A375	V273-I318 HydrophobicContact CG2-CG2 4.45Å; A276-I318 HydrophobicContact CB-CB 4.38Å; A276-I318 HydrophobicContact CB-CG1 3.63Å; Y314-I318 HydrophobicContact CD1-CD1 3.9Å; Y314-I318 HydrophobicContact CD2-CD1 4.38Å; Y314-I318 HydrophobicContact CD2-CG1 4.45Å; Y314-I318 HydrophobicContact CE1-CD1 3.58Å; Y314-I318 HydrophobicContact CE2-CD1 4.06Å; Y314-I318 HydrophobicContact CE2-CG1 4.14Å; Y314-I318 HydrophobicContact CG-CD1 4.3Å; Y314-I318 WeakPolarHBondContact O-CG1 3.29Å; Y314-I318 PolarHBondContact O-N 3.34Å; I315-I318 PolarHBondContact O-N 3.46Å; I318-T322 VanDerWaalsContact O-CB 3.22Å; I318-T322 WeakPolarHBondContact O-CB 3.4Å; I318-T322 PolarHBondContact O-N 3.42Å; I318-T322 PolarHBondContact O-OG1 3.32Å; I318-L374 HydrophobicContact CG2-CB 4.02Å; I318-A375 HydrophobicContact CG2-CB 4.21Å
319	I	91.4	Very high	86.3	Confident	51 Å²	51	44.6 Å²	44.6	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-51.1	-179.8	-66.3	170.3	0	0	0	109.8	I315 V316 L317 F321 T322 Y323 A375	I315-I319 HydrophobicContact CG2-CD1 3.85Å; I315-I319 WeakPolarHBondContact O-CG1 3.2Å; I315-I319 PolarHBondContact O-N 3.16Å; V316-I319 PolarHBondContact O-N 3.18Å; L317-I319 VanDerWaalsContact C-N 3.32Å; L317-I319 PolarHBondContact O-N 3.46Å; I319-F321 PolarHBondContact O-N 2.96Å; I319-T322 PolarHBondContact O-N 3.22Å; I319-Y323 HydrophobicContact CG2-CD2 3.8Å; I319-Y323 HydrophobicContact CG2-CE2 3.79Å; I319-Y323 VanDerWaalsContact O-CD2 3.29Å; I319-Y323 WeakPolarHBondContact O-CD2 3.45Å; I319-Y323 PolarHBondContact O-N 2.95Å; I319-A375 HydrophobicContact CG1-CB 4.4Å
320	L	91.3	Very high	86.5	Confident	95 Å²	95	41 Å²	41	50%	0.497	21%	0.212	S	C	.	.	H	α-helix	trans	-57.5	-51.3	-179.5	-173.3	157.5	0	0	0	111.9	V316 L317 T322 Y323 F324	V316-L320 VanDerWaalsContact O-CB 3.27Å; V316-L320 WeakPolarHBondContact O-CB 3.35Å; V316-L320 PolarHBondContact O-N 2.8Å; L317-L320 PolarHBondContact O-N 2.92Å; L320-T322 VanDerWaalsContact C-N 3.29Å; L320-T322 PolarHBondContact O-N 2.75Å; L320-Y323 PolarHBondContact O-N 3.18Å; L320-F324 WeakPolarHBondContact O-CB 3.45Å; L320-F324 PolarHBondContact O-N 3.28Å
321	F	87.8	Confident	87	Confident	30 Å²	30	43.2 Å²	43.2	13%	0.132	22%	0.224	C	C	.	.	H	α-helix	trans	-67.1	-30.8	179.3	-76.7	-62	0	0	0	112.4	P272 F275 A276 F279 L317 I319 Y325	P272-F321 HydrophobicContact CB-CB 4.08Å; F275-F321 HydrophobicContact CB-CB 4.44Å; F275-F321 HydrophobicContact CB-CD1 4.08Å; F275-F321 HydrophobicContact CB-CD2 4.28Å; F275-F321 HydrophobicContact CB-CE1 4.41Å; F275-F321 HydrophobicContact CB-CG 4.02Å; F275-F321 HydrophobicContact CD2-CD1 4.48Å; A276-F321 HydrophobicContact CB-CD2 3.94Å; F279-F321 HydrophobicContact CB-CE2 3.78Å; F279-F321 HydrophobicContact CB-CZ 3.95Å; F279-F321 HydrophobicContact CD2-CZ 4.05Å; F279-F321 HydrophobicContact CG-CE2 4.09Å; F279-F321 AromaticContact CG-CZ 4Å; F279-F321 HydrophobicContact CG-CZ 4Å; L317-F321 HydrophobicContact CB-CD2 4.28Å; L317-F321 HydrophobicContact CB-CE2 4.38Å; L317-F321 HydrophobicContact CD2-CE2 3.97Å; L317-F321 WeakPolarHBondContact O-CB 3.32Å; L317-F321 WeakPolarHBondContact O-CD2 3.42Å; L317-F321 PolarHBondContact O-N 2.87Å; I319-F321 PolarHBondContact O-N 2.96Å; F321-Y325 WeakPolarHBondContact O-CB 3.42Å; F321-Y325 PolarHBondContact O-N 2.81Å
322	T	89.7	Confident	87.3	Confident	1 Å²	1	43 Å²	43	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-67.5	-43.3	175.6	-57.6	0	0	0	0	110.6	P272 I318 I319 L320 A326 T367 L374	P272-T322 WeakPolarHBondContact CB-OG1 3.23Å; I318-T322 VanDerWaalsContact O-CB 3.22Å; I318-T322 WeakPolarHBondContact O-CB 3.4Å; I318-T322 PolarHBondContact O-N 3.42Å; I318-T322 PolarHBondContact O-OG1 3.32Å; I319-T322 PolarHBondContact O-N 3.22Å; L320-T322 VanDerWaalsContact C-N 3.29Å; L320-T322 PolarHBondContact O-N 2.75Å; T322-A326 WeakPolarHBondContact O-CB 3.39Å; T322-A326 PolarHBondContact O-N 3.21Å; T322-T367 HydrophobicContact CG2-CG2 4.14Å; T322-L374 HydrophobicContact CG2-CD1 3.88Å
323	Y	90.1	Very high	87.5	Confident	52 Å²	52	43.4 Å²	43.4	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-56.6	172.5	-89.1	-81.6	0	0	0	111.2	I319 L320 Y325 A326 F327 Y364 T367 F368	I319-Y323 HydrophobicContact CG2-CD2 3.8Å; I319-Y323 HydrophobicContact CG2-CE2 3.79Å; I319-Y323 VanDerWaalsContact O-CD2 3.29Å; I319-Y323 WeakPolarHBondContact O-CD2 3.45Å; I319-Y323 PolarHBondContact O-N 2.95Å; L320-Y323 PolarHBondContact O-N 3.18Å; Y323-Y325 PolarHBondContact O-N 2.95Å; Y323-A326 PolarHBondContact O-N 3.43Å; Y323-F327 HydrophobicContact CD1-CE2 4.19Å; Y323-F327 VanDerWaalsContact O-CD2 3.28Å; Y323-F327 WeakPolarHBondContact O-CD2 3.46Å; Y323-F327 PolarHBondContact O-N 3.06Å; Y323-F327 VanDerWaalsContact O-N 3.15Å; Y323-Y364 HydrophobicContact CD1-CD1 4.27Å; Y323-Y364 HydrophobicContact CD1-CE1 4.44Å; Y323-Y364 AromaticContact CE1-CD1 3.86Å; Y323-Y364 HydrophobicContact CE1-CD1 3.86Å; Y323-Y364 HydrophobicContact CE1-CE1 4.42Å; Y323-T367 HydrophobicContact CD1-CG2 3.73Å; Y323-T367 HydrophobicContact CD2-CG2 4.22Å; Y323-T367 HydrophobicContact CE1-CG2 3.91Å; Y323-T367 HydrophobicContact CE2-CG2 4.4Å; Y323-T367 HydrophobicContact CG-CG2 3.9Å; Y323-F368 WeakPolarHBondContact OH-CA 3.42Å; Y323-F368 VanDerWaalsContact OH-CB 3.23Å; Y323-F368 WeakPolarHBondContact OH-CB 3.34Å; Y323-F368 WeakPolarHBondContact OH-CD2 3.4Å; Y323-F368 PolarHBondContact OH-N 2.88Å
324	F	86.7	Confident	87.5	Confident	69 Å²	69	44.7 Å²	44.7	30%	0.303	22%	0.22	S	C	.	.	H	α-helix	trans	-50.6	-58.6	-179.5	179.3	-100.3	0	0	0	110.9	L87 M90 L320 A326 F327 V328	L87-F324 HydrophobicContact CD2-CE1 3.37Å; L87-F324 HydrophobicContact CD2-CZ 3.35Å; M90-F324 HydrophobicContact CE-CE2 3.78Å; M90-F324 HydrophobicContact CE-CZ 3.85Å; M90-F324 HydrophobicContact SD-CE1 3.89Å; M90-F324 HydrophobicContact SD-CE2 3.8Å; M90-F324 HydrophobicContact SD-CZ 3.2Å; M90-F324 WeakPolarHBondContact SD-CZ 3.47Å; L320-F324 WeakPolarHBondContact O-CB 3.45Å; L320-F324 PolarHBondContact O-N 3.28Å; F324-A326 PolarHBondContact O-N 2.91Å; F324-F327 PolarHBondContact O-N 3.49Å; F324-F327 VanDerWaalsContact O-N 3.16Å; F324-V328 HydrophobicContact CD1-CG2 4.08Å; F324-V328 HydrophobicContact CE1-CG2 3.85Å; F324-V328 HydrophobicContact CE2-CG2 4.48Å; F324-V328 HydrophobicContact CG-CG2 4.5Å; F324-V328 HydrophobicContact CZ-CG2 4.09Å; F324-V328 WeakPolarHBondContact O-CG2 3.39Å; F324-V328 PolarHBondContact O-N 3.42Å
325	Y	83.5	Confident	87.7	Confident	27 Å²	27	46.4 Å²	46.4	11%	0.106	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-36.3	-174.6	-164.8	-86	0	0	0	113.2	A268 I271 P272 F275 F321 Y323 F327 V328 Q329	A268-Y325 VanDerWaalsContact CA-CD1 3.48Å; A268-Y325 HydrophobicContact CB-CD1 3.39Å; A268-Y325 HydrophobicContact CB-CE1 4.23Å; A268-Y325 HydrophobicContact CB-CG 4.14Å; I271-Y325 HydrophobicContact CB-CE1 4.3Å; I271-Y325 HydrophobicContact CB-CE2 4.29Å; I271-Y325 HydrophobicContact CD1-CE1 4.16Å; I271-Y325 HydrophobicContact CD1-CE2 4.4Å; I271-Y325 WeakPolarHBondContact CD1-OH 3.34Å; I271-Y325 HydrophobicContact CG2-CD2 3.98Å; I271-Y325 HydrophobicContact CG2-CE1 4.45Å; I271-Y325 HydrophobicContact CG2-CE2 3.58Å; P272-Y325 HydrophobicContact CG-CG 4.45Å; F275-Y325 HydrophobicContact CD2-CD2 4.43Å; F275-Y325 AromaticContact CE2-CD2 3.75Å; F275-Y325 HydrophobicContact CE2-CD2 3.75Å; F275-Y325 HydrophobicContact CE2-CE2 4Å; F275-Y325 HydrophobicContact CZ-CE2 4.33Å; F321-Y325 WeakPolarHBondContact O-CB 3.42Å; F321-Y325 PolarHBondContact O-N 2.81Å; Y323-Y325 PolarHBondContact O-N 2.95Å; Y325-F327 VanDerWaalsContact C-N 3.3Å; Y325-F327 PolarHBondContact O-N 2.9Å; Y325-V328 PolarHBondContact O-N 3.24Å; Y325-Q329 HydrophobicContact CD1-CB 4.36Å; Y325-Q329 HydrophobicContact CE1-CB 4.2Å; Y325-Q329 HydrophobicContact CE1-CG 4.5Å; Y325-Q329 VanDerWaalsContact CE1-OE1 3.27Å; Y325-Q329 WeakPolarHBondContact O-CB 3.3Å; Y325-Q329 PolarHBondContact O-N 3.43Å
326	A	87.5	Confident	87.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-41.4	175.5	0	0	0	0	0	111.7	T322 Y323 F324 V330 T367	T322-A326 WeakPolarHBondContact O-CB 3.39Å; T322-A326 PolarHBondContact O-N 3.21Å; Y323-A326 PolarHBondContact O-N 3.43Å; F324-A326 PolarHBondContact O-N 2.91Å; A326-V330 WeakPolarHBondContact O-CB 3.35Å; A326-V330 WeakPolarHBondContact O-CG2 3.44Å; A326-V330 PolarHBondContact O-N 3.46Å; A326-T367 HydrophobicContact CB-CG2 3.87Å
327	F	86.6	Confident	87.7	Confident	44 Å²	44	43.8 Å²	43.8	19%	0.193	21%	0.212	C	C	.	.	H	α-helix	trans	-69.1	-38.8	176	-85.1	-81.8	0	0	0	112.8	Y323 F324 Y325 N331 P332 T360 L363 Y364	Y323-F327 HydrophobicContact CD1-CE2 4.19Å; Y323-F327 VanDerWaalsContact O-CD2 3.28Å; Y323-F327 WeakPolarHBondContact O-CD2 3.46Å; Y323-F327 PolarHBondContact O-N 3.06Å; Y323-F327 VanDerWaalsContact O-N 3.15Å; F324-F327 PolarHBondContact O-N 3.49Å; F324-F327 VanDerWaalsContact O-N 3.16Å; Y325-F327 VanDerWaalsContact C-N 3.3Å; Y325-F327 PolarHBondContact O-N 2.9Å; F327-N331 WeakPolarHBondContact O-CA 3.41Å; F327-N331 PolarHBondContact O-N 3.49Å; F327-P332 HydrophobicContact CD1-CG 4.28Å; F327-P332 HydrophobicContact CE1-CG 4.38Å; F327-T360 HydrophobicContact CE1-CG2 4.09Å; F327-T360 HydrophobicContact CZ-CG2 4.5Å; F327-L363 HydrophobicContact CD1-CD2 3.81Å; F327-L363 HydrophobicContact CD2-CD2 4.43Å; F327-L363 HydrophobicContact CE1-CD2 3.78Å; F327-L363 HydrophobicContact CE1-CG 4.44Å; F327-L363 HydrophobicContact CE2-CD2 4.4Å; F327-L363 HydrophobicContact CE2-CG 4.48Å; F327-L363 HydrophobicContact CG-CD2 4.13Å; F327-L363 HydrophobicContact CZ-CB 4.48Å; F327-L363 HydrophobicContact CZ-CD2 4.07Å; F327-L363 HydrophobicContact CZ-CG 4.25Å; F327-Y364 HydrophobicContact CE1-CD2 4.47Å; F327-Y364 HydrophobicContact CE1-CE2 4.05Å; F327-Y364 AromaticContact CE2-CD1 3.86Å; F327-Y364 HydrophobicContact CE2-CD1 3.86Å; F327-Y364 AromaticContact CE2-CE1 3.6Å; F327-Y364 HydrophobicContact CE2-CE1 3.6Å; F327-Y364 HydrophobicContact CE2-CE2 4.32Å; F327-Y364 HydrophobicContact CE2-CG 4.29Å; F327-Y364 AromaticContact CE2-CZ 3.84Å; F327-Y364 AromaticContact CZ-CD1 3.8Å; F327-Y364 HydrophobicContact CZ-CD1 3.8Å; F327-Y364 AromaticContact CZ-CD2 3.66Å; F327-Y364 HydrophobicContact CZ-CD2 3.66Å; F327-Y364 AromaticContact CZ-CE1 3.57Å; F327-Y364 HydrophobicContact CZ-CE1 3.57Å; F327-Y364 AromaticContact CZ-CE2 3.44Å; F327-Y364 HydrophobicContact CZ-CE2 3.44Å; F327-Y364 VanDerWaalsContact CZ-CE2 3.44Å; F327-Y364 AromaticContact CZ-CG 3.81Å; F327-Y364 HydrophobicContact CZ-CG 3.81Å; F327-Y364 AromaticContact CZ-CZ 3.37Å
328	V	82	Confident	87.7	Confident	45 Å²	45	46.8 Å²	46.8	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-48.7	175	-174.7	0	0	0	0	110.9	M90 F324 Y325	M90-V328 HydrophobicContact CE-CG2 3.49Å; M90-V328 VanDerWaalsContact CE-CG2 3.49Å; M90-V328 HydrophobicContact CG-CG1 4.22Å; M90-V328 HydrophobicContact CG-CG2 4.5Å; M90-V328 HydrophobicContact SD-CB 4.28Å; M90-V328 HydrophobicContact SD-CG1 3.99Å; M90-V328 HydrophobicContact SD-CG2 3.29Å; M90-V328 WeakPolarHBondContact SD-CG2 3.24Å; F324-V328 HydrophobicContact CD1-CG2 4.08Å; F324-V328 HydrophobicContact CE1-CG2 3.85Å; F324-V328 HydrophobicContact CE2-CG2 4.48Å; F324-V328 HydrophobicContact CG-CG2 4.5Å; F324-V328 HydrophobicContact CZ-CG2 4.09Å; F324-V328 WeakPolarHBondContact O-CG2 3.39Å; F324-V328 PolarHBondContact O-N 3.42Å; Y325-V328 PolarHBondContact O-N 3.24Å
329	Q	82.2	Confident	87.7	Confident	102 Å²	102	47.2 Å²	47.2	48%	0.477	23%	0.231	S	C	.	.	H	α-helix	trans	-75.8	-43.7	-170.7	-173.4	179.6	11.2	0	0	112.9	S267 A268 Y325	S267-Q329 VanDerWaalsContact O-CD 3.25Å; S267-Q329 PolarHBondContact O-NE2 3.03Å; S267-Q329 PolarHBondContact O-OE1 3.09Å; A268-Q329 VanDerWaalsContact CA-OE1 3.3Å; Y325-Q329 HydrophobicContact CD1-CB 4.36Å; Y325-Q329 HydrophobicContact CE1-CB 4.2Å; Y325-Q329 HydrophobicContact CE1-CG 4.5Å; Y325-Q329 VanDerWaalsContact CE1-OE1 3.27Å; Y325-Q329 WeakPolarHBondContact O-CB 3.3Å; Y325-Q329 PolarHBondContact O-N 3.43Å
330	V	85.2	Confident	87.5	Confident	16 Å²	16	50.8 Å²	50.8	10%	0.097	25%	0.245	C	C	.	.	H	α-helix	trans	-76.4	-36.6	-179.5	176.1	0	0	0	0	110.8	L263 S267 A326 M335 L363	L263-V330 HydrophobicContact CD2-CG1 4.12Å; S267-V330 WeakPolarHBondContact OG-CG2 3.09Å; A326-V330 WeakPolarHBondContact O-CB 3.35Å; A326-V330 WeakPolarHBondContact O-CG2 3.44Å; A326-V330 PolarHBondContact O-N 3.46Å; V330-M335 HydrophobicContact CG1-CE 3.69Å; V330-M335 HydrophobicContact CG1-SD 4.02Å; V330-L363 HydrophobicContact CB-CD1 4.28Å; V330-L363 HydrophobicContact CB-CD2 3.89Å; V330-L363 HydrophobicContact CG1-CD1 4.38Å; V330-L363 HydrophobicContact CG1-CD2 4.02Å; V330-L363 HydrophobicContact CG2-CD1 3.89Å; V330-L363 HydrophobicContact CG2-CD2 4.37Å
331	N	87.4	Confident	87.3	Confident	48 Å²	48	54.6 Å²	54.6	26%	0.257	26%	0.257	S	S	.	.			trans	40.9	80.7	-175.6	-165.9	-44	0	0	0	112.2	F327 E333 K334 M335	F327-N331 WeakPolarHBondContact O-CA 3.41Å; F327-N331 PolarHBondContact O-N 3.49Å; N331-E333 PolarHBondContact O-N 3.08Å; N331-K334 HydrophobicContact CB-CB 4.18Å; N331-K334 HydrophobicContact CB-CD 4.3Å; N331-K334 HydrophobicContact CB-CG 4.41Å; N331-K334 PolarHBondContact O-N 3.22Å; N331-K334 WeakPolarHBondContact OD1-CG 3.37Å; N331-K334 PolarHBondContact OD1-N 2.75Å; N331-M335 WeakPolarHBondContact O-CB 3.38Å; N331-M335 PolarHBondContact O-N 2.79Å
332	P	89	Confident	87.1	Confident	12 Å²	12	59 Å²	59	8%	0.078	28%	0.278	C	S	.	.	H	α-helix	trans	-58.9	-26.2	-171.9	23.3	-34.2	0	0	0	113.7	F327 A336 I359 T360	F327-P332 HydrophobicContact CD1-CG 4.28Å; F327-P332 HydrophobicContact CE1-CG 4.38Å; P332-A336 WeakPolarHBondContact O-CB 3.2Å; P332-A336 PolarHBondContact O-N 3.03Å; P332-I359 HydrophobicContact CB-CB 4.21Å; P332-I359 HydrophobicContact CB-CG2 3.79Å; P332-T360 WeakPolarHBondContact CB-OG1 3.4Å; P332-T360 WeakPolarHBondContact CG-OG1 3.32Å
333	E	89.5	Confident	86.9	Confident	99 Å²	99	60.6 Å²	60.6	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-70	-56	175.8	-178.6	167.5	158.2	0	0	111.9	N331 M335 A336 D337 K356	N331-E333 PolarHBondContact O-N 3.08Å; E333-M335 PolarHBondContact O-N 2.83Å; E333-A336 PolarHBondContact O-N 3.41Å; E333-A336 VanDerWaalsContact O-N 3.15Å; E333-D337 PolarHBondContact O-N 3.22Å; E333-K356 HydrophobicContact CB-CD 3.97Å; E333-K356 HydrophobicContact CB-CG 4.48Å; E333-K356 HydrophobicContact CG-CD 4.17Å; E333-K356 IonicContact OE2-NZ 3.85Å; E333-K356 PolarHBondContact OE2-NZ 3.22Å
334	K	87.4	Confident	86.6	Confident	97 Å²	97	58.2 Å²	58.2	42%	0.422	29%	0.285	S	S	.	.	H	α-helix	trans	-58.1	-37.3	175.3	-71.7	-177.7	-175	173.9	0	111.5	N331 D337 N338	N331-K334 HydrophobicContact CB-CB 4.18Å; N331-K334 HydrophobicContact CB-CD 4.3Å; N331-K334 HydrophobicContact CB-CG 4.41Å; N331-K334 PolarHBondContact O-N 3.22Å; N331-K334 WeakPolarHBondContact OD1-CG 3.37Å; N331-K334 PolarHBondContact OD1-N 2.75Å; K334-D337 PolarHBondContact O-N 2.81Å; K334-N338 VanDerWaalsContact O-CB 3.27Å; K334-N338 WeakPolarHBondContact O-CB 3.05Å; K334-N338 PolarHBondContact O-N 3.34Å; K334-N338 PolarHBondContact O-ND2 2.94Å
335	M	88.4	Confident	86.7	Confident	38 Å²	38	58.4 Å²	58.4	19%	0.187	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-46.1	177.6	-173.1	172.1	-79.7	0	0	112	L261 L263 V330 N331 E333 N338 L339 I359	L261-M335 HydrophobicContact CD2-CG 4.15Å; L261-M335 HydrophobicContact CD2-SD 3.66Å; L261-M335 HydrophobicContact CG-SD 4.46Å; L263-M335 HydrophobicContact CD2-CE 4.01Å; L263-M335 HydrophobicContact CD2-SD 3.97Å; V330-M335 HydrophobicContact CG1-CE 3.69Å; V330-M335 HydrophobicContact CG1-SD 4.02Å; N331-M335 WeakPolarHBondContact O-CB 3.38Å; N331-M335 PolarHBondContact O-N 2.79Å; E333-M335 PolarHBondContact O-N 2.83Å; M335-N338 PolarHBondContact O-N 2.92Å; M335-L339 WeakPolarHBondContact O-CG 3.42Å; M335-L339 PolarHBondContact O-N 3.21Å; M335-I359 HydrophobicContact CB-CD1 4.33Å; M335-I359 HydrophobicContact CG-CD1 3.87Å; M335-I359 HydrophobicContact SD-CD1 4.01Å; M335-I359 HydrophobicContact SD-CG2 3.93Å
336	A	89.8	Confident	86.9	Confident	2 Å²	2	57.3 Å²	57.3	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-41	176.1	0	0	0	0	0	112.2	P332 E333 L339 K340 T355 K356	P332-A336 WeakPolarHBondContact O-CB 3.2Å; P332-A336 PolarHBondContact O-N 3.03Å; E333-A336 PolarHBondContact O-N 3.41Å; E333-A336 VanDerWaalsContact O-N 3.15Å; A336-L339 PolarHBondContact O-N 3.49Å; A336-K340 WeakPolarHBondContact O-CB 3.43Å; A336-K340 PolarHBondContact O-N 3.44Å; A336-T355 HydrophobicContact CB-CG2 4.07Å; A336-K356 HydrophobicContact CB-CB 3.87Å
337	D	90.4	Very high	86.8	Confident	70 Å²	70	59.5 Å²	59.5	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-41.4	175.7	-78.9	-18.8	0	0	0	112.4	E333 K334 K340 K341	E333-D337 PolarHBondContact O-N 3.22Å; K334-D337 PolarHBondContact O-N 2.81Å; D337-K340 PolarHBondContact O-N 2.97Å; D337-K341 WeakPolarHBondContact O-CB 3.42Å; D337-K341 VanDerWaalsContact O-CG 3.3Å; D337-K341 WeakPolarHBondContact O-CG 3.33Å; D337-K341 PolarHBondContact O-N 3.44Å
338	N	88.4	Confident	86.8	Confident	83 Å²	83	61.7 Å²	61.7	44%	0.444	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-43.1	176.5	-74.9	-19.6	0	0	0	111.5	K334 M335 K340 K341 Q342	K334-N338 VanDerWaalsContact O-CB 3.27Å; K334-N338 WeakPolarHBondContact O-CB 3.05Å; K334-N338 PolarHBondContact O-N 3.34Å; K334-N338 PolarHBondContact O-ND2 2.94Å; M335-N338 PolarHBondContact O-N 2.92Å; N338-K340 VanDerWaalsContact C-N 3.35Å; N338-K340 PolarHBondContact O-N 2.78Å; N338-K341 PolarHBondContact O-N 2.9Å; N338-Q342 WeakPolarHBondContact O-CB 3.48Å; N338-Q342 VanDerWaalsContact O-CG 3.25Å; N338-Q342 WeakPolarHBondContact O-CG 3.44Å; N338-Q342 PolarHBondContact O-N 3.21Å
339	L	87.9	Confident	87.2	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-47.5	174.1	-71.9	173.4	0	0	0	110.9	I243 L261 M335 A336 K341 Q342 G343 S344 T355 I359	I243-L339 HydrophobicContact CD1-CD2 4.46Å; I243-L339 HydrophobicContact CG2-CD2 4.31Å; L261-L339 HydrophobicContact CD2-CD1 4.2Å; M335-L339 WeakPolarHBondContact O-CG 3.42Å; M335-L339 PolarHBondContact O-N 3.21Å; A336-L339 PolarHBondContact O-N 3.49Å; L339-K341 PolarHBondContact O-N 3.32Å; L339-Q342 PolarHBondContact O-N 2.93Å; L339-G343 PolarHBondContact O-N 2.93Å; L339-S344 CarbonylContact C-O 3.29Å; L339-S344 VanDerWaalsContact C-O 3.29Å; L339-S344 PolarHBondContact O-N 3.21Å; L339-T355 HydrophobicContact CD1-CG2 4Å; L339-I359 HydrophobicContact CD1-CD1 4.07Å
340	K	87	Confident	87.5	Confident	127 Å²	127	66.3 Å²	66.3	55%	0.552	34%	0.34	S	S	*	.	H	α-helix	trans	-58.3	-46.6	176.5	-176.6	-177.7	176.1	-174.8	0	111.9	A336 D337 N338 Q342 G343 P351	A336-K340 WeakPolarHBondContact O-CB 3.43Å; A336-K340 PolarHBondContact O-N 3.44Å; D337-K340 PolarHBondContact O-N 2.97Å; N338-K340 VanDerWaalsContact C-N 3.35Å; N338-K340 PolarHBondContact O-N 2.78Å; K340-Q342 PolarHBondContact O-N 3.5Å; K340-G343 PolarHBondContact O-N 2.81Å; K340-P351 HydrophobicContact CG-CB 4.37Å
341	K	87.2	Confident	87.7	Confident	174 Å²	174	68.9 Å²	68.9	76%	0.757	36%	0.357	S	S	*	.	H	α-helix	trans	-65.8	-34.3	178.9	-74.7	175.7	-178.4	178	0	113	D337 N338 L339 G343	D337-K341 WeakPolarHBondContact O-CB 3.42Å; D337-K341 VanDerWaalsContact O-CG 3.3Å; D337-K341 WeakPolarHBondContact O-CG 3.33Å; D337-K341 PolarHBondContact O-N 3.44Å; N338-K341 PolarHBondContact O-N 2.9Å; L339-K341 PolarHBondContact O-N 3.32Å; K341-G343 PolarHBondContact O-N 2.83Å
342	Q	84.4	Confident	87.8	Confident	124 Å²	124	67.1 Å²	67.1	58%	0.579	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-4.9	176.6	-70.7	174	2.7	0	0	113.3	N338 L339 K340 S344	N338-Q342 WeakPolarHBondContact O-CB 3.48Å; N338-Q342 VanDerWaalsContact O-CG 3.25Å; N338-Q342 WeakPolarHBondContact O-CG 3.44Å; N338-Q342 PolarHBondContact O-N 3.21Å; L339-Q342 PolarHBondContact O-N 2.93Å; K340-Q342 PolarHBondContact O-N 3.5Å; Q342-S344 PolarHBondContact O-N 3.44Å
343	G	83.5	Confident	87.9	Confident	33 Å²	33	71.4 Å²	71.4	34%	0.34	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	21.5	-173.7	0	0	0	0	0	113.1	A246 L339 K340 K341	A246-G343 VanDerWaalsContact CB-O 3.28Å; A246-G343 WeakPolarHBondContact CB-O 3.5Å; A246-G343 PolarHBondContact N-O 3.28Å; L339-G343 PolarHBondContact O-N 2.93Å; K340-G343 PolarHBondContact O-N 2.81Å; K341-G343 PolarHBondContact O-N 2.83Å
344	S	85.4	Confident	88.1	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.014	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	142.1	177.8	-57.5	0	0	0	0	110.4	Q244 Y245 L339 Q342	Q244-S344 CarbonylContact O-C 3.51Å; Q244-S344 WeakPolarHBondContact O-CA 3.38Å; Y245-S344 WeakPolarHBondContact CD1-OG 3.17Å; Y245-S344 WeakPolarHBondContact CE1-OG 3.33Å; L339-S344 CarbonylContact C-O 3.29Å; L339-S344 VanDerWaalsContact C-O 3.29Å; L339-S344 PolarHBondContact O-N 3.21Å; Q342-S344 PolarHBondContact O-N 3.44Å
345	Y	87.1	Confident	88.3	Confident	74 Å²	74	67 Å²	67	29%	0.29	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.3	176.4	61.6	-92.5	0	0	0	111.7	I243 Q244 A246	I243-Y345 WeakPolarHBondContact CA-O 3.49Å; Q244-Y345 HydrophobicContact CB-CE1 4.39Å; Q244-Y345 HydrophobicContact CB-CE2 3.97Å; Q244-Y345 PolarHBondContact N-O 2.88Å; Q244-Y345 PolarHBondContact O-N 3.23Å; Q244-Y345 PolarHBondContact OE1-OH 3.3Å; A246-Y345 HydrophobicContact CB-CD1 4.08Å; A246-Y345 HydrophobicContact CB-CE1 3.79Å
346	V	88.4	Confident	88.5	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.018	35%	0.353	C	S	.	.			trans	-81.4	123.3	170.6	-179.7	0	0	0	0	107.3	I241 I243 G348 I349 T355 Y358	I241-V346 HydrophobicContact CG2-CG1 4.05Å; I241-V346 HydrophobicContact CG2-CG2 3.93Å; I243-V346 HydrophobicContact CG2-CG2 4.28Å; V346-G348 PolarHBondContact O-N 3.33Å; V346-I349 HydrophobicContact CB-CB 4.26Å; V346-I349 HydrophobicContact CB-CD1 4.22Å; V346-I349 HydrophobicContact CB-CG1 4.4Å; V346-I349 HydrophobicContact CG1-CD1 3.74Å; V346-I349 HydrophobicContact CG1-CG1 4.14Å; V346-I349 PolarHBondContact O-N 3.24Å; V346-T355 HydrophobicContact CG2-CG2 4.32Å; V346-Y358 HydrophobicContact CG1-CD1 4.38Å; V346-Y358 HydrophobicContact CG1-CE1 4.04Å
347	P	85.6	Confident	88.7	Confident	48 Å²	48	73.1 Å²	73.1	31%	0.312	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	129.5	-179.8	-28	36.4	0	0	0	111.8	P242 Q244	P242-P347 WeakPolarHBondContact O-CD 3.36Å; Q244-P347 HydrophobicContact CB-CG 4.46Å; Q244-P347 HydrophobicContact CG-CG 3.8Å
348	G	86.3	Confident	88.9	Confident	90 Å²	90	73.3 Å²	73.3	93%	0.928	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-0.3	-178.5	0	0	0	0	0	115.9	V346	V346-G348 PolarHBondContact O-N 3.33Å
349	I	90	Very high	89	Confident	36 Å²	36	69.4 Å²	69.4	19%	0.185	35%	0.35	C	S	.	.	S	Bend	trans	-125.3	127.2	-177.7	-49.1	-176	0	0	0	110	V346 Q354 Y358	V346-I349 HydrophobicContact CB-CB 4.26Å; V346-I349 HydrophobicContact CB-CD1 4.22Å; V346-I349 HydrophobicContact CB-CG1 4.4Å; V346-I349 HydrophobicContact CG1-CD1 3.74Å; V346-I349 HydrophobicContact CG1-CG1 4.14Å; V346-I349 PolarHBondContact O-N 3.24Å; I349-Q354 HydrophobicContact CG2-CB 3.87Å; I349-Y358 HydrophobicContact CD1-CD1 3.5Å; I349-Y358 HydrophobicContact CD1-CD2 3.31Å; I349-Y358 HydrophobicContact CD1-CE1 3.93Å; I349-Y358 HydrophobicContact CD1-CE2 3.77Å; I349-Y358 HydrophobicContact CD1-CG 3.15Å
350	R	89.7	Confident	89.3	Confident	207 Å²	207	70.4 Å²	70.4	78%	0.781	36%	0.357	S	S	*	.			trans	-63.5	132.5	179.3	-67.8	-177.2	179.9	172.7	0	110.5	Q354 T355	R350-Q354 HydrophobicContact CB-CB 4.4Å; R350-Q354 HydrophobicContact CB-CG 4.42Å; R350-T355 PolarHBondContact O-N 3.29Å; R350-T355 PolarHBondContact O-OG1 3.49Å
351	P	88.7	Confident	89.6	Confident	71 Å²	71	70.1 Å²	70.1	46%	0.461	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	144.6	176.1	-26.1	35.6	0	0	0	112.8	K340 T355	K340-P351 HydrophobicContact CG-CB 4.37Å; P351-T355 WeakPolarHBondContact CA-OG1 3.41Å
352	G	89.8	Confident	89.8	Confident	10 Å²	10	62.8 Å²	62.8	10%	0.103	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	99	-131.3	-176.7	0	0	0	0	0	112.8	Q354 T355 K356	G352-Q354 VanDerWaalsContact C-N 3.32Å; G352-Q354 PolarHBondContact O-N 3.34Å; G352-T355 WeakPolarHBondContact O-CA 3.2Å; G352-T355 VanDerWaalsContact O-CB 3.32Å; G352-T355 WeakPolarHBondContact O-CB 3.44Å; G352-T355 PolarHBondContact O-N 3.25Å; G352-K356 PolarHBondContact O-N 3.21Å
353	E	91.8	Very high	90.2	Very high	103 Å²	103	56.9 Å²	56.9	48%	0.481	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-37.3	-169.3	-173.4	55.8	-152.8	0	0	114	T355 K356 K357	E353-T355 VanDerWaalsContact C-N 3.33Å; E353-T355 PolarHBondContact O-N 3.39Å; E353-K356 WeakPolarHBondContact O-CB 3.22Å; E353-K356 PolarHBondContact O-N 3.29Å; E353-K357 WeakPolarHBondContact O-CG 3.39Å; E353-K357 PolarHBondContact O-N 3.02Å; E353-K357 WeakPolarHBondContact OE1-CE 3.33Å
354	Q	92.9	Very high	90.6	Very high	101 Å²	101	61 Å²	61	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-34.9	176.8	-62.8	-63.2	-18.8	0	0	111.9	I349 R350 G352 K357 Y358	I349-Q354 HydrophobicContact CG2-CB 3.87Å; R350-Q354 HydrophobicContact CB-CB 4.4Å; R350-Q354 HydrophobicContact CB-CG 4.42Å; G352-Q354 VanDerWaalsContact C-N 3.32Å; G352-Q354 PolarHBondContact O-N 3.34Å; Q354-K357 PolarHBondContact O-N 3.33Å; Q354-Y358 WeakPolarHBondContact O-CB 3.36Å; Q354-Y358 PolarHBondContact O-N 2.9Å
355	T	91.8	Very high	91	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-66.6	-43.3	173.4	-57.3	0	0	0	0	110.7	A336 L339 V346 R350 P351 G352 E353 K357 Y358 I359	A336-T355 HydrophobicContact CB-CG2 4.07Å; L339-T355 HydrophobicContact CD1-CG2 4Å; V346-T355 HydrophobicContact CG2-CG2 4.32Å; R350-T355 PolarHBondContact O-N 3.29Å; R350-T355 PolarHBondContact O-OG1 3.49Å; P351-T355 WeakPolarHBondContact CA-OG1 3.41Å; G352-T355 WeakPolarHBondContact O-CA 3.2Å; G352-T355 VanDerWaalsContact O-CB 3.32Å; G352-T355 WeakPolarHBondContact O-CB 3.44Å; G352-T355 PolarHBondContact O-N 3.25Å; E353-T355 VanDerWaalsContact C-N 3.33Å; E353-T355 PolarHBondContact O-N 3.39Å; T355-K357 PolarHBondContact O-N 3.46Å; T355-Y358 PolarHBondContact O-N 3.31Å; T355-I359 HydrophobicContact CG2-CD1 3.82Å; T355-I359 HydrophobicContact CG2-CG1 4.37Å; T355-I359 WeakPolarHBondContact O-CG1 3.08Å; T355-I359 PolarHBondContact O-N 2.87Å
356	K	93	Very high	91.2	Very high	53 Å²	53	66.5 Å²	66.5	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-56.5	-49.2	173.6	174.7	-178	169	176.4	0	111.4	E333 A336 G352 E353 Y358 I359 T360	E333-K356 HydrophobicContact CB-CD 3.97Å; E333-K356 HydrophobicContact CB-CG 4.48Å; E333-K356 HydrophobicContact CG-CD 4.17Å; E333-K356 IonicContact OE2-NZ 3.85Å; E333-K356 PolarHBondContact OE2-NZ 3.22Å; A336-K356 HydrophobicContact CB-CB 3.87Å; G352-K356 PolarHBondContact O-N 3.21Å; E353-K356 WeakPolarHBondContact O-CB 3.22Å; E353-K356 PolarHBondContact O-N 3.29Å; K356-Y358 VanDerWaalsContact C-N 3.35Å; K356-Y358 PolarHBondContact O-N 2.97Å; K356-I359 PolarHBondContact O-N 3.08Å; K356-T360 VanDerWaalsContact O-CB 3.23Å; K356-T360 WeakPolarHBondContact O-CB 3.15Å; K356-T360 PolarHBondContact O-N 2.94Å; K356-T360 PolarHBondContact O-OG1 2.98Å
357	K	94.3	Very high	91.3	Very high	115 Å²	115	66.5 Å²	66.5	50%	0.5	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-41.8	177.8	-73.6	-179.9	-179.7	-178.8	0	112.4	E353 Q354 T355 T360 K361	E353-K357 WeakPolarHBondContact O-CG 3.39Å; E353-K357 PolarHBondContact O-N 3.02Å; E353-K357 WeakPolarHBondContact OE1-CE 3.33Å; Q354-K357 PolarHBondContact O-N 3.33Å; T355-K357 PolarHBondContact O-N 3.46Å; K357-T360 PolarHBondContact O-N 3.5Å; K357-K361 WeakPolarHBondContact O-CB 3.48Å; K357-K361 PolarHBondContact O-N 3.01Å
358	Y	93.3	Very high	91.6	Very high	74 Å²	74	69.7 Å²	69.7	29%	0.29	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-51.2	176.9	177.6	-103.5	0	0	0	112.4	I241 V346 I349 Q354 T355 K356 T360 K361 V362	I241-Y358 HydrophobicContact CD1-CE1 4.14Å; I241-Y358 HydrophobicContact CG2-CE1 3.93Å; V346-Y358 HydrophobicContact CG1-CD1 4.38Å; V346-Y358 HydrophobicContact CG1-CE1 4.04Å; I349-Y358 HydrophobicContact CD1-CD1 3.5Å; I349-Y358 HydrophobicContact CD1-CD2 3.31Å; I349-Y358 HydrophobicContact CD1-CE1 3.93Å; I349-Y358 HydrophobicContact CD1-CE2 3.77Å; I349-Y358 HydrophobicContact CD1-CG 3.15Å; Q354-Y358 WeakPolarHBondContact O-CB 3.36Å; Q354-Y358 PolarHBondContact O-N 2.9Å; T355-Y358 PolarHBondContact O-N 3.31Å; K356-Y358 VanDerWaalsContact C-N 3.35Å; K356-Y358 PolarHBondContact O-N 2.97Å; Y358-T360 VanDerWaalsContact C-N 3.27Å; Y358-T360 PolarHBondContact O-N 3.48Å; Y358-K361 PolarHBondContact O-N 3.25Å; Y358-V362 HydrophobicContact CD1-CG2 4.35Å; Y358-V362 HydrophobicContact CD2-CG2 4.41Å; Y358-V362 HydrophobicContact CE1-CG2 3.98Å; Y358-V362 HydrophobicContact CE2-CG2 4.04Å; Y358-V362 WeakPolarHBondContact O-CG2 3.4Å; Y358-V362 PolarHBondContact O-N 2.9Å
359	I	91.7	Very high	91.8	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-42.8	178.3	-65.4	171.2	0	0	0	109.9	L263 P332 M335 L339 T355 K356 K361 V362 L363	L263-I359 HydrophobicContact CD1-CG2 4.41Å; P332-I359 HydrophobicContact CB-CB 4.21Å; P332-I359 HydrophobicContact CB-CG2 3.79Å; M335-I359 HydrophobicContact CB-CD1 4.33Å; M335-I359 HydrophobicContact CG-CD1 3.87Å; M335-I359 HydrophobicContact SD-CD1 4.01Å; M335-I359 HydrophobicContact SD-CG2 3.93Å; L339-I359 HydrophobicContact CD1-CD1 4.07Å; T355-I359 HydrophobicContact CG2-CD1 3.82Å; T355-I359 HydrophobicContact CG2-CG1 4.37Å; T355-I359 WeakPolarHBondContact O-CG1 3.08Å; T355-I359 PolarHBondContact O-N 2.87Å; K356-I359 PolarHBondContact O-N 3.08Å; I359-K361 PolarHBondContact O-N 3.19Å; I359-V362 PolarHBondContact O-N 3.13Å; I359-L363 VanDerWaalsContact O-CB 3.28Å; I359-L363 WeakPolarHBondContact O-CB 3.47Å; I359-L363 PolarHBondContact O-N 2.95Å
360	T	93.3	Very high	91.7	Very high	30 Å²	30	67.8 Å²	67.8	18%	0.184	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-48.3	176.1	-61.6	0	0	0	0	111.9	F327 P332 K356 K357 Y358 V362 L363 Y364	F327-T360 HydrophobicContact CE1-CG2 4.09Å; F327-T360 HydrophobicContact CZ-CG2 4.5Å; P332-T360 WeakPolarHBondContact CB-OG1 3.4Å; P332-T360 WeakPolarHBondContact CG-OG1 3.32Å; K356-T360 VanDerWaalsContact O-CB 3.23Å; K356-T360 WeakPolarHBondContact O-CB 3.15Å; K356-T360 PolarHBondContact O-N 2.94Å; K356-T360 PolarHBondContact O-OG1 2.98Å; K357-T360 PolarHBondContact O-N 3.5Å; Y358-T360 VanDerWaalsContact C-N 3.27Å; Y358-T360 PolarHBondContact O-N 3.48Å; T360-V362 PolarHBondContact O-N 3.43Å; T360-L363 PolarHBondContact O-N 3.37Å; T360-Y364 HydrophobicContact CG2-CD2 3.74Å; T360-Y364 HydrophobicContact CG2-CE2 3.47Å; T360-Y364 VanDerWaalsContact CG2-CE2 3.47Å; T360-Y364 WeakPolarHBondContact O-CD2 3.5Å; T360-Y364 PolarHBondContact O-N 3.21Å
361	K	93.6	Very high	91.7	Very high	122 Å²	122	58 Å²	58	53%	0.53	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-40.2	178.2	-175.2	176.2	-177.3	175.1	0	112.4	K357 Y358 I359 R365	K357-K361 WeakPolarHBondContact O-CB 3.48Å; K357-K361 PolarHBondContact O-N 3.01Å; Y358-K361 PolarHBondContact O-N 3.25Å; I359-K361 PolarHBondContact O-N 3.19Å; K361-R365 WeakPolarHBondContact O-CG 3.35Å; K361-R365 PolarHBondContact O-N 3.24Å
362	V	92.2	Very high	91.8	Very high	19 Å²	19	58 Å²	58	12%	0.115	27%	0.265	C	S	.	.	H	α-helix	trans	-65.5	-44.7	175.4	174.2	0	0	0	0	110.1	R239 I241 L263 Y358 I359 T360 R365 L366	R239-V362 HydrophobicContact CG-CG1 4.31Å; I241-V362 HydrophobicContact CD1-CG1 4.16Å; L263-V362 HydrophobicContact CD1-CG1 4.09Å; Y358-V362 HydrophobicContact CD1-CG2 4.35Å; Y358-V362 HydrophobicContact CD2-CG2 4.41Å; Y358-V362 HydrophobicContact CE1-CG2 3.98Å; Y358-V362 HydrophobicContact CE2-CG2 4.04Å; Y358-V362 WeakPolarHBondContact O-CG2 3.4Å; Y358-V362 PolarHBondContact O-N 2.9Å; I359-V362 PolarHBondContact O-N 3.13Å; T360-V362 PolarHBondContact O-N 3.43Å; V362-R365 PolarHBondContact O-N 3.03Å; V362-L366 HydrophobicContact CG1-CD1 3.64Å; V362-L366 HydrophobicContact CG1-CG 4.14Å; V362-L366 VanDerWaalsContact O-CG 3.31Å; V362-L366 WeakPolarHBondContact O-CG 3.44Å; V362-L366 PolarHBondContact O-N 3.33Å
363	L	91.9	Very high	91.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-48.3	179.4	-171.3	61	0	0	0	111.4	F327 V330 I359 T360 R365 L366 T367	F327-L363 HydrophobicContact CD1-CD2 3.81Å; F327-L363 HydrophobicContact CD2-CD2 4.43Å; F327-L363 HydrophobicContact CE1-CD2 3.78Å; F327-L363 HydrophobicContact CE1-CG 4.44Å; F327-L363 HydrophobicContact CE2-CD2 4.4Å; F327-L363 HydrophobicContact CE2-CG 4.48Å; F327-L363 HydrophobicContact CG-CD2 4.13Å; F327-L363 HydrophobicContact CZ-CB 4.48Å; F327-L363 HydrophobicContact CZ-CD2 4.07Å; F327-L363 HydrophobicContact CZ-CG 4.25Å; V330-L363 HydrophobicContact CB-CD1 4.28Å; V330-L363 HydrophobicContact CB-CD2 3.89Å; V330-L363 HydrophobicContact CG1-CD1 4.38Å; V330-L363 HydrophobicContact CG1-CD2 4.02Å; V330-L363 HydrophobicContact CG2-CD1 3.89Å; V330-L363 HydrophobicContact CG2-CD2 4.37Å; I359-L363 VanDerWaalsContact O-CB 3.28Å; I359-L363 WeakPolarHBondContact O-CB 3.47Å; I359-L363 PolarHBondContact O-N 2.95Å; T360-L363 PolarHBondContact O-N 3.37Å; L363-R365 VanDerWaalsContact C-N 3.3Å; L363-R365 PolarHBondContact O-N 3.46Å; L363-L366 PolarHBondContact O-N 2.91Å; L363-T367 VanDerWaalsContact O-CB 3.27Å; L363-T367 WeakPolarHBondContact O-CB 3.32Å; L363-T367 PolarHBondContact O-N 2.91Å; L363-T367 PolarHBondContact O-OG1 3.4Å
364	Y	92.5	Very high	91.4	Very high	120 Å²	120	55.5 Å²	55.5	47%	0.471	25%	0.25	S	S	.	.	H	α-helix	trans	-52.8	-45.7	175.4	-85.7	-67.3	0	0	0	112.8	Y323 F327 T360 F368	Y323-Y364 HydrophobicContact CD1-CD1 4.27Å; Y323-Y364 HydrophobicContact CD1-CE1 4.44Å; Y323-Y364 AromaticContact CE1-CD1 3.86Å; Y323-Y364 HydrophobicContact CE1-CD1 3.86Å; Y323-Y364 HydrophobicContact CE1-CE1 4.42Å; F327-Y364 HydrophobicContact CE1-CD2 4.47Å; F327-Y364 HydrophobicContact CE1-CE2 4.05Å; F327-Y364 AromaticContact CE2-CD1 3.86Å; F327-Y364 HydrophobicContact CE2-CD1 3.86Å; F327-Y364 AromaticContact CE2-CE1 3.6Å; F327-Y364 HydrophobicContact CE2-CE1 3.6Å; F327-Y364 HydrophobicContact CE2-CE2 4.32Å; F327-Y364 HydrophobicContact CE2-CG 4.29Å; F327-Y364 AromaticContact CE2-CZ 3.84Å; F327-Y364 AromaticContact CZ-CD1 3.8Å; F327-Y364 HydrophobicContact CZ-CD1 3.8Å; F327-Y364 AromaticContact CZ-CD2 3.66Å; F327-Y364 HydrophobicContact CZ-CD2 3.66Å; F327-Y364 AromaticContact CZ-CE1 3.57Å; F327-Y364 HydrophobicContact CZ-CE1 3.57Å; F327-Y364 AromaticContact CZ-CE2 3.44Å; F327-Y364 HydrophobicContact CZ-CE2 3.44Å; F327-Y364 VanDerWaalsContact CZ-CE2 3.44Å; F327-Y364 AromaticContact CZ-CG 3.81Å; F327-Y364 HydrophobicContact CZ-CG 3.81Å; F327-Y364 AromaticContact CZ-CZ 3.37Å; T360-Y364 HydrophobicContact CG2-CD2 3.74Å; T360-Y364 HydrophobicContact CG2-CE2 3.47Å; T360-Y364 VanDerWaalsContact CG2-CE2 3.47Å; T360-Y364 WeakPolarHBondContact O-CD2 3.5Å; T360-Y364 PolarHBondContact O-N 3.21Å; Y364-F368 WeakPolarHBondContact O-CB 3.34Å; Y364-F368 PolarHBondContact O-N 3.41Å
365	R	92.5	Very high	91.1	Very high	167 Å²	167	50.9 Å²	50.9	63%	0.63	23%	0.229	S	C	*	.	H	α-helix	trans	-69.4	-39.9	-179.3	-69.2	178	179.2	-167.6	-4.9	112.8	K361 V362 L363	K361-R365 WeakPolarHBondContact O-CG 3.35Å; K361-R365 PolarHBondContact O-N 3.24Å; V362-R365 PolarHBondContact O-N 3.03Å; L363-R365 VanDerWaalsContact C-N 3.3Å; L363-R365 PolarHBondContact O-N 3.46Å
366	L	91.5	Very high	90.9	Very high	25 Å²	25	54 Å²	54	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-67.8	-46.2	177.3	-69.5	174.7	0	0	0	111	R239 L263 V265 V362 L363 F368 V369 G370	R239-L366 HydrophobicContact CB-CD1 3.65Å; R239-L366 HydrophobicContact CB-CD2 3.87Å; R239-L366 HydrophobicContact CB-CG 4.4Å; R239-L366 HydrophobicContact CG-CD1 4.17Å; R239-L366 HydrophobicContact CG-CD2 4.36Å; L263-L366 HydrophobicContact CB-CD1 3.98Å; L263-L366 HydrophobicContact CD1-CD1 4.48Å; V265-L366 HydrophobicContact CG2-CD2 4.22Å; V362-L366 HydrophobicContact CG1-CD1 3.64Å; V362-L366 HydrophobicContact CG1-CG 4.14Å; V362-L366 VanDerWaalsContact O-CG 3.31Å; V362-L366 WeakPolarHBondContact O-CG 3.44Å; V362-L366 PolarHBondContact O-N 3.33Å; L363-L366 PolarHBondContact O-N 2.91Å; L366-F368 VanDerWaalsContact C-N 3.29Å; L366-F368 PolarHBondContact O-N 2.87Å; L366-V369 PolarHBondContact O-N 3.27Å; L366-G370 PolarHBondContact O-N 3.48Å
367	T	90.5	Very high	90.4	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-66.2	-30.6	179.6	-56.8	0	0	0	0	112.1	T322 Y323 A326 L363 G370 S371	T322-T367 HydrophobicContact CG2-CG2 4.14Å; Y323-T367 HydrophobicContact CD1-CG2 3.73Å; Y323-T367 HydrophobicContact CD2-CG2 4.22Å; Y323-T367 HydrophobicContact CE1-CG2 3.91Å; Y323-T367 HydrophobicContact CE2-CG2 4.4Å; Y323-T367 HydrophobicContact CG-CG2 3.9Å; A326-T367 HydrophobicContact CB-CG2 3.87Å; L363-T367 VanDerWaalsContact O-CB 3.27Å; L363-T367 WeakPolarHBondContact O-CB 3.32Å; L363-T367 PolarHBondContact O-N 2.91Å; L363-T367 PolarHBondContact O-OG1 3.4Å; T367-G370 PolarHBondContact O-N 2.86Å; T367-S371 WeakPolarHBondContact O-CB 3.26Å; T367-S371 PolarHBondContact O-N 2.8Å; T367-S371 PolarHBondContact O-OG 3.48Å
368	F	91.9	Very high	89.8	Confident	116 Å²	116	46.2 Å²	46.2	51%	0.509	22%	0.215	S	C	.	.	H	α-helix	trans	-58	-50.5	170.9	-176.7	-100.7	0	0	0	112	Y323 Y364 L366 S371 I372	Y323-F368 WeakPolarHBondContact OH-CA 3.42Å; Y323-F368 VanDerWaalsContact OH-CB 3.23Å; Y323-F368 WeakPolarHBondContact OH-CB 3.34Å; Y323-F368 WeakPolarHBondContact OH-CD2 3.4Å; Y323-F368 PolarHBondContact OH-N 2.88Å; Y364-F368 WeakPolarHBondContact O-CB 3.34Å; Y364-F368 PolarHBondContact O-N 3.41Å; L366-F368 VanDerWaalsContact C-N 3.29Å; L366-F368 PolarHBondContact O-N 2.87Å; F368-S371 PolarHBondContact O-OG 3.49Å; F368-I372 HydrophobicContact CD1-CD1 3.95Å; F368-I372 HydrophobicContact CD2-CD1 4.27Å; F368-I372 HydrophobicContact CE1-CD1 3.48Å; F368-I372 VanDerWaalsContact CE1-CD1 3.48Å; F368-I372 HydrophobicContact CE2-CD1 3.83Å; F368-I372 HydrophobicContact CG-CD1 4.33Å; F368-I372 HydrophobicContact CZ-CD1 3.42Å; F368-I372 VanDerWaalsContact CZ-CD1 3.42Å; F368-I372 WeakPolarHBondContact O-CG1 3.4Å; F368-I372 PolarHBondContact O-N 3.39Å
369	V	91.2	Very high	89.2	Confident	86 Å²	86	43.5 Å²	43.5	52%	0.521	21%	0.205	S	C	.	.	H	α-helix	trans	-65.8	-44.6	177.9	-179.8	0	0	0	0	110.8	V265 L366 S371 F373	V265-V369 HydrophobicContact CG1-CG1 4.46Å; L366-V369 PolarHBondContact O-N 3.27Å; V369-S371 PolarHBondContact O-N 3.11Å; V369-F373 VanDerWaalsContact O-CB 3.31Å; V369-F373 WeakPolarHBondContact O-CB 3.34Å; V369-F373 PolarHBondContact O-N 2.79Å; V369-F373 VanDerWaalsContact O-N 3.09Å
370	G	88.2	Confident	88.7	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-41.9	179.8	0	0	0	0	0	113.6	L366 T367 F373 L374	L366-G370 PolarHBondContact O-N 3.48Å; T367-G370 PolarHBondContact O-N 2.86Å; G370-F373 PolarHBondContact O-N 2.99Å; G370-L374 WeakPolarHBondContact O-CB 3.29Å; G370-L374 WeakPolarHBondContact O-CG 3.39Å; G370-L374 PolarHBondContact O-N 3.46Å
371	S	89.9	Confident	87.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-43.5	-178.6	56.7	0	0	0	0	112.9	T367 F368 V369 F373 L374 A375	T367-S371 WeakPolarHBondContact O-CB 3.26Å; T367-S371 PolarHBondContact O-N 2.8Å; T367-S371 PolarHBondContact O-OG 3.48Å; F368-S371 PolarHBondContact O-OG 3.49Å; V369-S371 PolarHBondContact O-N 3.11Å; S371-F373 VanDerWaalsContact C-N 3.31Å; S371-F373 PolarHBondContact O-N 3.31Å; S371-L374 PolarHBondContact O-N 3.1Å; S371-A375 WeakPolarHBondContact O-CB 3.38Å; S371-A375 PolarHBondContact O-N 3.26Å
372	I	90.5	Very high	86.9	Confident	72 Å²	72	40.7 Å²	40.7	37%	0.369	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-45	174.1	-68.3	171.3	0	0	0	109.9	F368 A375 V376	F368-I372 HydrophobicContact CD1-CD1 3.95Å; F368-I372 HydrophobicContact CD2-CD1 4.27Å; F368-I372 HydrophobicContact CE1-CD1 3.48Å; F368-I372 VanDerWaalsContact CE1-CD1 3.48Å; F368-I372 HydrophobicContact CE2-CD1 3.83Å; F368-I372 HydrophobicContact CG-CD1 4.33Å; F368-I372 HydrophobicContact CZ-CD1 3.42Å; F368-I372 VanDerWaalsContact CZ-CD1 3.42Å; F368-I372 WeakPolarHBondContact O-CG1 3.4Å; F368-I372 PolarHBondContact O-N 3.39Å; I372-A375 WeakPolarHBondContact O-CB 3.15Å; I372-A375 PolarHBondContact O-N 3.41Å; I372-V376 HydrophobicContact CG2-CG2 4.34Å; I372-V376 VanDerWaalsContact O-CG2 3.31Å; I372-V376 WeakPolarHBondContact O-CG2 3.29Å; I372-V376 PolarHBondContact O-N 2.86Å
373	F	86.8	Confident	86.2	Confident	55 Å²	55	42.5 Å²	42.5	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-44.6	-179.9	-173.6	-99.3	0	0	0	112.8	G230 V234 V369 G370 S371 A375 V376 I377	G230-F373 VanDerWaalsContact C-CZ 3.46Å; G230-F373 WeakPolarHBondContact O-CE1 3.27Å; G230-F373 WeakPolarHBondContact O-CZ 3.33Å; V234-F373 HydrophobicContact CB-CD1 3.47Å; V234-F373 VanDerWaalsContact CB-CD1 3.47Å; V234-F373 HydrophobicContact CB-CE1 3.3Å; V234-F373 HydrophobicContact CB-CG 4.17Å; V234-F373 HydrophobicContact CB-CZ 3.94Å; V234-F373 HydrophobicContact CG1-CB 4.36Å; V234-F373 HydrophobicContact CG1-CD1 3.47Å; V234-F373 VanDerWaalsContact CG1-CD1 3.47Å; V234-F373 HydrophobicContact CG1-CE1 3.89Å; V234-F373 HydrophobicContact CG1-CG 3.99Å; V234-F373 HydrophobicContact CG2-CD1 3.51Å; V234-F373 HydrophobicContact CG2-CD2 3.85Å; V234-F373 HydrophobicContact CG2-CE1 3.25Å; V234-F373 HydrophobicContact CG2-CE2 3.66Å; V234-F373 HydrophobicContact CG2-CG 3.77Å; V234-F373 HydrophobicContact CG2-CZ 3.34Å; V369-F373 VanDerWaalsContact O-CB 3.31Å; V369-F373 WeakPolarHBondContact O-CB 3.34Å; V369-F373 PolarHBondContact O-N 2.79Å; V369-F373 VanDerWaalsContact O-N 3.09Å; G370-F373 PolarHBondContact O-N 2.99Å; S371-F373 VanDerWaalsContact C-N 3.31Å; S371-F373 PolarHBondContact O-N 3.31Å; F373-A375 VanDerWaalsContact C-N 3.31Å; F373-A375 PolarHBondContact O-N 3.19Å; F373-V376 PolarHBondContact O-N 2.94Å; F373-I377 HydrophobicContact CD1-CD1 3.76Å; F373-I377 HydrophobicContact CD1-CG1 4.42Å; F373-I377 HydrophobicContact CE1-CD1 3.04Å; F373-I377 HydrophobicContact CE1-CG1 4Å; F373-I377 HydrophobicContact CE2-CD1 4.25Å; F373-I377 HydrophobicContact CZ-CD1 3.34Å; F373-I377 HydrophobicContact CZ-CG1 4.05Å; F373-I377 PolarHBondContact O-N 3.01Å
374	L	85.2	Confident	85.2	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-41.3	174.1	-77.8	-179.2	0	0	0	112.1	N266 V273 I318 T322 G370 S371 S378 L402	N266-L374 WeakPolarHBondContact ND2-CD1 3.24Å; V273-L374 HydrophobicContact CG2-CB 4.44Å; V273-L374 HydrophobicContact CG2-CD1 4.36Å; V273-L374 HydrophobicContact CG2-CD2 4.27Å; I318-L374 HydrophobicContact CG2-CB 4.02Å; T322-L374 HydrophobicContact CG2-CD1 3.88Å; G370-L374 WeakPolarHBondContact O-CB 3.29Å; G370-L374 WeakPolarHBondContact O-CG 3.39Å; G370-L374 PolarHBondContact O-N 3.46Å; S371-L374 PolarHBondContact O-N 3.1Å; L374-S378 WeakPolarHBondContact O-CB 3.38Å; L374-S378 PolarHBondContact O-N 3.02Å; L374-S378 PolarHBondContact O-OG 3.35Å; L374-L402 HydrophobicContact CD2-CD1 4.5Å
375	A	87.3	Confident	84	Confident	4 Å²	4	38 Å²	38	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-50.9	175.2	0	0	0	0	0	110.5	I315 I318 I319 S371 I372 F373 I377 S378 I379	I315-A375 HydrophobicContact CG2-CB 4.09Å; I318-A375 HydrophobicContact CG2-CB 4.21Å; I319-A375 HydrophobicContact CG1-CB 4.4Å; S371-A375 WeakPolarHBondContact O-CB 3.38Å; S371-A375 PolarHBondContact O-N 3.26Å; I372-A375 WeakPolarHBondContact O-CB 3.15Å; I372-A375 PolarHBondContact O-N 3.41Å; F373-A375 VanDerWaalsContact C-N 3.31Å; F373-A375 PolarHBondContact O-N 3.19Å; A375-I377 PolarHBondContact O-N 3.38Å; A375-S378 PolarHBondContact O-N 2.94Å; A375-S378 VanDerWaalsContact O-N 3.08Å; A375-I379 HydrophobicContact CB-CD1 4.34Å; A375-I379 WeakPolarHBondContact O-CD1 3.5Å; A375-I379 WeakPolarHBondContact O-CG1 3.42Å; A375-I379 PolarHBondContact O-N 3.02Å
376	V	87.2	Confident	83.1	Confident	67 Å²	67	35.1 Å²	35.1	41%	0.406	18%	0.183	S	C	.	.	H	α-helix	trans	-55.8	-49.2	179.3	170.3	0	0	0	0	111.7	I372 F373 S378 I379 L380	I372-V376 HydrophobicContact CG2-CG2 4.34Å; I372-V376 VanDerWaalsContact O-CG2 3.31Å; I372-V376 WeakPolarHBondContact O-CG2 3.29Å; I372-V376 PolarHBondContact O-N 2.86Å; F373-V376 PolarHBondContact O-N 2.94Å; V376-S378 VanDerWaalsContact C-N 3.29Å; V376-S378 PolarHBondContact O-N 3.12Å; V376-I379 PolarHBondContact O-N 2.91Å; V376-L380 HydrophobicContact CG1-CD1 3.67Å; V376-L380 HydrophobicContact CG1-CG 4.07Å; V376-L380 WeakPolarHBondContact O-CB 3.35Å; V376-L380 VanDerWaalsContact O-CG 3.27Å; V376-L380 WeakPolarHBondContact O-CG 3.16Å; V376-L380 PolarHBondContact O-N 3.29Å
377	I	83.5	Confident	82.2	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-38.6	178.1	-68.3	178	0	0	0	111.8	L227 A231 F373 A375 I379 P381 L402	L227-I377 HydrophobicContact CD2-CG1 4.5Å; L227-I377 HydrophobicContact CD2-CG2 4.4Å; A231-I377 HydrophobicContact CB-CD1 3.9Å; F373-I377 HydrophobicContact CD1-CD1 3.76Å; F373-I377 HydrophobicContact CD1-CG1 4.42Å; F373-I377 HydrophobicContact CE1-CD1 3.04Å; F373-I377 HydrophobicContact CE1-CG1 4Å; F373-I377 HydrophobicContact CE2-CD1 4.25Å; F373-I377 HydrophobicContact CZ-CD1 3.34Å; F373-I377 HydrophobicContact CZ-CG1 4.05Å; F373-I377 PolarHBondContact O-N 3.01Å; A375-I377 PolarHBondContact O-N 3.38Å; I377-I379 VanDerWaalsContact C-N 3.31Å; I377-I379 PolarHBondContact O-N 3.22Å; I377-P381 WeakPolarHBondContact O-CD 3.26Å; I377-L402 HydrophobicContact CB-CD1 4.3Å; I377-L402 HydrophobicContact CB-CD2 4.29Å; I377-L402 HydrophobicContact CD1-CD2 4.25Å; I377-L402 HydrophobicContact CG2-CD1 3.82Å; I377-L402 HydrophobicContact CG2-CD2 3.57Å; I377-L402 HydrophobicContact CG2-CG 3.64Å
378	S	80.3	Confident	81.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-68.7	-32.6	-178	-56.6	0	0	0	0	112.4	L374 A375 V376 L402	L374-S378 WeakPolarHBondContact O-CB 3.38Å; L374-S378 PolarHBondContact O-N 3.02Å; L374-S378 PolarHBondContact O-OG 3.35Å; A375-S378 PolarHBondContact O-N 2.94Å; A375-S378 VanDerWaalsContact O-N 3.08Å; V376-S378 VanDerWaalsContact C-N 3.29Å; V376-S378 PolarHBondContact O-N 3.12Å; S378-L402 WeakPolarHBondContact OG-CD1 3.39Å
379	I	81.9	Confident	79.8	Confident	17 Å²	17	44 Å²	44	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-85.2	-33.9	-179	-54.9	147.5	0	0	0	112	M311 I315 A375 V376 I377 P381 I382 L383	M311-I379 HydrophobicContact CE-CG2 4.19Å; M311-I379 HydrophobicContact CG-CG2 4Å; M311-I379 HydrophobicContact SD-CG2 3.53Å; M311-I379 VanDerWaalsContact SD-CG2 3.53Å; I315-I379 HydrophobicContact CD1-CD1 3.31Å; I315-I379 HydrophobicContact CD1-CG1 3.9Å; I315-I379 HydrophobicContact CG1-CD1 3.32Å; I315-I379 HydrophobicContact CG1-CG1 3.64Å; A375-I379 HydrophobicContact CB-CD1 4.34Å; A375-I379 WeakPolarHBondContact O-CD1 3.5Å; A375-I379 WeakPolarHBondContact O-CG1 3.42Å; A375-I379 PolarHBondContact O-N 3.02Å; V376-I379 PolarHBondContact O-N 2.91Å; I377-I379 VanDerWaalsContact C-N 3.31Å; I377-I379 PolarHBondContact O-N 3.22Å; I379-P381 VanDerWaalsContact C-N 3.31Å; I379-I382 CarbonylContact O-C 3.55Å; I379-I382 WeakPolarHBondContact O-CA 3.23Å; I379-I382 WeakPolarHBondContact O-CB 3.3Å; I379-I382 PolarHBondContact O-N 2.97Å; I379-L383 HydrophobicContact CG2-CD1 3.63Å; I379-L383 HydrophobicContact CG2-CD2 4.49Å; I379-L383 HydrophobicContact CG2-CG 3.68Å; I379-L383 PolarHBondContact O-N 3.49Å
380	L	80.8	Confident	78.5	Confident	73 Å²	73	40.6 Å²	40.6	38%	0.382	22%	0.221	S	C	.	.	H	α-helix	trans	-51.9	-44.1	-172.2	-90.9	170.2	0	0	0	112.8	L227 V376 I382 L383 A384	L227-L380 HydrophobicContact CD2-CB 4.03Å; L227-L380 HydrophobicContact CD2-CD1 3.58Å; L227-L380 HydrophobicContact CD2-CG 4.46Å; V376-L380 HydrophobicContact CG1-CD1 3.67Å; V376-L380 HydrophobicContact CG1-CG 4.07Å; V376-L380 WeakPolarHBondContact O-CB 3.35Å; V376-L380 VanDerWaalsContact O-CG 3.27Å; V376-L380 WeakPolarHBondContact O-CG 3.16Å; V376-L380 PolarHBondContact O-N 3.29Å; L380-I382 VanDerWaalsContact C-N 3.35Å; L380-I382 PolarHBondContact O-N 2.63Å; L380-L383 PolarHBondContact O-N 3.07Å; L380-A384 VanDerWaalsContact O-CB 3.3Å; L380-A384 WeakPolarHBondContact O-CB 3.41Å; L380-A384 PolarHBondContact O-N 3.11Å
381	P	75.2	Confident	77.2	Confident	11 Å²	11	42.2 Å²	42.2	7%	0.071	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-32.6	175.3	-31.2	44.9	0	0	0	113.9	L227 I377 I379 A384 T385 G398	L227-P381 HydrophobicContact CD1-CG 3.83Å; I377-P381 WeakPolarHBondContact O-CD 3.26Å; I379-P381 VanDerWaalsContact C-N 3.31Å; P381-A384 PolarHBondContact O-N 3.47Å; P381-T385 WeakPolarHBondContact O-CG2 3.38Å; P381-T385 PolarHBondContact O-N 3.18Å; P381-T385 PolarHBondContact O-OG1 3.37Å; P381-G398 VanDerWaalsContact CG-CA 3.42Å
382	I	74.6	Confident	75.8	Confident	9 Å²	9	45.8 Å²	45.8	5%	0.046	25%	0.248	C	C	.	.	H	α-helix	trans	-67.4	-41.5	175	-51.8	175	0	0	0	110.1	P305 M311 Y314 I379 L380 T385 K386	P305-I382 HydrophobicContact CB-CD1 4.04Å; M311-I382 HydrophobicContact CE-CB 4.16Å; M311-I382 HydrophobicContact CE-CG2 3.57Å; Y314-I382 HydrophobicContact CD1-CD1 4.47Å; Y314-I382 HydrophobicContact CE1-CD1 4.48Å; I379-I382 CarbonylContact O-C 3.55Å; I379-I382 WeakPolarHBondContact O-CA 3.23Å; I379-I382 WeakPolarHBondContact O-CB 3.3Å; I379-I382 PolarHBondContact O-N 2.97Å; L380-I382 VanDerWaalsContact C-N 3.35Å; L380-I382 PolarHBondContact O-N 2.63Å; I382-T385 PolarHBondContact O-OG1 3.27Å; I382-K386 WeakPolarHBondContact O-CB 3.49Å; I382-K386 PolarHBondContact O-N 2.93Å
383	L	76.7	Confident	74	Confident	57 Å²	57	43.1 Å²	43.1	30%	0.298	24%	0.236	S	C	.	.	H	α-helix	trans	-69.1	-44.7	174.6	-69	174.2	0	0	0	111.7	M311 I379 L380 T385 K386 F387	M311-L383 HydrophobicContact CE-CD2 3.79Å; M311-L383 HydrophobicContact CE-CG 4.27Å; M311-L383 HydrophobicContact SD-CD2 3.87Å; M311-L383 HydrophobicContact SD-CG 4.34Å; I379-L383 HydrophobicContact CG2-CD1 3.63Å; I379-L383 HydrophobicContact CG2-CD2 4.49Å; I379-L383 HydrophobicContact CG2-CG 3.68Å; I379-L383 PolarHBondContact O-N 3.49Å; L380-L383 PolarHBondContact O-N 3.07Å; L383-T385 VanDerWaalsContact C-N 3.31Å; L383-T385 PolarHBondContact O-N 3.14Å; L383-K386 PolarHBondContact O-N 3.44Å; L383-K386 VanDerWaalsContact O-N 3.13Å; L383-F387 HydrophobicContact CB-CD2 4.19Å; L383-F387 HydrophobicContact CB-CE2 4.15Å; L383-F387 HydrophobicContact CD2-CE2 4.02Å; L383-F387 WeakPolarHBondContact O-CD2 3.49Å; L383-F387 PolarHBondContact O-N 3.45Å
384	A	71.6	Confident	72.5	Confident	23 Å²	23	42 Å²	42	19%	0.19	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-44.9	-179.7	0	0	0	0	0	111.3	L380 P381 F387 M388	L380-A384 VanDerWaalsContact O-CB 3.3Å; L380-A384 WeakPolarHBondContact O-CB 3.41Å; L380-A384 PolarHBondContact O-N 3.11Å; P381-A384 PolarHBondContact O-N 3.47Å; A384-F387 PolarHBondContact O-N 3.33Å; A384-M388 WeakPolarHBondContact O-CB 3.49Å; A384-M388 VanDerWaalsContact O-CG 3.3Å; A384-M388 WeakPolarHBondContact O-CG 3.11Å; A384-M388 PolarHBondContact O-N 3Å
385	T	67.5	Low	71	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-37.7	176.4	55.5	0	0	0	0	113.5	P381 I382 L383 G389 L390 I394 Q395	P381-T385 WeakPolarHBondContact O-CG2 3.38Å; P381-T385 PolarHBondContact O-N 3.18Å; P381-T385 PolarHBondContact O-OG1 3.37Å; I382-T385 PolarHBondContact O-OG1 3.27Å; L383-T385 VanDerWaalsContact C-N 3.31Å; L383-T385 PolarHBondContact O-N 3.14Å; T385-G389 WeakPolarHBondContact O-CA 3.45Å; T385-G389 PolarHBondContact O-N 3.25Å; T385-L390 HydrophobicContact CG2-CB 3.97Å; T385-L390 HydrophobicContact CG2-CD1 4.47Å; T385-L390 PolarHBondContact O-N 2.92Å; T385-I394 HydrophobicContact CG2-CB 3.82Å; T385-I394 HydrophobicContact CG2-CG2 3.76Å; T385-Q395 VanDerWaalsContact CB-CG 3.48Å; T385-Q395 HydrophobicContact CG2-CB 4.4Å; T385-Q395 HydrophobicContact CG2-CG 3.6Å; T385-Q395 WeakPolarHBondContact OG1-CG 3.25Å; T385-Q395 PolarHBondContact OG1-NE2 3.38Å
386	K	72.1	Confident	69.4	Low	106 Å²	106	44.2 Å²	44.2	46%	0.461	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-41.4	176.5	-173.1	177.9	-179.6	179.9	0	112.1	N308 I382 L383	N308-K386 PolarHBondContact OD1-NZ 2.89Å; I382-K386 WeakPolarHBondContact O-CB 3.49Å; I382-K386 PolarHBondContact O-N 2.93Å; L383-K386 PolarHBondContact O-N 3.44Å; L383-K386 VanDerWaalsContact O-N 3.13Å
387	F	73.4	Confident	68.1	Low	166 Å²	166	42.1 Å²	42.1	73%	0.728	23%	0.234	S	C	*	.	H	α-helix	trans	-83.2	-34.1	-178.9	-70.3	-64	0	0	0	113.6	L383 A384	L383-F387 HydrophobicContact CB-CD2 4.19Å; L383-F387 HydrophobicContact CB-CE2 4.15Å; L383-F387 HydrophobicContact CD2-CE2 4.02Å; L383-F387 WeakPolarHBondContact O-CD2 3.49Å; L383-F387 PolarHBondContact O-N 3.45Å; A384-F387 PolarHBondContact O-N 3.33Å
388	M	67.5	Low	67.3	Low	96 Å²	96	41.9 Å²	41.9	47%	0.473	23%	0.233	S	C	.	.	H	α-helix	trans	-94.9	-2.1	-175.8	-60.5	179.2	177.6	0	0	113.8	A384 L390	A384-M388 WeakPolarHBondContact O-CB 3.49Å; A384-M388 VanDerWaalsContact O-CG 3.3Å; A384-M388 WeakPolarHBondContact O-CG 3.11Å; A384-M388 PolarHBondContact O-N 3Å; M388-L390 HydrophobicContact CB-CD1 3.93Å; M388-L390 HydrophobicContact CB-CG 3.81Å; M388-L390 PolarHBondContact O-N 3.5Å; M388-L390 HydrophobicContact SD-CD1 4.13Å
389	G	64.6	Low	66.9	Low	67 Å²	67	42.3 Å²	42.3	69%	0.691	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	30.5	-178.2	0	0	0	0	0	113	T385	T385-G389 WeakPolarHBondContact O-CA 3.45Å; T385-G389 PolarHBondContact O-N 3.25Å
390	L	64	Low	66.5	Low	15 Å²	15	41.9 Å²	41.9	8%	0.079	23%	0.234	C	C	.	.			trans	-75.1	151.5	-178.6	-65.3	165.7	0	0	0	110.3	F199 L220 T385 M388 Q392 I394	F199-L390 HydrophobicContact CD2-CD2 4.45Å; F199-L390 HydrophobicContact CE2-CD2 3.5Å; F199-L390 VanDerWaalsContact CE2-CD2 3.5Å; F199-L390 HydrophobicContact CZ-CD2 4.08Å; L220-L390 HydrophobicContact CD1-CD1 4.43Å; T385-L390 HydrophobicContact CG2-CB 3.97Å; T385-L390 HydrophobicContact CG2-CD1 4.47Å; T385-L390 PolarHBondContact O-N 2.92Å; M388-L390 HydrophobicContact CB-CD1 3.93Å; M388-L390 HydrophobicContact CB-CG 3.81Å; M388-L390 PolarHBondContact O-N 3.5Å; M388-L390 HydrophobicContact SD-CD1 4.13Å; L390-Q392 PolarHBondContact O-N 3.22Å; L390-I394 HydrophobicContact CB-CD1 4.15Å; L390-I394 HydrophobicContact CD2-CD1 4.38Å
391	P	61.2	Low	66.5	Low	33 Å²	33	39.6 Å²	39.6	21%	0.214	22%	0.222	C	C	.	.			trans	-48.7	139.5	174.1	-28.6	34.7	0	0	0	112.4	F199 S393 I394	F199-P391 HydrophobicContact CD2-CG 4.26Å; P391-S393 PolarHBondContact O-N 3.29Å; P391-S393 VanDerWaalsContact O-N 3.08Å; P391-I394 WeakPolarHBondContact O-CB 3.5Å; P391-I394 PolarHBondContact O-N 2.87Å
392	Q	59.2	Low	66.6	Low	76 Å²	76	39.1 Å²	39.1	36%	0.355	22%	0.219	S	C	.	.	H	α-helix	trans	-59.8	-21.4	179.5	-67.7	-170.8	-8.6	0	0	113	Q51 L390 I394 Q395	Q51-Q392 PolarHBondContact O-OE1 3.26Å; L390-Q392 PolarHBondContact O-N 3.22Å; Q392-I394 PolarHBondContact O-N 3.45Å; Q392-I394 VanDerWaalsContact O-N 3.12Å; Q392-Q395 WeakPolarHBondContact O-CB 3.36Å; Q392-Q395 PolarHBondContact O-N 2.96Å
393	S	54.1	Low	66.8	Low	17 Å²	17	39 Å²	39	12%	0.119	22%	0.218	C	C	.	.	H	α-helix	trans	-56.1	-27.4	171.2	59.8	0	0	0	0	113.3	E55 P391	E55-S393 VanDerWaalsContact OE1-CA 3.22Å; E55-S393 WeakPolarHBondContact OE1-CA 3.23Å; E55-S393 WeakPolarHBondContact OE1-CB 3.17Å; P391-S393 PolarHBondContact O-N 3.29Å; P391-S393 VanDerWaalsContact O-N 3.08Å
394	I	54.8	Low	67.1	Low	30 Å²	30	37.3 Å²	37.3	15%	0.154	21%	0.21	C	C	.	.	H	α-helix	trans	-80.6	-24	175.6	-62	173.3	0	0	0	111.7	F199 L220 T385 L390 P391 Q392 I396 G397	F199-I394 HydrophobicContact CD2-CD1 3.96Å; F199-I394 HydrophobicContact CE2-CD1 4.32Å; F199-I394 HydrophobicContact CG-CD1 4.46Å; L220-I394 HydrophobicContact CD1-CD1 4.4Å; L220-I394 HydrophobicContact CD1-CG2 4.04Å; L220-I394 HydrophobicContact CD2-CD1 4.01Å; T385-I394 HydrophobicContact CG2-CB 3.82Å; T385-I394 HydrophobicContact CG2-CG2 3.76Å; L390-I394 HydrophobicContact CB-CD1 4.15Å; L390-I394 HydrophobicContact CD2-CD1 4.38Å; P391-I394 WeakPolarHBondContact O-CB 3.5Å; P391-I394 PolarHBondContact O-N 2.87Å; Q392-I394 PolarHBondContact O-N 3.45Å; Q392-I394 VanDerWaalsContact O-N 3.12Å; I394-I396 VanDerWaalsContact C-N 3.3Å; I394-I396 PolarHBondContact O-N 2.92Å; I394-G397 VanDerWaalsContact O-CA 3.3Å; I394-G397 WeakPolarHBondContact O-CA 3.36Å; I394-G397 PolarHBondContact O-N 3.03Å
395	Q	53.7	Low	67.8	Low	31 Å²	31	36.7 Å²	36.7	15%	0.145	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-43.2	177.3	-76	172.5	6.5	0	0	111.9	S306 T385 Q392 G397	S306-Q395 PolarHBondContact OG-OE1 3.48Å; T385-Q395 VanDerWaalsContact CB-CG 3.48Å; T385-Q395 HydrophobicContact CG2-CB 4.4Å; T385-Q395 HydrophobicContact CG2-CG 3.6Å; T385-Q395 WeakPolarHBondContact OG1-CG 3.25Å; T385-Q395 PolarHBondContact OG1-NE2 3.38Å; Q392-Q395 WeakPolarHBondContact O-CB 3.36Å; Q392-Q395 PolarHBondContact O-N 2.96Å; Q395-G397 PolarHBondContact O-N 3.48Å
396	I	52.8	Low	68.5	Low	25 Å²	25	37.2 Å²	37.2	13%	0.128	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.6	178.2	-66.5	160.8	0	0	0	111.2	E55 L56 T59 I394 G398 S400	E55-I396 HydrophobicContact CB-CD1 3.61Å; E55-I396 HydrophobicContact CG-CD1 3.6Å; L56-I396 HydrophobicContact CB-CD1 4.29Å; L56-I396 HydrophobicContact CB-CG2 4.47Å; L56-I396 HydrophobicContact CD1-CG2 3.45Å; L56-I396 VanDerWaalsContact CD1-CG2 3.45Å; T59-I396 HydrophobicContact CG2-CG2 4.38Å; I394-I396 VanDerWaalsContact C-N 3.3Å; I394-I396 PolarHBondContact O-N 2.92Å; I396-G398 VanDerWaalsContact C-N 3.28Å; I396-G398 PolarHBondContact O-N 3.39Å; I396-S400 WeakPolarHBondContact O-CB 3.45Å; I396-S400 PolarHBondContact O-N 3.24Å; I396-S400 PolarHBondContact O-OG 2.84Å
397	G	61.2	Low	69.1	Low	23 Å²	23	32.7 Å²	32.7	24%	0.237	19%	0.191	C	C	.	.	H	α-helix	trans	-54	-34.3	177.6	0	0	0	0	0	114.5	I394 Q395 S400 L401	I394-G397 VanDerWaalsContact O-CA 3.3Å; I394-G397 WeakPolarHBondContact O-CA 3.36Å; I394-G397 PolarHBondContact O-N 3.03Å; Q395-G397 PolarHBondContact O-N 3.48Å; G397-S400 VanDerWaalsContact CA-OG 3.27Å; G397-S400 WeakPolarHBondContact CA-OG 3.34Å; G397-S400 PolarHBondContact O-OG 3.22Å; G397-S400 VanDerWaalsContact O-OG 3.13Å; G397-L401 WeakPolarHBondContact O-CA 3.26Å; G397-L401 WeakPolarHBondContact O-CB 3.3Å; G397-L401 PolarHBondContact O-N 3.02Å
398	G	67	Low	69.8	Low	0 Å²	0	27 Å²	27	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.9	-47	-174.1	0	0	0	0	0	115	P381 I396 L402	P381-G398 VanDerWaalsContact CG-CA 3.42Å; I396-G398 VanDerWaalsContact C-N 3.28Å; I396-G398 PolarHBondContact O-N 3.39Å; G398-L402 PolarHBondContact O-N 3.24Å; G398-L402 VanDerWaalsContact O-N 3.16Å
399	T	70.6	Confident	70.6	Confident	10 Å²	10	23.8 Å²	23.8	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-71.7	-40.6	177.5	-58.3	0	0	0	0	110.5	V273 Y314 L402 I403	V273-T399 HydrophobicContact CG1-CG2 3.7Å; Y314-T399 PolarHBondContact OH-OG1 3.45Å; T399-L402 PolarHBondContact O-N 3.13Å; T399-I403 HydrophobicContact CG2-CD1 4.11Å; T399-I403 WeakPolarHBondContact O-CD1 3.43Å; T399-I403 VanDerWaalsContact O-CG1 3.27Å; T399-I403 WeakPolarHBondContact O-CG1 3.07Å; T399-I403 PolarHBondContact O-N 3.31Å; T399-I403 VanDerWaalsContact O-N 3.11Å
400	S	74.8	Confident	71.5	Confident	8 Å²	8	25.2 Å²	25.2	6%	0.056	15%	0.147	C	C	.	.	H	α-helix	trans	-67.3	-36.6	179.1	70.2	0	0	0	0	112.1	I396 G397 I403 V404	I396-S400 WeakPolarHBondContact O-CB 3.45Å; I396-S400 PolarHBondContact O-N 3.24Å; I396-S400 PolarHBondContact O-OG 2.84Å; G397-S400 VanDerWaalsContact CA-OG 3.27Å; G397-S400 WeakPolarHBondContact CA-OG 3.34Å; G397-S400 PolarHBondContact O-OG 3.22Å; G397-S400 VanDerWaalsContact O-OG 3.13Å; S400-I403 PolarHBondContact O-N 3.35Å; S400-V404 VanDerWaalsContact O-CG2 3.27Å; S400-V404 WeakPolarHBondContact O-CG2 3.15Å; S400-V404 PolarHBondContact O-N 3.37Å
401	L	79.8	Confident	72.6	Confident	25 Å²	25	25.8 Å²	25.8	13%	0.131	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-46.3	173.1	-180	66.9	0	0	0	111.5	L224 L227 G397 I403 V404 I405	L224-L401 HydrophobicContact CD1-CD1 3.95Å; L224-L401 HydrophobicContact CD1-CD2 4.05Å; L227-L401 HydrophobicContact CB-CD2 3.99Å; L227-L401 HydrophobicContact CD1-CD2 4.31Å; G397-L401 WeakPolarHBondContact O-CA 3.26Å; G397-L401 WeakPolarHBondContact O-CB 3.3Å; G397-L401 PolarHBondContact O-N 3.02Å; L401-I403 VanDerWaalsContact C-N 3.27Å; L401-I403 PolarHBondContact O-N 2.86Å; L401-V404 PolarHBondContact O-N 2.97Å; L401-I405 HydrophobicContact CD1-CD1 3.93Å; L401-I405 HydrophobicContact CD1-CG1 4.24Å; L401-I405 HydrophobicContact CD2-CD1 4.38Å; L401-I405 HydrophobicContact CG-CD1 3.71Å; L401-I405 HydrophobicContact CG-CG1 4.4Å; L401-I405 VanDerWaalsContact O-CG1 3.26Å; L401-I405 WeakPolarHBondContact O-CG1 3.47Å; L401-I405 PolarHBondContact O-N 3.11Å
402	L	77.8	Confident	73.7	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-42.9	176	-80.2	176.8	0	0	0	111.5	A231 V270 V273 L374 I377 S378 G398 T399 I405 G406	A231-L402 HydrophobicContact CB-CD2 4.11Å; V270-L402 HydrophobicContact CG1-CB 4.02Å; V270-L402 VanDerWaalsContact CG2-O 3.3Å; V270-L402 WeakPolarHBondContact CG2-O 3.22Å; V273-L402 HydrophobicContact CG1-CD1 4.4Å; V273-L402 HydrophobicContact CG2-CD1 4.19Å; L374-L402 HydrophobicContact CD2-CD1 4.5Å; I377-L402 HydrophobicContact CB-CD1 4.3Å; I377-L402 HydrophobicContact CB-CD2 4.29Å; I377-L402 HydrophobicContact CD1-CD2 4.25Å; I377-L402 HydrophobicContact CG2-CD1 3.82Å; I377-L402 HydrophobicContact CG2-CD2 3.57Å; I377-L402 HydrophobicContact CG2-CG 3.64Å; S378-L402 WeakPolarHBondContact OG-CD1 3.39Å; G398-L402 PolarHBondContact O-N 3.24Å; G398-L402 VanDerWaalsContact O-N 3.16Å; T399-L402 PolarHBondContact O-N 3.13Å; L402-I405 PolarHBondContact O-N 3.25Å; L402-G406 PolarHBondContact O-N 3.11Å
403	I	77.9	Confident	74.9	Confident	5 Å²	5	28.3 Å²	28.3	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-46.6	176.8	-63.8	163.2	0	0	0	110.2	F60 I184 I188 V270 I274 T399 S400 L401 I405 G406 V407	F60-I403 HydrophobicContact CE1-CD1 3.6Å; F60-I403 HydrophobicContact CZ-CD1 4.01Å; I184-I403 HydrophobicContact CG2-CG2 3.76Å; I188-I403 HydrophobicContact CD1-CB 3.88Å; I188-I403 HydrophobicContact CD1-CD1 4.25Å; I188-I403 HydrophobicContact CD1-CG2 3.69Å; V270-I403 HydrophobicContact CG1-CB 4.34Å; V270-I403 HydrophobicContact CG1-CG1 3.63Å; I274-I403 HydrophobicContact CD1-CD1 4.29Å; I274-I403 HydrophobicContact CD1-CG1 4.11Å; I274-I403 HydrophobicContact CG1-CD1 3.88Å; I274-I403 HydrophobicContact CG1-CG1 3.96Å; T399-I403 HydrophobicContact CG2-CD1 4.11Å; T399-I403 WeakPolarHBondContact O-CD1 3.43Å; T399-I403 VanDerWaalsContact O-CG1 3.27Å; T399-I403 WeakPolarHBondContact O-CG1 3.07Å; T399-I403 PolarHBondContact O-N 3.31Å; T399-I403 VanDerWaalsContact O-N 3.11Å; S400-I403 PolarHBondContact O-N 3.35Å; L401-I403 VanDerWaalsContact C-N 3.27Å; L401-I403 PolarHBondContact O-N 2.86Å; I403-I405 PolarHBondContact O-N 3.21Å; I403-G406 PolarHBondContact O-N 3.42Å; I403-V407 HydrophobicContact CG2-CG2 4.3Å; I403-V407 VanDerWaalsContact O-CG2 3.3Å; I403-V407 WeakPolarHBondContact O-CG2 3.14Å; I403-V407 PolarHBondContact O-N 2.92Å
404	V	84.3	Confident	76.2	Confident	22 Å²	22	29.2 Å²	29.2	13%	0.133	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-48.3	178.6	166.5	0	0	0	0	111.4	F185 I188 L189 S400 L401 A408	F185-V404 HydrophobicContact CD2-CB 4.27Å; F185-V404 HydrophobicContact CD2-CG1 4.06Å; F185-V404 HydrophobicContact CD2-CG2 4.29Å; F185-V404 HydrophobicContact CE2-CB 4.37Å; F185-V404 HydrophobicContact CE2-CG1 3.67Å; I188-V404 HydrophobicContact CB-CG2 4.01Å; I188-V404 HydrophobicContact CD1-CG2 4.34Å; I188-V404 HydrophobicContact CG2-CG2 3.51Å; L189-V404 HydrophobicContact CD2-CG1 3.93Å; L189-V404 HydrophobicContact CD2-CG2 4.07Å; L189-V404 HydrophobicContact CG-CG2 4.38Å; S400-V404 VanDerWaalsContact O-CG2 3.27Å; S400-V404 WeakPolarHBondContact O-CG2 3.15Å; S400-V404 PolarHBondContact O-N 3.37Å; L401-V404 PolarHBondContact O-N 2.97Å; V404-A408 VanDerWaalsContact O-CB 3.24Å; V404-A408 WeakPolarHBondContact O-CB 3.22Å; V404-A408 PolarHBondContact O-N 2.88Å
405	I	85.5	Confident	77.5	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-64.5	-46.8	179.7	-64.8	165.5	0	0	0	110.7	T228 A231 I232 L235 L401 L402 I403 V407 A408 I409	T228-I405 HydrophobicContact CG2-CD1 3.87Å; T228-I405 HydrophobicContact CG2-CG1 4.08Å; A231-I405 HydrophobicContact CB-CD1 3.8Å; A231-I405 HydrophobicContact CB-CG2 4.26Å; I232-I405 HydrophobicContact CG1-CG2 3.92Å; L235-I405 HydrophobicContact CD1-CG2 4.12Å; L401-I405 HydrophobicContact CD1-CD1 3.93Å; L401-I405 HydrophobicContact CD1-CG1 4.24Å; L401-I405 HydrophobicContact CD2-CD1 4.38Å; L401-I405 HydrophobicContact CG-CD1 3.71Å; L401-I405 HydrophobicContact CG-CG1 4.4Å; L401-I405 VanDerWaalsContact O-CG1 3.26Å; L401-I405 WeakPolarHBondContact O-CG1 3.47Å; L401-I405 PolarHBondContact O-N 3.11Å; L402-I405 PolarHBondContact O-N 3.25Å; I403-I405 PolarHBondContact O-N 3.21Å; I405-V407 PolarHBondContact O-N 2.88Å; I405-A408 PolarHBondContact O-N 3.25Å; I405-I409 HydrophobicContact CG2-CD1 3.76Å; I405-I409 HydrophobicContact CG2-CG1 4.39Å; I405-I409 VanDerWaalsContact O-CG1 3.29Å; I405-I409 WeakPolarHBondContact O-CG1 3.2Å; I405-I409 PolarHBondContact O-N 2.89Å
406	G	81.8	Confident	78.8	Confident	14 Å²	14	30.9 Å²	30.9	14%	0.144	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-46.5	-179.2	0	0	0	0	0	112.6	L402 I403 I409 E410	L402-G406 PolarHBondContact O-N 3.11Å; I403-G406 PolarHBondContact O-N 3.42Å; G406-I409 PolarHBondContact O-N 3.47Å; G406-E410 WeakPolarHBondContact O-CB 3.17Å; G406-E410 PolarHBondContact O-N 3.23Å
407	V	84.7	Confident	80.1	Confident	12 Å²	12	32.2 Å²	32.2	7%	0.073	19%	0.189	C	C	.	.	H	α-helix	trans	-68.6	-38	178.3	177.8	0	0	0	0	111.4	I182 F185 I403 I405 E410 T411	I182-V407 HydrophobicContact CG1-CG1 4.36Å; F185-V407 HydrophobicContact CB-CB 4.2Å; F185-V407 HydrophobicContact CB-CG1 3.82Å; F185-V407 HydrophobicContact CD2-CB 4.15Å; F185-V407 HydrophobicContact CD2-CG1 4.23Å; F185-V407 HydrophobicContact CG-CG1 4.21Å; I403-V407 HydrophobicContact CG2-CG2 4.3Å; I403-V407 VanDerWaalsContact O-CG2 3.3Å; I403-V407 WeakPolarHBondContact O-CG2 3.14Å; I403-V407 PolarHBondContact O-N 2.92Å; I405-V407 PolarHBondContact O-N 2.88Å; V407-E410 PolarHBondContact O-N 3.48Å; V407-T411 VanDerWaalsContact O-CB 3.27Å; V407-T411 WeakPolarHBondContact O-CB 3.16Å; V407-T411 PolarHBondContact O-N 3.26Å; V407-T411 PolarHBondContact O-OG1 3.44Å
408	A	88.1	Confident	80.7	Confident	45 Å²	45	33.2 Å²	33.2	37%	0.372	19%	0.188	S	C	.	.	H	α-helix	trans	-60.9	-46.4	175.6	0	0	0	0	0	111.7	F185 V404 I405 T411 M412	F185-A408 HydrophobicContact CE2-CB 4.14Å; V404-A408 VanDerWaalsContact O-CB 3.24Å; V404-A408 WeakPolarHBondContact O-CB 3.22Å; V404-A408 PolarHBondContact O-N 2.88Å; I405-A408 PolarHBondContact O-N 3.25Å; A408-T411 PolarHBondContact O-N 3.5Å; A408-M412 VanDerWaalsContact O-CB 3.29Å; A408-M412 WeakPolarHBondContact O-CB 3.28Å; A408-M412 PolarHBondContact O-N 2.9Å
409	I	85.2	Confident	81.1	Confident	30 Å²	30	34.1 Å²	34.1	15%	0.154	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-47.3	176.1	-69.2	170.3	0	0	0	110.9	I232 L235 E236 I405 G406 T411 M412 K413	I232-I409 HydrophobicContact CG1-CD1 4.1Å; L235-I409 HydrophobicContact CB-CD1 4.28Å; L235-I409 HydrophobicContact CD1-CD1 4.06Å; E236-I409 WeakPolarHBondContact OE1-CG2 3.41Å; I405-I409 HydrophobicContact CG2-CD1 3.76Å; I405-I409 HydrophobicContact CG2-CG1 4.39Å; I405-I409 VanDerWaalsContact O-CG1 3.29Å; I405-I409 WeakPolarHBondContact O-CG1 3.2Å; I405-I409 PolarHBondContact O-N 2.89Å; G406-I409 PolarHBondContact O-N 3.47Å; I409-T411 VanDerWaalsContact C-N 3.34Å; I409-T411 PolarHBondContact O-N 3.44Å; I409-M412 PolarHBondContact O-N 3.45Å; I409-K413 HydrophobicContact CG2-CD 3.99Å; I409-K413 HydrophobicContact CG2-CG 4.49Å; I409-K413 WeakPolarHBondContact O-CB 3.27Å; I409-K413 WeakPolarHBondContact O-CG 3.43Å; I409-K413 PolarHBondContact O-N 2.84Å
410	E	82.9	Confident	81.3	Confident	97 Å²	97	36.6 Å²	36.6	45%	0.453	21%	0.211	S	C	.	.	H	α-helix	trans	-61.7	-43.4	-179.6	-173.8	177.3	-172.2	0	0	111.6	G406 V407 K413 S414	G406-E410 WeakPolarHBondContact O-CB 3.17Å; G406-E410 PolarHBondContact O-N 3.23Å; V407-E410 PolarHBondContact O-N 3.48Å; E410-K413 PolarHBondContact O-N 3.39Å; E410-S414 WeakPolarHBondContact O-CB 2.97Å; E410-S414 PolarHBondContact O-N 3.36Å
411	T	86.5	Confident	81.2	Confident	27 Å²	27	42.8 Å²	42.8	17%	0.166	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-44.8	177.8	-54.8	0	0	0	0	111.1	V176 I182 V407 A408 I409 S414 L415	V176-T411 HydrophobicContact CG1-CG2 3.74Å; I182-T411 HydrophobicContact CD1-CG2 4.34Å; V407-T411 VanDerWaalsContact O-CB 3.27Å; V407-T411 WeakPolarHBondContact O-CB 3.16Å; V407-T411 PolarHBondContact O-N 3.26Å; V407-T411 PolarHBondContact O-OG1 3.44Å; A408-T411 PolarHBondContact O-N 3.5Å; I409-T411 VanDerWaalsContact C-N 3.34Å; I409-T411 PolarHBondContact O-N 3.44Å; T411-S414 PolarHBondContact O-N 2.82Å; T411-L415 HydrophobicContact CG2-CD1 4.45Å; T411-L415 WeakPolarHBondContact O-CG 3.17Å; T411-L415 PolarHBondContact O-N 3.16Å
412	M	85.9	Confident	80.6	Confident	91 Å²	91	46.8 Å²	46.8	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-60.3	-47.1	176.6	-179.3	173.6	174.2	0	0	111.3	A408 I409 S414 L415 E416	A408-M412 VanDerWaalsContact O-CB 3.29Å; A408-M412 WeakPolarHBondContact O-CB 3.28Å; A408-M412 PolarHBondContact O-N 2.9Å; I409-M412 PolarHBondContact O-N 3.45Å; M412-S414 VanDerWaalsContact C-N 3.33Å; M412-S414 PolarHBondContact O-N 2.84Å; M412-L415 WeakPolarHBondContact O-CB 3.14Å; M412-L415 PolarHBondContact O-N 3.24Å; M412-L415 VanDerWaalsContact O-N 3.14Å; M412-E416 WeakPolarHBondContact CE-OE1 3.29Å; M412-E416 WeakPolarHBondContact O-CG 3.38Å; M412-E416 PolarHBondContact O-N 3.46Å
413	K	82.6	Confident	80	Confident	70 Å²	70	52.8 Å²	52.8	30%	0.304	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-40.1	176.5	-76.4	178.4	169.5	178.1	0	112.7	E236 I409 E410 L415 E416 A417	E236-K413 WeakPolarHBondContact OE1-CE 3.33Å; E236-K413 IonicContact OE1-NZ 2.73Å; E236-K413 PolarHBondContact OE1-NZ 3.46Å; E236-K413 WeakPolarHBondContact OE2-CE 3.4Å; E236-K413 IonicContact OE2-NZ 3.99Å; E236-K413 PolarHBondContact OE2-NZ 3.35Å; I409-K413 HydrophobicContact CG2-CD 3.99Å; I409-K413 HydrophobicContact CG2-CG 4.49Å; I409-K413 WeakPolarHBondContact O-CB 3.27Å; I409-K413 WeakPolarHBondContact O-CG 3.43Å; I409-K413 PolarHBondContact O-N 2.84Å; E410-K413 PolarHBondContact O-N 3.39Å; K413-L415 VanDerWaalsContact C-N 3.3Å; K413-L415 PolarHBondContact O-N 3.45Å; K413-E416 PolarHBondContact O-N 3.47Å; K413-A417 WeakPolarHBondContact O-CB 3.41Å; K413-A417 PolarHBondContact O-N 3.23Å
414	S	81.9	Confident	79.2	Confident	36 Å²	36	61.7 Å²	61.7	25%	0.252	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-36.8	175.7	-177.1	0	0	0	0	111.9	E410 T411 M412 Q418	E410-S414 WeakPolarHBondContact O-CB 2.97Å; E410-S414 PolarHBondContact O-N 3.36Å; T411-S414 PolarHBondContact O-N 2.82Å; M412-S414 VanDerWaalsContact C-N 3.33Å; M412-S414 PolarHBondContact O-N 2.84Å; S414-Q418 WeakPolarHBondContact O-CG 3.45Å; S414-Q418 PolarHBondContact O-N 3.26Å
415	L	82.2	Confident	77.8	Confident	22 Å²	22	69.9 Å²	69.9	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-69.1	-47.2	175.6	-77.1	169.5	0	0	0	111.8	F8 V14 V176 T411 M412 K413 A417 Q418 V419	F8-L415 HydrophobicContact CE1-CB 4.11Å; F8-L415 HydrophobicContact CZ-CB 4.21Å; V14-L415 HydrophobicContact CG1-CD2 3.72Å; V176-L415 HydrophobicContact CB-CD2 4.25Å; V176-L415 HydrophobicContact CG1-CD1 3.9Å; V176-L415 HydrophobicContact CG1-CD2 3.33Å; V176-L415 HydrophobicContact CG1-CG 3.36Å; V176-L415 HydrophobicContact CG2-CD2 3.84Å; T411-L415 HydrophobicContact CG2-CD1 4.45Å; T411-L415 WeakPolarHBondContact O-CG 3.17Å; T411-L415 PolarHBondContact O-N 3.16Å; M412-L415 WeakPolarHBondContact O-CB 3.14Å; M412-L415 PolarHBondContact O-N 3.24Å; M412-L415 VanDerWaalsContact O-N 3.14Å; K413-L415 VanDerWaalsContact C-N 3.3Å; K413-L415 PolarHBondContact O-N 3.45Å; L415-A417 PolarHBondContact O-N 3.25Å; L415-Q418 PolarHBondContact O-N 3.18Å; L415-V419 PolarHBondContact O-N 2.98Å; L415-V419 VanDerWaalsContact O-N 3.1Å
416	E	81	Confident	76.3	Confident	75 Å²	75	72.1 Å²	72.1	35%	0.35	38%	0.377	S	S	.	.	H	α-helix	trans	-58.3	-46.9	177.1	-74	179.8	171.3	0	0	111.2	F8 M412 K413 Q418 V419 S420	F8-E416 HydrophobicContact CZ-CG 4.15Å; M412-E416 WeakPolarHBondContact CE-OE1 3.29Å; M412-E416 WeakPolarHBondContact O-CG 3.38Å; M412-E416 PolarHBondContact O-N 3.46Å; K413-E416 PolarHBondContact O-N 3.47Å; E416-Q418 VanDerWaalsContact C-N 3.27Å; E416-Q418 PolarHBondContact O-N 3.28Å; E416-V419 PolarHBondContact O-N 3.47Å; E416-V419 VanDerWaalsContact O-N 3.07Å; E416-S420 PolarHBondContact O-N 2.82Å; E416-S420 PolarHBondContact O-OG 3.25Å; E416-S420 VanDerWaalsContact O-OG 3.09Å
417	A	79.8	Confident	75.3	Confident	53 Å²	53	82.5 Å²	82.5	44%	0.438	42%	0.419	S	S	.	.	H	α-helix	trans	-57.3	-39	178.3	0	0	0	0	0	112.8	K413 L415 Q421	K413-A417 WeakPolarHBondContact O-CB 3.41Å; K413-A417 PolarHBondContact O-N 3.23Å; L415-A417 PolarHBondContact O-N 3.25Å; A417-Q421 WeakPolarHBondContact O-CG 3.24Å; A417-Q421 PolarHBondContact O-N 3.4Å
418	Q	75.3	Confident	74	Confident	44 Å²	44	85.4 Å²	85.4	21%	0.206	45%	0.451	C	S	.	.	H	α-helix	trans	-70.8	-34.3	177.1	-71.5	-178.4	31.6	0	0	112.7	S414 L415 E416	S414-Q418 WeakPolarHBondContact O-CG 3.45Å; S414-Q418 PolarHBondContact O-N 3.26Å; L415-Q418 PolarHBondContact O-N 3.18Å; E416-Q418 VanDerWaalsContact C-N 3.27Å; E416-Q418 PolarHBondContact O-N 3.28Å
419	V	75.2	Confident	72	Confident	19 Å²	19	86.9 Å²	86.9	12%	0.115	47%	0.47	C	S	.	.	H	α-helix	trans	-74.4	-44.4	176.5	173.1	0	0	0	0	111.3	F8 V14 L415 E416 Q421 K422 E423	F8-V419 HydrophobicContact CD1-CG2 3.54Å; F8-V419 HydrophobicContact CE1-CB 4.21Å; F8-V419 HydrophobicContact CE1-CG2 3.49Å; F8-V419 VanDerWaalsContact CE1-CG2 3.49Å; V14-V419 HydrophobicContact CG2-CG2 4.24Å; L415-V419 PolarHBondContact O-N 2.98Å; L415-V419 VanDerWaalsContact O-N 3.1Å; E416-V419 PolarHBondContact O-N 3.47Å; E416-V419 VanDerWaalsContact O-N 3.07Å; V419-Q421 PolarHBondContact O-N 3.2Å; V419-K422 WeakPolarHBondContact O-CA 3.19Å; V419-K422 WeakPolarHBondContact O-CB 3.31Å; V419-K422 PolarHBondContact O-N 3.18Å; V419-E423 HydrophobicContact CG1-CG 4.45Å; V419-E423 PolarHBondContact O-N 3.42Å; V419-E423 VanDerWaalsContact O-N 3.14Å
420	S	74.8	Confident	69.7	Low	61 Å²	61	100.5 Å²	100.5	43%	0.427	52%	0.52	S	S	.	.	H	α-helix	trans	-60.9	-32.4	178.2	-58.9	0	0	0	0	112.5	E416 K422 E423 Y424	E416-S420 PolarHBondContact O-N 2.82Å; E416-S420 PolarHBondContact O-OG 3.25Å; E416-S420 VanDerWaalsContact O-OG 3.09Å; S420-K422 PolarHBondContact O-N 2.98Å; S420-E423 PolarHBondContact O-N 2.85Å; S420-Y424 WeakPolarHBondContact O-CD2 3.17Å; S420-Y424 PolarHBondContact O-N 3.42Å
421	Q	72	Confident	69.1	Low	139 Å²	139	100.7 Å²	100.7	65%	0.65	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.9	172.1	-80.1	178.6	-0.4	0	0	113.4	A417 V419 Y424	A417-Q421 WeakPolarHBondContact O-CG 3.24Å; A417-Q421 PolarHBondContact O-N 3.4Å; V419-Q421 PolarHBondContact O-N 3.2Å; Q421-Y424 WeakPolarHBondContact O-CD2 3.3Å
422	K	67.3	Low	68.2	Low	108 Å²	108	104.5 Å²	104.5	47%	0.47	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-26.2	176.1	-62.9	-171.4	178.2	-169.4	0	113	T11 E13 V419 S420 Y424	T11-K422 HydrophobicContact CG2-CD 4.08Å; E13-K422 WeakPolarHBondContact OE2-CE 3.31Å; E13-K422 IonicContact OE2-NZ 3.02Å; E13-K422 PolarHBondContact OE2-NZ 3.19Å; V419-K422 WeakPolarHBondContact O-CA 3.19Å; V419-K422 WeakPolarHBondContact O-CB 3.31Å; V419-K422 PolarHBondContact O-N 3.18Å; S420-K422 PolarHBondContact O-N 2.98Å; K422-Y424 PolarHBondContact O-N 3.44Å
423	E	65.1	Low	67.2	Low	128 Å²	128	105.3 Å²	105.3	60%	0.598	55%	0.547	S	S	*	.			trans	-80.5	1	176.9	-68	-172.4	159.1	0	0	113.6	V419 S420 K425	V419-E423 HydrophobicContact CG1-CG 4.45Å; V419-E423 PolarHBondContact O-N 3.42Å; V419-E423 VanDerWaalsContact O-N 3.14Å; S420-E423 PolarHBondContact O-N 2.85Å; E423-K425 PolarHBondContact O-N 2.87Å
424	Y	60.7	Low	66.3	Low	192 Å²	192	107.4 Å²	107.4	75%	0.753	56%	0.561	S	S	*	*			trans	-60.4	87.7	164.9	-80.1	-72	0	0	0	109.2	S420 Q421 K422 G426	S420-Y424 WeakPolarHBondContact O-CD2 3.17Å; S420-Y424 PolarHBondContact O-N 3.42Å; Q421-Y424 WeakPolarHBondContact O-CD2 3.3Å; K422-Y424 PolarHBondContact O-N 3.44Å; Y424-G426 PolarHBondContact O-N 2.92Å; Y424-G426 VanDerWaalsContact O-N 3.07Å
425	K	56	Low	65.3	Low	194 Å²	194	111.8 Å²	111.8	84%	0.843	58%	0.581	S	S	*	*			trans	-62.2	111.5	170	-67.4	-173.3	178.9	-175.6	0	106.6	E423	E423-K425 PolarHBondContact O-N 2.87Å
426	G	52.9	Low	64.2	Low	57 Å²	57	117.8 Å²	117.8	59%	0.588	61%	0.612	S	S	*	*			trans	-54.9	147	163.9	0	0	0	0	0	108.9	Y424 G428 G429	Y424-G426 PolarHBondContact O-N 2.92Å; Y424-G426 VanDerWaalsContact O-N 3.07Å; G426-G428 PolarHBondContact O-N 2.87Å; G426-G429 PolarHBondContact O-N 3.45Å
427	F	62.1	Low	63	Low	233 Å²	233	120.9 Å²	120.9	100%	1.022	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-7.5	-179.8	-98.5	-91.7	0	0	0	114.8
428	G	56.6	Low	61.7	Low	72 Å²	72	126.1 Å²	126.1	74%	0.742	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	17	-178.5	0	0	0	0	0	116.6	G426 R430	G426-G428 PolarHBondContact O-N 2.87Å; G428-R430 VanDerWaalsContact C-N 3.26Å; G428-R430 PolarHBondContact O-N 3.13Å
429	G	46.9	Very low	60.5	Low	76 Å²	76	132.9 Å²	132.9	78%	0.784	68%	0.682	S	S	*	*			trans	-79.4	65.6	176.5	0	0	0	0	0	113.7	G426	G426-G429 PolarHBondContact O-N 3.45Å
430	R	36.9	Very low	59.2	Low	316 Å²	316	143.3 Å²	143.3	100%	1.192	73%	0.733	S	S	*	*			trans	-107.6	0	149	-106.8	-171.7	147.9	163.2	-4.5	108.2	G428	G428-R430 VanDerWaalsContact C-N 3.26Å; G428-R430 PolarHBondContact O-N 3.13Å

Retrieved 430 of 430 residues in 1016.2 ms (Link to these results)

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